NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
652960 | 6tub | 26715 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 TYR 1 H TYR 1 -4.526 1.876 12.096 2 HA TYR 1 HA TYR 1 -7.281 1.211 12.906 3 HB2 TYR 1 HB2 TYR 1 -6.809 2.927 14.772 4 HB3 TYR 1 HB3 TYR 1 -6.080 1.332 14.916 5 HD1 TYR 1 HD1 TYR 1 -5.464 4.888 14.488 6 HD2 TYR 1 HD2 TYR 1 -3.664 1.032 14.491 7 HE1 TYR 1 HE1 TYR 1 -3.246 5.930 14.699 8 HE2 TYR 1 HE2 TYR 1 -1.442 2.064 14.703 9 HH TYR 1 HH TYR 1 -0.950 5.461 14.336 10 H GLY 2 H GLY 2 -8.728 3.083 13.172 11 HA2 GLY 2 HA2 GLY 2 -8.843 5.568 12.690 12 HA3 GLY 2 HA3 GLY 2 -8.117 5.143 11.146 13 H GLY 3 H GLY 3 -10.785 6.340 12.007 14 HA2 GLY 3 HA2 GLY 3 -12.989 6.220 11.367 15 HA3 GLY 3 HA3 GLY 3 -12.359 5.431 9.928 16 H PHE 4 H PHE 4 -13.542 3.685 9.535 17 HA PHE 4 HA PHE 4 -14.812 2.208 11.655 18 HB2 PHE 4 HB2 PHE 4 -14.770 2.003 8.661 19 HB3 PHE 4 HB3 PHE 4 -15.417 0.681 9.627 20 HD1 PHE 4 HD1 PHE 4 -17.590 0.769 10.475 21 HD2 PHE 4 HD2 PHE 4 -15.779 4.305 8.945 22 HE1 PHE 4 HE1 PHE 4 -19.750 1.938 10.628 23 HE2 PHE 4 HE2 PHE 4 -17.936 5.479 9.097 24 HZ PHE 4 HZ PHE 4 -19.925 4.296 9.940 25 H MET 5 H MET 5 -14.002 0.521 12.706 26 HA MET 5 HA MET 5 -11.464 -0.607 11.837 27 HB2 MET 5 HB2 MET 5 -11.661 0.021 14.173 28 HB3 MET 5 HB3 MET 5 -13.078 -1.004 14.362 29 HG2 MET 5 HG2 MET 5 -11.102 -2.041 15.316 30 HG3 MET 5 HG3 MET 5 -11.726 -2.980 13.962 31 HE1 MET 5 HE1 MET 5 -9.547 -4.214 14.301 32 HE2 MET 5 HE2 MET 5 -8.021 -3.750 13.550 33 HE3 MET 5 HE3 MET 5 -8.430 -3.152 15.157 34 H THR 6 H THR 6 -11.576 -2.197 10.391 35 HA THR 6 HA THR 6 -13.752 -4.164 10.607 36 HB THR 6 HB THR 6 -11.944 -4.075 8.232 37 HG1 THR 6 HG1 THR 6 -13.968 -2.183 8.862 38 HG21 THR 6 HG21 THR 6 -14.826 -4.265 7.848 39 HG22 THR 6 HG22 THR 6 -13.540 -5.339 7.297 40 HG23 THR 6 HG23 THR 6 -14.197 -5.513 8.924 41 H SER 7 H SER 7 -12.876 -5.501 12.187 42 HA SER 7 HA SER 7 -10.300 -6.772 11.580 43 HB2 SER 7 HB2 SER 7 -11.037 -5.710 13.910 44 HB3 SER 7 HB3 SER 7 -11.739 -7.311 14.136 45 HG SER 7 HG SER 7 -9.402 -6.846 14.755 46 H GLU 8 H GLU 8 -10.717 -8.385 10.161 47 HA GLU 8 HA GLU 8 -12.736 -10.380 10.956 48 HB2 GLU 8 HB2 GLU 8 -12.040 -9.210 8.320 49 HB3 GLU 8 HB3 GLU 8 -12.403 -10.930 8.345 50 HG2 GLU 8 HG2 GLU 8 -14.504 -10.212 8.035 51 HG3 GLU 8 HG3 GLU 8 -14.470 -10.010 9.786 52 H LYS 9 H LYS 9 -11.787 -12.110 11.791 53 HA LYS 9 HA LYS 9 -9.161 -12.935 10.759 54 HB2 LYS 9 HB2 LYS 9 -9.265 -12.479 13.173 55 HB3 LYS 9 HB3 LYS 9 -10.541 -13.677 13.346 56 HG2 LYS 9 HG2 LYS 9 -8.695 -15.220 12.209 57 HG3 LYS 9 HG3 LYS 9 -7.630 -14.041 12.976 58 HD2 LYS 9 HD2 LYS 9 -9.847 -15.166 14.602 59 HD3 LYS 9 HD3 LYS 9 -8.477 -16.219 14.242 60 HE2 LYS 9 HE2 LYS 9 -7.814 -15.236 16.222 61 HE3 LYS 9 HE3 LYS 9 -7.055 -14.186 15.026 62 HZ1 LYS 9 HZ1 LYS 9 -8.863 -12.623 15.277 63 HZ2 LYS 9 HZ2 LYS 9 -9.642 -13.641 16.381 64 HZ3 LYS 9 HZ3 LYS 9 -8.160 -12.931 16.786 65 H SER 10 H SER 10 -9.324 -14.420 9.212 66 HA SER 10 HA SER 10 -10.690 -16.899 9.743 67 HB2 SER 10 HB2 SER 10 -12.030 -16.803 7.618 68 HB3 SER 10 HB3 SER 10 -12.579 -15.687 8.869 69 HG SER 10 HG SER 10 -11.366 -15.168 6.420 70 H GLN 11 H GLN 11 -9.851 -18.590 8.588 71 HA GLN 11 HA GLN 11 -7.429 -18.022 7.094 72 HB2 GLN 11 HB2 GLN 11 -7.118 -20.486 7.149 73 HB3 GLN 11 HB3 GLN 11 -7.306 -19.774 8.746 74 HG2 GLN 11 HG2 GLN 11 -9.473 -20.622 8.994 75 HG3 GLN 11 HG3 GLN 11 -9.622 -20.976 7.273 76 HE21 GLN 11 HE21 GLN 11 -7.427 -21.768 9.951 77 HE22 GLN 11 HE22 GLN 11 -7.327 -23.456 9.594 78 H THR 12 H THR 12 -9.701 -17.156 5.755 79 HA THR 12 HA THR 12 -9.537 -18.796 3.349 80 HB THR 12 HB THR 12 -12.209 -18.136 3.319 81 HG1 THR 12 HG1 THR 12 -12.017 -17.644 5.609 82 HG21 THR 12 HG21 THR 12 -12.189 -20.720 4.283 83 HG22 THR 12 HG22 THR 12 -12.008 -20.247 2.594 84 HG23 THR 12 HG23 THR 12 -10.579 -20.539 3.586 85 HA PRO 13 HA PRO 13 -9.545 -14.956 1.225 86 HB2 PRO 13 HB2 PRO 13 -10.915 -15.547 -1.044 87 HB3 PRO 13 HB3 PRO 13 -9.281 -16.142 -0.725 88 HG2 PRO 13 HG2 PRO 13 -11.906 -17.540 -0.384 89 HG3 PRO 13 HG3 PRO 13 -10.389 -18.159 -1.061 90 HD2 PRO 13 HD2 PRO 13 -11.185 -18.704 1.469 91 HD3 PRO 13 HD3 PRO 13 -9.474 -18.551 1.018 92 H LEU 14 H LEU 14 -10.931 -13.931 2.859 93 HA LEU 14 HA LEU 14 -13.770 -13.794 2.345 94 HB2 LEU 14 HB2 LEU 14 -13.934 -12.538 4.314 95 HB3 LEU 14 HB3 LEU 14 -12.677 -13.732 4.628 96 HG LEU 14 HG LEU 14 -11.961 -10.958 3.746 97 HD11 LEU 14 HD11 LEU 14 -11.624 -10.907 6.450 98 HD12 LEU 14 HD12 LEU 14 -12.963 -10.158 5.580 99 HD13 LEU 14 HD13 LEU 14 -13.160 -11.759 6.292 100 HD21 LEU 14 HD21 LEU 14 -10.108 -12.374 3.702 101 HD22 LEU 14 HD22 LEU 14 -9.986 -11.571 5.267 102 HD23 LEU 14 HD23 LEU 14 -10.600 -13.222 5.168 103 H VAL 15 H VAL 15 -14.324 -11.137 2.924 104 HA VAL 15 HA VAL 15 -12.889 -9.372 1.183 105 HB VAL 15 HB VAL 15 -14.147 -10.641 -0.501 106 HG11 VAL 15 HG11 VAL 15 -16.767 -9.570 0.203 107 HG12 VAL 15 HG12 VAL 15 -16.307 -11.191 -0.318 108 HG13 VAL 15 HG13 VAL 15 -16.146 -10.731 1.377 109 HG21 VAL 15 HG21 VAL 15 -14.175 -7.821 -0.120 110 HG22 VAL 15 HG22 VAL 15 -14.153 -8.730 -1.631 111 HG23 VAL 15 HG23 VAL 15 -15.691 -8.298 -0.884 112 H THR 16 H THR 16 -13.198 -7.314 1.798 113 HA THR 16 HA THR 16 -15.097 -6.802 3.937 114 HB THR 16 HB THR 16 -12.889 -5.938 4.301 115 HG1 THR 16 HG1 THR 16 -14.588 -3.764 3.579 116 HG21 THR 16 HG21 THR 16 -11.622 -5.313 2.578 117 HG22 THR 16 HG22 THR 16 -13.022 -5.311 1.505 118 HG23 THR 16 HG23 THR 16 -12.610 -3.860 2.419 119 H LEU 17 H LEU 17 -17.120 -6.386 3.294 120 HA LEU 17 HA LEU 17 -17.660 -4.987 0.822 121 HB2 LEU 17 HB2 LEU 17 -19.021 -6.910 1.709 122 HB3 LEU 17 HB3 LEU 17 -19.624 -5.812 2.950 123 HG LEU 17 HG LEU 17 -21.137 -6.206 0.966 124 HD11 LEU 17 HD11 LEU 17 -22.023 -4.075 1.101 125 HD12 LEU 17 HD12 LEU 17 -21.071 -4.182 2.583 126 HD13 LEU 17 HD13 LEU 17 -20.437 -3.308 1.188 127 HD21 LEU 17 HD21 LEU 17 -20.611 -5.510 -1.129 128 HD22 LEU 17 HD22 LEU 17 -19.565 -4.211 -0.557 129 HD23 LEU 17 HD23 LEU 17 -18.981 -5.875 -0.565 130 H PHE 18 H PHE 18 -16.943 -2.896 1.062 131 HA PHE 18 HA PHE 18 -18.234 -1.306 3.179 132 HB2 PHE 18 HB2 PHE 18 -15.515 -1.289 2.045 133 HB3 PHE 18 HB3 PHE 18 -16.235 0.303 2.253 134 HD1 PHE 18 HD1 PHE 18 -17.662 0.288 4.661 135 HD2 PHE 18 HD2 PHE 18 -14.074 -1.808 3.740 136 HE1 PHE 18 HE1 PHE 18 -17.082 0.238 7.051 137 HE2 PHE 18 HE2 PHE 18 -13.488 -1.863 6.129 138 HZ PHE 18 HZ PHE 18 -14.993 -0.839 7.788 139 H LYS 19 H LYS 19 -19.954 -0.282 2.404 140 HA LYS 19 HA LYS 19 -19.758 0.957 -0.264 141 HB2 LYS 19 HB2 LYS 19 -22.105 0.600 -0.589 142 HB3 LYS 19 HB3 LYS 19 -21.392 -0.933 -0.104 143 HG2 LYS 19 HG2 LYS 19 -22.244 -0.690 2.126 144 HG3 LYS 19 HG3 LYS 19 -22.825 0.938 1.768 145 HD2 LYS 19 HD2 LYS 19 -24.749 -0.340 1.565 146 HD3 LYS 19 HD3 LYS 19 -24.188 -0.227 -0.104 147 HE2 LYS 19 HE2 LYS 19 -23.027 -2.429 0.250 148 HE3 LYS 19 HE3 LYS 19 -23.868 -2.542 1.796 149 HZ1 LYS 19 HZ1 LYS 19 -25.013 -3.733 0.003 150 HZ2 LYS 19 HZ2 LYS 19 -25.968 -2.497 0.651 151 HZ3 LYS 19 HZ3 LYS 19 -25.205 -2.281 -0.843 152 H ASN 20 H ASN 20 -20.633 3.024 -0.539 153 HA ASN 20 HA ASN 20 -21.008 5.187 0.061 154 HB2 ASN 20 HB2 ASN 20 -22.734 3.652 1.978 155 HB3 ASN 20 HB3 ASN 20 -22.630 5.406 2.093 156 HD21 ASN 20 HD21 ASN 20 -23.043 6.593 0.042 157 HD22 ASN 20 HD22 ASN 20 -24.294 5.992 -0.987 158 H ALA 21 H ALA 21 -18.631 3.957 1.086 159 HA ALA 21 HA ALA 21 -18.233 4.675 3.814 160 HB1 ALA 21 HB1 ALA 21 -16.603 3.593 1.625 161 HB2 ALA 21 HB2 ALA 21 -15.719 4.563 2.803 162 HB3 ALA 21 HB3 ALA 21 -16.645 3.159 3.333 163 H ILE 22 H ILE 22 -18.136 6.678 4.566 164 HA ILE 22 HA ILE 22 -16.847 8.744 2.907 165 HB ILE 22 HB ILE 22 -19.214 9.157 4.737 166 HG12 ILE 22 HG12 ILE 22 -19.072 9.351 1.722 167 HG13 ILE 22 HG13 ILE 22 -19.722 7.967 2.595 168 HG21 ILE 22 HG21 ILE 22 -17.295 10.973 3.498 169 HG22 ILE 22 HG22 ILE 22 -18.977 11.382 3.159 170 HG23 ILE 22 HG23 ILE 22 -18.422 11.246 4.827 171 HD11 ILE 22 HD11 ILE 22 -20.863 10.671 2.200 172 HD12 ILE 22 HD12 ILE 22 -21.643 9.090 2.157 173 HD13 ILE 22 HD13 ILE 22 -21.227 9.826 3.704 174 H ILE 23 H ILE 23 -15.009 9.344 3.829 175 HA ILE 23 HA ILE 23 -14.704 9.142 6.729 176 HB ILE 23 HB ILE 23 -12.719 9.524 4.498 177 HG12 ILE 23 HG12 ILE 23 -13.524 7.233 4.942 178 HG13 ILE 23 HG13 ILE 23 -11.813 7.409 5.319 179 HG21 ILE 23 HG21 ILE 23 -11.768 10.903 6.089 180 HG22 ILE 23 HG22 ILE 23 -12.389 9.951 7.437 181 HG23 ILE 23 HG23 ILE 23 -11.043 9.342 6.474 182 HD11 ILE 23 HD11 ILE 23 -12.475 7.713 7.713 183 HD12 ILE 23 HD12 ILE 23 -14.114 7.264 7.242 184 HD13 ILE 23 HD13 ILE 23 -12.792 6.115 7.039 185 H LYS 24 H LYS 24 -15.471 10.890 7.753 186 HA LYS 24 HA LYS 24 -14.814 13.547 6.677 187 HB2 LYS 24 HB2 LYS 24 -17.105 12.463 8.215 188 HB3 LYS 24 HB3 LYS 24 -16.595 14.096 8.621 189 HG2 LYS 24 HG2 LYS 24 -16.736 14.572 6.116 190 HG3 LYS 24 HG3 LYS 24 -17.629 13.053 6.008 191 HD2 LYS 24 HD2 LYS 24 -19.406 13.864 7.266 192 HD3 LYS 24 HD3 LYS 24 -18.433 15.143 7.997 193 HE2 LYS 24 HE2 LYS 24 -19.188 15.041 5.080 194 HE3 LYS 24 HE3 LYS 24 -20.087 15.938 6.303 195 HZ1 LYS 24 HZ1 LYS 24 -18.699 17.614 5.978 196 HZ2 LYS 24 HZ2 LYS 24 -17.427 16.669 6.570 197 HZ3 LYS 24 HZ3 LYS 24 -17.755 16.702 4.911 198 H ASN 25 H ASN 25 -12.785 13.893 7.497 199 HA ASN 25 HA ASN 25 -11.172 14.424 9.010 200 HB2 ASN 25 HB2 ASN 25 -13.610 15.017 10.698 201 HB3 ASN 25 HB3 ASN 25 -11.966 15.446 11.160 202 HD21 ASN 25 HD21 ASN 25 -12.397 17.634 11.171 203 HD22 ASN 25 HD22 ASN 25 -12.649 18.539 9.721 204 H ALA 26 H ALA 26 -11.624 11.730 8.779 205 HA ALA 26 HA ALA 26 -12.204 10.241 11.016 206 HB1 ALA 26 HB1 ALA 26 -11.810 8.868 9.256 207 HB2 ALA 26 HB2 ALA 26 -10.466 9.839 8.655 208 HB3 ALA 26 HB3 ALA 26 -10.226 8.750 10.021 209 H TYR 27 H TYR 27 -9.280 12.045 10.291 210 HA TYR 27 HA TYR 27 -8.261 11.354 12.969 211 HB2 TYR 27 HB2 TYR 27 -6.869 11.587 10.341 212 HB3 TYR 27 HB3 TYR 27 -5.998 12.084 11.787 213 HD1 TYR 27 HD1 TYR 27 -4.993 10.488 13.186 214 HD2 TYR 27 HD2 TYR 27 -7.810 9.226 10.258 215 HE1 TYR 27 HE1 TYR 27 -4.410 8.143 13.645 216 HE2 TYR 27 HE2 TYR 27 -7.235 6.877 10.709 217 HH TYR 27 HH TYR 27 -4.513 5.976 12.572 218 H LYS 28 H LYS 28 -8.143 12.996 14.336 219 HA LYS 28 HA LYS 28 -8.578 15.700 13.400 220 HB2 LYS 28 HB2 LYS 28 -8.524 14.342 16.058 221 HB3 LYS 28 HB3 LYS 28 -8.278 16.082 16.003 222 HG2 LYS 28 HG2 LYS 28 -10.643 14.684 14.777 223 HG3 LYS 28 HG3 LYS 28 -10.631 15.373 16.402 224 HD2 LYS 28 HD2 LYS 28 -9.786 17.102 14.132 225 HD3 LYS 28 HD3 LYS 28 -11.505 16.746 14.314 226 HE2 LYS 28 HE2 LYS 28 -11.330 17.514 16.685 227 HE3 LYS 28 HE3 LYS 28 -9.678 18.024 16.343 228 HZ1 LYS 28 HZ1 LYS 28 -11.444 19.787 16.173 229 HZ2 LYS 28 HZ2 LYS 28 -10.429 19.636 14.828 230 HZ3 LYS 28 HZ3 LYS 28 -11.996 19.000 14.781 231 H LYS 29 H LYS 29 -7.224 17.406 14.771 232 HA LYS 29 HA LYS 29 -4.700 17.552 13.688 233 HB2 LYS 29 HB2 LYS 29 -5.684 19.517 14.612 234 HB3 LYS 29 HB3 LYS 29 -5.814 18.784 16.205 235 HG2 LYS 29 HG2 LYS 29 -3.347 18.749 16.348 236 HG3 LYS 29 HG3 LYS 29 -3.278 19.593 14.799 237 HD2 LYS 29 HD2 LYS 29 -4.902 21.267 16.042 238 HD3 LYS 29 HD3 LYS 29 -4.128 20.584 17.474 239 HE2 LYS 29 HE2 LYS 29 -1.962 21.241 16.693 240 HE3 LYS 29 HE3 LYS 29 -2.617 21.727 15.130 241 HZ1 LYS 29 HZ1 LYS 29 -2.226 23.650 16.504 242 HZ2 LYS 29 HZ2 LYS 29 -3.891 23.459 16.273 243 HZ3 LYS 29 HZ3 LYS 29 -3.184 23.015 17.745 244 H GLY 30 H GLY 30 -5.161 17.073 17.190 245 HA2 GLY 30 HA2 GLY 30 -2.638 16.202 17.813 246 HA3 GLY 30 HA3 GLY 30 -4.080 15.684 18.674 247 H GLU 31 H GLU 31 -5.275 14.292 16.465 248 HA GLU 31 HA GLU 31 -3.588 12.393 15.293 249 HB2 GLU 31 HB2 GLU 31 -3.073 11.571 17.475 250 HB3 GLU 31 HB3 GLU 31 -4.765 11.592 17.952 251 HG2 GLU 31 HG2 GLU 31 -5.236 9.807 16.347 252 HG3 GLU 31 HG3 GLU 31 -3.534 9.778 15.888 253 H1 TYR 1 H TYR 1 -1.811 3.775 8.429 254 HA TYR 1 HA TYR 1 -4.537 2.961 9.200 255 HB2 TYR 1 HB2 TYR 1 -4.233 4.790 10.993 256 HB3 TYR 1 HB3 TYR 1 -3.403 3.256 11.230 257 HD1 TYR 1 HD1 TYR 1 -3.015 6.822 10.653 258 HD2 TYR 1 HD2 TYR 1 -0.962 3.102 10.875 259 HE1 TYR 1 HE1 TYR 1 -0.878 8.021 10.868 260 HE2 TYR 1 HE2 TYR 1 1.181 4.291 11.092 261 HH TYR 1 HH TYR 1 1.454 7.693 10.579 262 H GLY 2 H GLY 2 -6.115 4.737 9.338 263 HA2 GLY 2 HA2 GLY 2 -6.386 7.183 8.737 264 HA3 GLY 2 HA3 GLY 2 -5.589 6.741 7.234 265 H GLY 3 H GLY 3 -8.353 7.790 7.960 266 HA2 GLY 3 HA2 GLY 3 -10.524 7.489 7.269 267 HA3 GLY 3 HA3 GLY 3 -9.800 6.676 5.889 268 H PHE 4 H PHE 4 -10.854 4.838 5.553 269 HA PHE 4 HA PHE 4 -12.083 3.381 7.711 270 HB2 PHE 4 HB2 PHE 4 -11.943 3.042 4.733 271 HB3 PHE 4 HB3 PHE 4 -12.519 1.720 5.742 272 HD1 PHE 4 HD1 PHE 4 -14.707 1.703 6.578 273 HD2 PHE 4 HD2 PHE 4 -13.132 5.255 4.840 274 HE1 PHE 4 HE1 PHE 4 -16.949 2.716 6.625 275 HE2 PHE 4 HE2 PHE 4 -15.371 6.274 4.885 276 HZ PHE 4 HZ PHE 4 -17.283 5.005 5.779 277 H MET 5 H MET 5 -11.209 1.788 8.856 278 HA MET 5 HA MET 5 -8.572 0.801 8.115 279 HB2 MET 5 HB2 MET 5 -8.884 1.526 10.412 280 HB3 MET 5 HB3 MET 5 -10.230 0.412 10.613 281 HG2 MET 5 HG2 MET 5 -8.194 -0.418 11.665 282 HG3 MET 5 HG3 MET 5 -8.743 -1.479 10.370 283 HE1 MET 5 HE1 MET 5 -6.494 -2.548 10.800 284 HE2 MET 5 HE2 MET 5 -4.991 -2.034 10.034 285 HE3 MET 5 HE3 MET 5 -5.457 -1.363 11.596 286 H THR 6 H THR 6 -8.536 -0.860 6.747 287 HA THR 6 HA THR 6 -10.588 -2.951 6.993 288 HB THR 6 HB THR 6 -8.694 -2.860 4.684 289 HG1 THR 6 HG1 THR 6 -10.859 -1.081 5.148 290 HG21 THR 6 HG21 THR 6 -11.540 -3.273 4.207 291 HG22 THR 6 HG22 THR 6 -10.162 -4.277 3.756 292 HG23 THR 6 HG23 THR 6 -10.867 -4.419 5.367 293 H SER 7 H SER 7 -9.719 -4.185 8.645 294 HA SER 7 HA SER 7 -7.036 -5.300 8.219 295 HB2 SER 7 HB2 SER 7 -7.958 -4.196 10.464 296 HB3 SER 7 HB3 SER 7 -8.559 -5.833 10.727 297 HG SER 7 HG SER 7 -6.289 -5.175 11.428 298 H GLU 8 H GLU 8 -7.293 -6.984 6.841 299 HA GLU 8 HA GLU 8 -9.210 -9.078 7.632 300 HB2 GLU 8 HB2 GLU 8 -8.478 -7.958 4.987 301 HB3 GLU 8 HB3 GLU 8 -8.709 -9.700 5.060 302 HG2 GLU 8 HG2 GLU 8 -10.844 -9.172 4.640 303 HG3 GLU 8 HG3 GLU 8 -10.905 -8.882 6.378 304 H LYS 9 H LYS 9 -8.223 -10.748 8.534 305 HA LYS 9 HA LYS 9 -5.489 -11.418 7.680 306 HB2 LYS 9 HB2 LYS 9 -5.830 -10.891 10.088 307 HB3 LYS 9 HB3 LYS 9 -6.938 -12.252 10.200 308 HG2 LYS 9 HG2 LYS 9 -4.852 -13.556 9.223 309 HG3 LYS 9 HG3 LYS 9 -3.982 -12.219 9.979 310 HD2 LYS 9 HD2 LYS 9 -6.096 -13.551 11.579 311 HD3 LYS 9 HD3 LYS 9 -4.603 -14.450 11.297 312 HE2 LYS 9 HE2 LYS 9 -4.125 -13.327 13.257 313 HE3 LYS 9 HE3 LYS 9 -3.447 -12.245 12.042 314 HZ1 LYS 9 HZ1 LYS 9 -5.422 -10.885 12.176 315 HZ2 LYS 9 HZ2 LYS 9 -6.123 -11.943 13.295 316 HZ3 LYS 9 HZ3 LYS 9 -4.744 -11.057 13.716 317 H SER 10 H SER 10 -5.456 -12.963 6.187 318 HA SER 10 HA SER 10 -6.700 -15.505 6.716 319 HB2 SER 10 HB2 SER 10 -7.937 -15.570 4.546 320 HB3 SER 10 HB3 SER 10 -8.597 -14.402 5.691 321 HG SER 10 HG SER 10 -7.273 -13.987 3.279 322 H GLN 11 H GLN 11 -5.652 -17.163 5.715 323 HA GLN 11 HA GLN 11 -3.206 -16.481 4.314 324 HB2 GLN 11 HB2 GLN 11 -2.719 -18.910 4.503 325 HB3 GLN 11 HB3 GLN 11 -3.043 -18.144 6.053 326 HG2 GLN 11 HG2 GLN 11 -5.153 -19.141 6.234 327 HG3 GLN 11 HG3 GLN 11 -5.185 -19.581 4.527 328 HE21 GLN 11 HE21 GLN 11 -3.081 -20.087 7.344 329 HE22 GLN 11 HE22 GLN 11 -2.840 -21.776 7.073 330 H THR 12 H THR 12 -5.474 -15.859 2.828 331 HA THR 12 HA THR 12 -5.045 -17.568 0.507 332 HB THR 12 HB THR 12 -7.762 -17.160 0.325 333 HG1 THR 12 HG1 THR 12 -7.744 -16.575 2.594 334 HG21 THR 12 HG21 THR 12 -7.547 -19.698 1.391 335 HG22 THR 12 HG22 THR 12 -7.341 -19.267 -0.307 336 HG23 THR 12 HG23 THR 12 -5.934 -19.388 0.749 337 HA PRO 13 HA PRO 13 -5.324 -13.842 -1.795 338 HB2 PRO 13 HB2 PRO 13 -6.595 -14.629 -4.062 339 HB3 PRO 13 HB3 PRO 13 -4.928 -15.083 -3.688 340 HG2 PRO 13 HG2 PRO 13 -7.447 -16.663 -3.338 341 HG3 PRO 13 HG3 PRO 13 -5.872 -17.191 -3.960 342 HD2 PRO 13 HD2 PRO 13 -6.679 -17.693 -1.424 343 HD3 PRO 13 HD3 PRO 13 -4.976 -17.427 -1.849 344 H LEU 14 H LEU 14 -6.805 -12.828 -0.260 345 HA LEU 14 HA LEU 14 -9.640 -12.942 -0.819 346 HB2 LEU 14 HB2 LEU 14 -9.938 -11.608 1.085 347 HB3 LEU 14 HB3 LEU 14 -8.610 -12.697 1.477 348 HG LEU 14 HG LEU 14 -8.054 -9.929 0.479 349 HD11 LEU 14 HD11 LEU 14 -7.810 -9.723 3.189 350 HD12 LEU 14 HD12 LEU 14 -9.157 -9.098 2.238 351 HD13 LEU 14 HD13 LEU 14 -9.288 -10.671 3.023 352 HD21 LEU 14 HD21 LEU 14 -6.111 -11.214 0.565 353 HD22 LEU 14 HD22 LEU 14 -6.097 -10.334 2.093 354 HD23 LEU 14 HD23 LEU 14 -6.598 -12.024 2.054 355 H VAL 15 H VAL 15 -10.388 -10.300 -0.360 356 HA VAL 15 HA VAL 15 -9.058 -8.515 -2.158 357 HB VAL 15 HB VAL 15 -10.189 -9.958 -3.799 358 HG11 VAL 15 HG11 VAL 15 -12.885 -9.012 -3.182 359 HG12 VAL 15 HG12 VAL 15 -12.324 -10.618 -3.648 360 HG13 VAL 15 HG13 VAL 15 -12.215 -10.100 -1.966 361 HG21 VAL 15 HG21 VAL 15 -10.392 -7.131 -3.570 362 HG22 VAL 15 HG22 VAL 15 -10.296 -8.114 -5.031 363 HG23 VAL 15 HG23 VAL 15 -11.867 -7.733 -4.326 364 H THR 16 H THR 16 -9.563 -6.449 -1.690 365 HA THR 16 HA THR 16 -11.539 -5.993 0.399 366 HB THR 16 HB THR 16 -9.410 -4.957 0.788 367 HG1 THR 16 HG1 THR 16 -11.221 -2.935 -0.084 368 HG21 THR 16 HG21 THR 16 -8.135 -4.318 -0.924 369 HG22 THR 16 HG22 THR 16 -9.495 -4.466 -2.037 370 HG23 THR 16 HG23 THR 16 -9.218 -2.950 -1.180 371 H LEU 17 H LEU 17 -13.566 -5.734 -0.303 372 HA LEU 17 HA LEU 17 -14.131 -4.487 -2.851 373 HB2 LEU 17 HB2 LEU 17 -15.382 -6.460 -1.909 374 HB3 LEU 17 HB3 LEU 17 -16.095 -5.351 -0.739 375 HG LEU 17 HG LEU 17 -17.519 -5.938 -2.738 376 HD11 LEU 17 HD11 LEU 17 -18.550 -3.873 -2.726 377 HD12 LEU 17 HD12 LEU 17 -17.626 -3.834 -1.224 378 HD13 LEU 17 HD13 LEU 17 -17.023 -2.993 -2.652 379 HD21 LEU 17 HD21 LEU 17 -16.980 -5.309 -4.852 380 HD22 LEU 17 HD22 LEU 17 -16.037 -3.918 -4.318 381 HD23 LEU 17 HD23 LEU 17 -15.347 -5.538 -4.228 382 H PHE 18 H PHE 18 -13.543 -2.345 -2.670 383 HA PHE 18 HA PHE 18 -15.001 -0.758 -0.662 384 HB2 PHE 18 HB2 PHE 18 -12.263 -0.605 -1.736 385 HB3 PHE 18 HB3 PHE 18 -13.094 0.943 -1.621 386 HD1 PHE 18 HD1 PHE 18 -14.566 0.967 0.748 387 HD2 PHE 18 HD2 PHE 18 -10.846 -0.968 0.019 388 HE1 PHE 18 HE1 PHE 18 -14.047 1.068 3.151 389 HE2 PHE 18 HE2 PHE 18 -10.321 -0.871 2.420 390 HZ PHE 18 HZ PHE 18 -11.922 0.148 3.990 391 H LYS 19 H LYS 19 -16.779 0.081 -1.532 392 HA LYS 19 HA LYS 19 -16.598 1.229 -4.241 393 HB2 LYS 19 HB2 LYS 19 -18.906 0.689 -4.604 394 HB3 LYS 19 HB3 LYS 19 -18.093 -0.767 -4.045 395 HG2 LYS 19 HG2 LYS 19 -19.017 -0.507 -1.846 396 HG3 LYS 19 HG3 LYS 19 -19.705 1.060 -2.277 397 HD2 LYS 19 HD2 LYS 19 -21.527 -0.359 -2.477 398 HD3 LYS 19 HD3 LYS 19 -20.931 -0.274 -4.136 399 HE2 LYS 19 HE2 LYS 19 -19.624 -2.370 -3.656 400 HE3 LYS 19 HE3 LYS 19 -20.502 -2.481 -2.132 401 HZ1 LYS 19 HZ1 LYS 19 -21.502 -3.823 -3.907 402 HZ2 LYS 19 HZ2 LYS 19 -22.563 -2.636 -3.334 403 HZ3 LYS 19 HZ3 LYS 19 -21.774 -2.421 -4.815 404 H ASN 20 H ASN 20 -17.587 3.220 -4.621 405 HA ASN 20 HA ASN 20 -18.146 5.369 -4.126 406 HB2 ASN 20 HB2 ASN 20 -19.802 3.791 -2.182 407 HB3 ASN 20 HB3 ASN 20 -19.828 5.551 -2.138 408 HD21 ASN 20 HD21 ASN 20 -20.277 6.624 -4.243 409 HD22 ASN 20 HD22 ASN 20 -21.456 5.893 -5.273 410 H ALA 21 H ALA 21 -15.715 4.346 -2.988 411 HA ALA 21 HA ALA 21 -15.437 5.212 -0.290 412 HB1 ALA 21 HB1 ALA 21 -13.688 4.141 -2.385 413 HB2 ALA 21 HB2 ALA 21 -12.895 5.239 -1.256 414 HB3 ALA 21 HB3 ALA 21 -13.727 3.805 -0.654 415 H ILE 22 H ILE 22 -15.508 7.249 0.370 416 HA ILE 22 HA ILE 22 -14.324 9.327 -1.352 417 HB ILE 22 HB ILE 22 -16.753 9.654 0.413 418 HG12 ILE 22 HG12 ILE 22 -16.566 9.713 -2.605 419 HG13 ILE 22 HG13 ILE 22 -17.131 8.328 -1.677 420 HG21 ILE 22 HG21 ILE 22 -14.941 11.540 -0.876 421 HG22 ILE 22 HG22 ILE 22 -16.637 11.810 -1.276 422 HG23 ILE 22 HG23 ILE 22 -16.120 11.798 0.410 423 HD11 ILE 22 HD11 ILE 22 -18.455 10.923 -2.218 424 HD12 ILE 22 HD12 ILE 22 -19.119 9.289 -2.205 425 HD13 ILE 22 HD13 ILE 22 -18.790 10.119 -0.684 426 H ILE 23 H ILE 23 -12.566 10.123 -0.423 427 HA ILE 23 HA ILE 23 -12.316 10.065 2.491 428 HB ILE 23 HB ILE 23 -10.303 10.477 0.290 429 HG12 ILE 23 HG12 ILE 23 -10.974 8.159 0.826 430 HG13 ILE 23 HG13 ILE 23 -9.285 8.464 1.218 431 HG21 ILE 23 HG21 ILE 23 -9.488 11.986 1.839 432 HG22 ILE 23 HG22 ILE 23 -10.079 11.053 3.214 433 HG23 ILE 23 HG23 ILE 23 -8.671 10.496 2.309 434 HD11 ILE 23 HD11 ILE 23 -10.003 8.830 3.586 435 HD12 ILE 23 HD12 ILE 23 -11.604 8.259 3.115 436 HD13 ILE 23 HD13 ILE 23 -10.210 7.186 2.982 437 H LYS 24 H LYS 24 -13.212 11.804 3.417 438 HA LYS 24 HA LYS 24 -12.713 14.446 2.222 439 HB2 LYS 24 HB2 LYS 24 -14.957 13.286 3.779 440 HB3 LYS 24 HB3 LYS 24 -14.569 14.972 4.096 441 HG2 LYS 24 HG2 LYS 24 -14.691 15.288 1.563 442 HG3 LYS 24 HG3 LYS 24 -15.481 13.710 1.536 443 HD2 LYS 24 HD2 LYS 24 -17.330 14.474 2.712 444 HD3 LYS 24 HD3 LYS 24 -16.457 15.854 3.383 445 HE2 LYS 24 HE2 LYS 24 -17.144 15.539 0.465 446 HE3 LYS 24 HE3 LYS 24 -18.124 16.442 1.619 447 HZ1 LYS 24 HZ1 LYS 24 -16.841 18.184 1.223 448 HZ2 LYS 24 HZ2 LYS 24 -15.522 17.360 1.888 449 HZ3 LYS 24 HZ3 LYS 24 -15.819 17.278 0.224 450 H ASN 25 H ASN 25 -10.731 14.969 3.060 451 HA ASN 25 HA ASN 25 -9.190 15.681 4.574 452 HB2 ASN 25 HB2 ASN 25 -11.697 16.184 6.190 453 HB3 ASN 25 HB3 ASN 25 -10.095 16.751 6.654 454 HD21 ASN 25 HD21 ASN 25 -10.674 18.901 6.547 455 HD22 ASN 25 HD22 ASN 25 -10.963 19.713 5.050 456 H ALA 26 H ALA 26 -9.464 12.951 4.468 457 HA ALA 26 HA ALA 26 -9.988 11.534 6.761 458 HB1 ALA 26 HB1 ALA 26 -9.455 10.111 5.078 459 HB2 ALA 26 HB2 ALA 26 -8.167 11.146 4.462 460 HB3 ALA 26 HB3 ALA 26 -7.887 10.141 5.884 461 H TYR 27 H TYR 27 -7.186 13.512 6.018 462 HA TYR 27 HA TYR 27 -6.189 13.019 8.748 463 HB2 TYR 27 HB2 TYR 27 -4.747 13.225 6.145 464 HB3 TYR 27 HB3 TYR 27 -3.950 13.846 7.586 465 HD1 TYR 27 HD1 TYR 27 -2.871 12.389 9.076 466 HD2 TYR 27 HD2 TYR 27 -5.530 10.802 6.159 467 HE1 TYR 27 HE1 TYR 27 -2.143 10.114 9.660 468 HE2 TYR 27 HE2 TYR 27 -4.811 8.522 6.735 469 HH TYR 27 HH TYR 27 -2.078 7.897 8.694 470 H LYS 28 H LYS 28 -6.211 14.730 10.035 471 HA LYS 28 HA LYS 28 -6.817 17.347 8.959 472 HB2 LYS 28 HB2 LYS 28 -6.709 16.131 11.684 473 HB3 LYS 28 HB3 LYS 28 -6.597 17.880 11.540 474 HG2 LYS 28 HG2 LYS 28 -8.825 16.241 10.357 475 HG3 LYS 28 HG3 LYS 28 -8.895 17.011 11.944 476 HD2 LYS 28 HD2 LYS 28 -8.145 18.682 9.600 477 HD3 LYS 28 HD3 LYS 28 -9.835 18.204 9.777 478 HE2 LYS 28 HE2 LYS 28 -9.757 19.101 12.109 479 HE3 LYS 28 HE3 LYS 28 -8.146 19.725 11.757 480 HZ1 LYS 28 HZ1 LYS 28 -10.045 21.329 11.479 481 HZ2 LYS 28 HZ2 LYS 28 -9.006 21.189 10.150 482 HZ3 LYS 28 HZ3 LYS 28 -10.517 20.428 10.127 483 H LYS 29 H LYS 29 -5.611 19.205 10.287 484 HA LYS 29 HA LYS 29 -3.092 19.495 9.226 485 HB2 LYS 29 HB2 LYS 29 -4.222 21.415 10.069 486 HB3 LYS 29 HB3 LYS 29 -4.324 20.730 11.686 487 HG2 LYS 29 HG2 LYS 29 -1.866 20.878 11.865 488 HG3 LYS 29 HG3 LYS 29 -1.827 21.662 10.284 489 HD2 LYS 29 HD2 LYS 29 -3.591 23.262 11.441 490 HD3 LYS 29 HD3 LYS 29 -2.779 22.700 12.905 491 HE2 LYS 29 HE2 LYS 29 -0.661 23.480 12.102 492 HE3 LYS 29 HE3 LYS 29 -1.343 23.856 10.520 493 HZ1 LYS 29 HZ1 LYS 29 -1.101 25.854 11.819 494 HZ2 LYS 29 HZ2 LYS 29 -2.747 25.531 11.594 495 HZ3 LYS 29 HZ3 LYS 29 -2.015 25.199 13.083 496 H GLY 30 H GLY 30 -3.513 19.167 12.745 497 HA2 GLY 30 HA2 GLY 30 -0.949 18.471 13.398 498 HA3 GLY 30 HA3 GLY 30 -2.356 17.912 14.291 499 H GLU 31 H GLU 31 -3.482 16.328 12.196 500 HA GLU 31 HA GLU 31 -1.661 14.472 11.127 501 HB2 GLU 31 HB2 GLU 31 -1.181 13.799 13.375 502 HB3 GLU 31 HB3 GLU 31 -2.890 13.731 13.780 503 HG2 GLU 31 HG2 GLU 31 -3.179 11.849 12.248 504 HG3 GLU 31 HG3 GLU 31 -1.462 11.914 11.852 505 H1 TYR 1 H TYR 1 0.890 5.679 4.742 506 HA TYR 1 HA TYR 1 -1.801 4.731 5.483 507 HB2 TYR 1 HB2 TYR 1 -1.666 6.655 7.190 508 HB3 TYR 1 HB3 TYR 1 -0.734 5.199 7.519 509 HD1 TYR 1 HD1 TYR 1 -0.590 8.753 6.773 510 HD2 TYR 1 HD2 TYR 1 1.720 5.208 7.224 511 HE1 TYR 1 HE1 TYR 1 1.449 10.114 6.973 512 HE2 TYR 1 HE2 TYR 1 3.765 6.559 7.426 513 HH TYR 1 HH TYR 1 3.806 9.943 6.749 514 H GLY 2 H GLY 2 -3.495 6.400 5.487 515 HA2 GLY 2 HA2 GLY 2 -3.908 8.791 4.758 516 HA3 GLY 2 HA3 GLY 2 -3.039 8.331 3.301 517 H GLY 3 H GLY 3 -5.891 9.220 3.916 518 HA2 GLY 3 HA2 GLY 3 -8.016 8.740 3.183 519 HA3 GLY 3 HA3 GLY 3 -7.200 7.920 1.860 520 H PHE 4 H PHE 4 -8.106 5.997 1.582 521 HA PHE 4 HA PHE 4 -9.300 4.555 3.770 522 HB2 PHE 4 HB2 PHE 4 -9.047 4.099 0.817 523 HB3 PHE 4 HB3 PHE 4 -9.554 2.780 1.867 524 HD1 PHE 4 HD1 PHE 4 -11.757 2.639 2.654 525 HD2 PHE 4 HD2 PHE 4 -10.399 6.216 0.788 526 HE1 PHE 4 HE1 PHE 4 -14.067 3.483 2.599 527 HE2 PHE 4 HE2 PHE 4 -12.708 7.066 0.731 528 HZ PHE 4 HZ PHE 4 -14.545 5.700 1.637 529 H MET 5 H MET 5 -8.360 3.069 5.006 530 HA MET 5 HA MET 5 -5.639 2.236 4.381 531 HB2 MET 5 HB2 MET 5 -6.057 3.055 6.629 532 HB3 MET 5 HB3 MET 5 -7.328 1.862 6.859 533 HG2 MET 5 HG2 MET 5 -5.268 1.229 7.997 534 HG3 MET 5 HG3 MET 5 -5.711 0.069 6.747 535 HE1 MET 5 HE1 MET 5 -3.407 -0.819 7.280 536 HE2 MET 5 HE2 MET 5 -1.924 -0.244 6.518 537 HE3 MET 5 HE3 MET 5 -2.471 0.471 8.034 538 H THR 6 H THR 6 -5.476 0.523 3.084 539 HA THR 6 HA THR 6 -7.389 -1.686 3.395 540 HB THR 6 HB THR 6 -5.430 -1.591 1.140 541 HG1 THR 6 HG1 THR 6 -7.726 0.057 1.438 542 HG21 THR 6 HG21 THR 6 -8.220 -2.214 0.591 543 HG22 THR 6 HG22 THR 6 -6.767 -3.155 0.257 544 HG23 THR 6 HG23 THR 6 -7.530 -3.245 1.845 545 H SER 7 H SER 7 -6.510 -2.793 5.122 546 HA SER 7 HA SER 7 -3.743 -3.739 4.851 547 HB2 SER 7 HB2 SER 7 -4.832 -2.610 7.007 548 HB3 SER 7 HB3 SER 7 -5.331 -4.273 7.317 549 HG SER 7 HG SER 7 -3.146 -3.435 8.081 550 H GLU 8 H GLU 8 -3.823 -5.494 3.542 551 HA GLU 8 HA GLU 8 -5.627 -7.681 4.348 552 HB2 GLU 8 HB2 GLU 8 -4.872 -6.619 1.688 553 HB3 GLU 8 HB3 GLU 8 -4.977 -8.368 1.824 554 HG2 GLU 8 HG2 GLU 8 -7.128 -8.021 1.307 555 HG3 GLU 8 HG3 GLU 8 -7.278 -7.663 3.026 556 H LYS 9 H LYS 9 -4.566 -9.242 5.357 557 HA LYS 9 HA LYS 9 -1.760 -9.751 4.638 558 HB2 LYS 9 HB2 LYS 9 -2.266 -9.156 7.012 559 HB3 LYS 9 HB3 LYS 9 -3.241 -10.615 7.128 560 HG2 LYS 9 HG2 LYS 9 -1.011 -11.753 6.298 561 HG3 LYS 9 HG3 LYS 9 -0.291 -10.304 7.003 562 HD2 LYS 9 HD2 LYS 9 -2.325 -11.728 8.623 563 HD3 LYS 9 HD3 LYS 9 -0.760 -12.520 8.418 564 HE2 LYS 9 HE2 LYS 9 -0.416 -11.267 10.326 565 HE3 LYS 9 HE3 LYS 9 0.202 -10.194 9.070 566 HZ1 LYS 9 HZ1 LYS 9 -1.871 -8.988 9.100 567 HZ2 LYS 9 HZ2 LYS 9 -2.521 -10.047 10.247 568 HZ3 LYS 9 HZ3 LYS 9 -1.227 -9.040 10.663 569 H SER 10 H SER 10 -1.541 -11.355 3.228 570 HA SER 10 HA SER 10 -2.629 -13.953 3.806 571 HB2 SER 10 HB2 SER 10 -3.779 -14.194 1.606 572 HB3 SER 10 HB3 SER 10 -4.557 -13.019 2.666 573 HG SER 10 HG SER 10 -3.172 -12.633 0.285 574 H GLN 11 H GLN 11 -1.429 -15.568 2.911 575 HA GLN 11 HA GLN 11 1.012 -14.761 1.566 576 HB2 GLN 11 HB2 GLN 11 1.679 -17.129 1.890 577 HB3 GLN 11 HB3 GLN 11 1.230 -16.328 3.389 578 HG2 GLN 11 HG2 GLN 11 -0.801 -17.484 3.531 579 HG3 GLN 11 HG3 GLN 11 -0.722 -17.997 1.846 580 HE21 GLN 11 HE21 GLN 11 1.292 -18.208 4.765 581 HE22 GLN 11 HE22 GLN 11 1.678 -19.882 4.583 582 H THR 12 H THR 12 -1.238 -14.381 -0.023 583 HA THR 12 HA THR 12 -0.597 -16.151 -2.246 584 HB THR 12 HB THR 12 -3.332 -15.966 -2.528 585 HG1 THR 12 HG1 THR 12 -3.430 -15.299 -0.283 586 HG21 THR 12 HG21 THR 12 -2.945 -18.438 -1.353 587 HG22 THR 12 HG22 THR 12 -2.733 -18.057 -3.062 588 HG23 THR 12 HG23 THR 12 -1.347 -18.022 -1.972 589 HA PRO 13 HA PRO 13 -1.092 -12.567 -4.729 590 HB2 PRO 13 HB2 PRO 13 -2.230 -13.549 -6.990 591 HB3 PRO 13 HB3 PRO 13 -0.546 -13.857 -6.550 592 HG2 PRO 13 HG2 PRO 13 -2.947 -15.609 -6.195 593 HG3 PRO 13 HG3 PRO 13 -1.318 -16.041 -6.749 594 HD2 PRO 13 HD2 PRO 13 -2.162 -16.490 -4.215 595 HD3 PRO 13 HD3 PRO 13 -0.472 -16.113 -4.606 596 H LEU 14 H LEU 14 -2.685 -11.585 -3.298 597 HA LEU 14 HA LEU 14 -5.488 -11.947 -3.925 598 HB2 LEU 14 HB2 LEU 14 -5.945 -10.561 -2.092 599 HB3 LEU 14 HB3 LEU 14 -4.550 -11.526 -1.613 600 HG LEU 14 HG LEU 14 -4.172 -8.770 -2.723 601 HD11 LEU 14 HD11 LEU 14 -4.042 -8.429 -0.016 602 HD12 LEU 14 HD12 LEU 14 -5.390 -7.940 -1.043 603 HD13 LEU 14 HD13 LEU 14 -5.444 -9.485 -0.192 604 HD21 LEU 14 HD21 LEU 14 -2.145 -9.907 -2.511 605 HD22 LEU 14 HD22 LEU 14 -2.247 -8.946 -1.036 606 HD23 LEU 14 HD23 LEU 14 -2.622 -10.669 -0.994 607 H VAL 15 H VAL 15 -6.435 -9.343 -3.598 608 HA VAL 15 HA VAL 15 -5.188 -7.549 -5.445 609 HB VAL 15 HB VAL 15 -6.174 -9.144 -7.042 610 HG11 VAL 15 HG11 VAL 15 -8.941 -8.353 -6.538 611 HG12 VAL 15 HG12 VAL 15 -8.263 -9.938 -6.910 612 HG13 VAL 15 HG13 VAL 15 -8.236 -9.334 -5.253 613 HG21 VAL 15 HG21 VAL 15 -6.566 -6.330 -6.954 614 HG22 VAL 15 HG22 VAL 15 -6.368 -7.371 -8.364 615 HG23 VAL 15 HG23 VAL 15 -7.979 -7.062 -7.715 616 H THR 16 H THR 16 -5.863 -5.504 -5.104 617 HA THR 16 HA THR 16 -7.918 -5.099 -3.079 618 HB THR 16 HB THR 16 -5.878 -3.900 -2.683 619 HG1 THR 16 HG1 THR 16 -7.799 -2.050 -3.691 620 HG21 THR 16 HG21 THR 16 -4.602 -3.245 -4.388 621 HG22 THR 16 HG22 THR 16 -5.915 -3.540 -5.528 622 HG23 THR 16 HG23 THR 16 -5.771 -1.971 -4.736 623 H LEU 17 H LEU 17 -9.937 -5.022 -3.848 624 HA LEU 17 HA LEU 17 -10.513 -3.928 -6.462 625 HB2 LEU 17 HB2 LEU 17 -11.650 -5.942 -5.462 626 HB3 LEU 17 HB3 LEU 17 -12.473 -4.835 -4.365 627 HG LEU 17 HG LEU 17 -13.795 -5.609 -6.369 628 HD11 LEU 17 HD11 LEU 17 -14.963 -3.621 -6.485 629 HD12 LEU 17 HD12 LEU 17 -14.088 -3.448 -4.963 630 HD13 LEU 17 HD13 LEU 17 -13.502 -2.636 -6.415 631 HD21 LEU 17 HD21 LEU 17 -13.239 -5.045 -8.496 632 HD22 LEU 17 HD22 LEU 17 -12.406 -3.569 -8.007 633 HD23 LEU 17 HD23 LEU 17 -11.612 -5.133 -7.820 634 H PHE 18 H PHE 18 -10.082 -1.744 -6.364 635 HA PHE 18 HA PHE 18 -11.703 -0.178 -4.468 636 HB2 PHE 18 HB2 PHE 18 -8.954 0.120 -5.478 637 HB3 PHE 18 HB3 PHE 18 -9.892 1.609 -5.464 638 HD1 PHE 18 HD1 PHE 18 -11.433 1.643 -3.138 639 HD2 PHE 18 HD2 PHE 18 -7.567 -0.056 -3.672 640 HE1 PHE 18 HE1 PHE 18 -10.992 1.898 -0.731 641 HE2 PHE 18 HE2 PHE 18 -7.120 0.196 -1.266 642 HZ PHE 18 HZ PHE 18 -8.834 1.173 0.209 643 H LYS 19 H LYS 19 -13.511 0.494 -5.417 644 HA LYS 19 HA LYS 19 -13.338 1.531 -8.171 645 HB2 LYS 19 HB2 LYS 19 -15.591 0.810 -8.565 646 HB3 LYS 19 HB3 LYS 19 -14.692 -0.558 -7.920 647 HG2 LYS 19 HG2 LYS 19 -15.694 -0.274 -5.761 648 HG3 LYS 19 HG3 LYS 19 -16.474 1.224 -6.274 649 HD2 LYS 19 HD2 LYS 19 -18.190 -0.324 -6.456 650 HD3 LYS 19 HD3 LYS 19 -17.558 -0.263 -8.103 651 HE2 LYS 19 HE2 LYS 19 -16.125 -2.244 -7.508 652 HE3 LYS 19 HE3 LYS 19 -17.034 -2.356 -6.002 653 HZ1 LYS 19 HZ1 LYS 19 -17.891 -3.830 -7.747 654 HZ2 LYS 19 HZ2 LYS 19 -19.046 -2.701 -7.244 655 HZ3 LYS 19 HZ3 LYS 19 -18.237 -2.485 -8.714 656 H ASN 20 H ASN 20 -14.455 3.427 -8.665 657 HA ASN 20 HA ASN 20 -15.180 5.550 -8.282 658 HB2 ASN 20 HB2 ASN 20 -16.771 3.941 -6.309 659 HB3 ASN 20 HB3 ASN 20 -16.922 5.696 -6.342 660 HD21 ASN 20 HD21 ASN 20 -17.390 6.643 -8.503 661 HD22 ASN 20 HD22 ASN 20 -18.487 5.787 -9.527 662 H ALA 21 H ALA 21 -12.713 4.755 -7.041 663 HA ALA 21 HA ALA 21 -12.569 5.756 -4.379 664 HB1 ALA 21 HB1 ALA 21 -10.694 4.724 -6.383 665 HB2 ALA 21 HB2 ALA 21 -10.012 5.926 -5.286 666 HB3 ALA 21 HB3 ALA 21 -10.755 4.463 -4.640 667 H ILE 22 H ILE 22 -12.805 7.809 -3.814 668 HA ILE 22 HA ILE 22 -11.730 9.891 -5.602 669 HB ILE 22 HB ILE 22 -14.220 10.109 -3.905 670 HG12 ILE 22 HG12 ILE 22 -13.956 10.073 -6.918 671 HG13 ILE 22 HG13 ILE 22 -14.447 8.686 -5.951 672 HG21 ILE 22 HG21 ILE 22 -12.514 12.076 -5.218 673 HG22 ILE 22 HG22 ILE 22 -14.213 12.207 -5.671 674 HG23 ILE 22 HG23 ILE 22 -13.744 12.292 -3.973 675 HD11 ILE 22 HD11 ILE 22 -15.936 11.158 -6.625 676 HD12 ILE 22 HD12 ILE 22 -16.483 9.482 -6.563 677 HD13 ILE 22 HD13 ILE 22 -16.254 10.391 -5.069 678 H ILE 23 H ILE 23 -10.062 10.863 -4.677 679 HA ILE 23 HA ILE 23 -9.875 10.948 -1.757 680 HB ILE 23 HB ILE 23 -7.843 11.400 -3.933 681 HG12 ILE 23 HG12 ILE 23 -8.363 9.067 -3.302 682 HG13 ILE 23 HG13 ILE 23 -6.710 9.509 -2.889 683 HG21 ILE 23 HG21 ILE 23 -7.173 13.033 -2.440 684 HG22 ILE 23 HG22 ILE 23 -7.731 12.124 -1.035 685 HG23 ILE 23 HG23 ILE 23 -6.266 11.627 -1.882 686 HD11 ILE 23 HD11 ILE 23 -7.512 9.933 -0.556 687 HD12 ILE 23 HD12 ILE 23 -9.055 9.225 -1.034 688 HD13 ILE 23 HD13 ILE 23 -7.585 8.252 -1.085 689 H LYS 24 H LYS 24 -10.911 12.660 -0.933 690 HA LYS 24 HA LYS 24 -10.569 15.273 -2.241 691 HB2 LYS 24 HB2 LYS 24 -12.761 14.032 -0.672 692 HB3 LYS 24 HB3 LYS 24 -12.501 15.755 -0.435 693 HG2 LYS 24 HG2 LYS 24 -12.585 15.929 -2.986 694 HG3 LYS 24 HG3 LYS 24 -13.267 14.302 -2.941 695 HD2 LYS 24 HD2 LYS 24 -15.188 15.002 -1.841 696 HD3 LYS 24 HD3 LYS 24 -14.423 16.471 -1.231 697 HE2 LYS 24 HE2 LYS 24 -15.027 15.953 -4.139 698 HE3 LYS 24 HE3 LYS 24 -16.087 16.851 -3.054 699 HZ1 LYS 24 HZ1 LYS 24 -14.912 18.650 -3.526 700 HZ2 LYS 24 HZ2 LYS 24 -13.557 17.953 -2.793 701 HZ3 LYS 24 HZ3 LYS 24 -13.813 17.760 -4.454 702 H ASN 25 H ASN 25 -8.652 15.979 -1.389 703 HA ASN 25 HA ASN 25 -7.199 16.865 0.120 704 HB2 ASN 25 HB2 ASN 25 -9.771 17.263 1.661 705 HB3 ASN 25 HB3 ASN 25 -8.224 17.963 2.128 706 HD21 ASN 25 HD21 ASN 25 -8.950 20.059 1.906 707 HD22 ASN 25 HD22 ASN 25 -9.261 20.778 0.366 708 H ALA 26 H ALA 26 -7.288 14.117 0.139 709 HA ALA 26 HA ALA 26 -7.764 12.773 2.484 710 HB1 ALA 26 HB1 ALA 26 -7.089 11.318 0.881 711 HB2 ALA 26 HB2 ALA 26 -5.860 12.413 0.248 712 HB3 ALA 26 HB3 ALA 26 -5.548 11.496 1.721 713 H TYR 27 H TYR 27 -5.094 14.916 1.715 714 HA TYR 27 HA TYR 27 -4.138 14.621 4.487 715 HB2 TYR 27 HB2 TYR 27 -2.641 14.803 1.913 716 HB3 TYR 27 HB3 TYR 27 -1.929 15.544 3.342 717 HD1 TYR 27 HD1 TYR 27 -0.805 14.235 4.935 718 HD2 TYR 27 HD2 TYR 27 -3.251 12.336 2.017 719 HE1 TYR 27 HE1 TYR 27 0.058 12.044 5.646 720 HE2 TYR 27 HE2 TYR 27 -2.395 10.140 2.720 721 HH TYR 27 HH TYR 27 0.308 9.798 4.788 722 H LYS 28 H LYS 28 -4.308 16.387 5.686 723 HA LYS 28 HA LYS 28 -5.065 18.899 4.468 724 HB2 LYS 28 HB2 LYS 28 -4.939 17.828 7.254 725 HB3 LYS 28 HB3 LYS 28 -4.946 19.572 7.023 726 HG2 LYS 28 HG2 LYS 28 -7.025 17.721 5.880 727 HG3 LYS 28 HG3 LYS 28 -7.187 18.563 7.424 728 HD2 LYS 28 HD2 LYS 28 -6.498 20.166 5.014 729 HD3 LYS 28 HD3 LYS 28 -8.153 19.574 5.175 730 HE2 LYS 28 HE2 LYS 28 -8.202 20.588 7.461 731 HE3 LYS 28 HE3 LYS 28 -6.632 21.311 7.114 732 HZ1 LYS 28 HZ1 LYS 28 -8.633 22.756 6.711 733 HZ2 LYS 28 HZ2 LYS 28 -7.553 22.626 5.414 734 HZ3 LYS 28 HZ3 LYS 28 -9.005 21.756 5.398 735 H LYS 29 H LYS 29 -4.023 20.900 5.725 736 HA LYS 29 HA LYS 29 -1.504 21.313 4.703 737 HB2 LYS 29 HB2 LYS 29 -2.781 23.191 5.423 738 HB3 LYS 29 HB3 LYS 29 -2.882 22.578 7.068 739 HG2 LYS 29 HG2 LYS 29 -0.445 22.902 7.301 740 HG3 LYS 29 HG3 LYS 29 -0.416 23.612 5.685 741 HD2 LYS 29 HD2 LYS 29 -2.314 25.141 6.718 742 HD3 LYS 29 HD3 LYS 29 -1.509 24.703 8.227 743 HE2 LYS 29 HE2 LYS 29 0.575 25.588 7.444 744 HE3 LYS 29 HE3 LYS 29 -0.084 25.843 5.829 745 HZ1 LYS 29 HZ1 LYS 29 -0.016 27.911 7.034 746 HZ2 LYS 29 HZ2 LYS 29 -1.629 27.466 6.783 747 HZ3 LYS 29 HZ3 LYS 29 -0.920 27.255 8.305 748 H GLY 30 H GLY 30 -1.988 21.130 8.225 749 HA2 GLY 30 HA2 GLY 30 0.600 20.650 8.968 750 HA3 GLY 30 HA3 GLY 30 -0.786 20.033 9.855 751 H GLU 31 H GLU 31 -1.741 18.275 7.815 752 HA GLU 31 HA GLU 31 0.238 16.509 6.881 753 HB2 GLU 31 HB2 GLU 31 0.702 15.966 9.164 754 HB3 GLU 31 HB3 GLU 31 -1.009 15.813 9.539 755 HG2 GLU 31 HG2 GLU 31 -1.151 13.843 8.105 756 HG3 GLU 31 HG3 GLU 31 0.563 13.996 7.726 757 H1 TYR 1 H TYR 1 3.528 7.614 1.003 758 HA TYR 1 HA TYR 1 0.892 6.513 1.731 759 HB2 TYR 1 HB2 TYR 1 0.847 8.517 3.347 760 HB3 TYR 1 HB3 TYR 1 1.869 7.147 3.768 761 HD1 TYR 1 HD1 TYR 1 1.788 10.664 2.850 762 HD2 TYR 1 HD2 TYR 1 4.322 7.316 3.539 763 HE1 TYR 1 HE1 TYR 1 3.721 12.173 3.033 764 HE2 TYR 1 HE2 TYR 1 6.262 8.816 3.725 765 HH TYR 1 HH TYR 1 6.091 12.156 2.877 766 H GLY 2 H GLY 2 -0.912 8.056 1.613 767 HA2 GLY 2 HA2 GLY 2 -1.469 10.377 0.761 768 HA3 GLY 2 HA3 GLY 2 -0.530 9.914 -0.650 769 H GLY 3 H GLY 3 -3.455 10.623 -0.141 770 HA2 GLY 3 HA2 GLY 3 -5.520 9.963 -0.904 771 HA3 GLY 3 HA3 GLY 3 -4.613 9.145 -2.168 772 H PHE 4 H PHE 4 -5.374 7.151 -2.377 773 HA PHE 4 HA PHE 4 -6.526 5.729 -0.155 774 HB2 PHE 4 HB2 PHE 4 -6.157 5.159 -3.076 775 HB3 PHE 4 HB3 PHE 4 -6.600 3.856 -1.978 776 HD1 PHE 4 HD1 PHE 4 -8.808 3.592 -1.240 777 HD2 PHE 4 HD2 PHE 4 -7.655 7.170 -3.238 778 HE1 PHE 4 HE1 PHE 4 -11.170 4.265 -1.393 779 HE2 PHE 4 HE2 PHE 4 -10.015 7.848 -3.393 780 HZ PHE 4 HZ PHE 4 -11.776 6.395 -2.469 781 H MET 5 H MET 5 -5.522 4.369 1.173 782 HA MET 5 HA MET 5 -2.732 3.702 0.654 783 HB2 MET 5 HB2 MET 5 -3.264 4.598 2.849 784 HB3 MET 5 HB3 MET 5 -4.457 3.332 3.109 785 HG2 MET 5 HG2 MET 5 -2.391 2.897 4.324 786 HG3 MET 5 HG3 MET 5 -2.718 1.652 3.122 787 HE1 MET 5 HE1 MET 5 -0.371 0.961 3.765 788 HE2 MET 5 HE2 MET 5 1.088 1.600 3.008 789 HE3 MET 5 HE3 MET 5 0.451 2.352 4.470 790 H THR 6 H THR 6 -2.412 1.941 -0.544 791 HA THR 6 HA THR 6 -4.184 -0.374 -0.179 792 HB THR 6 HB THR 6 -2.155 -0.273 -2.368 793 HG1 THR 6 HG1 THR 6 -4.545 1.259 -2.237 794 HG21 THR 6 HG21 THR 6 -4.884 -1.073 -2.985 795 HG22 THR 6 HG22 THR 6 -3.372 -1.953 -3.210 796 HG23 THR 6 HG23 THR 6 -4.196 -1.999 -1.651 797 H SER 7 H SER 7 -3.306 -1.351 1.620 798 HA SER 7 HA SER 7 -0.471 -2.110 1.500 799 HB2 SER 7 HB2 SER 7 -1.726 -0.969 3.559 800 HB3 SER 7 HB3 SER 7 -2.119 -2.649 3.925 801 HG SER 7 HG SER 7 -0.032 -1.625 4.734 802 H GLU 8 H GLU 8 -0.382 -3.918 0.266 803 HA GLU 8 HA GLU 8 -2.057 -6.192 1.108 804 HB2 GLU 8 HB2 GLU 8 -1.282 -5.192 -1.572 805 HB3 GLU 8 HB3 GLU 8 -1.275 -6.938 -1.361 806 HG2 GLU 8 HG2 GLU 8 -3.424 -6.762 -1.962 807 HG3 GLU 8 HG3 GLU 8 -3.659 -6.340 -0.267 808 H LYS 9 H LYS 9 -0.922 -7.622 2.225 809 HA LYS 9 HA LYS 9 1.935 -7.961 1.619 810 HB2 LYS 9 HB2 LYS 9 1.296 -7.306 3.947 811 HB3 LYS 9 HB3 LYS 9 0.434 -8.832 4.094 812 HG2 LYS 9 HG2 LYS 9 2.772 -9.825 3.390 813 HG3 LYS 9 HG3 LYS 9 3.354 -8.295 4.048 814 HD2 LYS 9 HD2 LYS 9 1.383 -9.808 5.666 815 HD3 LYS 9 HD3 LYS 9 3.014 -10.473 5.552 816 HE2 LYS 9 HE2 LYS 9 3.183 -9.112 7.408 817 HE3 LYS 9 HE3 LYS 9 3.753 -8.046 6.124 818 HZ1 LYS 9 HZ1 LYS 9 1.590 -7.019 6.031 819 HZ2 LYS 9 HZ2 LYS 9 0.986 -8.081 7.201 820 HZ3 LYS 9 HZ3 LYS 9 2.175 -6.952 7.617 821 H SER 10 H SER 10 2.318 -9.604 0.290 822 HA SER 10 HA SER 10 1.401 -12.247 0.946 823 HB2 SER 10 HB2 SER 10 0.343 -12.661 -1.278 824 HB3 SER 10 HB3 SER 10 -0.555 -11.516 -0.282 825 HG SER 10 HG SER 10 0.864 -11.103 -2.638 826 H GLN 11 H GLN 11 2.755 -13.797 0.172 827 HA GLN 11 HA GLN 11 5.162 -12.867 -1.154 828 HB2 GLN 11 HB2 GLN 11 6.007 -15.149 -0.693 829 HB3 GLN 11 HB3 GLN 11 5.437 -14.327 0.754 830 HG2 GLN 11 HG2 GLN 11 3.509 -15.645 0.882 831 HG3 GLN 11 HG3 GLN 11 3.686 -16.217 -0.776 832 HE21 GLN 11 HE21 GLN 11 5.610 -16.142 2.210 833 HE22 GLN 11 HE22 GLN 11 6.139 -17.784 2.111 834 H THR 12 H THR 12 2.969 -12.717 -2.831 835 HA THR 12 HA THR 12 3.795 -14.545 -4.940 836 HB THR 12 HB THR 12 1.062 -14.576 -5.304 837 HG1 THR 12 HG1 THR 12 0.855 -13.817 -3.093 838 HG21 THR 12 HG21 THR 12 1.593 -16.957 -4.006 839 HG22 THR 12 HG22 THR 12 1.830 -16.638 -5.724 840 HG23 THR 12 HG23 THR 12 3.175 -16.452 -4.598 841 HA PRO 13 HA PRO 13 3.117 -11.129 -7.609 842 HB2 PRO 13 HB2 PRO 13 2.127 -12.298 -9.850 843 HB3 PRO 13 HB3 PRO 13 3.814 -12.457 -9.348 844 HG2 PRO 13 HG2 PRO 13 1.539 -14.367 -8.975 845 HG3 PRO 13 HG3 PRO 13 3.212 -14.701 -9.461 846 HD2 PRO 13 HD2 PRO 13 2.323 -15.093 -6.933 847 HD3 PRO 13 HD3 PRO 13 3.993 -14.608 -7.294 848 H LEU 14 H LEU 14 1.411 -10.203 -6.274 849 HA LEU 14 HA LEU 14 -1.336 -10.802 -6.966 850 HB2 LEU 14 HB2 LEU 14 -1.954 -9.372 -5.214 851 HB3 LEU 14 HB3 LEU 14 -0.514 -10.216 -4.648 852 HG LEU 14 HG LEU 14 -0.288 -7.489 -5.866 853 HD11 LEU 14 HD11 LEU 14 -0.274 -7.042 -3.165 854 HD12 LEU 14 HD12 LEU 14 -1.604 -6.667 -4.260 855 HD13 LEU 14 HD13 LEU 14 -1.605 -8.182 -3.357 856 HD21 LEU 14 HD21 LEU 14 1.804 -8.470 -5.543 857 HD22 LEU 14 HD22 LEU 14 1.586 -7.459 -4.114 858 HD23 LEU 14 HD23 LEU 14 1.330 -9.201 -4.010 859 H VAL 15 H VAL 15 -2.477 -8.260 -6.782 860 HA VAL 15 HA VAL 15 -1.304 -6.462 -8.673 861 HB VAL 15 HB VAL 15 -2.128 -8.198 -10.218 862 HG11 VAL 15 HG11 VAL 15 -4.956 -7.571 -9.844 863 HG12 VAL 15 HG12 VAL 15 -4.163 -9.124 -10.106 864 HG13 VAL 15 HG13 VAL 15 -4.236 -8.434 -8.485 865 HG21 VAL 15 HG21 VAL 15 -2.706 -5.415 -10.279 866 HG22 VAL 15 HG22 VAL 15 -2.389 -6.504 -11.630 867 HG23 VAL 15 HG23 VAL 15 -4.039 -6.275 -11.049 868 H THR 16 H THR 16 -2.137 -4.458 -8.451 869 HA THR 16 HA THR 16 -4.275 -4.115 -6.501 870 HB THR 16 HB THR 16 -2.339 -2.755 -6.107 871 HG1 THR 16 HG1 THR 16 -4.357 -1.095 -7.249 872 HG21 THR 16 HG21 THR 16 -1.064 -2.072 -7.802 873 HG22 THR 16 HG22 THR 16 -2.310 -2.530 -8.963 874 HG23 THR 16 HG23 THR 16 -2.320 -0.917 -8.249 875 H LEU 17 H LEU 17 -6.273 -4.206 -7.319 876 HA LEU 17 HA LEU 17 -6.846 -3.280 -9.999 877 HB2 LEU 17 HB2 LEU 17 -7.868 -5.323 -8.940 878 HB3 LEU 17 HB3 LEU 17 -8.796 -4.232 -7.913 879 HG LEU 17 HG LEU 17 -10.003 -5.185 -9.914 880 HD11 LEU 17 HD11 LEU 17 -11.309 -3.295 -10.141 881 HD12 LEU 17 HD12 LEU 17 -10.490 -2.996 -8.608 882 HD13 LEU 17 HD13 LEU 17 -9.926 -2.202 -10.079 883 HD21 LEU 17 HD21 LEU 17 -9.431 -4.666 -12.049 884 HD22 LEU 17 HD22 LEU 17 -8.721 -3.115 -11.602 885 HD23 LEU 17 HD23 LEU 17 -7.821 -4.607 -11.330 886 H PHE 18 H PHE 18 -6.570 -1.068 -9.989 887 HA PHE 18 HA PHE 18 -8.352 0.461 -8.212 888 HB2 PHE 18 HB2 PHE 18 -5.604 0.911 -9.167 889 HB3 PHE 18 HB3 PHE 18 -6.646 2.328 -9.245 890 HD1 PHE 18 HD1 PHE 18 -8.249 2.355 -6.961 891 HD2 PHE 18 HD2 PHE 18 -4.259 0.918 -7.321 892 HE1 PHE 18 HE1 PHE 18 -7.894 2.749 -4.559 893 HE2 PHE 18 HE2 PHE 18 -3.898 1.308 -4.919 894 HZ PHE 18 HZ PHE 18 -5.717 2.224 -3.534 895 H LYS 19 H LYS 19 -10.176 0.958 -9.235 896 HA LYS 19 HA LYS 19 -10.001 1.880 -12.030 897 HB2 LYS 19 HB2 LYS 19 -12.181 0.978 -12.448 898 HB3 LYS 19 HB3 LYS 19 -11.210 -0.289 -11.709 899 HG2 LYS 19 HG2 LYS 19 -12.296 0.026 -9.596 900 HG3 LYS 19 HG3 LYS 19 -13.162 1.439 -10.205 901 HD2 LYS 19 HD2 LYS 19 -14.760 -0.232 -10.357 902 HD3 LYS 19 HD3 LYS 19 -14.084 -0.204 -11.987 903 HE2 LYS 19 HE2 LYS 19 -12.537 -2.050 -11.256 904 HE3 LYS 19 HE3 LYS 19 -13.482 -2.154 -9.771 905 HZ1 LYS 19 HZ1 LYS 19 -14.181 -3.766 -11.465 906 HZ2 LYS 19 HZ2 LYS 19 -15.427 -2.699 -11.049 907 HZ3 LYS 19 HZ3 LYS 19 -14.590 -2.495 -12.505 908 H ASN 20 H ASN 20 -11.224 3.671 -12.637 909 HA ASN 20 HA ASN 20 -12.113 5.748 -12.373 910 HB2 ASN 20 HB2 ASN 20 -13.638 4.123 -10.362 911 HB3 ASN 20 HB3 ASN 20 -13.913 5.858 -10.486 912 HD21 ASN 20 HD21 ASN 20 -14.387 6.663 -12.704 913 HD22 ASN 20 HD22 ASN 20 -15.392 5.681 -13.709 914 H ALA 21 H ALA 21 -9.631 5.188 -11.036 915 HA ALA 21 HA ALA 21 -9.627 6.313 -8.422 916 HB1 ALA 21 HB1 ALA 21 -7.635 5.331 -10.333 917 HB2 ALA 21 HB2 ALA 21 -7.066 6.636 -9.291 918 HB3 ALA 21 HB3 ALA 21 -7.712 5.157 -8.580 919 H ILE 22 H ILE 22 -10.040 8.365 -7.962 920 HA ILE 22 HA ILE 22 -9.074 10.443 -9.814 921 HB ILE 22 HB ILE 22 -11.615 10.543 -8.184 922 HG12 ILE 22 HG12 ILE 22 -11.265 10.401 -11.185 923 HG13 ILE 22 HG13 ILE 22 -11.690 9.027 -10.170 924 HG21 ILE 22 HG21 ILE 22 -10.026 12.580 -9.535 925 HG22 ILE 22 HG22 ILE 22 -11.717 12.564 -10.035 926 HG23 ILE 22 HG23 ILE 22 -11.303 12.751 -8.331 927 HD11 ILE 22 HD11 ILE 22 -13.320 11.361 -10.993 928 HD12 ILE 22 HD12 ILE 22 -13.755 9.655 -10.873 929 HD13 ILE 22 HD13 ILE 22 -13.633 10.639 -9.414 930 H ILE 23 H ILE 23 -7.499 11.567 -8.896 931 HA ILE 23 HA ILE 23 -7.399 11.799 -5.980 932 HB ILE 23 HB ILE 23 -5.343 12.293 -8.125 933 HG12 ILE 23 HG12 ILE 23 -5.720 9.960 -7.400 934 HG13 ILE 23 HG13 ILE 23 -4.113 10.533 -6.969 935 HG21 ILE 23 HG21 ILE 23 -4.829 14.033 -6.692 936 HG22 ILE 23 HG22 ILE 23 -5.359 13.149 -5.261 937 HG23 ILE 23 HG23 ILE 23 -3.841 12.721 -6.051 938 HD11 ILE 23 HD11 ILE 23 -5.002 11.003 -4.678 939 HD12 ILE 23 HD12 ILE 23 -6.480 10.171 -5.159 940 HD13 ILE 23 HD13 ILE 23 -4.947 9.300 -5.131 941 H LYS 24 H LYS 24 -8.572 13.470 -5.263 942 HA LYS 24 HA LYS 24 -8.376 16.037 -6.687 943 HB2 LYS 24 HB2 LYS 24 -10.518 14.720 -5.110 944 HB3 LYS 24 HB3 LYS 24 -10.383 16.466 -4.952 945 HG2 LYS 24 HG2 LYS 24 -10.412 16.515 -7.509 946 HG3 LYS 24 HG3 LYS 24 -10.981 14.848 -7.401 947 HD2 LYS 24 HD2 LYS 24 -12.974 15.461 -6.382 948 HD3 LYS 24 HD3 LYS 24 -12.329 17.006 -5.824 949 HE2 LYS 24 HE2 LYS 24 -12.818 16.316 -8.718 950 HE3 LYS 24 HE3 LYS 24 -13.966 17.185 -7.701 951 HZ1 LYS 24 HZ1 LYS 24 -12.907 19.039 -8.231 952 HZ2 LYS 24 HZ2 LYS 24 -11.527 18.474 -7.432 953 HZ3 LYS 24 HZ3 LYS 24 -11.722 18.187 -9.088 954 H ASN 25 H ASN 25 -6.535 16.915 -5.826 955 HA ASN 25 HA ASN 25 -5.187 17.970 -4.328 956 HB2 ASN 25 HB2 ASN 25 -7.820 18.254 -2.866 957 HB3 ASN 25 HB3 ASN 25 -6.338 19.082 -2.397 958 HD21 ASN 25 HD21 ASN 25 -7.200 21.109 -2.733 959 HD22 ASN 25 HD22 ASN 25 -7.522 21.734 -4.311 960 H ALA 26 H ALA 26 -5.083 15.227 -4.182 961 HA ALA 26 HA ALA 26 -5.524 13.959 -1.790 962 HB1 ALA 26 HB1 ALA 26 -4.704 12.487 -3.307 963 HB2 ALA 26 HB2 ALA 26 -3.539 13.638 -3.962 964 HB3 ALA 26 HB3 ALA 26 -3.203 12.812 -2.440 965 H TYR 27 H TYR 27 -2.989 16.248 -2.597 966 HA TYR 27 HA TYR 27 -2.092 16.151 0.209 967 HB2 TYR 27 HB2 TYR 27 -0.540 16.316 -2.334 968 HB3 TYR 27 HB3 TYR 27 0.079 17.173 -0.927 969 HD1 TYR 27 HD1 TYR 27 1.245 16.024 0.757 970 HD2 TYR 27 HD2 TYR 27 -0.978 13.820 -2.125 971 HE1 TYR 27 HE1 TYR 27 2.238 13.936 1.596 972 HE2 TYR 27 HE2 TYR 27 0.009 11.726 -1.294 973 HH TYR 27 HH TYR 27 2.667 11.676 0.860 974 H LYS 28 H LYS 28 -2.410 17.956 1.317 975 HA LYS 28 HA LYS 28 -3.310 20.349 -0.039 976 HB2 LYS 28 HB2 LYS 28 -3.181 19.420 2.797 977 HB3 LYS 28 HB3 LYS 28 -3.300 21.146 2.484 978 HG2 LYS 28 HG2 LYS 28 -5.220 19.106 1.387 979 HG3 LYS 28 HG3 LYS 28 -5.477 20.009 2.882 980 HD2 LYS 28 HD2 LYS 28 -4.835 21.538 0.413 981 HD3 LYS 28 HD3 LYS 28 -6.450 20.840 0.562 982 HE2 LYS 28 HE2 LYS 28 -6.632 21.954 2.794 983 HE3 LYS 28 HE3 LYS 28 -5.107 22.769 2.450 984 HZ1 LYS 28 HZ1 LYS 28 -7.191 24.049 1.928 985 HZ2 LYS 28 HZ2 LYS 28 -6.070 23.933 0.666 986 HZ3 LYS 28 HZ3 LYS 28 -7.457 22.964 0.657 987 H LYS 29 H LYS 29 -2.441 22.475 1.140 988 HA LYS 29 HA LYS 29 0.068 23.016 0.154 989 HB2 LYS 29 HB2 LYS 29 -1.352 24.831 0.755 990 HB3 LYS 29 HB3 LYS 29 -1.454 24.290 2.425 991 HG2 LYS 29 HG2 LYS 29 0.948 24.794 2.698 992 HG3 LYS 29 HG3 LYS 29 0.971 25.429 1.051 993 HD2 LYS 29 HD2 LYS 29 -1.053 26.868 1.964 994 HD3 LYS 29 HD3 LYS 29 -0.264 26.556 3.512 995 HE2 LYS 29 HE2 LYS 29 1.776 27.548 2.740 996 HE3 LYS 29 HE3 LYS 29 1.148 27.681 1.099 997 HZ1 LYS 29 HZ1 LYS 29 1.040 29.802 2.204 998 HZ2 LYS 29 HZ2 LYS 29 -0.530 29.235 1.933 999 HZ3 LYS 29 HZ3 LYS 29 0.147 29.144 3.481 1000 H GLY 30 H GLY 30 -0.489 22.964 3.670 1001 HA2 GLY 30 HA2 GLY 30 2.107 22.703 4.491 1002 HA3 GLY 30 HA3 GLY 30 0.746 22.032 5.377 1003 H GLU 31 H GLU 31 -0.035 20.117 3.406 1004 HA GLU 31 HA GLU 31 2.083 18.453 2.599 1005 HB2 GLU 31 HB2 GLU 31 2.532 18.053 4.914 1006 HB3 GLU 31 HB3 GLU 31 0.828 17.798 5.263 1007 HG2 GLU 31 HG2 GLU 31 0.856 15.757 3.924 1008 HG3 GLU 31 HG3 GLU 31 2.565 16.012 3.574 1009 H1 TYR 1 H TYR 1 6.124 9.558 -2.732 1010 HA TYR 1 HA TYR 1 3.549 8.319 -2.010 1011 HB2 TYR 1 HB2 TYR 1 3.328 10.388 -0.496 1012 HB3 TYR 1 HB3 TYR 1 4.430 9.115 0.015 1013 HD1 TYR 1 HD1 TYR 1 4.131 12.569 -1.075 1014 HD2 TYR 1 HD2 TYR 1 6.872 9.444 -0.171 1015 HE1 TYR 1 HE1 TYR 1 5.950 14.217 -0.924 1016 HE2 TYR 1 HE2 TYR 1 8.699 11.083 -0.016 1017 HH TYR 1 HH TYR 1 8.320 14.358 -1.030 1018 H GLY 2 H GLY 2 1.649 9.717 -2.257 1019 HA2 GLY 2 HA2 GLY 2 0.961 11.954 -3.233 1020 HA3 GLY 2 HA3 GLY 2 1.970 11.492 -4.595 1021 H GLY 3 H GLY 3 -1.012 12.017 -4.192 1022 HA2 GLY 3 HA2 GLY 3 -3.004 11.179 -4.974 1023 HA3 GLY 3 HA3 GLY 3 -2.007 10.371 -6.176 1024 H PHE 4 H PHE 4 -2.623 8.321 -6.311 1025 HA PHE 4 HA PHE 4 -3.734 6.922 -4.053 1026 HB2 PHE 4 HB2 PHE 4 -3.247 6.250 -6.935 1027 HB3 PHE 4 HB3 PHE 4 -3.626 4.969 -5.789 1028 HD1 PHE 4 HD1 PHE 4 -5.830 4.585 -5.088 1029 HD2 PHE 4 HD2 PHE 4 -4.877 8.136 -7.232 1030 HE1 PHE 4 HE1 PHE 4 -8.228 5.079 -5.328 1031 HE2 PHE 4 HE2 PHE 4 -7.274 8.636 -7.475 1032 HZ PHE 4 HZ PHE 4 -8.953 7.107 -6.522 1033 H MET 5 H MET 5 -2.672 5.706 -2.636 1034 HA MET 5 HA MET 5 0.168 5.208 -3.060 1035 HB2 MET 5 HB2 MET 5 -0.475 6.173 -0.926 1036 HB3 MET 5 HB3 MET 5 -1.588 4.845 -0.627 1037 HG2 MET 5 HG2 MET 5 0.473 4.613 0.653 1038 HG3 MET 5 HG3 MET 5 0.258 3.289 -0.489 1039 HE1 MET 5 HE1 MET 5 2.628 2.782 0.227 1040 HE2 MET 5 HE2 MET 5 4.060 3.484 -0.525 1041 HE3 MET 5 HE3 MET 5 3.338 4.257 0.885 1042 H THR 6 H THR 6 0.637 3.415 -4.158 1043 HA THR 6 HA THR 6 -0.987 1.007 -3.719 1044 HB THR 6 HB THR 6 1.102 1.134 -5.850 1045 HG1 THR 6 HG1 THR 6 -1.392 2.499 -5.875 1046 HG21 THR 6 HG21 THR 6 -1.541 0.120 -6.512 1047 HG22 THR 6 HG22 THR 6 0.032 -0.670 -6.630 1048 HG23 THR 6 HG23 THR 6 -0.850 -0.684 -5.103 1049 H SER 7 H SER 7 -0.113 0.165 -1.857 1050 HA SER 7 HA SER 7 2.770 -0.396 -1.844 1051 HB2 SER 7 HB2 SER 7 1.365 0.744 0.116 1052 HB3 SER 7 HB3 SER 7 1.076 -0.942 0.547 1053 HG SER 7 HG SER 7 3.056 0.262 1.377 1054 H GLU 8 H GLU 8 3.037 -2.250 -2.979 1055 HA GLU 8 HA GLU 8 1.492 -4.596 -2.086 1056 HB2 GLU 8 HB2 GLU 8 2.279 -3.664 -4.788 1057 HB3 GLU 8 HB3 GLU 8 2.397 -5.394 -4.494 1058 HG2 GLU 8 HG2 GLU 8 0.261 -5.397 -5.158 1059 HG3 GLU 8 HG3 GLU 8 -0.055 -4.907 -3.495 1060 H LYS 9 H LYS 9 2.695 -5.874 -0.860 1061 HA LYS 9 HA LYS 9 5.585 -6.036 -1.371 1062 HB2 LYS 9 HB2 LYS 9 4.813 -5.340 0.907 1063 HB3 LYS 9 HB3 LYS 9 4.070 -6.923 1.089 1064 HG2 LYS 9 HG2 LYS 9 6.497 -7.758 0.505 1065 HG3 LYS 9 HG3 LYS 9 6.940 -6.158 1.105 1066 HD2 LYS 9 HD2 LYS 9 5.041 -7.743 2.740 1067 HD3 LYS 9 HD3 LYS 9 6.721 -8.284 2.702 1068 HE2 LYS 9 HE2 LYS 9 6.729 -6.830 4.494 1069 HE3 LYS 9 HE3 LYS 9 7.255 -5.783 3.176 1070 HZ1 LYS 9 HZ1 LYS 9 5.023 -4.933 2.975 1071 HZ2 LYS 9 HZ2 LYS 9 4.467 -5.984 4.178 1072 HZ3 LYS 9 HZ3 LYS 9 5.552 -4.747 4.571 1073 H SER 10 H SER 10 6.127 -7.696 -2.622 1074 HA SER 10 HA SER 10 5.386 -10.372 -1.885 1075 HB2 SER 10 HB2 SER 10 4.437 -10.948 -4.124 1076 HB3 SER 10 HB3 SER 10 3.422 -9.841 -3.198 1077 HG SER 10 HG SER 10 4.884 -9.401 -5.525 1078 H GLN 11 H GLN 11 6.891 -11.833 -2.526 1079 HA GLN 11 HA GLN 11 9.258 -10.782 -3.829 1080 HB2 GLN 11 HB2 GLN 11 10.256 -12.972 -3.241 1081 HB3 GLN 11 HB3 GLN 11 9.580 -12.134 -1.851 1082 HG2 GLN 11 HG2 GLN 11 7.759 -13.591 -1.711 1083 HG3 GLN 11 HG3 GLN 11 8.017 -14.209 -3.341 1084 HE21 GLN 11 HE21 GLN 11 9.854 -13.885 -0.318 1085 HE22 GLN 11 HE22 GLN 11 10.505 -15.485 -0.344 1086 H THR 12 H THR 12 7.122 -10.868 -5.578 1087 HA THR 12 HA THR 12 8.150 -12.718 -7.576 1088 HB THR 12 HB THR 12 5.440 -12.970 -8.020 1089 HG1 THR 12 HG1 THR 12 5.106 -12.140 -5.851 1090 HG21 THR 12 HG21 THR 12 6.106 -15.249 -6.605 1091 HG22 THR 12 HG22 THR 12 6.372 -14.983 -8.329 1092 HG23 THR 12 HG23 THR 12 7.663 -14.650 -7.175 1093 HA PRO 13 HA PRO 13 7.312 -9.476 -10.412 1094 HB2 PRO 13 HB2 PRO 13 6.502 -10.811 -12.632 1095 HB3 PRO 13 HB3 PRO 13 8.177 -10.815 -12.066 1096 HG2 PRO 13 HG2 PRO 13 6.045 -12.882 -11.688 1097 HG3 PRO 13 HG3 PRO 13 7.755 -13.102 -12.101 1098 HD2 PRO 13 HD2 PRO 13 6.806 -13.459 -9.590 1099 HD3 PRO 13 HD3 PRO 13 8.444 -12.858 -9.915 1100 H LEU 14 H LEU 14 5.492 -8.630 -9.182 1101 HA LEU 14 HA LEU 14 2.828 -9.475 -9.941 1102 HB2 LEU 14 HB2 LEU 14 2.033 -8.024 -8.277 1103 HB3 LEU 14 HB3 LEU 14 3.507 -8.735 -7.623 1104 HG LEU 14 HG LEU 14 3.582 -6.049 -8.945 1105 HD11 LEU 14 HD11 LEU 14 3.456 -5.474 -6.282 1106 HD12 LEU 14 HD12 LEU 14 2.128 -5.286 -7.428 1107 HD13 LEU 14 HD13 LEU 14 2.243 -6.743 -6.441 1108 HD21 LEU 14 HD21 LEU 14 5.727 -6.856 -8.505 1109 HD22 LEU 14 HD22 LEU 14 5.378 -5.813 -7.127 1110 HD23 LEU 14 HD23 LEU 14 5.247 -7.564 -6.963 1111 H VAL 15 H VAL 15 1.491 -7.019 -9.901 1112 HA VAL 15 HA VAL 15 2.593 -5.223 -11.838 1113 HB VAL 15 HB VAL 15 1.934 -7.077 -13.323 1114 HG11 VAL 15 HG11 VAL 15 -0.940 -6.634 -13.041 1115 HG12 VAL 15 HG12 VAL 15 -0.035 -8.137 -13.222 1116 HG13 VAL 15 HG13 VAL 15 -0.195 -7.391 -11.633 1117 HG21 VAL 15 HG21 VAL 15 1.180 -4.348 -13.528 1118 HG22 VAL 15 HG22 VAL 15 1.583 -5.477 -14.822 1119 HG23 VAL 15 HG23 VAL 15 -0.087 -5.322 -14.274 1120 H THR 16 H THR 16 1.605 -3.276 -11.752 1121 HA THR 16 HA THR 16 -0.597 -2.995 -9.862 1122 HB THR 16 HB THR 16 1.226 -1.480 -9.493 1123 HG1 THR 16 HG1 THR 16 -0.878 -0.032 -10.761 1124 HG21 THR 16 HG21 THR 16 2.494 -0.794 -11.192 1125 HG22 THR 16 HG22 THR 16 1.311 -1.391 -12.356 1126 HG23 THR 16 HG23 THR 16 1.175 0.249 -11.722 1127 H LEU 17 H LEU 17 -2.561 -3.274 -10.720 1128 HA LEU 17 HA LEU 17 -3.131 -2.518 -13.453 1129 HB2 LEU 17 HB2 LEU 17 -4.029 -4.578 -12.319 1130 HB3 LEU 17 HB3 LEU 17 -5.060 -3.512 -11.367 1131 HG LEU 17 HG LEU 17 -6.146 -4.641 -13.343 1132 HD11 LEU 17 HD11 LEU 17 -7.572 -2.860 -13.698 1133 HD12 LEU 17 HD12 LEU 17 -6.818 -2.430 -12.163 1134 HD13 LEU 17 HD13 LEU 17 -6.270 -1.672 -13.658 1135 HD21 LEU 17 HD21 LEU 17 -5.556 -4.192 -15.488 1136 HD22 LEU 17 HD22 LEU 17 -4.968 -2.574 -15.107 1137 HD23 LEU 17 HD23 LEU 17 -3.974 -3.983 -14.738 1138 H PHE 18 H PHE 18 -3.017 -0.293 -13.546 1139 HA PHE 18 HA PHE 18 -4.951 1.182 -11.886 1140 HB2 PHE 18 HB2 PHE 18 -2.217 1.787 -12.796 1141 HB3 PHE 18 HB3 PHE 18 -3.356 3.119 -12.966 1142 HD1 PHE 18 HD1 PHE 18 -5.016 3.139 -10.726 1143 HD2 PHE 18 HD2 PHE 18 -0.927 1.971 -10.919 1144 HE1 PHE 18 HE1 PHE 18 -4.756 3.667 -8.337 1145 HE2 PHE 18 HE2 PHE 18 -0.661 2.497 -8.531 1146 HZ PHE 18 HZ PHE 18 -2.576 3.345 -7.236 1147 H LYS 19 H LYS 19 -6.777 1.495 -12.975 1148 HA LYS 19 HA LYS 19 -6.592 2.298 -15.806 1149 HB2 LYS 19 HB2 LYS 19 -8.685 1.218 -16.235 1150 HB3 LYS 19 HB3 LYS 19 -7.651 0.062 -15.406 1151 HG2 LYS 19 HG2 LYS 19 -8.822 0.399 -13.344 1152 HG3 LYS 19 HG3 LYS 19 -9.764 1.717 -14.044 1153 HD2 LYS 19 HD2 LYS 19 -11.236 -0.071 -14.154 1154 HD3 LYS 19 HD3 LYS 19 -10.518 -0.068 -15.767 1155 HE2 LYS 19 HE2 LYS 19 -8.864 -1.762 -14.910 1156 HE3 LYS 19 HE3 LYS 19 -9.845 -1.870 -13.449 1157 HZ1 LYS 19 HZ1 LYS 19 -10.374 -3.599 -15.088 1158 HZ2 LYS 19 HZ2 LYS 19 -11.705 -2.609 -14.754 1159 HZ3 LYS 19 HZ3 LYS 19 -10.841 -2.407 -16.195 1160 H ASN 20 H ASN 20 -7.929 3.962 -16.528 1161 HA ASN 20 HA ASN 20 -8.973 5.979 -16.385 1162 HB2 ASN 20 HB2 ASN 20 -10.428 4.336 -14.338 1163 HB3 ASN 20 HB3 ASN 20 -10.822 6.041 -14.541 1164 HD21 ASN 20 HD21 ASN 20 -11.297 6.719 -16.800 1165 HD22 ASN 20 HD22 ASN 20 -12.205 5.628 -17.785 1166 H ALA 21 H ALA 21 -6.492 5.664 -14.965 1167 HA ALA 21 HA ALA 21 -6.634 6.903 -12.410 1168 HB1 ALA 21 HB1 ALA 21 -4.537 5.978 -14.224 1169 HB2 ALA 21 HB2 ALA 21 -4.086 7.388 -13.265 1170 HB3 ALA 21 HB3 ALA 21 -4.627 5.913 -12.464 1171 H ILE 22 H ILE 22 -7.184 8.940 -12.034 1172 HA ILE 22 HA ILE 22 -6.349 11.003 -13.964 1173 HB ILE 22 HB ILE 22 -8.927 10.972 -12.390 1174 HG12 ILE 22 HG12 ILE 22 -8.492 10.743 -15.375 1175 HG13 ILE 22 HG13 ILE 22 -8.845 9.383 -14.314 1176 HG21 ILE 22 HG21 ILE 22 -7.466 13.074 -13.784 1177 HG22 ILE 22 HG22 ILE 22 -9.139 12.910 -14.318 1178 HG23 ILE 22 HG23 ILE 22 -8.781 13.190 -12.614 1179 HD11 ILE 22 HD11 ILE 22 -10.615 11.558 -15.270 1180 HD12 ILE 22 HD12 ILE 22 -10.930 9.832 -15.091 1181 HD13 ILE 22 HD13 ILE 22 -10.917 10.878 -13.671 1182 H ILE 23 H ILE 23 -4.881 12.277 -13.067 1183 HA ILE 23 HA ILE 23 -4.867 12.646 -10.163 1184 HB ILE 23 HB ILE 23 -2.799 13.190 -12.283 1185 HG12 ILE 23 HG12 ILE 23 -3.026 10.870 -11.466 1186 HG13 ILE 23 HG13 ILE 23 -1.476 11.576 -11.018 1187 HG21 ILE 23 HG21 ILE 23 -2.448 15.024 -10.918 1188 HG22 ILE 23 HG22 ILE 23 -2.945 14.164 -9.461 1189 HG23 ILE 23 HG23 ILE 23 -1.383 13.815 -10.201 1190 HD11 ILE 23 HD11 ILE 23 -2.467 12.076 -8.774 1191 HD12 ILE 23 HD12 ILE 23 -3.865 11.116 -9.258 1192 HD13 ILE 23 HD13 ILE 23 -2.273 10.364 -9.150 1193 H LYS 24 H LYS 24 -6.189 14.255 -9.564 1194 HA LYS 24 HA LYS 24 -6.135 16.763 -11.099 1195 HB2 LYS 24 HB2 LYS 24 -8.215 15.366 -9.509 1196 HB3 LYS 24 HB3 LYS 24 -8.208 17.123 -9.425 1197 HG2 LYS 24 HG2 LYS 24 -8.176 17.058 -11.984 1198 HG3 LYS 24 HG3 LYS 24 -8.634 15.362 -11.811 1199 HD2 LYS 24 HD2 LYS 24 -10.688 15.882 -10.861 1200 HD3 LYS 24 HD3 LYS 24 -10.162 17.493 -10.365 1201 HE2 LYS 24 HE2 LYS 24 -10.536 16.637 -13.231 1202 HE3 LYS 24 HE3 LYS 24 -11.763 17.473 -12.280 1203 HZ1 LYS 24 HZ1 LYS 24 -10.817 19.367 -12.878 1204 HZ2 LYS 24 HZ2 LYS 24 -9.422 18.935 -12.025 1205 HZ3 LYS 24 HZ3 LYS 24 -9.559 18.559 -13.669 1206 H ASN 25 H ASN 25 -4.378 17.804 -10.242 1207 HA ASN 25 HA ASN 25 -3.145 19.022 -8.768 1208 HB2 ASN 25 HB2 ASN 25 -5.830 19.192 -7.385 1209 HB3 ASN 25 HB3 ASN 25 -4.420 20.140 -6.920 1210 HD21 ASN 25 HD21 ASN 25 -5.407 22.086 -7.373 1211 HD22 ASN 25 HD22 ASN 25 -5.726 22.614 -8.987 1212 H ALA 26 H ALA 26 -2.855 16.304 -8.485 1213 HA ALA 26 HA ALA 26 -3.269 15.124 -6.042 1214 HB1 ALA 26 HB1 ALA 26 -2.313 13.642 -7.466 1215 HB2 ALA 26 HB2 ALA 26 -1.212 14.838 -8.150 1216 HB3 ALA 26 HB3 ALA 26 -0.861 14.111 -6.583 1217 H TYR 27 H TYR 27 -0.872 17.539 -6.908 1218 HA TYR 27 HA TYR 27 -0.043 17.641 -4.081 1219 HB2 TYR 27 HB2 TYR 27 1.555 17.791 -6.596 1220 HB3 TYR 27 HB3 TYR 27 2.079 18.757 -5.221 1221 HD1 TYR 27 HD1 TYR 27 3.279 17.778 -3.456 1222 HD2 TYR 27 HD2 TYR 27 1.288 15.284 -6.269 1223 HE1 TYR 27 HE1 TYR 27 4.394 15.810 -2.490 1224 HE2 TYR 27 HE2 TYR 27 2.397 13.308 -5.311 1225 HH TYR 27 HH TYR 27 4.998 13.552 -3.102 1226 H LYS 28 H LYS 28 -0.515 19.469 -3.071 1227 HA LYS 28 HA LYS 28 -1.542 21.726 -4.561 1228 HB2 LYS 28 HB2 LYS 28 -1.419 20.946 -1.681 1229 HB3 LYS 28 HB3 LYS 28 -1.651 22.642 -2.083 1230 HG2 LYS 28 HG2 LYS 28 -3.394 20.418 -3.117 1231 HG3 LYS 28 HG3 LYS 28 -3.752 21.371 -1.674 1232 HD2 LYS 28 HD2 LYS 28 -3.158 22.825 -4.199 1233 HD3 LYS 28 HD3 LYS 28 -4.721 22.017 -4.056 1234 HE2 LYS 28 HE2 LYS 28 -5.046 23.217 -1.886 1235 HE3 LYS 28 HE3 LYS 28 -3.575 24.125 -2.231 1236 HZ1 LYS 28 HZ1 LYS 28 -5.728 25.224 -2.865 1237 HZ2 LYS 28 HZ2 LYS 28 -4.568 25.131 -4.093 1238 HZ3 LYS 28 HZ3 LYS 28 -5.881 24.064 -4.088 1239 H LYS 29 H LYS 29 -0.851 23.963 -3.483 1240 HA LYS 29 HA LYS 29 1.639 24.628 -4.435 1241 HB2 LYS 29 HB2 LYS 29 0.089 26.369 -3.963 1242 HB3 LYS 29 HB3 LYS 29 -0.029 25.902 -2.271 1243 HG2 LYS 29 HG2 LYS 29 2.326 26.581 -1.959 1244 HG3 LYS 29 HG3 LYS 29 2.354 27.140 -3.633 1245 HD2 LYS 29 HD2 LYS 29 0.212 28.477 -2.843 1246 HD3 LYS 29 HD3 LYS 29 0.971 28.290 -1.261 1247 HE2 LYS 29 HE2 LYS 29 2.964 29.382 -2.021 1248 HE3 LYS 29 HE3 LYS 29 2.379 29.401 -3.684 1249 HZ1 LYS 29 HZ1 LYS 29 2.095 31.556 -2.680 1250 HZ2 LYS 29 HZ2 LYS 29 0.575 30.871 -2.965 1251 HZ3 LYS 29 HZ3 LYS 29 1.211 30.895 -1.398 1252 H GLY 30 H GLY 30 0.990 24.697 -0.935 1253 HA2 GLY 30 HA2 GLY 30 3.577 24.665 -0.041 1254 HA3 GLY 30 HA3 GLY 30 2.243 23.942 0.845 1255 H GLU 31 H GLU 31 1.649 21.883 -1.042 1256 HA GLU 31 HA GLU 31 3.898 20.337 -1.720 1257 HB2 GLU 31 HB2 GLU 31 4.321 20.082 0.618 1258 HB3 GLU 31 HB3 GLU 31 2.631 19.728 0.949 1259 HG2 GLU 31 HG2 GLU 31 2.827 17.631 -0.288 1260 HG3 GLU 31 HG3 GLU 31 4.524 17.984 -0.611 1261 H1 TYR 1 H TYR 1 8.702 11.511 -6.505 1262 HA TYR 1 HA TYR 1 6.197 10.132 -5.789 1263 HB2 TYR 1 HB2 TYR 1 5.787 12.248 -4.385 1264 HB3 TYR 1 HB3 TYR 1 6.963 11.084 -3.783 1265 HD1 TYR 1 HD1 TYR 1 6.450 14.451 -5.051 1266 HD2 TYR 1 HD2 TYR 1 9.378 11.580 -3.920 1267 HE1 TYR 1 HE1 TYR 1 8.142 16.232 -4.935 1268 HE2 TYR 1 HE2 TYR 1 11.078 13.353 -3.799 1269 HH TYR 1 HH TYR 1 10.491 16.545 -4.978 1270 H GLY 2 H GLY 2 4.215 11.384 -6.157 1271 HA2 GLY 2 HA2 GLY 2 3.413 13.522 -7.263 1272 HA3 GLY 2 HA3 GLY 2 4.487 13.057 -8.574 1273 H GLY 3 H GLY 3 1.465 13.405 -8.265 1274 HA2 GLY 3 HA2 GLY 3 -0.447 12.399 -9.048 1275 HA3 GLY 3 HA3 GLY 3 0.630 11.604 -10.186 1276 H PHE 4 H PHE 4 0.182 9.509 -10.232 1277 HA PHE 4 HA PHE 4 -0.906 8.146 -7.939 1278 HB2 PHE 4 HB2 PHE 4 -0.283 7.374 -10.769 1279 HB3 PHE 4 HB3 PHE 4 -0.603 6.124 -9.571 1280 HD1 PHE 4 HD1 PHE 4 -2.794 5.619 -8.901 1281 HD2 PHE 4 HD2 PHE 4 -2.035 9.112 -11.212 1282 HE1 PHE 4 HE1 PHE 4 -5.213 5.924 -9.229 1283 HE2 PHE 4 HE2 PHE 4 -4.453 9.423 -11.543 1284 HZ PHE 4 HZ PHE 4 -6.046 7.828 -10.550 1285 H MET 5 H MET 5 0.171 7.011 -6.459 1286 HA MET 5 HA MET 5 3.059 6.718 -6.765 1287 HB2 MET 5 HB2 MET 5 2.270 7.734 -4.700 1288 HB3 MET 5 HB3 MET 5 1.261 6.333 -4.367 1289 HG2 MET 5 HG2 MET 5 3.293 6.327 -3.024 1290 HG3 MET 5 HG3 MET 5 3.224 4.942 -4.111 1291 HE1 MET 5 HE1 MET 5 5.605 4.657 -3.323 1292 HE2 MET 5 HE2 MET 5 6.997 5.451 -4.059 1293 HE3 MET 5 HE3 MET 5 6.167 6.208 -2.699 1294 H THR 6 H THR 6 3.709 4.909 -7.730 1295 HA THR 6 HA THR 6 2.227 2.420 -7.239 1296 HB THR 6 HB THR 6 4.380 2.559 -9.297 1297 HG1 THR 6 HG1 THR 6 1.849 3.837 -9.472 1298 HG21 THR 6 HG21 THR 6 1.800 1.417 -10.006 1299 HG22 THR 6 HG22 THR 6 3.405 0.687 -10.044 1300 HG23 THR 6 HG23 THR 6 2.477 0.698 -8.544 1301 H SER 7 H SER 7 3.091 1.744 -5.301 1302 HA SER 7 HA SER 7 6.001 1.380 -5.167 1303 HB2 SER 7 HB2 SER 7 4.450 2.510 -3.314 1304 HB3 SER 7 HB3 SER 7 4.260 0.830 -2.810 1305 HG SER 7 HG SER 7 6.122 2.208 -1.976 1306 H GLU 8 H GLU 8 6.428 -0.501 -6.209 1307 HA GLU 8 HA GLU 8 5.018 -2.905 -5.250 1308 HB2 GLU 8 HB2 GLU 8 5.841 -2.051 -7.967 1309 HB3 GLU 8 HB3 GLU 8 6.054 -3.753 -7.583 1310 HG2 GLU 8 HG2 GLU 8 3.947 -3.919 -8.322 1311 HG3 GLU 8 HG3 GLU 8 3.543 -3.381 -6.694 1312 H LYS 9 H LYS 9 6.267 -4.013 -3.906 1313 HA LYS 9 HA LYS 9 9.176 -3.988 -4.303 1314 HB2 LYS 9 HB2 LYS 9 8.222 -3.297 -2.083 1315 HB3 LYS 9 HB3 LYS 9 7.637 -4.944 -1.885 1316 HG2 LYS 9 HG2 LYS 9 10.155 -5.547 -2.335 1317 HG3 LYS 9 HG3 LYS 9 10.415 -3.890 -1.785 1318 HD2 LYS 9 HD2 LYS 9 8.605 -5.569 -0.151 1319 HD3 LYS 9 HD3 LYS 9 10.320 -5.986 -0.119 1320 HE2 LYS 9 HE2 LYS 9 10.161 -4.473 1.617 1321 HE3 LYS 9 HE3 LYS 9 10.660 -3.441 0.278 1322 HZ1 LYS 9 HZ1 LYS 9 8.381 -2.760 -0.030 1323 HZ2 LYS 9 HZ2 LYS 9 7.859 -3.800 1.199 1324 HZ3 LYS 9 HZ3 LYS 9 8.843 -2.474 1.573 1325 H SER 10 H SER 10 9.891 -5.630 -5.491 1326 HA SER 10 HA SER 10 9.325 -8.338 -4.702 1327 HB2 SER 10 HB2 SER 10 8.548 -9.034 -6.983 1328 HB3 SER 10 HB3 SER 10 7.396 -8.016 -6.118 1329 HG SER 10 HG SER 10 8.920 -7.464 -8.381 1330 H GLN 11 H GLN 11 10.911 -9.750 -5.332 1331 HA GLN 11 HA GLN 11 13.270 -8.537 -6.530 1332 HB2 GLN 11 HB2 GLN 11 14.406 -10.623 -5.818 1333 HB3 GLN 11 HB3 GLN 11 13.617 -9.784 -4.490 1334 HG2 GLN 11 HG2 GLN 11 11.892 -11.364 -4.369 1335 HG3 GLN 11 HG3 GLN 11 12.288 -12.039 -5.948 1336 HE21 GLN 11 HE21 GLN 11 13.931 -11.414 -2.861 1337 HE22 GLN 11 HE22 GLN 11 14.701 -12.957 -2.765 1338 H THR 12 H THR 12 11.226 -8.852 -8.358 1339 HA THR 12 HA THR 12 12.477 -10.685 -10.239 1340 HB THR 12 HB THR 12 9.832 -11.193 -10.788 1341 HG1 THR 12 HG1 THR 12 9.307 -10.273 -8.693 1342 HG21 THR 12 HG21 THR 12 10.601 -13.322 -9.197 1343 HG22 THR 12 HG22 THR 12 10.928 -13.140 -10.920 1344 HG23 THR 12 HG23 THR 12 12.131 -12.630 -9.736 1345 HA PRO 13 HA PRO 13 11.487 -7.639 -13.239 1346 HB2 PRO 13 HB2 PRO 13 10.842 -9.118 -15.422 1347 HB3 PRO 13 HB3 PRO 13 12.495 -8.978 -14.811 1348 HG2 PRO 13 HG2 PRO 13 10.505 -11.177 -14.403 1349 HG3 PRO 13 HG3 PRO 13 12.239 -11.288 -14.760 1350 HD2 PRO 13 HD2 PRO 13 11.242 -11.612 -12.264 1351 HD3 PRO 13 HD3 PRO 13 12.843 -10.908 -12.569 1352 H LEU 14 H LEU 14 9.567 -6.909 -12.065 1353 HA LEU 14 HA LEU 14 6.998 -7.965 -12.870 1354 HB2 LEU 14 HB2 LEU 14 6.053 -6.527 -11.282 1355 HB3 LEU 14 HB3 LEU 14 7.566 -7.080 -10.568 1356 HG LEU 14 HG LEU 14 7.413 -4.449 -11.997 1357 HD11 LEU 14 HD11 LEU 14 7.247 -3.799 -9.352 1358 HD12 LEU 14 HD12 LEU 14 5.903 -3.769 -10.495 1359 HD13 LEU 14 HD13 LEU 14 6.152 -5.177 -9.463 1360 HD21 LEU 14 HD21 LEU 14 9.624 -5.006 -11.550 1361 HD22 LEU 14 HD22 LEU 14 9.180 -4.001 -10.171 1362 HD23 LEU 14 HD23 LEU 14 9.227 -5.756 -10.004 1363 H VAL 15 H VAL 15 5.447 -5.682 -13.014 1364 HA VAL 15 HA VAL 15 6.481 -3.857 -14.975 1365 HB VAL 15 HB VAL 15 6.015 -5.825 -16.393 1366 HG11 VAL 15 HG11 VAL 15 3.113 -5.589 -16.248 1367 HG12 VAL 15 HG12 VAL 15 4.133 -7.027 -16.291 1368 HG13 VAL 15 HG13 VAL 15 3.839 -6.199 -14.761 1369 HG21 VAL 15 HG21 VAL 15 5.085 -3.169 -16.749 1370 HG22 VAL 15 HG22 VAL 15 5.604 -4.324 -17.976 1371 HG23 VAL 15 HG23 VAL 15 3.911 -4.259 -17.486 1372 H THR 16 H THR 16 5.330 -1.997 -15.015 1373 HA THR 16 HA THR 16 3.053 -1.819 -13.201 1374 HB THR 16 HB THR 16 4.726 -0.147 -12.829 1375 HG1 THR 16 HG1 THR 16 2.590 1.086 -14.259 1376 HG21 THR 16 HG21 THR 16 6.024 0.530 -14.510 1377 HG22 THR 16 HG22 THR 16 4.918 -0.163 -15.696 1378 HG23 THR 16 HG23 THR 16 4.670 1.484 -15.117 1379 H LEU 17 H LEU 17 1.125 -2.220 -14.073 1380 HA LEU 17 HA LEU 17 0.598 -1.650 -16.865 1381 HB2 LEU 17 HB2 LEU 17 -0.190 -3.715 -15.657 1382 HB3 LEU 17 HB3 LEU 17 -1.326 -2.681 -14.793 1383 HG LEU 17 HG LEU 17 -2.258 -3.979 -16.746 1384 HD11 LEU 17 HD11 LEU 17 -3.798 -2.330 -17.224 1385 HD12 LEU 17 HD12 LEU 17 -3.123 -1.767 -15.694 1386 HD13 LEU 17 HD13 LEU 17 -2.587 -1.047 -17.213 1387 HD21 LEU 17 HD21 LEU 17 -1.626 -3.586 -18.890 1388 HD22 LEU 17 HD22 LEU 17 -1.172 -1.913 -18.569 1389 HD23 LEU 17 HD23 LEU 17 -0.090 -3.225 -18.101 1390 H PHE 18 H PHE 18 0.573 0.576 -17.045 1391 HA PHE 18 HA PHE 18 -1.509 1.984 -15.511 1392 HB2 PHE 18 HB2 PHE 18 1.198 2.737 -16.390 1393 HB3 PHE 18 HB3 PHE 18 -0.025 3.975 -16.649 1394 HD1 PHE 18 HD1 PHE 18 -1.739 3.985 -14.450 1395 HD2 PHE 18 HD2 PHE 18 2.424 3.097 -14.496 1396 HE1 PHE 18 HE1 PHE 18 -1.576 4.642 -12.085 1397 HE2 PHE 18 HE2 PHE 18 2.593 3.751 -12.131 1398 HZ PHE 18 HZ PHE 18 0.592 4.524 -10.921 1399 H LYS 19 H LYS 19 -3.325 2.105 -16.657 1400 HA LYS 19 HA LYS 19 -3.123 2.796 -19.517 1401 HB2 LYS 19 HB2 LYS 19 -5.114 1.540 -19.948 1402 HB3 LYS 19 HB3 LYS 19 -4.022 0.504 -19.038 1403 HG2 LYS 19 HG2 LYS 19 -5.277 0.843 -17.026 1404 HG3 LYS 19 HG3 LYS 19 -6.291 2.056 -17.811 1405 HD2 LYS 19 HD2 LYS 19 -7.628 0.164 -17.882 1406 HD3 LYS 19 HD3 LYS 19 -6.858 0.143 -19.471 1407 HE2 LYS 19 HE2 LYS 19 -5.119 -1.385 -18.481 1408 HE3 LYS 19 HE3 LYS 19 -6.138 -1.494 -17.047 1409 HZ1 LYS 19 HZ1 LYS 19 -6.490 -3.333 -18.611 1410 HZ2 LYS 19 HZ2 LYS 19 -7.897 -2.425 -18.369 1411 HZ3 LYS 19 HZ3 LYS 19 -7.000 -2.232 -19.791 1412 H ASN 20 H ASN 20 -4.578 4.309 -20.348 1413 HA ASN 20 HA ASN 20 -5.766 6.250 -20.320 1414 HB2 ASN 20 HB2 ASN 20 -7.152 4.588 -18.240 1415 HB3 ASN 20 HB3 ASN 20 -7.668 6.247 -18.528 1416 HD21 ASN 20 HD21 ASN 20 -8.115 6.790 -20.834 1417 HD22 ASN 20 HD22 ASN 20 -8.914 5.593 -21.789 1418 H ALA 21 H ALA 21 -3.311 6.196 -18.833 1419 HA ALA 21 HA ALA 21 -3.626 7.532 -16.338 1420 HB1 ALA 21 HB1 ALA 21 -1.402 6.693 -18.051 1421 HB2 ALA 21 HB2 ALA 21 -1.092 8.155 -17.113 1422 HB3 ALA 21 HB3 ALA 21 -1.559 6.664 -16.294 1423 H ILE 22 H ILE 22 -4.320 9.542 -16.076 1424 HA ILE 22 HA ILE 22 -3.571 11.563 -18.085 1425 HB ILE 22 HB ILE 22 -6.186 11.426 -16.578 1426 HG12 ILE 22 HG12 ILE 22 -5.651 11.094 -19.537 1427 HG13 ILE 22 HG13 ILE 22 -5.936 9.761 -18.423 1428 HG21 ILE 22 HG21 ILE 22 -4.833 13.559 -18.034 1429 HG22 ILE 22 HG22 ILE 22 -6.474 13.254 -18.602 1430 HG23 ILE 22 HG23 ILE 22 -6.186 13.637 -16.905 1431 HD11 ILE 22 HD11 ILE 22 -7.829 11.756 -19.523 1432 HD12 ILE 22 HD12 ILE 22 -8.025 10.022 -19.270 1433 HD13 ILE 22 HD13 ILE 22 -8.126 11.130 -17.901 1434 H ILE 23 H ILE 23 -2.217 12.974 -17.213 1435 HA ILE 23 HA ILE 23 -2.312 13.482 -14.332 1436 HB ILE 23 HB ILE 23 -0.230 14.094 -16.422 1437 HG12 ILE 23 HG12 ILE 23 -0.325 11.783 -15.544 1438 HG13 ILE 23 HG13 ILE 23 1.165 12.603 -15.090 1439 HG21 ILE 23 HG21 ILE 23 -0.017 15.976 -15.107 1440 HG22 ILE 23 HG22 ILE 23 -0.534 15.140 -13.642 1441 HG23 ILE 23 HG23 ILE 23 1.077 14.852 -14.300 1442 HD11 ILE 23 HD11 ILE 23 0.129 13.087 -12.877 1443 HD12 ILE 23 HD12 ILE 23 -1.227 12.064 -13.353 1444 HD13 ILE 23 HD13 ILE 23 0.391 11.375 -13.210 1445 H LYS 24 H LYS 24 -3.764 15.017 -13.848 1446 HA LYS 24 HA LYS 24 -3.846 17.446 -15.504 1447 HB2 LYS 24 HB2 LYS 24 -5.857 15.988 -13.878 1448 HB3 LYS 24 HB3 LYS 24 -5.976 17.743 -13.892 1449 HG2 LYS 24 HG2 LYS 24 -5.874 17.532 -16.446 1450 HG3 LYS 24 HG3 LYS 24 -6.236 15.825 -16.177 1451 HD2 LYS 24 HD2 LYS 24 -8.336 16.278 -15.299 1452 HD3 LYS 24 HD3 LYS 24 -7.917 17.944 -14.894 1453 HE2 LYS 24 HE2 LYS 24 -8.180 16.894 -17.707 1454 HE3 LYS 24 HE3 LYS 24 -9.471 17.715 -16.832 1455 HZ1 LYS 24 HZ1 LYS 24 -8.621 19.621 -17.530 1456 HZ2 LYS 24 HZ2 LYS 24 -7.220 19.321 -16.630 1457 HZ3 LYS 24 HZ3 LYS 24 -7.305 18.838 -18.250 1458 H ASN 25 H ASN 25 -2.162 18.623 -14.659 1459 HA ASN 25 HA ASN 25 -1.056 20.004 -13.230 1460 HB2 ASN 25 HB2 ASN 25 -3.774 20.059 -11.906 1461 HB3 ASN 25 HB3 ASN 25 -2.443 21.127 -11.469 1462 HD21 ASN 25 HD21 ASN 25 -3.546 22.974 -12.044 1463 HD22 ASN 25 HD22 ASN 25 -3.870 23.393 -13.689 1464 H ALA 26 H ALA 26 -0.582 17.335 -12.802 1465 HA ALA 26 HA ALA 26 -0.975 16.246 -10.314 1466 HB1 ALA 26 HB1 ALA 26 0.123 14.772 -11.643 1467 HB2 ALA 26 HB2 ALA 26 1.154 16.011 -12.357 1468 HB3 ALA 26 HB3 ALA 26 1.513 15.386 -10.748 1469 H TYR 27 H TYR 27 1.277 18.777 -11.245 1470 HA TYR 27 HA TYR 27 2.015 19.078 -8.407 1471 HB2 TYR 27 HB2 TYR 27 3.668 19.218 -10.886 1472 HB3 TYR 27 HB3 TYR 27 4.085 20.284 -9.549 1473 HD1 TYR 27 HD1 TYR 27 5.293 19.476 -7.702 1474 HD2 TYR 27 HD2 TYR 27 3.574 16.718 -10.448 1475 HE1 TYR 27 HE1 TYR 27 6.514 17.640 -6.612 1476 HE2 TYR 27 HE2 TYR 27 4.789 14.874 -9.366 1477 HH TYR 27 HH TYR 27 7.297 15.405 -7.102 1478 H LYS 28 H LYS 28 1.368 20.908 -7.505 1479 HA LYS 28 HA LYS 28 0.226 23.009 -9.126 1480 HB2 LYS 28 HB2 LYS 28 0.355 22.392 -6.206 1481 HB3 LYS 28 HB3 LYS 28 0.010 24.044 -6.702 1482 HG2 LYS 28 HG2 LYS 28 -1.554 21.650 -7.638 1483 HG3 LYS 28 HG3 LYS 28 -2.002 22.649 -6.254 1484 HD2 LYS 28 HD2 LYS 28 -1.470 24.006 -8.846 1485 HD3 LYS 28 HD3 LYS 28 -2.975 23.099 -8.677 1486 HE2 LYS 28 HE2 LYS 28 -3.414 24.388 -6.578 1487 HE3 LYS 28 HE3 LYS 28 -2.006 25.379 -6.959 1488 HZ1 LYS 28 HZ1 LYS 28 -4.223 26.285 -7.674 1489 HZ2 LYS 28 HZ2 LYS 28 -3.043 26.208 -8.884 1490 HZ3 LYS 28 HZ3 LYS 28 -4.277 25.052 -8.832 1491 H LYS 29 H LYS 29 0.738 25.341 -8.100 1492 HA LYS 29 HA LYS 29 3.184 26.143 -9.076 1493 HB2 LYS 29 HB2 LYS 29 1.501 27.783 -8.695 1494 HB3 LYS 29 HB3 LYS 29 1.407 27.389 -6.983 1495 HG2 LYS 29 HG2 LYS 29 3.703 28.254 -6.696 1496 HG3 LYS 29 HG3 LYS 29 3.702 28.732 -8.395 1497 HD2 LYS 29 HD2 LYS 29 1.466 29.949 -7.687 1498 HD3 LYS 29 HD3 LYS 29 2.215 29.888 -6.089 1499 HE2 LYS 29 HE2 LYS 29 4.135 31.085 -6.877 1500 HE3 LYS 29 HE3 LYS 29 3.574 30.985 -8.545 1501 HZ1 LYS 29 HZ1 LYS 29 3.124 33.158 -7.647 1502 HZ2 LYS 29 HZ2 LYS 29 1.660 32.354 -7.916 1503 HZ3 LYS 29 HZ3 LYS 29 2.271 32.495 -6.345 1504 H GLY 30 H GLY 30 2.491 26.325 -5.589 1505 HA2 GLY 30 HA2 GLY 30 5.069 26.512 -4.680 1506 HA3 GLY 30 HA3 GLY 30 3.774 25.753 -3.765 1507 H GLU 31 H GLU 31 3.328 23.564 -5.543 1508 HA GLU 31 HA GLU 31 5.681 22.131 -6.118 1509 HB2 GLU 31 HB2 GLU 31 6.075 22.025 -3.760 1510 HB3 GLU 31 HB3 GLU 31 4.407 21.571 -3.441 1511 HG2 GLU 31 HG2 GLU 31 4.770 19.435 -4.569 1512 HG3 GLU 31 HG3 GLU 31 6.444 19.889 -4.883 Start of MODEL 2 1 H1 TYR 1 H TYR 1 -4.577 4.690 13.145 2 HA TYR 1 HA TYR 1 -6.216 3.836 10.865 3 HB2 TYR 1 HB2 TYR 1 -6.857 2.941 13.668 4 HB3 TYR 1 HB3 TYR 1 -7.516 2.341 12.150 5 HD1 TYR 1 HD1 TYR 1 -5.682 1.271 14.735 6 HD2 TYR 1 HD2 TYR 1 -5.271 1.689 10.521 7 HE1 TYR 1 HE1 TYR 1 -4.004 -0.528 14.726 8 HE2 TYR 1 HE2 TYR 1 -3.594 -0.109 10.500 9 HH TYR 1 HH TYR 1 -2.290 -1.426 11.765 10 H GLY 2 H GLY 2 -8.566 4.374 11.221 11 HA2 GLY 2 HA2 GLY 2 -9.259 6.357 13.159 12 HA3 GLY 2 HA3 GLY 2 -8.945 7.077 11.587 13 H GLY 3 H GLY 3 -10.006 5.318 9.831 14 HA2 GLY 3 HA2 GLY 3 -12.783 5.861 10.039 15 HA3 GLY 3 HA3 GLY 3 -12.017 4.855 8.818 16 H PHE 4 H PHE 4 -13.298 3.098 8.774 17 HA PHE 4 HA PHE 4 -14.342 1.918 11.183 18 HB2 PHE 4 HB2 PHE 4 -14.549 1.338 8.258 19 HB3 PHE 4 HB3 PHE 4 -14.970 0.070 9.403 20 HD1 PHE 4 HD1 PHE 4 -17.209 -0.126 9.811 21 HD2 PHE 4 HD2 PHE 4 -15.587 3.741 9.082 22 HE1 PHE 4 HE1 PHE 4 -19.447 0.859 10.080 23 HE2 PHE 4 HE2 PHE 4 -17.822 4.733 9.351 24 HZ PHE 4 HZ PHE 4 -19.756 3.292 9.851 25 H MET 5 H MET 5 -13.926 -0.245 11.891 26 HA MET 5 HA MET 5 -11.228 -1.197 11.182 27 HB2 MET 5 HB2 MET 5 -11.683 -0.216 13.545 28 HB3 MET 5 HB3 MET 5 -12.513 -1.738 13.841 29 HG2 MET 5 HG2 MET 5 -10.257 -2.739 12.905 30 HG3 MET 5 HG3 MET 5 -9.625 -1.190 13.459 31 HE1 MET 5 HE1 MET 5 -8.698 -4.260 15.269 32 HE2 MET 5 HE2 MET 5 -10.307 -4.906 15.591 33 HE3 MET 5 HE3 MET 5 -9.849 -4.459 13.948 34 H THR 6 H THR 6 -11.440 -2.939 9.935 35 HA THR 6 HA THR 6 -13.580 -4.865 10.536 36 HB THR 6 HB THR 6 -11.963 -4.492 8.008 37 HG1 THR 6 HG1 THR 6 -14.764 -4.183 8.361 38 HG21 THR 6 HG21 THR 6 -12.486 -6.845 8.324 39 HG22 THR 6 HG22 THR 6 -14.177 -6.449 8.635 40 HG23 THR 6 HG23 THR 6 -13.487 -6.173 7.036 41 H SER 7 H SER 7 -12.695 -6.164 12.086 42 HA SER 7 HA SER 7 -10.087 -7.391 11.529 43 HB2 SER 7 HB2 SER 7 -10.848 -6.238 13.810 44 HB3 SER 7 HB3 SER 7 -11.495 -7.849 14.116 45 HG SER 7 HG SER 7 -9.476 -8.693 13.992 46 H GLU 8 H GLU 8 -10.595 -9.006 10.097 47 HA GLU 8 HA GLU 8 -12.545 -11.018 11.003 48 HB2 GLU 8 HB2 GLU 8 -11.737 -10.033 8.313 49 HB3 GLU 8 HB3 GLU 8 -12.170 -11.731 8.459 50 HG2 GLU 8 HG2 GLU 8 -14.357 -11.288 8.847 51 HG3 GLU 8 HG3 GLU 8 -14.019 -9.764 9.666 52 H LYS 9 H LYS 9 -11.660 -12.745 11.901 53 HA LYS 9 HA LYS 9 -8.987 -13.597 11.007 54 HB2 LYS 9 HB2 LYS 9 -9.343 -12.933 13.437 55 HB3 LYS 9 HB3 LYS 9 -10.338 -14.376 13.590 56 HG2 LYS 9 HG2 LYS 9 -7.540 -14.562 12.553 57 HG3 LYS 9 HG3 LYS 9 -7.860 -14.479 14.287 58 HD2 LYS 9 HD2 LYS 9 -9.514 -16.405 13.858 59 HD3 LYS 9 HD3 LYS 9 -8.672 -16.594 12.318 60 HE2 LYS 9 HE2 LYS 9 -7.496 -18.051 13.656 61 HE3 LYS 9 HE3 LYS 9 -6.535 -16.582 13.820 62 HZ1 LYS 9 HZ1 LYS 9 -8.567 -16.586 15.767 63 HZ2 LYS 9 HZ2 LYS 9 -7.743 -18.062 15.841 64 HZ3 LYS 9 HZ3 LYS 9 -6.890 -16.608 15.991 65 H SER 10 H SER 10 -9.217 -15.123 9.493 66 HA SER 10 HA SER 10 -10.473 -17.614 10.192 67 HB2 SER 10 HB2 SER 10 -12.016 -17.686 8.282 68 HB3 SER 10 HB3 SER 10 -12.418 -16.352 9.362 69 HG SER 10 HG SER 10 -12.343 -15.892 7.022 70 H GLN 11 H GLN 11 -9.614 -19.315 9.085 71 HA GLN 11 HA GLN 11 -7.316 -18.732 7.418 72 HB2 GLN 11 HB2 GLN 11 -6.842 -21.125 7.590 73 HB3 GLN 11 HB3 GLN 11 -7.129 -20.424 9.177 74 HG2 GLN 11 HG2 GLN 11 -9.101 -21.540 9.471 75 HG3 GLN 11 HG3 GLN 11 -9.412 -21.670 7.741 76 HE21 GLN 11 HE21 GLN 11 -7.303 -22.852 10.312 77 HE22 GLN 11 HE22 GLN 11 -7.039 -24.414 9.623 78 H THR 12 H THR 12 -9.589 -17.946 6.124 79 HA THR 12 HA THR 12 -9.522 -19.663 3.785 80 HB THR 12 HB THR 12 -12.224 -19.168 3.885 81 HG1 THR 12 HG1 THR 12 -11.903 -18.599 6.161 82 HG21 THR 12 HG21 THR 12 -11.935 -21.721 4.955 83 HG22 THR 12 HG22 THR 12 -11.995 -21.296 3.245 84 HG23 THR 12 HG23 THR 12 -10.439 -21.442 4.063 85 HA PRO 13 HA PRO 13 -9.895 -15.892 1.572 86 HB2 PRO 13 HB2 PRO 13 -11.389 -16.610 -0.578 87 HB3 PRO 13 HB3 PRO 13 -9.708 -17.114 -0.364 88 HG2 PRO 13 HG2 PRO 13 -12.227 -18.632 0.196 89 HG3 PRO 13 HG3 PRO 13 -10.731 -19.192 -0.574 90 HD2 PRO 13 HD2 PRO 13 -11.316 -19.710 2.018 91 HD3 PRO 13 HD3 PRO 13 -9.652 -19.483 1.442 92 H LEU 14 H LEU 14 -11.055 -14.314 2.523 93 HA LEU 14 HA LEU 14 -13.993 -14.477 2.368 94 HB2 LEU 14 HB2 LEU 14 -14.155 -13.207 4.354 95 HB3 LEU 14 HB3 LEU 14 -12.980 -14.484 4.659 96 HG LEU 14 HG LEU 14 -12.093 -11.727 3.880 97 HD11 LEU 14 HD11 LEU 14 -11.760 -11.570 6.481 98 HD12 LEU 14 HD12 LEU 14 -13.278 -11.083 5.727 99 HD13 LEU 14 HD13 LEU 14 -13.145 -12.662 6.502 100 HD21 LEU 14 HD21 LEU 14 -10.277 -13.140 3.802 101 HD22 LEU 14 HD22 LEU 14 -10.201 -12.569 5.469 102 HD23 LEU 14 HD23 LEU 14 -10.876 -14.159 5.112 103 H VAL 15 H VAL 15 -14.431 -11.772 3.111 104 HA VAL 15 HA VAL 15 -13.036 -9.998 1.369 105 HB VAL 15 HB VAL 15 -14.300 -11.138 -0.360 106 HG11 VAL 15 HG11 VAL 15 -16.786 -10.338 1.147 107 HG12 VAL 15 HG12 VAL 15 -16.712 -11.217 -0.380 108 HG13 VAL 15 HG13 VAL 15 -16.115 -11.968 1.100 109 HG21 VAL 15 HG21 VAL 15 -15.937 -8.732 -0.304 110 HG22 VAL 15 HG22 VAL 15 -14.241 -8.417 0.064 111 HG23 VAL 15 HG23 VAL 15 -14.682 -9.221 -1.442 112 H THR 16 H THR 16 -13.374 -7.917 1.949 113 HA THR 16 HA THR 16 -15.234 -7.448 4.150 114 HB THR 16 HB THR 16 -13.038 -6.652 4.612 115 HG1 THR 16 HG1 THR 16 -13.858 -4.869 5.388 116 HG21 THR 16 HG21 THR 16 -13.076 -5.914 1.802 117 HG22 THR 16 HG22 THR 16 -12.464 -4.614 2.825 118 HG23 THR 16 HG23 THR 16 -11.705 -6.205 2.872 119 H LEU 17 H LEU 17 -17.240 -7.133 3.308 120 HA LEU 17 HA LEU 17 -17.708 -5.585 0.947 121 HB2 LEU 17 HB2 LEU 17 -19.116 -7.496 2.086 122 HB3 LEU 17 HB3 LEU 17 -19.856 -6.141 2.935 123 HG LEU 17 HG LEU 17 -19.814 -6.569 -0.052 124 HD11 LEU 17 HD11 LEU 17 -21.648 -7.338 2.075 125 HD12 LEU 17 HD12 LEU 17 -22.421 -6.404 0.794 126 HD13 LEU 17 HD13 LEU 17 -21.553 -7.889 0.402 127 HD21 LEU 17 HD21 LEU 17 -21.437 -4.624 0.015 128 HD22 LEU 17 HD22 LEU 17 -20.853 -4.318 1.650 129 HD23 LEU 17 HD23 LEU 17 -19.739 -4.236 0.286 130 H PHE 18 H PHE 18 -16.930 -3.522 1.220 131 HA PHE 18 HA PHE 18 -18.130 -1.931 3.386 132 HB2 PHE 18 HB2 PHE 18 -15.468 -1.946 2.127 133 HB3 PHE 18 HB3 PHE 18 -16.152 -0.343 2.373 134 HD1 PHE 18 HD1 PHE 18 -17.463 -0.335 4.842 135 HD2 PHE 18 HD2 PHE 18 -13.965 -2.503 3.755 136 HE1 PHE 18 HE1 PHE 18 -16.776 -0.403 7.203 137 HE2 PHE 18 HE2 PHE 18 -13.272 -2.575 6.115 138 HZ PHE 18 HZ PHE 18 -14.679 -1.525 7.842 139 H LYS 19 H LYS 19 -19.882 -0.897 2.695 140 HA LYS 19 HA LYS 19 -19.802 0.360 0.030 141 HB2 LYS 19 HB2 LYS 19 -22.009 -1.013 1.513 142 HB3 LYS 19 HB3 LYS 19 -22.406 0.269 0.377 143 HG2 LYS 19 HG2 LYS 19 -21.143 -0.983 -1.368 144 HG3 LYS 19 HG3 LYS 19 -20.968 -2.307 -0.214 145 HD2 LYS 19 HD2 LYS 19 -22.840 -2.908 -1.473 146 HD3 LYS 19 HD3 LYS 19 -23.528 -2.198 -0.010 147 HE2 LYS 19 HE2 LYS 19 -24.231 -0.299 -1.103 148 HE3 LYS 19 HE3 LYS 19 -23.009 -0.445 -2.365 149 HZ1 LYS 19 HZ1 LYS 19 -25.667 -1.283 -2.444 150 HZ2 LYS 19 HZ2 LYS 19 -24.485 -1.459 -3.641 151 HZ3 LYS 19 HZ3 LYS 19 -24.707 -2.676 -2.487 152 H ASN 20 H ASN 20 -20.770 2.426 -0.199 153 HA ASN 20 HA ASN 20 -21.042 4.602 0.416 154 HB2 ASN 20 HB2 ASN 20 -23.107 3.304 1.417 155 HB3 ASN 20 HB3 ASN 20 -22.359 3.723 2.955 156 HD21 ASN 20 HD21 ASN 20 -24.885 4.602 1.803 157 HD22 ASN 20 HD22 ASN 20 -24.804 6.326 1.730 158 H ALA 21 H ALA 21 -18.584 3.418 1.202 159 HA ALA 21 HA ALA 21 -17.903 4.011 3.882 160 HB1 ALA 21 HB1 ALA 21 -16.302 3.538 1.393 161 HB2 ALA 21 HB2 ALA 21 -15.522 4.005 2.905 162 HB3 ALA 21 HB3 ALA 21 -16.466 2.517 2.822 163 H ILE 22 H ILE 22 -18.101 5.995 4.705 164 HA ILE 22 HA ILE 22 -17.107 8.267 3.111 165 HB ILE 22 HB ILE 22 -19.219 8.294 5.270 166 HG12 ILE 22 HG12 ILE 22 -19.624 9.030 2.385 167 HG13 ILE 22 HG13 ILE 22 -19.734 7.351 2.903 168 HG21 ILE 22 HG21 ILE 22 -18.369 10.388 5.507 169 HG22 ILE 22 HG22 ILE 22 -17.724 10.432 3.866 170 HG23 ILE 22 HG23 ILE 22 -19.446 10.693 4.144 171 HD11 ILE 22 HD11 ILE 22 -21.371 9.595 4.056 172 HD12 ILE 22 HD12 ILE 22 -21.912 8.509 2.777 173 HD13 ILE 22 HD13 ILE 22 -21.546 7.870 4.379 174 H ILE 23 H ILE 23 -15.258 9.073 3.825 175 HA ILE 23 HA ILE 23 -14.563 8.735 6.662 176 HB ILE 23 HB ILE 23 -12.861 9.074 4.206 177 HG12 ILE 23 HG12 ILE 23 -13.608 6.798 4.906 178 HG13 ILE 23 HG13 ILE 23 -11.859 6.997 4.928 179 HG21 ILE 23 HG21 ILE 23 -11.677 10.497 5.551 180 HG22 ILE 23 HG22 ILE 23 -12.211 9.713 7.038 181 HG23 ILE 23 HG23 ILE 23 -10.973 8.955 6.037 182 HD11 ILE 23 HD11 ILE 23 -13.703 7.036 7.303 183 HD12 ILE 23 HD12 ILE 23 -12.560 5.767 6.865 184 HD13 ILE 23 HD13 ILE 23 -11.969 7.352 7.364 185 H LYS 24 H LYS 24 -15.108 10.477 7.807 186 HA LYS 24 HA LYS 24 -14.380 13.121 6.730 187 HB2 LYS 24 HB2 LYS 24 -16.911 12.170 7.940 188 HB3 LYS 24 HB3 LYS 24 -16.355 13.757 8.456 189 HG2 LYS 24 HG2 LYS 24 -16.153 14.319 5.986 190 HG3 LYS 24 HG3 LYS 24 -17.075 12.843 5.690 191 HD2 LYS 24 HD2 LYS 24 -17.993 15.096 7.473 192 HD3 LYS 24 HD3 LYS 24 -18.469 14.905 5.784 193 HE2 LYS 24 HE2 LYS 24 -19.529 12.799 6.272 194 HE3 LYS 24 HE3 LYS 24 -18.929 12.836 7.929 195 HZ1 LYS 24 HZ1 LYS 24 -20.235 15.053 8.024 196 HZ2 LYS 24 HZ2 LYS 24 -21.079 14.421 6.701 197 HZ3 LYS 24 HZ3 LYS 24 -21.069 13.589 8.174 198 H ASN 25 H ASN 25 -12.626 13.736 7.823 199 HA ASN 25 HA ASN 25 -11.185 14.186 9.526 200 HB2 ASN 25 HB2 ASN 25 -13.513 14.274 11.419 201 HB3 ASN 25 HB3 ASN 25 -12.085 15.304 11.367 202 HD21 ASN 25 HD21 ASN 25 -15.243 15.427 11.008 203 HD22 ASN 25 HD22 ASN 25 -15.398 16.634 9.781 204 H ALA 26 H ALA 26 -11.716 11.425 8.994 205 HA ALA 26 HA ALA 26 -12.186 9.853 11.241 206 HB1 ALA 26 HB1 ALA 26 -11.085 8.064 10.058 207 HB2 ALA 26 HB2 ALA 26 -12.046 9.008 8.920 208 HB3 ALA 26 HB3 ALA 26 -10.296 9.214 8.980 209 H TYR 27 H TYR 27 -9.174 11.302 10.076 210 HA TYR 27 HA TYR 27 -7.977 10.716 12.700 211 HB2 TYR 27 HB2 TYR 27 -7.153 9.333 10.625 212 HB3 TYR 27 HB3 TYR 27 -6.267 10.806 10.242 213 HD1 TYR 27 HD1 TYR 27 -5.164 11.818 12.596 214 HD2 TYR 27 HD2 TYR 27 -5.834 7.732 11.616 215 HE1 TYR 27 HE1 TYR 27 -3.381 11.157 14.157 216 HE2 TYR 27 HE2 TYR 27 -4.055 7.060 13.175 217 HH TYR 27 HH TYR 27 -2.114 9.471 14.898 218 H LYS 28 H LYS 28 -7.465 12.517 13.731 219 HA LYS 28 HA LYS 28 -6.824 14.918 12.147 220 HB2 LYS 28 HB2 LYS 28 -7.994 14.782 14.932 221 HB3 LYS 28 HB3 LYS 28 -7.668 16.248 14.017 222 HG2 LYS 28 HG2 LYS 28 -9.479 15.976 12.664 223 HG3 LYS 28 HG3 LYS 28 -9.450 14.216 12.792 224 HD2 LYS 28 HD2 LYS 28 -10.654 14.200 14.735 225 HD3 LYS 28 HD3 LYS 28 -10.053 15.779 15.247 226 HE2 LYS 28 HE2 LYS 28 -11.425 16.650 13.210 227 HE3 LYS 28 HE3 LYS 28 -12.272 15.111 13.358 228 HZ1 LYS 28 HZ1 LYS 28 -12.303 15.935 15.885 229 HZ2 LYS 28 HZ2 LYS 28 -12.330 17.433 15.100 230 HZ3 LYS 28 HZ3 LYS 28 -13.534 16.288 14.779 231 H LYS 29 H LYS 29 -5.284 16.416 13.113 232 HA LYS 29 HA LYS 29 -3.308 15.033 14.807 233 HB2 LYS 29 HB2 LYS 29 -2.397 15.304 12.598 234 HB3 LYS 29 HB3 LYS 29 -2.879 16.994 12.551 235 HG2 LYS 29 HG2 LYS 29 -0.522 16.873 12.931 236 HG3 LYS 29 HG3 LYS 29 -1.302 17.448 14.406 237 HD2 LYS 29 HD2 LYS 29 -1.240 15.090 15.251 238 HD3 LYS 29 HD3 LYS 29 -0.263 14.674 13.841 239 HE2 LYS 29 HE2 LYS 29 1.471 16.189 14.533 240 HE3 LYS 29 HE3 LYS 29 0.472 16.798 15.852 241 HZ1 LYS 29 HZ1 LYS 29 1.528 15.282 17.076 242 HZ2 LYS 29 HZ2 LYS 29 0.541 14.135 16.318 243 HZ3 LYS 29 HZ3 LYS 29 2.099 14.431 15.729 244 H GLY 30 H GLY 30 -4.925 18.070 14.071 245 HA2 GLY 30 HA2 GLY 30 -4.355 18.972 16.792 246 HA3 GLY 30 HA3 GLY 30 -3.805 20.003 15.480 247 H GLU 31 H GLU 31 -6.771 18.121 15.418 248 HA GLU 31 HA GLU 31 -8.279 20.563 14.974 249 HB2 GLU 31 HB2 GLU 31 -8.627 18.553 13.551 250 HB3 GLU 31 HB3 GLU 31 -9.227 17.693 14.961 251 HG2 GLU 31 HG2 GLU 31 -10.958 18.642 13.389 252 HG3 GLU 31 HG3 GLU 31 -11.148 19.029 15.098 253 H1 TYR 1 H TYR 1 -2.070 6.480 9.420 254 HA TYR 1 HA TYR 1 -3.577 5.470 7.114 255 HB2 TYR 1 HB2 TYR 1 -4.263 4.611 9.916 256 HB3 TYR 1 HB3 TYR 1 -4.829 3.933 8.394 257 HD1 TYR 1 HD1 TYR 1 -3.011 3.064 11.076 258 HD2 TYR 1 HD2 TYR 1 -2.509 3.356 6.861 259 HE1 TYR 1 HE1 TYR 1 -1.230 1.370 11.177 260 HE2 TYR 1 HE2 TYR 1 -0.728 1.662 6.950 261 HH TYR 1 HH TYR 1 0.615 0.471 8.296 262 H GLY 2 H GLY 2 -5.971 5.869 7.391 263 HA2 GLY 2 HA2 GLY 2 -6.840 7.860 9.246 264 HA3 GLY 2 HA3 GLY 2 -6.518 8.555 7.664 265 H GLY 3 H GLY 3 -7.417 6.684 5.929 266 HA2 GLY 3 HA2 GLY 3 -10.225 7.068 6.032 267 HA3 GLY 3 HA3 GLY 3 -9.362 6.072 4.870 268 H PHE 4 H PHE 4 -10.551 4.248 4.845 269 HA PHE 4 HA PHE 4 -11.601 3.083 7.256 270 HB2 PHE 4 HB2 PHE 4 -11.678 2.405 4.347 271 HB3 PHE 4 HB3 PHE 4 -12.057 1.145 5.517 272 HD1 PHE 4 HD1 PHE 4 -14.290 0.824 5.875 273 HD2 PHE 4 HD2 PHE 4 -12.888 4.758 5.055 274 HE1 PHE 4 HE1 PHE 4 -16.592 1.676 6.047 275 HE2 PHE 4 HE2 PHE 4 -15.187 5.617 5.227 276 HZ PHE 4 HZ PHE 4 -17.042 4.076 5.724 277 H MET 5 H MET 5 -11.096 0.952 8.029 278 HA MET 5 HA MET 5 -8.323 0.142 7.444 279 HB2 MET 5 HB2 MET 5 -8.897 1.171 9.755 280 HB3 MET 5 HB3 MET 5 -9.667 -0.376 10.080 281 HG2 MET 5 HG2 MET 5 -7.330 -1.293 9.241 282 HG3 MET 5 HG3 MET 5 -6.798 0.296 9.786 283 HE1 MET 5 HE1 MET 5 -5.779 -2.673 11.706 284 HE2 MET 5 HE2 MET 5 -7.362 -3.408 11.964 285 HE3 MET 5 HE3 MET 5 -6.852 -2.961 10.336 286 H THR 6 H THR 6 -8.396 -1.648 6.251 287 HA THR 6 HA THR 6 -10.449 -3.668 6.841 288 HB THR 6 HB THR 6 -8.752 -3.284 4.368 289 HG1 THR 6 HG1 THR 6 -11.580 -3.147 4.607 290 HG21 THR 6 HG21 THR 6 -9.137 -5.656 4.753 291 HG22 THR 6 HG22 THR 6 -10.862 -5.361 4.971 292 HG23 THR 6 HG23 THR 6 -10.114 -5.095 3.396 293 H SER 7 H SER 7 -9.588 -4.898 8.447 294 HA SER 7 HA SER 7 -6.886 -5.982 8.060 295 HB2 SER 7 HB2 SER 7 -7.815 -4.814 10.266 296 HB3 SER 7 HB3 SER 7 -8.402 -6.446 10.586 297 HG SER 7 HG SER 7 -6.343 -7.194 10.593 298 H GLU 8 H GLU 8 -7.234 -7.658 6.649 299 HA GLU 8 HA GLU 8 -9.111 -9.754 7.517 300 HB2 GLU 8 HB2 GLU 8 -8.239 -8.782 4.845 301 HB3 GLU 8 HB3 GLU 8 -8.561 -10.502 5.010 302 HG2 GLU 8 HG2 GLU 8 -10.790 -10.206 5.291 303 HG3 GLU 8 HG3 GLU 8 -10.596 -8.642 6.080 304 H LYS 9 H LYS 9 -8.213 -11.463 8.435 305 HA LYS 9 HA LYS 9 -5.439 -12.157 7.727 306 HB2 LYS 9 HB2 LYS 9 -6.035 -11.490 10.135 307 HB3 LYS 9 HB3 LYS 9 -6.864 -13.039 10.230 308 HG2 LYS 9 HG2 LYS 9 -4.009 -12.909 9.356 309 HG3 LYS 9 HG3 LYS 9 -4.429 -12.846 11.069 310 HD2 LYS 9 HD2 LYS 9 -5.841 -14.949 10.566 311 HD3 LYS 9 HD3 LYS 9 -4.870 -15.060 9.096 312 HE2 LYS 9 HE2 LYS 9 -3.634 -16.354 10.536 313 HE3 LYS 9 HE3 LYS 9 -2.869 -14.781 10.760 314 HZ1 LYS 9 HZ1 LYS 9 -5.040 -15.031 12.537 315 HZ2 LYS 9 HZ2 LYS 9 -4.045 -16.390 12.696 316 HZ3 LYS 9 HZ3 LYS 9 -3.398 -14.839 12.894 317 H SER 10 H SER 10 -5.488 -13.713 6.228 318 HA SER 10 HA SER 10 -6.654 -16.259 6.886 319 HB2 SER 10 HB2 SER 10 -8.051 -16.434 4.865 320 HB3 SER 10 HB3 SER 10 -8.607 -15.131 5.914 321 HG SER 10 HG SER 10 -8.402 -14.660 3.583 322 H GLN 11 H GLN 11 -5.620 -17.923 5.882 323 HA GLN 11 HA GLN 11 -3.262 -17.235 4.344 324 HB2 GLN 11 HB2 GLN 11 -2.658 -19.592 4.603 325 HB3 GLN 11 HB3 GLN 11 -3.084 -18.876 6.152 326 HG2 GLN 11 HG2 GLN 11 -5.012 -20.094 6.345 327 HG3 GLN 11 HG3 GLN 11 -5.186 -20.299 4.603 328 HE21 GLN 11 HE21 GLN 11 -3.208 -21.263 7.362 329 HE22 GLN 11 HE22 GLN 11 -2.797 -22.825 6.750 330 H THR 12 H THR 12 -5.593 -16.669 2.947 331 HA THR 12 HA THR 12 -5.242 -18.401 0.636 332 HB THR 12 HB THR 12 -7.970 -18.107 0.573 333 HG1 THR 12 HG1 THR 12 -7.833 -17.455 2.843 334 HG21 THR 12 HG21 THR 12 -7.576 -20.602 1.731 335 HG22 THR 12 HG22 THR 12 -7.539 -20.226 0.008 336 HG23 THR 12 HG23 THR 12 -6.042 -20.242 0.940 337 HA PRO 13 HA PRO 13 -5.782 -14.721 -1.692 338 HB2 PRO 13 HB2 PRO 13 -7.161 -15.575 -3.869 339 HB3 PRO 13 HB3 PRO 13 -5.462 -15.974 -3.591 340 HG2 PRO 13 HG2 PRO 13 -7.905 -17.625 -3.072 341 HG3 PRO 13 HG3 PRO 13 -6.355 -18.113 -3.782 342 HD2 PRO 13 HD2 PRO 13 -6.993 -18.605 -1.196 343 HD3 PRO 13 HD3 PRO 13 -5.327 -18.294 -1.727 344 H LEU 14 H LEU 14 -7.063 -13.206 -0.789 345 HA LEU 14 HA LEU 14 -9.980 -13.543 -1.033 346 HB2 LEU 14 HB2 LEU 14 -10.271 -12.225 0.909 347 HB3 LEU 14 HB3 LEU 14 -9.035 -13.425 1.283 348 HG LEU 14 HG LEU 14 -8.275 -10.649 0.442 349 HD11 LEU 14 HD11 LEU 14 -8.039 -10.431 3.070 350 HD12 LEU 14 HD12 LEU 14 -9.518 -9.975 2.225 351 HD13 LEU 14 HD13 LEU 14 -9.411 -11.538 3.035 352 HD21 LEU 14 HD21 LEU 14 -6.382 -11.956 0.477 353 HD22 LEU 14 HD22 LEU 14 -6.402 -11.339 2.129 354 HD23 LEU 14 HD23 LEU 14 -6.975 -12.972 1.791 355 H VAL 15 H VAL 15 -10.593 -10.847 -0.377 356 HA VAL 15 HA VAL 15 -9.262 -9.039 -2.131 357 HB VAL 15 HB VAL 15 -10.394 -10.305 -3.864 358 HG11 VAL 15 HG11 VAL 15 -12.974 -9.622 -2.460 359 HG12 VAL 15 HG12 VAL 15 -12.796 -10.536 -3.958 360 HG13 VAL 15 HG13 VAL 15 -12.202 -11.207 -2.439 361 HG21 VAL 15 HG21 VAL 15 -12.178 -8.005 -3.929 362 HG22 VAL 15 HG22 VAL 15 -10.517 -7.576 -3.521 363 HG23 VAL 15 HG23 VAL 15 -10.861 -8.447 -5.015 364 H THR 16 H THR 16 -9.756 -6.966 -1.633 365 HA THR 16 HA THR 16 -11.707 -6.557 0.500 366 HB THR 16 HB THR 16 -9.584 -5.603 0.999 367 HG1 THR 16 HG1 THR 16 -10.541 -3.856 1.692 368 HG21 THR 16 HG21 THR 16 -9.581 -4.958 -1.834 369 HG22 THR 16 HG22 THR 16 -9.091 -3.587 -0.839 370 HG23 THR 16 HG23 THR 16 -8.228 -5.120 -0.713 371 H LEU 17 H LEU 17 -13.709 -6.351 -0.357 372 HA LEU 17 HA LEU 17 -14.207 -4.928 -2.796 373 HB2 LEU 17 HB2 LEU 17 -15.525 -6.885 -1.622 374 HB3 LEU 17 HB3 LEU 17 -16.373 -5.547 -0.849 375 HG LEU 17 HG LEU 17 -16.214 -6.090 -3.813 376 HD11 LEU 17 HD11 LEU 17 -18.068 -6.873 -1.706 377 HD12 LEU 17 HD12 LEU 17 -18.850 -6.048 -3.054 378 HD13 LEU 17 HD13 LEU 17 -17.883 -7.494 -3.346 379 HD21 LEU 17 HD21 LEU 17 -17.949 -4.244 -3.874 380 HD22 LEU 17 HD22 LEU 17 -17.433 -3.836 -2.238 381 HD23 LEU 17 HD23 LEU 17 -16.285 -3.745 -3.574 382 H PHE 18 H PHE 18 -13.564 -2.813 -2.573 383 HA PHE 18 HA PHE 18 -14.917 -1.233 -0.490 384 HB2 PHE 18 HB2 PHE 18 -12.226 -1.123 -1.678 385 HB3 PHE 18 HB3 PHE 18 -13.012 0.443 -1.502 386 HD1 PHE 18 HD1 PHE 18 -14.390 0.443 0.930 387 HD2 PHE 18 HD2 PHE 18 -10.736 -1.533 0.005 388 HE1 PHE 18 HE1 PHE 18 -13.766 0.490 3.310 389 HE2 PHE 18 HE2 PHE 18 -10.107 -1.491 2.383 390 HZ PHE 18 HZ PHE 18 -11.623 -0.479 4.039 391 H LYS 19 H LYS 19 -16.710 -0.332 -1.261 392 HA LYS 19 HA LYS 19 -16.631 0.845 -3.963 393 HB2 LYS 19 HB2 LYS 19 -18.788 -0.620 -2.494 394 HB3 LYS 19 HB3 LYS 19 -19.236 0.606 -3.672 395 HG2 LYS 19 HG2 LYS 19 -17.849 -0.609 -5.353 396 HG3 LYS 19 HG3 LYS 19 -17.635 -1.893 -4.160 397 HD2 LYS 19 HD2 LYS 19 -19.433 -2.629 -5.453 398 HD3 LYS 19 HD3 LYS 19 -20.203 -1.920 -4.032 399 HE2 LYS 19 HE2 LYS 19 -20.973 -0.091 -5.196 400 HE3 LYS 19 HE3 LYS 19 -19.709 -0.204 -6.420 401 HZ1 LYS 19 HZ1 LYS 19 -22.315 -1.186 -6.549 402 HZ2 LYS 19 HZ2 LYS 19 -21.090 -1.333 -7.707 403 HZ3 LYS 19 HZ3 LYS 19 -21.282 -2.526 -6.523 404 H ASN 20 H ASN 20 -17.701 2.843 -4.284 405 HA ASN 20 HA ASN 20 -18.124 5.016 -3.749 406 HB2 ASN 20 HB2 ASN 20 -20.135 3.626 -2.760 407 HB3 ASN 20 HB3 ASN 20 -19.458 4.141 -1.217 408 HD21 ASN 20 HD21 ASN 20 -21.999 4.826 -2.459 409 HD22 ASN 20 HD22 ASN 20 -22.018 6.549 -2.592 410 H ALA 21 H ALA 21 -15.623 4.014 -2.865 411 HA ALA 21 HA ALA 21 -15.055 4.730 -0.187 412 HB1 ALA 21 HB1 ALA 21 -13.360 4.268 -2.614 413 HB2 ALA 21 HB2 ALA 21 -12.651 4.835 -1.103 414 HB3 ALA 21 HB3 ALA 21 -13.501 3.291 -1.153 415 H ILE 22 H ILE 22 -15.402 6.726 0.556 416 HA ILE 22 HA ILE 22 -14.494 8.999 -1.087 417 HB ILE 22 HB ILE 22 -16.664 8.970 1.014 418 HG12 ILE 22 HG12 ILE 22 -17.031 9.591 -1.903 419 HG13 ILE 22 HG13 ILE 22 -17.053 7.925 -1.335 420 HG21 ILE 22 HG21 ILE 22 -15.946 11.117 1.204 421 HG22 ILE 22 HG22 ILE 22 -15.257 11.148 -0.419 422 HG23 ILE 22 HG23 ILE 22 -16.998 11.315 -0.197 423 HD11 ILE 22 HD11 ILE 22 -18.854 10.097 -0.296 424 HD12 ILE 22 HD12 ILE 22 -19.293 8.943 -1.555 425 HD13 ILE 22 HD13 ILE 22 -18.934 8.375 0.075 426 H ILE 23 H ILE 23 -12.716 9.936 -0.354 427 HA ILE 23 HA ILE 23 -12.081 9.735 2.510 428 HB ILE 23 HB ILE 23 -10.335 10.093 0.088 429 HG12 ILE 23 HG12 ILE 23 -10.962 7.800 0.843 430 HG13 ILE 23 HG13 ILE 23 -9.230 8.106 0.912 431 HG21 ILE 23 HG21 ILE 23 -9.268 11.625 1.408 432 HG22 ILE 23 HG22 ILE 23 -9.805 10.871 2.909 433 HG23 ILE 23 HG23 ILE 23 -8.496 10.144 1.977 434 HD11 ILE 23 HD11 ILE 23 -11.152 8.109 3.225 435 HD12 ILE 23 HD12 ILE 23 -9.919 6.899 2.867 436 HD13 ILE 23 HD13 ILE 23 -9.443 8.533 3.331 437 H LYS 24 H LYS 24 -12.771 11.478 3.573 438 HA LYS 24 HA LYS 24 -12.162 14.123 2.428 439 HB2 LYS 24 HB2 LYS 24 -14.672 13.064 3.586 440 HB3 LYS 24 HB3 LYS 24 -14.227 14.694 4.074 441 HG2 LYS 24 HG2 LYS 24 -13.974 15.203 1.598 442 HG3 LYS 24 HG3 LYS 24 -14.795 13.666 1.312 443 HD2 LYS 24 HD2 LYS 24 -15.906 15.911 2.994 444 HD3 LYS 24 HD3 LYS 24 -16.317 15.634 1.299 445 HE2 LYS 24 HE2 LYS 24 -17.261 13.484 1.829 446 HE3 LYS 24 HE3 LYS 24 -16.716 13.612 3.501 447 HZ1 LYS 24 HZ1 LYS 24 -18.157 15.747 3.482 448 HZ2 LYS 24 HZ2 LYS 24 -18.919 15.021 2.156 449 HZ3 LYS 24 HZ3 LYS 24 -18.905 14.239 3.657 450 H ASN 25 H ASN 25 -10.472 14.859 3.552 451 HA ASN 25 HA ASN 25 -9.121 15.456 5.283 452 HB2 ASN 25 HB2 ASN 25 -11.509 15.467 7.101 453 HB3 ASN 25 HB3 ASN 25 -10.143 16.578 7.055 454 HD21 ASN 25 HD21 ASN 25 -13.289 16.502 6.602 455 HD22 ASN 25 HD22 ASN 25 -13.477 17.655 5.329 456 H ALA 26 H ALA 26 -9.473 12.653 4.828 457 HA ALA 26 HA ALA 26 -9.925 11.128 7.110 458 HB1 ALA 26 HB1 ALA 26 -8.682 9.370 6.024 459 HB2 ALA 26 HB2 ALA 26 -9.657 10.220 4.825 460 HB3 ALA 26 HB3 ALA 26 -7.924 10.531 4.935 461 H TYR 27 H TYR 27 -6.962 12.710 5.992 462 HA TYR 27 HA TYR 27 -5.823 12.280 8.672 463 HB2 TYR 27 HB2 TYR 27 -4.848 10.889 6.669 464 HB3 TYR 27 HB3 TYR 27 -4.040 12.401 6.268 465 HD1 TYR 27 HD1 TYR 27 -3.076 13.547 8.620 466 HD2 TYR 27 HD2 TYR 27 -3.474 9.401 7.753 467 HE1 TYR 27 HE1 TYR 27 -1.310 13.042 10.256 468 HE2 TYR 27 HE2 TYR 27 -1.711 8.884 9.389 469 HH TYR 27 HH TYR 27 0.028 11.458 11.091 470 H LYS 28 H LYS 28 -5.450 14.137 9.662 471 HA LYS 28 HA LYS 28 -4.904 16.526 8.024 472 HB2 LYS 28 HB2 LYS 28 -6.151 16.399 10.776 473 HB3 LYS 28 HB3 LYS 28 -5.884 17.856 9.827 474 HG2 LYS 28 HG2 LYS 28 -7.633 17.438 8.432 475 HG3 LYS 28 HG3 LYS 28 -7.502 15.687 8.609 476 HD2 LYS 28 HD2 LYS 28 -8.764 15.649 10.514 477 HD3 LYS 28 HD3 LYS 28 -8.273 17.273 11.002 478 HE2 LYS 28 HE2 LYS 28 -9.630 18.010 8.903 479 HE3 LYS 28 HE3 LYS 28 -10.390 16.428 9.066 480 HZ1 LYS 28 HZ1 LYS 28 -10.548 17.310 11.568 481 HZ2 LYS 28 HZ2 LYS 28 -10.638 18.784 10.743 482 HZ3 LYS 28 HZ3 LYS 28 -11.762 17.563 10.417 483 H LYS 29 H LYS 29 -3.485 18.140 8.984 484 HA LYS 29 HA LYS 29 -1.485 16.930 10.781 485 HB2 LYS 29 HB2 LYS 29 -0.522 17.186 8.592 486 HB3 LYS 29 HB3 LYS 29 -1.102 18.842 8.474 487 HG2 LYS 29 HG2 LYS 29 1.244 18.878 8.928 488 HG3 LYS 29 HG3 LYS 29 0.385 19.447 10.361 489 HD2 LYS 29 HD2 LYS 29 0.563 17.121 11.279 490 HD3 LYS 29 HD3 LYS 29 1.609 16.728 9.913 491 HE2 LYS 29 HE2 LYS 29 3.225 18.363 10.612 492 HE3 LYS 29 HE3 LYS 29 2.147 18.951 11.877 493 HZ1 LYS 29 HZ1 LYS 29 3.252 17.541 13.183 494 HZ2 LYS 29 HZ2 LYS 29 2.358 16.314 12.436 495 HZ3 LYS 29 HZ3 LYS 29 3.914 16.683 11.884 496 H GLY 30 H GLY 30 -3.252 19.842 9.897 497 HA2 GLY 30 HA2 GLY 30 -2.820 20.861 12.602 498 HA3 GLY 30 HA3 GLY 30 -2.295 21.882 11.272 499 H GLU 31 H GLU 31 -5.138 19.821 11.186 500 HA GLU 31 HA GLU 31 -6.777 22.152 10.624 501 HB2 GLU 31 HB2 GLU 31 -6.960 20.082 9.257 502 HB3 GLU 31 HB3 GLU 31 -7.551 19.230 10.677 503 HG2 GLU 31 HG2 GLU 31 -9.287 20.023 9.027 504 HG3 GLU 31 HG3 GLU 31 -9.551 20.452 10.716 505 H1 TYR 1 H TYR 1 0.432 8.308 5.715 506 HA TYR 1 HA TYR 1 -0.937 7.142 3.396 507 HB2 TYR 1 HB2 TYR 1 -1.659 6.331 6.205 508 HB3 TYR 1 HB3 TYR 1 -2.140 5.574 4.690 509 HD1 TYR 1 HD1 TYR 1 -0.357 4.893 7.447 510 HD2 TYR 1 HD2 TYR 1 0.255 5.089 3.241 511 HE1 TYR 1 HE1 TYR 1 1.514 3.310 7.652 512 HE2 TYR 1 HE2 TYR 1 2.127 3.506 3.434 513 HH TYR 1 HH TYR 1 3.493 2.434 4.853 514 H GLY 2 H GLY 2 -3.360 7.402 3.591 515 HA2 GLY 2 HA2 GLY 2 -4.403 9.396 5.350 516 HA3 GLY 2 HA3 GLY 2 -4.074 10.058 3.756 517 H GLY 3 H GLY 3 -4.805 8.081 2.060 518 HA2 GLY 3 HA2 GLY 3 -7.632 8.298 2.067 519 HA3 GLY 3 HA3 GLY 3 -6.676 7.319 0.965 520 H PHE 4 H PHE 4 -7.761 5.430 0.968 521 HA PHE 4 HA PHE 4 -8.811 4.282 3.386 522 HB2 PHE 4 HB2 PHE 4 -8.760 3.507 0.500 523 HB3 PHE 4 HB3 PHE 4 -9.103 2.266 1.701 524 HD1 PHE 4 HD1 PHE 4 -11.325 1.826 1.996 525 HD2 PHE 4 HD2 PHE 4 -10.122 5.810 1.101 526 HE1 PHE 4 HE1 PHE 4 -13.675 2.549 2.071 527 HE2 PHE 4 HE2 PHE 4 -12.471 6.539 1.176 528 HZ PHE 4 HZ PHE 4 -14.251 4.908 1.663 529 H MET 5 H MET 5 -8.205 2.216 4.249 530 HA MET 5 HA MET 5 -5.375 1.549 3.766 531 HB2 MET 5 HB2 MET 5 -6.069 2.622 6.022 532 HB3 MET 5 HB3 MET 5 -6.761 1.046 6.383 533 HG2 MET 5 HG2 MET 5 -4.353 0.236 5.636 534 HG3 MET 5 HG3 MET 5 -3.927 1.869 6.144 535 HE1 MET 5 HE1 MET 5 -2.808 -0.986 8.183 536 HE2 MET 5 HE2 MET 5 -4.357 -1.793 8.425 537 HE3 MET 5 HE3 MET 5 -3.827 -1.372 6.797 538 H THR 6 H THR 6 -5.323 -0.278 2.626 539 HA THR 6 HA THR 6 -7.273 -2.391 3.230 540 HB THR 6 HB THR 6 -5.509 -2.003 0.806 541 HG1 THR 6 HG1 THR 6 -8.346 -2.015 0.938 542 HG21 THR 6 HG21 THR 6 -5.778 -4.377 1.266 543 HG22 THR 6 HG22 THR 6 -7.523 -4.171 1.413 544 HG23 THR 6 HG23 THR 6 -6.734 -3.921 -0.144 545 H SER 7 H SER 7 -6.420 -3.539 4.894 546 HA SER 7 HA SER 7 -3.642 -4.465 4.660 547 HB2 SER 7 HB2 SER 7 -4.734 -3.299 6.788 548 HB3 SER 7 HB3 SER 7 -5.252 -4.950 7.126 549 HG SER 7 HG SER 7 -3.162 -5.590 7.254 550 H GLU 8 H GLU 8 -3.825 -6.193 3.281 551 HA GLU 8 HA GLU 8 -5.612 -8.377 4.121 552 HB2 GLU 8 HB2 GLU 8 -4.674 -7.422 1.465 553 HB3 GLU 8 HB3 GLU 8 -4.904 -9.154 1.664 554 HG2 GLU 8 HG2 GLU 8 -7.156 -8.982 1.829 555 HG3 GLU 8 HG3 GLU 8 -7.091 -7.393 2.590 556 H LYS 9 H LYS 9 -4.663 -10.017 5.112 557 HA LYS 9 HA LYS 9 -1.822 -10.555 4.552 558 HB2 LYS 9 HB2 LYS 9 -2.577 -9.865 6.914 559 HB3 LYS 9 HB3 LYS 9 -3.295 -11.468 7.013 560 HG2 LYS 9 HG2 LYS 9 -0.419 -11.143 6.265 561 HG3 LYS 9 HG3 LYS 9 -0.924 -11.083 7.956 562 HD2 LYS 9 HD2 LYS 9 -2.151 -13.294 7.431 563 HD3 LYS 9 HD3 LYS 9 -1.106 -13.357 6.009 564 HE2 LYS 9 HE2 LYS 9 0.157 -14.528 7.528 565 HE3 LYS 9 HE3 LYS 9 0.787 -12.898 7.761 566 HZ1 LYS 9 HZ1 LYS 9 -1.443 -13.291 9.436 567 HZ2 LYS 9 HZ2 LYS 9 -0.355 -14.567 9.666 568 HZ3 LYS 9 HZ3 LYS 9 0.161 -12.968 9.868 569 H SER 10 H SER 10 -1.711 -12.151 3.098 570 HA SER 10 HA SER 10 -2.750 -14.745 3.776 571 HB2 SER 10 HB2 SER 10 -4.027 -15.046 1.673 572 HB3 SER 10 HB3 SER 10 -4.732 -13.804 2.707 573 HG SER 10 HG SER 10 -4.470 -13.295 0.388 574 H GLN 11 H GLN 11 -1.587 -16.370 2.850 575 HA GLN 11 HA GLN 11 0.788 -15.576 1.386 576 HB2 GLN 11 HB2 GLN 11 1.534 -17.874 1.746 577 HB3 GLN 11 HB3 GLN 11 0.990 -17.151 3.254 578 HG2 GLN 11 HG2 GLN 11 -0.862 -18.492 3.394 579 HG3 GLN 11 HG3 GLN 11 -0.937 -18.754 1.652 580 HE21 GLN 11 HE21 GLN 11 0.965 -19.506 4.529 581 HE22 GLN 11 HE22 GLN 11 1.510 -21.052 3.983 582 H THR 12 H THR 12 -1.517 -15.198 -0.112 583 HA THR 12 HA THR 12 -0.968 -16.968 -2.354 584 HB THR 12 HB THR 12 -3.710 -16.851 -2.518 585 HG1 THR 12 HG1 THR 12 -3.693 -16.147 -0.262 586 HG21 THR 12 HG21 THR 12 -3.197 -19.292 -1.297 587 HG22 THR 12 HG22 THR 12 -3.120 -18.947 -3.025 588 HG23 THR 12 HG23 THR 12 -1.660 -18.849 -2.041 589 HA PRO 13 HA PRO 13 -1.663 -13.401 -4.814 590 HB2 PRO 13 HB2 PRO 13 -2.912 -14.403 -7.006 591 HB3 PRO 13 HB3 PRO 13 -1.202 -14.686 -6.662 592 HG2 PRO 13 HG2 PRO 13 -3.553 -16.472 -6.170 593 HG3 PRO 13 HG3 PRO 13 -1.953 -16.881 -6.815 594 HD2 PRO 13 HD2 PRO 13 -2.645 -17.338 -4.238 595 HD3 PRO 13 HD3 PRO 13 -0.985 -16.937 -4.724 596 H LEU 14 H LEU 14 -3.065 -11.945 -3.998 597 HA LEU 14 HA LEU 14 -5.945 -12.473 -4.323 598 HB2 LEU 14 HB2 LEU 14 -6.383 -11.121 -2.434 599 HB3 LEU 14 HB3 LEU 14 -5.089 -12.229 -1.984 600 HG LEU 14 HG LEU 14 -4.466 -9.440 -2.889 601 HD11 LEU 14 HD11 LEU 14 -4.348 -9.137 -0.254 602 HD12 LEU 14 HD12 LEU 14 -5.803 -8.768 -1.181 603 HD13 LEU 14 HD13 LEU 14 -5.670 -10.302 -0.322 604 HD21 LEU 14 HD21 LEU 14 -2.501 -10.623 -2.732 605 HD22 LEU 14 HD22 LEU 14 -2.628 -9.961 -1.103 606 HD23 LEU 14 HD23 LEU 14 -3.088 -11.635 -1.412 607 H VAL 15 H VAL 15 -6.737 -9.796 -3.763 608 HA VAL 15 HA VAL 15 -5.466 -7.964 -5.534 609 HB VAL 15 HB VAL 15 -6.467 -9.349 -7.259 610 HG11 VAL 15 HG11 VAL 15 -9.126 -8.775 -5.957 611 HG12 VAL 15 HG12 VAL 15 -8.846 -9.725 -7.417 612 HG13 VAL 15 HG13 VAL 15 -8.265 -10.311 -5.858 613 HG21 VAL 15 HG21 VAL 15 -8.379 -7.166 -7.459 614 HG22 VAL 15 HG22 VAL 15 -6.765 -6.620 -7.002 615 HG23 VAL 15 HG23 VAL 15 -6.994 -7.555 -8.480 616 H THR 16 H THR 16 -6.104 -5.911 -5.120 617 HA THR 16 HA THR 16 -8.138 -5.560 -3.055 618 HB THR 16 HB THR 16 -6.094 -4.459 -2.531 619 HG1 THR 16 HG1 THR 16 -7.180 -2.757 -1.920 620 HG21 THR 16 HG21 THR 16 -6.050 -3.902 -5.382 621 HG22 THR 16 HG22 THR 16 -5.676 -2.473 -4.419 622 HG23 THR 16 HG23 THR 16 -4.723 -3.943 -4.222 623 H LEU 17 H LEU 17 -10.127 -5.489 -3.953 624 HA LEU 17 HA LEU 17 -10.643 -4.185 -6.457 625 HB2 LEU 17 HB2 LEU 17 -11.872 -6.179 -5.245 626 HB3 LEU 17 HB3 LEU 17 -12.822 -4.870 -4.546 627 HG LEU 17 HG LEU 17 -12.540 -5.500 -7.484 628 HD11 LEU 17 HD11 LEU 17 -14.395 -6.346 -5.405 629 HD12 LEU 17 HD12 LEU 17 -15.195 -5.610 -6.794 630 HD13 LEU 17 HD13 LEU 17 -14.128 -6.996 -7.023 631 HD21 LEU 17 HD21 LEU 17 -14.391 -3.778 -7.656 632 HD22 LEU 17 HD22 LEU 17 -13.955 -3.287 -6.020 633 HD23 LEU 17 HD23 LEU 17 -12.774 -3.158 -7.323 634 H PHE 18 H PHE 18 -10.131 -2.029 -6.285 635 HA PHE 18 HA PHE 18 -11.635 -0.468 -4.293 636 HB2 PHE 18 HB2 PHE 18 -8.922 -0.234 -5.411 637 HB3 PHE 18 HB3 PHE 18 -9.805 1.286 -5.312 638 HD1 PHE 18 HD1 PHE 18 -11.253 1.281 -2.919 639 HD2 PHE 18 HD2 PHE 18 -7.460 -0.495 -3.675 640 HE1 PHE 18 HE1 PHE 18 -10.703 1.445 -0.526 641 HE2 PHE 18 HE2 PHE 18 -6.904 -0.336 -1.284 642 HZ PHE 18 HZ PHE 18 -8.526 0.634 0.295 643 H LYS 19 H LYS 19 -13.455 0.301 -5.140 644 HA LYS 19 HA LYS 19 -13.371 1.390 -7.878 645 HB2 LYS 19 HB2 LYS 19 -15.483 -0.143 -6.412 646 HB3 LYS 19 HB3 LYS 19 -15.962 1.009 -7.651 647 HG2 LYS 19 HG2 LYS 19 -14.452 -0.191 -9.238 648 HG3 LYS 19 HG3 LYS 19 -14.213 -1.415 -7.989 649 HD2 LYS 19 HD2 LYS 19 -15.925 -2.296 -9.308 650 HD3 LYS 19 HD3 LYS 19 -16.779 -1.573 -7.943 651 HE2 LYS 19 HE2 LYS 19 -17.601 0.166 -9.206 652 HE3 LYS 19 HE3 LYS 19 -16.292 0.070 -10.383 653 HZ1 LYS 19 HZ1 LYS 19 -18.839 -1.053 -10.554 654 HZ2 LYS 19 HZ2 LYS 19 -17.569 -1.179 -11.665 655 HZ3 LYS 19 HZ3 LYS 19 -17.740 -2.334 -10.440 656 H ASN 20 H ASN 20 -14.548 3.310 -8.295 657 HA ASN 20 HA ASN 20 -15.107 5.472 -7.846 658 HB2 ASN 20 HB2 ASN 20 -17.062 3.998 -6.861 659 HB3 ASN 20 HB3 ASN 20 -16.460 4.608 -5.322 660 HD21 ASN 20 HD21 ASN 20 -19.000 5.095 -6.657 661 HD22 ASN 20 HD22 ASN 20 -19.117 6.807 -6.855 662 H ALA 21 H ALA 21 -12.577 4.655 -6.868 663 HA ALA 21 HA ALA 21 -12.128 5.487 -4.200 664 HB1 ALA 21 HB1 ALA 21 -10.340 5.051 -6.564 665 HB2 ALA 21 HB2 ALA 21 -9.710 5.702 -5.051 666 HB3 ALA 21 HB3 ALA 21 -10.469 4.110 -5.078 667 H ILE 22 H ILE 22 -12.616 7.482 -3.537 668 HA ILE 22 HA ILE 22 -11.794 9.750 -5.231 669 HB ILE 22 HB ILE 22 -14.017 9.662 -3.188 670 HG12 ILE 22 HG12 ILE 22 -14.339 10.164 -6.133 671 HG13 ILE 22 HG13 ILE 22 -14.278 8.519 -5.510 672 HG21 ILE 22 HG21 ILE 22 -13.433 11.853 -3.054 673 HG22 ILE 22 HG22 ILE 22 -12.699 11.871 -4.657 674 HG23 ILE 22 HG23 ILE 22 -14.453 11.941 -4.490 675 HD11 ILE 22 HD11 ILE 22 -16.232 10.610 -4.590 676 HD12 ILE 22 HD12 ILE 22 -16.567 9.394 -5.822 677 HD13 ILE 22 HD13 ILE 22 -16.221 8.899 -4.165 678 H ILE 23 H ILE 23 -10.097 10.817 -4.484 679 HA ILE 23 HA ILE 23 -9.532 10.746 -1.599 680 HB ILE 23 HB ILE 23 -7.743 11.128 -3.985 681 HG12 ILE 23 HG12 ILE 23 -8.255 8.828 -3.168 682 HG13 ILE 23 HG13 ILE 23 -6.546 9.239 -3.062 683 HG21 ILE 23 HG21 ILE 23 -6.804 12.763 -2.693 684 HG22 ILE 23 HG22 ILE 23 -7.339 12.029 -1.180 685 HG23 ILE 23 HG23 ILE 23 -5.964 11.351 -2.052 686 HD11 ILE 23 HD11 ILE 23 -8.532 9.203 -0.804 687 HD12 ILE 23 HD12 ILE 23 -7.220 8.059 -1.086 688 HD13 ILE 23 HD13 ILE 23 -6.855 9.732 -0.666 689 H LYS 24 H LYS 24 -10.356 12.479 -0.616 690 HA LYS 24 HA LYS 24 -9.865 15.117 -1.831 691 HB2 LYS 24 HB2 LYS 24 -12.347 13.950 -0.716 692 HB3 LYS 24 HB3 LYS 24 -12.012 15.618 -0.271 693 HG2 LYS 24 HG2 LYS 24 -11.709 16.062 -2.753 694 HG3 LYS 24 HG3 LYS 24 -12.429 14.471 -3.012 695 HD2 LYS 24 HD2 LYS 24 -13.724 16.700 -1.444 696 HD3 LYS 24 HD3 LYS 24 -14.062 16.342 -3.139 697 HE2 LYS 24 HE2 LYS 24 -14.897 14.160 -2.562 698 HE3 LYS 24 HE3 LYS 24 -14.412 14.374 -0.881 699 HZ1 LYS 24 HZ1 LYS 24 -15.973 16.418 -1.016 700 HZ2 LYS 24 HZ2 LYS 24 -16.651 15.605 -2.335 701 HZ3 LYS 24 HZ3 LYS 24 -16.636 14.876 -0.809 702 H ASN 25 H ASN 25 -8.256 15.984 -0.682 703 HA ASN 25 HA ASN 25 -7.000 16.716 1.068 704 HB2 ASN 25 HB2 ASN 25 -9.443 16.639 2.811 705 HB3 ASN 25 HB3 ASN 25 -8.144 17.828 2.773 706 HD21 ASN 25 HD21 ASN 25 -11.263 17.554 2.224 707 HD22 ASN 25 HD22 ASN 25 -11.474 18.655 0.910 708 H ALA 26 H ALA 26 -7.172 13.884 0.695 709 HA ALA 26 HA ALA 26 -7.605 12.406 3.012 710 HB1 ALA 26 HB1 ALA 26 -6.227 10.694 2.022 711 HB2 ALA 26 HB2 ALA 26 -7.212 11.445 0.767 712 HB3 ALA 26 HB3 ALA 26 -5.506 11.864 0.916 713 H TYR 27 H TYR 27 -4.706 14.125 1.930 714 HA TYR 27 HA TYR 27 -3.628 13.847 4.655 715 HB2 TYR 27 HB2 TYR 27 -2.511 12.459 2.725 716 HB3 TYR 27 HB3 TYR 27 -1.781 14.004 2.302 717 HD1 TYR 27 HD1 TYR 27 -0.958 15.274 4.643 718 HD2 TYR 27 HD2 TYR 27 -1.089 11.087 3.899 719 HE1 TYR 27 HE1 TYR 27 0.781 14.923 6.347 720 HE2 TYR 27 HE2 TYR 27 0.649 10.724 5.601 721 HH TYR 27 HH TYR 27 2.182 13.446 7.271 722 H LYS 28 H LYS 28 -3.401 15.753 5.595 723 HA LYS 28 HA LYS 28 -2.947 18.120 3.899 724 HB2 LYS 28 HB2 LYS 28 -4.266 18.001 6.617 725 HB3 LYS 28 HB3 LYS 28 -4.058 19.442 5.630 726 HG2 LYS 28 HG2 LYS 28 -5.736 18.877 4.199 727 HG3 LYS 28 HG3 LYS 28 -5.506 17.143 4.438 728 HD2 LYS 28 HD2 LYS 28 -6.819 17.087 6.308 729 HD3 LYS 28 HD3 LYS 28 -6.443 18.754 6.754 730 HE2 LYS 28 HE2 LYS 28 -7.778 19.337 4.593 731 HE3 LYS 28 HE3 LYS 28 -8.445 17.717 4.789 732 HZ1 LYS 28 HZ1 LYS 28 -8.732 18.668 7.254 733 HZ2 LYS 28 HZ2 LYS 28 -8.886 20.107 6.378 734 HZ3 LYS 28 HZ3 LYS 28 -9.924 18.809 6.061 735 H LYS 29 H LYS 29 -1.656 19.845 4.847 736 HA LYS 29 HA LYS 29 0.357 18.814 6.737 737 HB2 LYS 29 HB2 LYS 29 1.369 19.060 4.569 738 HB3 LYS 29 HB3 LYS 29 0.695 20.674 4.381 739 HG2 LYS 29 HG2 LYS 29 3.020 20.865 4.900 740 HG3 LYS 29 HG3 LYS 29 2.087 21.425 6.290 741 HD2 LYS 29 HD2 LYS 29 2.374 19.146 7.290 742 HD3 LYS 29 HD3 LYS 29 3.479 18.770 5.965 743 HE2 LYS 29 HE2 LYS 29 4.978 20.520 6.650 744 HE3 LYS 29 HE3 LYS 29 3.834 21.083 7.867 745 HZ1 LYS 29 HZ1 LYS 29 4.985 19.783 9.245 746 HZ2 LYS 29 HZ2 LYS 29 4.181 18.483 8.519 747 HZ3 LYS 29 HZ3 LYS 29 5.728 18.922 7.992 748 H GLY 30 H GLY 30 -1.553 21.585 5.710 749 HA2 GLY 30 HA2 GLY 30 -1.264 22.710 8.392 750 HA3 GLY 30 HA3 GLY 30 -0.760 23.720 7.045 751 H GLU 31 H GLU 31 -3.471 21.490 6.944 752 HA GLU 31 HA GLU 31 -5.229 23.699 6.260 753 HB2 GLU 31 HB2 GLU 31 -5.247 21.580 4.957 754 HB3 GLU 31 HB3 GLU 31 -5.829 20.739 6.387 755 HG2 GLU 31 HG2 GLU 31 -7.559 21.373 4.665 756 HG3 GLU 31 HG3 GLU 31 -7.898 21.840 6.330 757 H1 TYR 1 H TYR 1 2.941 10.171 2.014 758 HA TYR 1 HA TYR 1 1.713 8.850 -0.300 759 HB2 TYR 1 HB2 TYR 1 0.956 8.090 2.513 760 HB3 TYR 1 HB3 TYR 1 0.566 7.257 1.013 761 HD1 TYR 1 HD1 TYR 1 2.300 6.772 3.840 762 HD2 TYR 1 HD2 TYR 1 3.028 6.870 -0.351 763 HE1 TYR 1 HE1 TYR 1 4.254 5.311 4.151 764 HE2 TYR 1 HE2 TYR 1 4.983 5.408 -0.051 765 HH TYR 1 HH TYR 1 6.366 4.467 1.442 766 H GLY 2 H GLY 2 -0.725 8.973 -0.185 767 HA2 GLY 2 HA2 GLY 2 -1.937 10.957 1.475 768 HA3 GLY 2 HA3 GLY 2 -1.598 11.586 -0.131 769 H GLY 3 H GLY 3 -2.159 9.515 -1.779 770 HA2 GLY 3 HA2 GLY 3 -4.993 9.564 -1.862 771 HA3 GLY 3 HA3 GLY 3 -3.948 8.608 -2.901 772 H PHE 4 H PHE 4 -4.921 6.659 -2.865 773 HA PHE 4 HA PHE 4 -5.977 5.530 -0.440 774 HB2 PHE 4 HB2 PHE 4 -5.794 4.667 -3.295 775 HB3 PHE 4 HB3 PHE 4 -6.100 3.447 -2.063 776 HD1 PHE 4 HD1 PHE 4 -8.301 2.886 -1.818 777 HD2 PHE 4 HD2 PHE 4 -7.305 6.904 -2.809 778 HE1 PHE 4 HE1 PHE 4 -10.691 3.471 -1.833 779 HE2 PHE 4 HE2 PHE 4 -9.693 7.496 -2.825 780 HZ PHE 4 HZ PHE 4 -11.390 5.779 -2.336 781 H MET 5 H MET 5 -5.279 3.530 0.508 782 HA MET 5 HA MET 5 -2.402 3.015 0.128 783 HB2 MET 5 HB2 MET 5 -3.222 4.121 2.325 784 HB3 MET 5 HB3 MET 5 -3.834 2.520 2.722 785 HG2 MET 5 HG2 MET 5 -1.361 1.828 2.069 786 HG3 MET 5 HG3 MET 5 -1.046 3.498 2.534 787 HE1 MET 5 HE1 MET 5 0.170 0.774 4.696 788 HE2 MET 5 HE2 MET 5 -1.339 -0.110 4.923 789 HE3 MET 5 HE3 MET 5 -0.786 0.288 3.296 790 H THR 6 H THR 6 -2.211 1.157 -0.944 791 HA THR 6 HA THR 6 -4.057 -1.043 -0.324 792 HB THR 6 HB THR 6 -2.235 -0.639 -2.703 793 HG1 THR 6 HG1 THR 6 -5.069 -0.808 -2.664 794 HG21 THR 6 HG21 THR 6 -2.391 -3.009 -2.159 795 HG22 THR 6 HG22 THR 6 -4.150 -2.894 -2.089 796 HG23 THR 6 HG23 THR 6 -3.310 -2.655 -3.622 797 H SER 7 H SER 7 -3.205 -2.096 1.398 798 HA SER 7 HA SER 7 -0.370 -2.859 1.297 799 HB2 SER 7 HB2 SER 7 -1.610 -1.701 3.346 800 HB3 SER 7 HB3 SER 7 -2.045 -3.369 3.715 801 HG SER 7 HG SER 7 0.073 -3.882 3.939 802 H GLU 8 H GLU 8 -0.398 -4.633 -0.036 803 HA GLU 8 HA GLU 8 -2.081 -6.897 0.806 804 HB2 GLU 8 HB2 GLU 8 -1.107 -5.962 -1.844 805 HB3 GLU 8 HB3 GLU 8 -1.244 -7.698 -1.601 806 HG2 GLU 8 HG2 GLU 8 -3.507 -7.652 -1.511 807 HG3 GLU 8 HG3 GLU 8 -3.559 -6.037 -0.807 808 H LYS 9 H LYS 9 -1.073 -8.451 1.874 809 HA LYS 9 HA LYS 9 1.814 -8.830 1.427 810 HB2 LYS 9 HB2 LYS 9 0.930 -8.123 3.742 811 HB3 LYS 9 HB3 LYS 9 0.315 -9.767 3.863 812 HG2 LYS 9 HG2 LYS 9 3.189 -9.268 3.206 813 HG3 LYS 9 HG3 LYS 9 2.619 -9.203 4.875 814 HD2 LYS 9 HD2 LYS 9 1.570 -11.503 4.380 815 HD3 LYS 9 HD3 LYS 9 2.644 -11.529 2.979 816 HE2 LYS 9 HE2 LYS 9 3.954 -12.576 4.546 817 HE3 LYS 9 HE3 LYS 9 4.466 -10.902 4.755 818 HZ1 LYS 9 HZ1 LYS 9 2.235 -11.412 6.396 819 HZ2 LYS 9 HZ2 LYS 9 3.403 -12.604 6.675 820 HZ3 LYS 9 HZ3 LYS 9 3.804 -10.970 6.851 821 H SER 10 H SER 10 2.074 -10.456 0.028 822 HA SER 10 HA SER 10 1.169 -13.088 0.747 823 HB2 SER 10 HB2 SER 10 -0.012 -13.523 -1.390 824 HB3 SER 10 HB3 SER 10 -0.829 -12.304 -0.413 825 HG SER 10 HG SER 10 -0.519 -11.838 -2.735 826 H GLN 11 H GLN 11 2.462 -14.663 -0.091 827 HA GLN 11 HA GLN 11 4.831 -13.764 -1.502 828 HB2 GLN 11 HB2 GLN 11 5.707 -15.998 -1.045 829 HB3 GLN 11 HB3 GLN 11 5.066 -15.267 0.421 830 HG2 GLN 11 HG2 GLN 11 3.305 -16.722 0.548 831 HG3 GLN 11 HG3 GLN 11 3.295 -17.032 -1.188 832 HE21 GLN 11 HE21 GLN 11 5.163 -17.589 1.755 833 HE22 GLN 11 HE22 GLN 11 5.816 -19.112 1.267 834 H THR 12 H THR 12 2.577 -13.566 -3.094 835 HA THR 12 HA THR 12 3.304 -15.368 -5.256 836 HB THR 12 HB THR 12 0.571 -15.434 -5.516 837 HG1 THR 12 HG1 THR 12 0.460 -14.655 -3.286 838 HG21 THR 12 HG21 THR 12 1.195 -17.794 -4.188 839 HG22 THR 12 HG22 THR 12 1.306 -17.506 -5.924 840 HG23 THR 12 HG23 THR 12 2.723 -17.278 -4.900 841 HA PRO 13 HA PRO 13 2.470 -11.927 -7.848 842 HB2 PRO 13 HB2 PRO 13 1.357 -13.070 -10.045 843 HB3 PRO 13 HB3 PRO 13 3.070 -13.234 -9.640 844 HG2 PRO 13 HG2 PRO 13 0.819 -15.149 -9.164 845 HG3 PRO 13 HG3 PRO 13 2.462 -15.476 -9.747 846 HD2 PRO 13 HD2 PRO 13 1.715 -15.899 -7.178 847 HD3 PRO 13 HD3 PRO 13 3.362 -15.409 -7.626 848 H LEU 14 H LEU 14 0.954 -10.541 -7.116 849 HA LEU 14 HA LEU 14 -1.876 -11.257 -7.517 850 HB2 LEU 14 HB2 LEU 14 -2.459 -9.881 -5.684 851 HB3 LEU 14 HB3 LEU 14 -1.116 -10.895 -5.160 852 HG LEU 14 HG LEU 14 -0.632 -8.100 -6.129 853 HD11 LEU 14 HD11 LEU 14 -0.621 -7.724 -3.496 854 HD12 LEU 14 HD12 LEU 14 -2.056 -7.454 -4.486 855 HD13 LEU 14 HD13 LEU 14 -1.878 -8.959 -3.583 856 HD21 LEU 14 HD21 LEU 14 1.394 -9.155 -5.872 857 HD22 LEU 14 HD22 LEU 14 1.172 -8.457 -4.268 858 HD23 LEU 14 HD23 LEU 14 0.825 -10.164 -4.542 859 H VAL 15 H VAL 15 -2.852 -8.623 -7.065 860 HA VAL 15 HA VAL 15 -1.638 -6.765 -8.851 861 HB VAL 15 HB VAL 15 -2.500 -8.260 -10.560 862 HG11 VAL 15 HG11 VAL 15 -5.229 -7.806 -9.360 863 HG12 VAL 15 HG12 VAL 15 -4.845 -8.784 -10.776 864 HG13 VAL 15 HG13 VAL 15 -4.283 -9.283 -9.181 865 HG21 VAL 15 HG21 VAL 15 -4.529 -6.205 -10.892 866 HG22 VAL 15 HG22 VAL 15 -2.971 -5.546 -10.395 867 HG23 VAL 15 HG23 VAL 15 -3.086 -6.535 -11.851 868 H THR 16 H THR 16 -2.421 -4.742 -8.532 869 HA THR 16 HA THR 16 -4.533 -4.459 -6.535 870 HB THR 16 HB THR 16 -2.581 -3.217 -5.982 871 HG1 THR 16 HG1 THR 16 -3.787 -1.566 -5.464 872 HG21 THR 16 HG21 THR 16 -2.473 -2.748 -8.848 873 HG22 THR 16 HG22 THR 16 -2.217 -1.270 -7.921 874 HG23 THR 16 HG23 THR 16 -1.186 -2.673 -7.644 875 H LEU 17 H LEU 17 -6.498 -4.524 -7.480 876 HA LEU 17 HA LEU 17 -7.014 -3.335 -10.043 877 HB2 LEU 17 HB2 LEU 17 -8.158 -5.362 -8.802 878 HB3 LEU 17 HB3 LEU 17 -9.204 -4.091 -8.173 879 HG LEU 17 HG LEU 17 -8.798 -4.796 -11.079 880 HD11 LEU 17 HD11 LEU 17 -10.660 -5.684 -9.027 881 HD12 LEU 17 HD12 LEU 17 -11.463 -5.035 -10.457 882 HD13 LEU 17 HD13 LEU 17 -10.314 -6.364 -10.617 883 HD21 LEU 17 HD21 LEU 17 -10.737 -3.191 -11.363 884 HD22 LEU 17 HD22 LEU 17 -10.380 -2.622 -9.732 885 HD23 LEU 17 HD23 LEU 17 -9.169 -2.467 -11.005 886 H PHE 18 H PHE 18 -6.637 -1.147 -9.927 887 HA PHE 18 HA PHE 18 -8.289 0.380 -8.029 888 HB2 PHE 18 HB2 PHE 18 -5.563 0.744 -9.080 889 HB3 PHE 18 HB3 PHE 18 -6.538 2.210 -9.052 890 HD1 PHE 18 HD1 PHE 18 -8.051 2.190 -6.701 891 HD2 PHE 18 HD2 PHE 18 -4.139 0.623 -7.297 892 HE1 PHE 18 HE1 PHE 18 -7.581 2.458 -4.300 893 HE2 PHE 18 HE2 PHE 18 -3.663 0.888 -4.898 894 HZ PHE 18 HZ PHE 18 -5.386 1.806 -3.396 895 H LYS 19 H LYS 19 -10.128 1.005 -8.952 896 HA LYS 19 HA LYS 19 -10.028 2.013 -11.720 897 HB2 LYS 19 HB2 LYS 19 -12.087 0.404 -10.261 898 HB3 LYS 19 HB3 LYS 19 -12.598 1.485 -11.551 899 HG2 LYS 19 HG2 LYS 19 -10.974 0.327 -13.055 900 HG3 LYS 19 HG3 LYS 19 -10.701 -0.840 -11.759 901 HD2 LYS 19 HD2 LYS 19 -12.319 -1.862 -13.094 902 HD3 LYS 19 HD3 LYS 19 -13.255 -1.147 -11.779 903 HE2 LYS 19 HE2 LYS 19 -14.137 0.499 -13.124 904 HE3 LYS 19 HE3 LYS 19 -12.790 0.441 -14.260 905 HZ1 LYS 19 HZ1 LYS 19 -15.262 -0.833 -14.463 906 HZ2 LYS 19 HZ2 LYS 19 -13.955 -0.921 -15.533 907 HZ3 LYS 19 HZ3 LYS 19 -14.095 -2.043 -14.275 908 H ASN 20 H ASN 20 -11.292 3.849 -12.233 909 HA ASN 20 HA ASN 20 -11.994 5.985 -11.872 910 HB2 ASN 20 HB2 ASN 20 -13.886 4.428 -10.887 911 HB3 ASN 20 HB3 ASN 20 -13.366 5.127 -9.356 912 HD21 ASN 20 HD21 ASN 20 -15.891 5.411 -10.776 913 HD22 ASN 20 HD22 ASN 20 -16.104 7.105 -11.040 914 H ALA 21 H ALA 21 -9.450 5.355 -10.802 915 HA ALA 21 HA ALA 21 -9.126 6.296 -8.152 916 HB1 ALA 21 HB1 ALA 21 -7.250 5.888 -10.453 917 HB2 ALA 21 HB2 ALA 21 -6.701 6.628 -8.949 918 HB3 ALA 21 HB3 ALA 21 -7.364 4.994 -8.937 919 H ILE 22 H ILE 22 -9.754 8.279 -7.573 920 HA ILE 22 HA ILE 22 -9.016 10.535 -9.320 921 HB ILE 22 HB ILE 22 -11.288 10.382 -7.335 922 HG12 ILE 22 HG12 ILE 22 -11.551 10.762 -10.304 923 HG13 ILE 22 HG13 ILE 22 -11.417 9.147 -9.618 924 HG21 ILE 22 HG21 ILE 22 -10.838 12.607 -7.263 925 HG22 ILE 22 HG22 ILE 22 -10.061 12.615 -8.846 926 HG23 ILE 22 HG23 ILE 22 -11.820 12.586 -8.728 927 HD11 ILE 22 HD11 ILE 22 -13.512 11.156 -8.834 928 HD12 ILE 22 HD12 ILE 22 -13.741 9.878 -10.027 929 HD13 ILE 22 HD13 ILE 22 -13.418 9.464 -8.344 930 H ILE 23 H ILE 23 -7.404 11.721 -8.563 931 HA ILE 23 HA ILE 23 -6.921 11.779 -5.663 932 HB ILE 23 HB ILE 23 -5.087 12.189 -8.010 933 HG12 ILE 23 HG12 ILE 23 -5.491 9.890 -7.132 934 HG13 ILE 23 HG13 ILE 23 -3.813 10.402 -6.994 935 HG21 ILE 23 HG21 ILE 23 -4.286 13.916 -6.745 936 HG22 ILE 23 HG22 ILE 23 -4.819 13.197 -5.225 937 HG23 ILE 23 HG23 ILE 23 -3.382 12.576 -6.038 938 HD11 ILE 23 HD11 ILE 23 -5.857 10.316 -4.791 939 HD12 ILE 23 HD12 ILE 23 -4.468 9.249 -4.998 940 HD13 ILE 23 HD13 ILE 23 -4.222 10.955 -4.625 941 H LYS 24 H LYS 24 -7.875 13.491 -4.763 942 HA LYS 24 HA LYS 24 -7.499 16.113 -6.052 943 HB2 LYS 24 HB2 LYS 24 -9.944 14.840 -4.971 944 HB3 LYS 24 HB3 LYS 24 -9.721 16.540 -4.581 945 HG2 LYS 24 HG2 LYS 24 -9.364 16.909 -7.067 946 HG3 LYS 24 HG3 LYS 24 -9.982 15.270 -7.286 947 HD2 LYS 24 HD2 LYS 24 -11.453 17.475 -5.846 948 HD3 LYS 24 HD3 LYS 24 -11.717 17.034 -7.535 949 HE2 LYS 24 HE2 LYS 24 -12.443 14.831 -6.897 950 HE3 LYS 24 HE3 LYS 24 -12.022 15.135 -5.212 951 HZ1 LYS 24 HZ1 LYS 24 -13.694 17.079 -5.472 952 HZ2 LYS 24 HZ2 LYS 24 -14.284 16.176 -6.776 953 HZ3 LYS 24 HZ3 LYS 24 -14.273 15.509 -5.221 954 H ASN 25 H ASN 25 -5.984 17.112 -4.884 955 HA ASN 25 HA ASN 25 -4.831 17.973 -3.121 956 HB2 ASN 25 HB2 ASN 25 -7.318 17.802 -1.450 957 HB3 ASN 25 HB3 ASN 25 -6.093 19.066 -1.491 958 HD21 ASN 25 HD21 ASN 25 -9.171 18.584 -2.117 959 HD22 ASN 25 HD22 ASN 25 -9.409 19.627 -3.474 960 H ALA 26 H ALA 26 -4.824 15.124 -3.406 961 HA ALA 26 HA ALA 26 -5.241 13.695 -1.057 962 HB1 ALA 26 HB1 ALA 26 -3.731 12.040 -1.949 963 HB2 ALA 26 HB2 ALA 26 -4.718 12.691 -3.257 964 HB3 ALA 26 HB3 ALA 26 -3.046 13.218 -3.069 965 H TYR 27 H TYR 27 -2.413 15.548 -2.107 966 HA TYR 27 HA TYR 27 -1.412 15.422 0.658 967 HB2 TYR 27 HB2 TYR 27 -0.152 14.045 -1.191 968 HB3 TYR 27 HB3 TYR 27 0.500 15.618 -1.638 969 HD1 TYR 27 HD1 TYR 27 1.168 17.002 0.687 970 HD2 TYR 27 HD2 TYR 27 1.307 12.795 0.069 971 HE1 TYR 27 HE1 TYR 27 2.866 16.805 2.455 972 HE2 TYR 27 HE2 TYR 27 3.005 12.586 1.837 973 HH TYR 27 HH TYR 27 4.319 15.441 3.469 974 H LYS 28 H LYS 28 -1.324 17.366 1.542 975 HA LYS 28 HA LYS 28 -0.959 19.702 -0.216 976 HB2 LYS 28 HB2 LYS 28 -2.354 19.588 2.465 977 HB3 LYS 28 HB3 LYS 28 -2.201 21.007 1.437 978 HG2 LYS 28 HG2 LYS 28 -3.796 20.296 -0.025 979 HG3 LYS 28 HG3 LYS 28 -3.473 18.588 0.281 980 HD2 LYS 28 HD2 LYS 28 -4.840 18.517 2.112 981 HD3 LYS 28 HD3 LYS 28 -4.575 20.216 2.510 982 HE2 LYS 28 HE2 LYS 28 -5.872 20.647 0.291 983 HE3 LYS 28 HE3 LYS 28 -6.450 18.998 0.524 984 HZ1 LYS 28 HZ1 LYS 28 -6.869 20.014 2.945 985 HZ2 LYS 28 HZ2 LYS 28 -7.080 21.410 2.012 986 HZ3 LYS 28 HZ3 LYS 28 -8.029 20.042 1.714 987 H LYS 29 H LYS 29 0.196 21.531 0.713 988 HA LYS 29 HA LYS 29 2.206 20.682 2.696 989 HB2 LYS 29 HB2 LYS 29 3.270 20.918 0.552 990 HB3 LYS 29 HB3 LYS 29 2.511 22.483 0.291 991 HG2 LYS 29 HG2 LYS 29 4.803 22.827 0.873 992 HG3 LYS 29 HG3 LYS 29 3.795 23.372 2.216 993 HD2 LYS 29 HD2 LYS 29 4.183 21.143 3.293 994 HD3 LYS 29 HD3 LYS 29 5.352 20.797 2.017 995 HE2 LYS 29 HE2 LYS 29 6.720 22.652 2.695 996 HE3 LYS 29 HE3 LYS 29 5.504 23.182 3.855 997 HZ1 LYS 29 HZ1 LYS 29 6.679 21.995 5.312 998 HZ2 LYS 29 HZ2 LYS 29 5.981 20.628 4.601 999 HZ3 LYS 29 HZ3 LYS 29 7.516 21.144 4.113 1000 H GLY 30 H GLY 30 0.173 23.301 1.518 1001 HA2 GLY 30 HA2 GLY 30 0.310 24.527 4.168 1002 HA3 GLY 30 HA3 GLY 30 0.794 25.521 2.802 1003 H GLU 31 H GLU 31 -1.776 23.129 2.701 1004 HA GLU 31 HA GLU 31 -3.639 25.205 1.891 1005 HB2 GLU 31 HB2 GLU 31 -3.491 23.047 0.662 1006 HB3 GLU 31 HB3 GLU 31 -4.068 22.220 2.102 1007 HG2 GLU 31 HG2 GLU 31 -5.776 22.694 0.308 1008 HG3 GLU 31 HG3 GLU 31 -6.195 23.193 1.945 1009 H1 TYR 1 H TYR 1 5.438 12.058 -1.679 1010 HA TYR 1 HA TYR 1 4.363 10.589 -3.981 1011 HB2 TYR 1 HB2 TYR 1 3.570 9.877 -1.165 1012 HB3 TYR 1 HB3 TYR 1 3.270 8.975 -2.646 1013 HD1 TYR 1 HD1 TYR 1 4.950 8.682 0.240 1014 HD2 TYR 1 HD2 TYR 1 5.789 8.691 -3.931 1015 HE1 TYR 1 HE1 TYR 1 6.975 7.349 0.651 1016 HE2 TYR 1 HE2 TYR 1 7.816 7.357 -3.532 1017 HH TYR 1 HH TYR 1 9.209 6.545 -1.972 1018 H GLY 2 H GLY 2 1.922 10.570 -3.945 1019 HA2 GLY 2 HA2 GLY 2 0.542 12.528 -2.389 1020 HA3 GLY 2 HA3 GLY 2 0.893 13.125 -4.005 1021 H GLY 3 H GLY 3 0.510 10.971 -5.597 1022 HA2 GLY 3 HA2 GLY 3 -2.318 10.846 -5.768 1023 HA3 GLY 3 HA3 GLY 3 -1.184 9.921 -6.740 1024 H PHE 4 H PHE 4 -2.046 7.920 -6.666 1025 HA PHE 4 HA PHE 4 -3.108 6.811 -4.235 1026 HB2 PHE 4 HB2 PHE 4 -2.790 5.868 -7.052 1027 HB3 PHE 4 HB3 PHE 4 -3.060 4.673 -5.789 1028 HD1 PHE 4 HD1 PHE 4 -5.230 3.989 -5.586 1029 HD2 PHE 4 HD2 PHE 4 -4.444 8.026 -6.684 1030 HE1 PHE 4 HE1 PHE 4 -7.649 4.430 -5.687 1031 HE2 PHE 4 HE2 PHE 4 -6.861 8.473 -6.786 1032 HZ PHE 4 HZ PHE 4 -8.467 6.674 -6.286 1033 H MET 5 H MET 5 -2.325 4.888 -3.199 1034 HA MET 5 HA MET 5 0.587 4.529 -3.481 1035 HB2 MET 5 HB2 MET 5 -0.355 5.661 -1.348 1036 HB3 MET 5 HB3 MET 5 -0.891 4.045 -0.910 1037 HG2 MET 5 HG2 MET 5 1.633 3.467 -1.468 1038 HG3 MET 5 HG3 MET 5 1.845 5.167 -1.057 1039 HE1 MET 5 HE1 MET 5 3.144 2.596 1.239 1040 HE2 MET 5 HE2 MET 5 1.680 1.636 1.454 1041 HE3 MET 5 HE3 MET 5 2.260 2.008 -0.169 1042 H THR 6 H THR 6 0.916 2.649 -4.478 1043 HA THR 6 HA THR 6 -0.821 0.369 -3.833 1044 HB THR 6 HB THR 6 1.054 0.792 -6.167 1045 HG1 THR 6 HG1 THR 6 -1.768 0.469 -6.211 1046 HG21 THR 6 HG21 THR 6 1.001 -1.564 -5.534 1047 HG22 THR 6 HG22 THR 6 -0.762 -1.540 -5.540 1048 HG23 THR 6 HG23 THR 6 0.128 -1.311 -7.045 1049 H SER 7 H SER 7 0.028 -0.585 -2.056 1050 HA SER 7 HA SER 7 2.905 -1.178 -2.035 1051 HB2 SER 7 HB2 SER 7 1.528 -0.035 -0.068 1052 HB3 SER 7 HB3 SER 7 1.176 -1.714 0.339 1053 HG SER 7 HG SER 7 3.311 -2.095 0.650 1054 H GLU 8 H GLU 8 3.037 -2.992 -3.303 1055 HA GLU 8 HA GLU 8 1.460 -5.326 -2.447 1056 HB2 GLU 8 HB2 GLU 8 2.477 -4.421 -5.094 1057 HB3 GLU 8 HB3 GLU 8 2.416 -6.152 -4.796 1058 HG2 GLU 8 HG2 GLU 8 0.152 -6.218 -4.790 1059 HG3 GLU 8 HG3 GLU 8 -0.005 -4.588 -4.137 1060 H LYS 9 H LYS 9 2.520 -6.787 -1.301 1061 HA LYS 9 HA LYS 9 5.439 -6.998 -1.635 1062 HB2 LYS 9 HB2 LYS 9 4.419 -6.292 0.626 1063 HB3 LYS 9 HB3 LYS 9 3.916 -7.971 0.770 1064 HG2 LYS 9 HG2 LYS 9 6.770 -7.284 0.205 1065 HG3 LYS 9 HG3 LYS 9 6.133 -7.226 1.850 1066 HD2 LYS 9 HD2 LYS 9 5.270 -9.604 1.371 1067 HD3 LYS 9 HD3 LYS 9 6.395 -9.583 0.011 1068 HE2 LYS 9 HE2 LYS 9 7.718 -10.499 1.645 1069 HE3 LYS 9 HE3 LYS 9 8.100 -8.789 1.837 1070 HZ1 LYS 9 HZ1 LYS 9 5.851 -9.429 3.406 1071 HZ2 LYS 9 HZ2 LYS 9 7.088 -10.530 3.752 1072 HZ3 LYS 9 HZ3 LYS 9 7.366 -8.868 3.909 1073 H SER 10 H SER 10 5.853 -8.640 -2.977 1074 HA SER 10 HA SER 10 5.090 -11.305 -2.219 1075 HB2 SER 10 HB2 SER 10 4.006 -11.870 -4.375 1076 HB3 SER 10 HB3 SER 10 3.085 -10.676 -3.461 1077 HG SER 10 HG SER 10 3.440 -10.258 -5.785 1078 H GLN 11 H GLN 11 6.532 -12.796 -2.937 1079 HA GLN 11 HA GLN 11 8.872 -11.787 -4.315 1080 HB2 GLN 11 HB2 GLN 11 9.878 -13.943 -3.762 1081 HB3 GLN 11 HB3 GLN 11 9.144 -13.215 -2.340 1082 HG2 GLN 11 HG2 GLN 11 7.482 -14.782 -2.221 1083 HG3 GLN 11 HG3 GLN 11 7.544 -15.138 -3.946 1084 HE21 GLN 11 HE21 GLN 11 9.352 -15.493 -0.935 1085 HE22 GLN 11 HE22 GLN 11 10.119 -16.980 -1.362 1086 H THR 12 H THR 12 6.666 -11.785 -5.981 1087 HA THR 12 HA THR 12 7.580 -13.597 -8.063 1088 HB THR 12 HB THR 12 4.870 -13.853 -8.411 1089 HG1 THR 12 HG1 THR 12 4.629 -13.006 -6.215 1090 HG21 THR 12 HG21 THR 12 5.593 -16.120 -6.977 1091 HG22 THR 12 HG22 THR 12 5.752 -15.884 -8.717 1092 HG23 THR 12 HG23 THR 12 7.112 -15.530 -7.652 1093 HA PRO 13 HA PRO 13 6.615 -10.294 -10.786 1094 HB2 PRO 13 HB2 PRO 13 5.653 -11.570 -12.980 1095 HB3 PRO 13 HB3 PRO 13 7.358 -11.610 -12.516 1096 HG2 PRO 13 HG2 PRO 13 5.220 -13.654 -12.053 1097 HG3 PRO 13 HG3 PRO 13 6.899 -13.889 -12.572 1098 HD2 PRO 13 HD2 PRO 13 6.095 -14.286 -10.017 1099 HD3 PRO 13 HD3 PRO 13 7.721 -13.703 -10.427 1100 H LEU 14 H LEU 14 4.991 -8.982 -10.166 1101 HA LEU 14 HA LEU 14 2.228 -9.894 -10.629 1102 HB2 LEU 14 HB2 LEU 14 1.494 -8.508 -8.859 1103 HB3 LEU 14 HB3 LEU 14 2.880 -9.417 -8.260 1104 HG LEU 14 HG LEU 14 3.210 -6.622 -9.293 1105 HD11 LEU 14 HD11 LEU 14 3.123 -6.188 -6.669 1106 HD12 LEU 14 HD12 LEU 14 1.705 -6.031 -7.704 1107 HD13 LEU 14 HD13 LEU 14 1.950 -7.501 -6.763 1108 HD21 LEU 14 HD21 LEU 14 5.295 -7.526 -8.956 1109 HD22 LEU 14 HD22 LEU 14 4.980 -6.816 -7.373 1110 HD23 LEU 14 HD23 LEU 14 4.758 -8.547 -7.623 1111 H VAL 15 H VAL 15 1.062 -7.324 -10.297 1112 HA VAL 15 HA VAL 15 2.221 -5.443 -12.099 1113 HB VAL 15 HB VAL 15 1.505 -7.037 -13.785 1114 HG11 VAL 15 HG11 VAL 15 -1.282 -6.722 -12.679 1115 HG12 VAL 15 HG12 VAL 15 -0.793 -7.717 -14.050 1116 HG13 VAL 15 HG13 VAL 15 -0.250 -8.129 -12.424 1117 HG21 VAL 15 HG21 VAL 15 -0.639 -5.131 -14.245 1118 HG22 VAL 15 HG22 VAL 15 0.851 -4.353 -13.711 1119 HG23 VAL 15 HG23 VAL 15 0.859 -5.385 -15.141 1120 H THR 16 H THR 16 1.303 -3.464 -11.873 1121 HA THR 16 HA THR 16 -0.879 -3.252 -9.943 1122 HB THR 16 HB THR 16 0.977 -1.873 -9.380 1123 HG1 THR 16 HG1 THR 16 -0.341 -0.282 -8.949 1124 HG21 THR 16 HG21 THR 16 1.129 -1.478 -12.257 1125 HG22 THR 16 HG22 THR 16 1.282 0.034 -11.363 1126 HG23 THR 16 HG23 THR 16 2.381 -1.303 -11.027 1127 H LEU 17 H LEU 17 -2.808 -3.465 -10.935 1128 HA LEU 17 HA LEU 17 -3.322 -2.393 -13.550 1129 HB2 LEU 17 HB2 LEU 17 -4.375 -4.447 -12.273 1130 HB3 LEU 17 HB3 LEU 17 -5.515 -3.224 -11.715 1131 HG LEU 17 HG LEU 17 -4.983 -3.994 -14.584 1132 HD11 LEU 17 HD11 LEU 17 -6.845 -4.933 -12.554 1133 HD12 LEU 17 HD12 LEU 17 -7.644 -4.383 -14.026 1134 HD13 LEU 17 HD13 LEU 17 -6.410 -5.640 -14.110 1135 HD21 LEU 17 HD21 LEU 17 -7.009 -2.524 -14.973 1136 HD22 LEU 17 HD22 LEU 17 -6.736 -1.885 -13.352 1137 HD23 LEU 17 HD23 LEU 17 -5.500 -1.692 -14.595 1138 H PHE 18 H PHE 18 -3.090 -0.185 -13.504 1139 HA PHE 18 HA PHE 18 -4.886 1.296 -11.702 1140 HB2 PHE 18 HB2 PHE 18 -2.158 1.797 -12.691 1141 HB3 PHE 18 HB3 PHE 18 -3.222 3.199 -12.734 1142 HD1 PHE 18 HD1 PHE 18 -4.790 3.172 -10.427 1143 HD2 PHE 18 HD2 PHE 18 -0.785 1.800 -10.866 1144 HE1 PHE 18 HE1 PHE 18 -4.404 3.539 -8.024 1145 HE2 PHE 18 HE2 PHE 18 -0.393 2.164 -8.465 1146 HZ PHE 18 HZ PHE 18 -2.204 3.034 -7.040 1147 H LYS 19 H LYS 19 -6.730 1.777 -12.695 1148 HA LYS 19 HA LYS 19 -6.612 2.697 -15.493 1149 HB2 LYS 19 HB2 LYS 19 -8.608 1.013 -14.034 1150 HB3 LYS 19 HB3 LYS 19 -9.152 2.022 -15.368 1151 HG2 LYS 19 HG2 LYS 19 -7.416 0.922 -16.794 1152 HG3 LYS 19 HG3 LYS 19 -7.119 -0.193 -15.458 1153 HD2 LYS 19 HD2 LYS 19 -8.638 -1.340 -16.806 1154 HD3 LYS 19 HD3 LYS 19 -9.653 -0.638 -15.544 1155 HE2 LYS 19 HE2 LYS 19 -10.577 0.917 -16.968 1156 HE3 LYS 19 HE3 LYS 19 -9.192 0.898 -18.059 1157 HZ1 LYS 19 HZ1 LYS 19 -11.585 -0.515 -18.298 1158 HZ2 LYS 19 HZ2 LYS 19 -10.240 -0.563 -19.324 1159 HZ3 LYS 19 HZ3 LYS 19 -10.361 -1.653 -18.035 1160 H ASN 20 H ASN 20 -7.950 4.443 -16.102 1161 HA ASN 20 HA ASN 20 -8.791 6.542 -15.836 1162 HB2 ASN 20 HB2 ASN 20 -10.616 4.909 -14.848 1163 HB3 ASN 20 HB3 ASN 20 -10.184 5.691 -13.330 1164 HD21 ASN 20 HD21 ASN 20 -12.678 5.774 -14.828 1165 HD22 ASN 20 HD22 ASN 20 -12.983 7.442 -15.161 1166 H ALA 21 H ALA 21 -6.247 6.097 -14.674 1167 HA ALA 21 HA ALA 21 -6.056 7.144 -12.051 1168 HB1 ALA 21 HB1 ALA 21 -4.094 6.770 -14.284 1169 HB2 ALA 21 HB2 ALA 21 -3.632 7.593 -12.794 1170 HB3 ALA 21 HB3 ALA 21 -4.199 5.923 -12.740 1171 H ILE 22 H ILE 22 -6.810 9.105 -11.555 1172 HA ILE 22 HA ILE 22 -6.155 11.342 -13.360 1173 HB ILE 22 HB ILE 22 -8.471 11.119 -11.435 1174 HG12 ILE 22 HG12 ILE 22 -8.672 11.395 -14.420 1175 HG13 ILE 22 HG13 ILE 22 -8.457 9.810 -13.683 1176 HG21 ILE 22 HG21 ILE 22 -8.152 13.368 -11.423 1177 HG22 ILE 22 HG22 ILE 22 -7.331 13.372 -12.983 1178 HG23 ILE 22 HG23 ILE 22 -9.088 13.244 -12.912 1179 HD11 ILE 22 HD11 ILE 22 -10.694 11.704 -13.012 1180 HD12 ILE 22 HD12 ILE 22 -10.810 10.382 -14.173 1181 HD13 ILE 22 HD13 ILE 22 -10.508 10.036 -12.470 1182 H ILE 23 H ILE 23 -4.631 12.639 -12.601 1183 HA ILE 23 HA ILE 23 -4.239 12.822 -9.692 1184 HB ILE 23 HB ILE 23 -2.366 13.262 -12.003 1185 HG12 ILE 23 HG12 ILE 23 -2.657 10.974 -11.057 1186 HG13 ILE 23 HG13 ILE 23 -1.017 11.591 -10.889 1187 HG21 ILE 23 HG21 ILE 23 -1.701 15.075 -10.781 1188 HG22 ILE 23 HG22 ILE 23 -2.238 14.381 -9.251 1189 HG23 ILE 23 HG23 ILE 23 -0.744 13.816 -10.000 1190 HD11 ILE 23 HD11 ILE 23 -3.119 11.453 -8.744 1191 HD12 ILE 23 HD12 ILE 23 -1.662 10.469 -8.873 1192 HD13 ILE 23 HD13 ILE 23 -1.533 12.198 -8.553 1193 H LYS 24 H LYS 24 -5.323 14.500 -8.881 1194 HA LYS 24 HA LYS 24 -5.058 17.099 -10.244 1195 HB2 LYS 24 HB2 LYS 24 -7.459 15.716 -9.198 1196 HB3 LYS 24 HB3 LYS 24 -7.348 17.437 -8.851 1197 HG2 LYS 24 HG2 LYS 24 -6.933 17.758 -11.335 1198 HG3 LYS 24 HG3 LYS 24 -7.448 16.080 -11.525 1199 HD2 LYS 24 HD2 LYS 24 -9.089 18.236 -10.197 1200 HD3 LYS 24 HD3 LYS 24 -9.273 17.730 -11.878 1201 HE2 LYS 24 HE2 LYS 24 -9.892 15.509 -11.195 1202 HE3 LYS 24 HE3 LYS 24 -9.541 15.884 -9.508 1203 HZ1 LYS 24 HZ1 LYS 24 -11.312 17.719 -9.874 1204 HZ2 LYS 24 HZ2 LYS 24 -11.810 16.748 -11.167 1205 HZ3 LYS 24 HZ3 LYS 24 -11.808 16.126 -9.593 1206 H ASN 25 H ASN 25 -3.651 18.231 -9.066 1207 HA ASN 25 HA ASN 25 -2.604 19.211 -7.299 1208 HB2 ASN 25 HB2 ASN 25 -5.128 18.944 -5.698 1209 HB3 ASN 25 HB3 ASN 25 -3.979 20.278 -5.744 1210 HD21 ASN 25 HD21 ASN 25 -7.002 19.592 -6.446 1211 HD22 ASN 25 HD22 ASN 25 -7.258 20.575 -7.844 1212 H ALA 26 H ALA 26 -2.423 16.359 -7.489 1213 HA ALA 26 HA ALA 26 -2.828 14.982 -5.107 1214 HB1 ALA 26 HB1 ALA 26 -1.193 13.395 -5.897 1215 HB2 ALA 26 HB2 ALA 26 -2.179 13.941 -7.253 1216 HB3 ALA 26 HB3 ALA 26 -0.548 14.576 -7.037 1217 H TYR 27 H TYR 27 -0.086 16.972 -6.131 1218 HA TYR 27 HA TYR 27 0.834 16.992 -3.335 1219 HB2 TYR 27 HB2 TYR 27 2.231 15.637 -5.101 1220 HB3 TYR 27 HB3 TYR 27 2.804 17.232 -5.578 1221 HD1 TYR 27 HD1 TYR 27 3.309 18.723 -3.275 1222 HD2 TYR 27 HD2 TYR 27 3.725 14.516 -3.761 1223 HE1 TYR 27 HE1 TYR 27 4.957 18.681 -1.451 1224 HE2 TYR 27 HE2 TYR 27 5.374 14.463 -1.937 1225 HH TYR 27 HH TYR 27 6.458 17.439 -0.352 1226 H LYS 28 H LYS 28 0.779 18.964 -2.513 1227 HA LYS 28 HA LYS 28 1.059 21.263 -4.337 1228 HB2 LYS 28 HB2 LYS 28 -0.408 21.147 -1.694 1229 HB3 LYS 28 HB3 LYS 28 -0.308 22.541 -2.762 1230 HG2 LYS 28 HG2 LYS 28 -1.813 21.693 -4.244 1231 HG3 LYS 28 HG3 LYS 28 -1.398 20.017 -3.877 1232 HD2 LYS 28 HD2 LYS 28 -2.813 19.916 -2.085 1233 HD3 LYS 28 HD3 LYS 28 -2.662 21.639 -1.731 1234 HE2 LYS 28 HE2 LYS 28 -3.915 21.926 -3.999 1235 HE3 LYS 28 HE3 LYS 28 -4.401 20.253 -3.730 1236 HZ1 LYS 28 HZ1 LYS 28 -4.951 21.314 -1.356 1237 HZ2 LYS 28 HZ2 LYS 28 -5.217 22.665 -2.338 1238 HZ3 LYS 28 HZ3 LYS 28 -6.074 21.234 -2.619 1239 H LYS 29 H LYS 29 2.073 23.186 -3.434 1240 HA LYS 29 HA LYS 29 4.070 22.521 -1.369 1241 HB2 LYS 29 HB2 LYS 29 5.180 22.757 -3.491 1242 HB3 LYS 29 HB3 LYS 29 4.338 24.266 -3.821 1243 HG2 LYS 29 HG2 LYS 29 6.592 24.756 -3.186 1244 HG3 LYS 29 HG3 LYS 29 5.512 25.288 -1.895 1245 HD2 LYS 29 HD2 LYS 29 5.989 23.121 -0.728 1246 HD3 LYS 29 HD3 LYS 29 7.216 22.801 -1.956 1247 HE2 LYS 29 HE2 LYS 29 8.455 24.753 -1.302 1248 HE3 LYS 29 HE3 LYS 29 7.175 25.249 -0.197 1249 HZ1 LYS 29 HZ1 LYS 29 8.369 24.180 1.334 1250 HZ2 LYS 29 HZ2 LYS 29 7.773 22.752 0.649 1251 HZ3 LYS 29 HZ3 LYS 29 9.291 23.341 0.189 1252 H GLY 30 H GLY 30 1.921 24.976 -2.688 1253 HA2 GLY 30 HA2 GLY 30 1.905 26.288 -0.076 1254 HA3 GLY 30 HA3 GLY 30 2.370 27.267 -1.460 1255 H GLU 31 H GLU 31 -0.049 24.722 -1.555 1256 HA GLU 31 HA GLU 31 -2.008 26.655 -2.482 1257 HB2 GLU 31 HB2 GLU 31 -1.695 24.476 -3.638 1258 HB3 GLU 31 HB3 GLU 31 -2.262 23.658 -2.189 1259 HG2 GLU 31 HG2 GLU 31 -3.943 23.973 -4.044 1260 HG3 GLU 31 HG3 GLU 31 -4.439 24.493 -2.435 1261 H1 TYR 1 H TYR 1 7.954 13.981 -5.379 1262 HA TYR 1 HA TYR 1 7.041 12.366 -7.653 1263 HB2 TYR 1 HB2 TYR 1 6.204 11.714 -4.834 1264 HB3 TYR 1 HB3 TYR 1 5.994 10.744 -6.287 1265 HD1 TYR 1 HD1 TYR 1 7.600 10.634 -3.352 1266 HD2 TYR 1 HD2 TYR 1 8.566 10.567 -7.495 1267 HE1 TYR 1 HE1 TYR 1 9.683 9.430 -2.841 1268 HE2 TYR 1 HE2 TYR 1 10.651 9.362 -6.996 1269 HH TYR 1 HH TYR 1 12.038 8.678 -5.371 1270 H GLY 2 H GLY 2 4.605 12.207 -7.692 1271 HA2 GLY 2 HA2 GLY 2 3.062 14.133 -6.254 1272 HA3 GLY 2 HA3 GLY 2 3.436 14.696 -7.877 1273 H GLY 3 H GLY 3 3.237 12.459 -9.397 1274 HA2 GLY 3 HA2 GLY 3 0.428 12.170 -9.666 1275 HA3 GLY 3 HA3 GLY 3 1.648 11.274 -10.559 1276 H PHE 4 H PHE 4 0.902 9.231 -10.436 1277 HA PHE 4 HA PHE 4 -0.190 8.156 -8.001 1278 HB2 PHE 4 HB2 PHE 4 0.273 7.136 -10.770 1279 HB3 PHE 4 HB3 PHE 4 0.037 5.968 -9.474 1280 HD1 PHE 4 HD1 PHE 4 -2.093 5.160 -9.308 1281 HD2 PHE 4 HD2 PHE 4 -1.518 9.199 -10.524 1282 HE1 PHE 4 HE1 PHE 4 -4.529 5.448 -9.492 1283 HE2 PHE 4 HE2 PHE 4 -3.953 9.493 -10.709 1284 HZ PHE 4 HZ PHE 4 -5.463 7.617 -10.192 1285 H MET 5 H MET 5 0.656 6.290 -6.891 1286 HA MET 5 HA MET 5 3.593 6.097 -7.050 1287 HB2 MET 5 HB2 MET 5 2.492 7.235 -4.988 1288 HB3 MET 5 HB3 MET 5 2.062 5.597 -4.516 1289 HG2 MET 5 HG2 MET 5 4.638 5.190 -4.975 1290 HG3 MET 5 HG3 MET 5 4.712 6.913 -4.616 1291 HE1 MET 5 HE1 MET 5 6.110 4.502 -2.202 1292 HE2 MET 5 HE2 MET 5 4.704 3.457 -1.991 1293 HE3 MET 5 HE3 MET 5 5.305 3.810 -3.611 1294 H THR 6 H THR 6 4.082 4.204 -7.948 1295 HA THR 6 HA THR 6 2.446 1.851 -7.296 1296 HB THR 6 HB THR 6 4.384 2.293 -9.575 1297 HG1 THR 6 HG1 THR 6 1.581 1.850 -9.712 1298 HG21 THR 6 HG21 THR 6 4.392 -0.044 -8.846 1299 HG22 THR 6 HG22 THR 6 2.632 -0.091 -8.958 1300 HG23 THR 6 HG23 THR 6 3.602 0.126 -10.414 1301 H SER 7 H SER 7 3.290 1.028 -5.447 1302 HA SER 7 HA SER 7 6.191 0.598 -5.312 1303 HB2 SER 7 HB2 SER 7 4.682 1.720 -3.434 1304 HB3 SER 7 HB3 SER 7 4.409 0.038 -2.983 1305 HG SER 7 HG SER 7 6.551 -0.211 -2.586 1306 H GLU 8 H GLU 8 6.469 -1.243 -6.519 1307 HA GLU 8 HA GLU 8 4.999 -3.638 -5.642 1308 HB2 GLU 8 HB2 GLU 8 6.085 -2.766 -8.275 1309 HB3 GLU 8 HB3 GLU 8 6.090 -4.488 -7.918 1310 HG2 GLU 8 HG2 GLU 8 3.834 -4.660 -8.008 1311 HG3 GLU 8 HG3 GLU 8 3.573 -3.019 -7.418 1312 H LYS 9 H LYS 9 6.090 -5.011 -4.418 1313 HA LYS 9 HA LYS 9 9.029 -5.039 -4.600 1314 HB2 LYS 9 HB2 LYS 9 7.815 -4.391 -2.406 1315 HB3 LYS 9 HB3 LYS 9 7.463 -6.108 -2.268 1316 HG2 LYS 9 HG2 LYS 9 10.266 -5.147 -2.681 1317 HG3 LYS 9 HG3 LYS 9 9.535 -5.168 -1.075 1318 HD2 LYS 9 HD2 LYS 9 8.946 -7.614 -1.600 1319 HD3 LYS 9 HD3 LYS 9 10.123 -7.472 -2.908 1320 HE2 LYS 9 HE2 LYS 9 11.460 -8.261 -1.222 1321 HE3 LYS 9 HE3 LYS 9 11.654 -6.523 -1.000 1322 HZ1 LYS 9 HZ1 LYS 9 9.414 -7.407 0.458 1323 HZ2 LYS 9 HZ2 LYS 9 10.739 -8.382 0.852 1324 HZ3 LYS 9 HZ3 LYS 9 10.840 -6.703 1.035 1325 H SER 10 H SER 10 9.596 -6.653 -5.927 1326 HA SER 10 HA SER 10 8.994 -9.360 -5.166 1327 HB2 SER 10 HB2 SER 10 8.054 -10.014 -7.370 1328 HB3 SER 10 HB3 SER 10 7.006 -8.897 -6.495 1329 HG SER 10 HG SER 10 7.417 -8.445 -8.801 1330 H GLN 11 H GLN 11 10.527 -10.786 -5.871 1331 HA GLN 11 HA GLN 11 12.853 -9.614 -7.164 1332 HB2 GLN 11 HB2 GLN 11 14.003 -11.670 -6.513 1333 HB3 GLN 11 HB3 GLN 11 13.173 -10.954 -5.137 1334 HG2 GLN 11 HG2 GLN 11 11.624 -12.635 -5.016 1335 HG3 GLN 11 HG3 GLN 11 11.779 -13.049 -6.723 1336 HE21 GLN 11 HE21 GLN 11 13.467 -13.170 -3.629 1337 HE22 GLN 11 HE22 GLN 11 14.371 -14.601 -3.973 1338 H THR 12 H THR 12 10.712 -9.834 -8.898 1339 HA THR 12 HA THR 12 11.829 -11.641 -10.885 1340 HB THR 12 HB THR 12 9.164 -12.101 -11.325 1341 HG1 THR 12 HG1 THR 12 8.768 -11.184 -9.179 1342 HG21 THR 12 HG21 THR 12 9.964 -14.256 -9.771 1343 HG22 THR 12 HG22 THR 12 10.203 -14.072 -11.508 1344 HG23 THR 12 HG23 THR 12 11.475 -13.587 -10.388 1345 HA PRO 13 HA PRO 13 10.730 -8.522 -13.769 1346 HB2 PRO 13 HB2 PRO 13 9.873 -9.934 -15.924 1347 HB3 PRO 13 HB3 PRO 13 11.569 -9.867 -15.433 1348 HG2 PRO 13 HG2 PRO 13 9.530 -11.998 -14.919 1349 HG3 PRO 13 HG3 PRO 13 11.228 -12.167 -15.402 1350 HD2 PRO 13 HD2 PRO 13 10.400 -12.502 -12.846 1351 HD3 PRO 13 HD3 PRO 13 12.001 -11.852 -13.254 1352 H LEU 14 H LEU 14 9.026 -7.290 -13.177 1353 HA LEU 14 HA LEU 14 6.323 -8.354 -13.670 1354 HB2 LEU 14 HB2 LEU 14 5.487 -6.963 -11.955 1355 HB3 LEU 14 HB3 LEU 14 6.916 -7.766 -11.307 1356 HG LEU 14 HG LEU 14 7.063 -4.983 -12.421 1357 HD11 LEU 14 HD11 LEU 14 6.966 -4.453 -9.838 1358 HD12 LEU 14 HD12 LEU 14 5.506 -4.510 -10.824 1359 HD13 LEU 14 HD13 LEU 14 5.948 -5.892 -9.822 1360 HD21 LEU 14 HD21 LEU 14 9.212 -5.698 -12.090 1361 HD22 LEU 14 HD22 LEU 14 8.858 -5.031 -10.496 1362 HD23 LEU 14 HD23 LEU 14 8.769 -6.772 -10.763 1363 H VAL 15 H VAL 15 4.969 -5.904 -13.496 1364 HA VAL 15 HA VAL 15 6.071 -3.987 -15.307 1365 HB VAL 15 HB VAL 15 5.513 -5.684 -16.957 1366 HG11 VAL 15 HG11 VAL 15 2.675 -5.494 -15.954 1367 HG12 VAL 15 HG12 VAL 15 3.265 -6.501 -17.276 1368 HG13 VAL 15 HG13 VAL 15 3.775 -6.831 -15.620 1369 HG21 VAL 15 HG21 VAL 15 3.282 -3.904 -17.533 1370 HG22 VAL 15 HG22 VAL 15 4.732 -3.045 -17.015 1371 HG23 VAL 15 HG23 VAL 15 4.800 -4.134 -18.401 1372 H THR 16 H THR 16 5.019 -2.068 -15.170 1373 HA THR 16 HA THR 16 2.767 -1.945 -13.313 1374 HB THR 16 HB THR 16 4.513 -0.429 -12.744 1375 HG1 THR 16 HG1 THR 16 3.079 1.079 -12.395 1376 HG21 THR 16 HG21 THR 16 4.739 -0.130 -15.619 1377 HG22 THR 16 HG22 THR 16 4.716 1.432 -14.800 1378 HG23 THR 16 HG23 THR 16 5.919 0.220 -14.356 1379 H LEU 17 H LEU 17 0.874 -2.283 -14.328 1380 HA LEU 17 HA LEU 17 0.374 -1.346 -17.000 1381 HB2 LEU 17 HB2 LEU 17 -0.587 -3.417 -15.681 1382 HB3 LEU 17 HB3 LEU 17 -1.813 -2.250 -15.193 1383 HG LEU 17 HG LEU 17 -1.160 -3.079 -18.020 1384 HD11 LEU 17 HD11 LEU 17 -3.019 -4.058 -16.004 1385 HD12 LEU 17 HD12 LEU 17 -3.809 -3.606 -17.515 1386 HD13 LEU 17 HD13 LEU 17 -2.501 -4.790 -17.523 1387 HD21 LEU 17 HD21 LEU 17 -3.255 -1.746 -18.512 1388 HD22 LEU 17 HD22 LEU 17 -3.070 -1.039 -16.907 1389 HD23 LEU 17 HD23 LEU 17 -1.811 -0.813 -18.121 1390 H PHE 18 H PHE 18 0.492 0.878 -17.003 1391 HA PHE 18 HA PHE 18 -1.448 2.304 -15.312 1392 HB2 PHE 18 HB2 PHE 18 1.270 2.941 -16.254 1393 HB3 PHE 18 HB3 PHE 18 0.123 4.272 -16.360 1394 HD1 PHE 18 HD1 PHE 18 -1.489 4.224 -14.089 1395 HD2 PHE 18 HD2 PHE 18 2.595 3.065 -14.397 1396 HE1 PHE 18 HE1 PHE 18 -1.183 4.680 -11.691 1397 HE2 PHE 18 HE2 PHE 18 2.907 3.519 -11.999 1398 HZ PHE 18 HZ PHE 18 1.017 4.327 -10.643 1399 H LYS 19 H LYS 19 -3.290 2.636 -16.370 1400 HA LYS 19 HA LYS 19 -3.148 3.468 -19.194 1401 HB2 LYS 19 HB2 LYS 19 -5.075 1.713 -17.728 1402 HB3 LYS 19 HB3 LYS 19 -5.649 2.648 -19.103 1403 HG2 LYS 19 HG2 LYS 19 -3.812 1.616 -20.456 1404 HG3 LYS 19 HG3 LYS 19 -3.489 0.555 -19.082 1405 HD2 LYS 19 HD2 LYS 19 -4.904 -0.715 -20.431 1406 HD3 LYS 19 HD3 LYS 19 -5.994 -0.031 -19.223 1407 HE2 LYS 19 HE2 LYS 19 -6.957 1.425 -20.723 1408 HE3 LYS 19 HE3 LYS 19 -5.539 1.451 -21.770 1409 HZ1 LYS 19 HZ1 LYS 19 -7.841 -0.100 -22.037 1410 HZ2 LYS 19 HZ2 LYS 19 -6.464 -0.105 -23.019 1411 HZ3 LYS 19 HZ3 LYS 19 -6.566 -1.160 -21.701 1412 H ASN 20 H ASN 20 -4.551 5.118 -19.897 1413 HA ASN 20 HA ASN 20 -5.524 7.169 -19.727 1414 HB2 ASN 20 HB2 ASN 20 -7.282 5.465 -18.737 1415 HB3 ASN 20 HB3 ASN 20 -6.943 6.321 -17.235 1416 HD21 ASN 20 HD21 ASN 20 -9.390 6.207 -18.806 1417 HD22 ASN 20 HD22 ASN 20 -9.780 7.842 -19.205 1418 H ALA 21 H ALA 21 -2.996 6.913 -18.479 1419 HA ALA 21 HA ALA 21 -2.948 8.055 -15.889 1420 HB1 ALA 21 HB1 ALA 21 -0.895 7.727 -18.047 1421 HB2 ALA 21 HB2 ALA 21 -0.531 8.611 -16.565 1422 HB3 ALA 21 HB3 ALA 21 -1.007 6.914 -16.486 1423 H ILE 22 H ILE 22 -3.818 9.987 -15.482 1424 HA ILE 22 HA ILE 22 -3.236 12.194 -17.348 1425 HB ILE 22 HB ILE 22 -5.593 11.907 -15.480 1426 HG12 ILE 22 HG12 ILE 22 -5.722 12.073 -18.477 1427 HG13 ILE 22 HG13 ILE 22 -5.438 10.528 -17.682 1428 HG21 ILE 22 HG21 ILE 22 -5.399 14.169 -15.537 1429 HG22 ILE 22 HG22 ILE 22 -4.533 14.168 -17.074 1430 HG23 ILE 22 HG23 ILE 22 -6.282 13.943 -17.047 1431 HD11 ILE 22 HD11 ILE 22 -7.797 12.309 -17.133 1432 HD12 ILE 22 HD12 ILE 22 -7.806 10.947 -18.253 1433 HD13 ILE 22 HD13 ILE 22 -7.532 10.673 -16.533 1434 H ILE 23 H ILE 23 -1.819 13.609 -16.596 1435 HA ILE 23 HA ILE 23 -1.516 13.908 -13.686 1436 HB ILE 23 HB ILE 23 0.393 14.414 -15.958 1437 HG12 ILE 23 HG12 ILE 23 0.205 12.117 -15.017 1438 HG13 ILE 23 HG13 ILE 23 1.800 12.825 -14.788 1439 HG21 ILE 23 HG21 ILE 23 0.916 16.266 -14.722 1440 HG22 ILE 23 HG22 ILE 23 0.387 15.540 -13.204 1441 HG23 ILE 23 HG23 ILE 23 1.928 15.065 -13.920 1442 HD11 ILE 23 HD11 ILE 23 -0.370 12.588 -12.720 1443 HD12 ILE 23 HD12 ILE 23 1.125 11.657 -12.800 1444 HD13 ILE 23 HD13 ILE 23 1.182 13.389 -12.475 1445 H LYS 24 H LYS 24 -2.714 15.546 -12.958 1446 HA LYS 24 HA LYS 24 -2.563 18.111 -14.400 1447 HB2 LYS 24 HB2 LYS 24 -4.912 16.627 -13.368 1448 HB3 LYS 24 HB3 LYS 24 -4.909 18.365 -13.097 1449 HG2 LYS 24 HG2 LYS 24 -4.438 18.601 -15.580 1450 HG3 LYS 24 HG3 LYS 24 -4.848 16.889 -15.708 1451 HD2 LYS 24 HD2 LYS 24 -6.652 19.000 -14.528 1452 HD3 LYS 24 HD3 LYS 24 -6.755 18.408 -16.188 1453 HE2 LYS 24 HE2 LYS 24 -7.265 16.188 -15.418 1454 HE3 LYS 24 HE3 LYS 24 -6.987 16.659 -13.742 1455 HZ1 LYS 24 HZ1 LYS 24 -8.849 18.369 -14.243 1456 HZ2 LYS 24 HZ2 LYS 24 -9.252 17.309 -15.499 1457 HZ3 LYS 24 HZ3 LYS 24 -9.260 16.764 -13.897 1458 H ASN 25 H ASN 25 -1.255 19.354 -13.218 1459 HA ASN 25 HA ASN 25 -0.325 20.451 -11.454 1460 HB2 ASN 25 HB2 ASN 25 -2.875 20.084 -9.916 1461 HB3 ASN 25 HB3 ASN 25 -1.807 21.483 -9.978 1462 HD21 ASN 25 HD21 ASN 25 -4.762 20.595 -10.735 1463 HD22 ASN 25 HD22 ASN 25 -5.035 21.514 -12.173 1464 H ALA 26 H ALA 26 0.028 17.610 -11.547 1465 HA ALA 26 HA ALA 26 -0.369 16.284 -9.136 1466 HB1 ALA 26 HB1 ALA 26 1.380 14.775 -9.826 1467 HB2 ALA 26 HB2 ALA 26 0.411 15.222 -11.230 1468 HB3 ALA 26 HB3 ALA 26 1.994 15.958 -10.981 1469 H TYR 27 H TYR 27 2.279 18.407 -10.138 1470 HA TYR 27 HA TYR 27 3.105 18.566 -7.318 1471 HB2 TYR 27 HB2 TYR 27 4.638 17.243 -8.992 1472 HB3 TYR 27 HB3 TYR 27 5.129 18.853 -9.507 1473 HD1 TYR 27 HD1 TYR 27 5.466 20.445 -7.239 1474 HD2 TYR 27 HD2 TYR 27 6.155 16.260 -7.573 1475 HE1 TYR 27 HE1 TYR 27 7.055 20.563 -5.365 1476 HE2 TYR 27 HE2 TYR 27 7.745 16.366 -5.700 1477 HH TYR 27 HH TYR 27 8.593 19.452 -4.182 1478 H LYS 28 H LYS 28 2.907 20.556 -6.563 1479 HA LYS 28 HA LYS 28 3.106 22.810 -8.451 1480 HB2 LYS 28 HB2 LYS 28 1.573 22.689 -5.847 1481 HB3 LYS 28 HB3 LYS 28 1.621 24.052 -6.958 1482 HG2 LYS 28 HG2 LYS 28 0.213 23.068 -8.451 1483 HG3 LYS 28 HG3 LYS 28 0.715 21.432 -8.017 1484 HD2 LYS 28 HD2 LYS 28 -0.745 21.304 -6.263 1485 HD3 LYS 28 HD3 LYS 28 -0.703 23.043 -5.961 1486 HE2 LYS 28 HE2 LYS 28 -1.904 23.188 -8.269 1487 HE3 LYS 28 HE3 LYS 28 -2.301 21.498 -7.961 1488 HZ1 LYS 28 HZ1 LYS 28 -2.980 22.596 -5.638 1489 HZ2 LYS 28 HZ2 LYS 28 -3.294 23.900 -6.668 1490 HZ3 LYS 28 HZ3 LYS 28 -4.059 22.414 -6.928 1491 H LYS 29 H LYS 29 3.978 24.818 -7.583 1492 HA LYS 29 HA LYS 29 5.950 24.338 -5.446 1493 HB2 LYS 29 HB2 LYS 29 7.105 24.576 -7.543 1494 HB3 LYS 29 HB3 LYS 29 6.185 26.020 -7.943 1495 HG2 LYS 29 HG2 LYS 29 8.386 26.664 -7.264 1496 HG3 LYS 29 HG3 LYS 29 7.239 27.171 -6.022 1497 HD2 LYS 29 HD2 LYS 29 7.808 25.076 -4.770 1498 HD3 LYS 29 HD3 LYS 29 9.087 24.790 -5.952 1499 HE2 LYS 29 HE2 LYS 29 10.191 26.832 -5.332 1500 HE3 LYS 29 HE3 LYS 29 8.851 27.287 -4.279 1501 HZ1 LYS 29 HZ1 LYS 29 10.059 26.340 -2.680 1502 HZ2 LYS 29 HZ2 LYS 29 9.570 24.858 -3.334 1503 HZ3 LYS 29 HZ3 LYS 29 11.063 25.523 -3.770 1504 H GLY 30 H GLY 30 3.701 26.620 -6.902 1505 HA2 GLY 30 HA2 GLY 30 3.529 28.005 -4.333 1506 HA3 GLY 30 HA3 GLY 30 3.978 28.969 -5.732 1507 H GLU 31 H GLU 31 1.717 26.283 -5.824 1508 HA GLU 31 HA GLU 31 -0.323 28.070 -6.864 1509 HB2 GLU 31 HB2 GLU 31 0.150 25.883 -7.947 1510 HB3 GLU 31 HB3 GLU 31 -0.405 25.072 -6.490 1511 HG2 GLU 31 HG2 GLU 31 -2.052 25.230 -8.394 1512 HG3 GLU 31 HG3 GLU 31 -2.621 25.764 -6.814 Start of MODEL 3 1 H1 TYR 1 H TYR 1 -8.580 2.951 16.280 2 HA TYR 1 HA TYR 1 -6.923 3.557 14.004 3 HB2 TYR 1 HB2 TYR 1 -9.590 2.166 14.279 4 HB3 TYR 1 HB3 TYR 1 -8.775 2.395 12.736 5 HD1 TYR 1 HD1 TYR 1 -8.248 0.933 16.125 6 HD2 TYR 1 HD2 TYR 1 -7.248 0.805 11.991 7 HE1 TYR 1 HE1 TYR 1 -6.964 -1.130 16.506 8 HE2 TYR 1 HE2 TYR 1 -5.962 -1.259 12.360 9 HH TYR 1 HH TYR 1 -5.071 -2.618 13.925 10 H GLY 2 H GLY 2 -8.290 4.255 11.940 11 HA2 GLY 2 HA2 GLY 2 -9.279 6.919 12.592 12 HA3 GLY 2 HA3 GLY 2 -8.864 6.325 10.992 13 H GLY 3 H GLY 3 -10.438 5.536 9.688 14 HA2 GLY 3 HA2 GLY 3 -13.140 6.113 10.339 15 HA3 GLY 3 HA3 GLY 3 -12.582 5.262 8.906 16 H PHE 4 H PHE 4 -13.693 3.431 8.747 17 HA PHE 4 HA PHE 4 -14.658 2.034 11.069 18 HB2 PHE 4 HB2 PHE 4 -14.892 1.655 8.108 19 HB3 PHE 4 HB3 PHE 4 -15.305 0.323 9.183 20 HD1 PHE 4 HD1 PHE 4 -17.545 0.101 9.567 21 HD2 PHE 4 HD2 PHE 4 -15.921 4.007 9.100 22 HE1 PHE 4 HE1 PHE 4 -19.782 1.067 9.906 23 HE2 PHE 4 HE2 PHE 4 -18.156 4.980 9.439 24 HZ PHE 4 HZ PHE 4 -20.090 3.510 9.843 25 H MET 5 H MET 5 -14.176 -0.168 11.592 26 HA MET 5 HA MET 5 -11.522 -1.056 10.673 27 HB2 MET 5 HB2 MET 5 -11.273 -0.201 12.913 28 HB3 MET 5 HB3 MET 5 -12.657 -1.131 13.471 29 HG2 MET 5 HG2 MET 5 -10.649 -2.197 14.211 30 HG3 MET 5 HG3 MET 5 -11.416 -3.206 12.987 31 HE1 MET 5 HE1 MET 5 -7.707 -3.982 12.214 32 HE2 MET 5 HE2 MET 5 -8.469 -3.806 13.795 33 HE3 MET 5 HE3 MET 5 -9.319 -4.639 12.493 34 H THR 6 H THR 6 -11.792 -2.834 9.500 35 HA THR 6 HA THR 6 -13.935 -4.709 10.211 36 HB THR 6 HB THR 6 -12.359 -4.366 7.658 37 HG1 THR 6 HG1 THR 6 -15.116 -4.057 8.321 38 HG21 THR 6 HG21 THR 6 -13.809 -6.164 6.746 39 HG22 THR 6 HG22 THR 6 -12.694 -6.737 7.986 40 HG23 THR 6 HG23 THR 6 -14.393 -6.478 8.381 41 H SER 7 H SER 7 -13.154 -6.082 11.717 42 HA SER 7 HA SER 7 -10.520 -7.302 11.271 43 HB2 SER 7 HB2 SER 7 -11.367 -6.189 13.527 44 HB3 SER 7 HB3 SER 7 -12.081 -7.782 13.772 45 HG SER 7 HG SER 7 -9.616 -7.090 14.247 46 H GLU 8 H GLU 8 -10.950 -8.891 9.786 47 HA GLU 8 HA GLU 8 -12.907 -10.944 10.587 48 HB2 GLU 8 HB2 GLU 8 -12.122 -9.836 7.941 49 HB3 GLU 8 HB3 GLU 8 -12.513 -11.548 8.014 50 HG2 GLU 8 HG2 GLU 8 -14.713 -11.165 8.557 51 HG3 GLU 8 HG3 GLU 8 -14.381 -9.568 9.226 52 H LYS 9 H LYS 9 -12.084 -12.799 11.264 53 HA LYS 9 HA LYS 9 -9.359 -13.527 10.411 54 HB2 LYS 9 HB2 LYS 9 -9.433 -13.099 12.787 55 HB3 LYS 9 HB3 LYS 9 -10.827 -14.153 12.977 56 HG2 LYS 9 HG2 LYS 9 -9.406 -16.058 12.242 57 HG3 LYS 9 HG3 LYS 9 -8.021 -14.965 12.256 58 HD2 LYS 9 HD2 LYS 9 -7.994 -14.810 14.545 59 HD3 LYS 9 HD3 LYS 9 -9.723 -15.133 14.694 60 HE2 LYS 9 HE2 LYS 9 -9.423 -17.446 14.375 61 HE3 LYS 9 HE3 LYS 9 -7.782 -17.231 13.766 62 HZ1 LYS 9 HZ1 LYS 9 -7.570 -16.174 16.206 63 HZ2 LYS 9 HZ2 LYS 9 -8.739 -17.362 16.497 64 HZ3 LYS 9 HZ3 LYS 9 -7.235 -17.795 15.853 65 H SER 10 H SER 10 -9.505 -14.984 8.827 66 HA SER 10 HA SER 10 -10.827 -17.496 9.342 67 HB2 SER 10 HB2 SER 10 -12.208 -17.464 7.310 68 HB3 SER 10 HB3 SER 10 -12.676 -16.166 8.408 69 HG SER 10 HG SER 10 -12.467 -15.503 6.191 70 H GLN 11 H GLN 11 -9.889 -19.167 8.259 71 HA GLN 11 HA GLN 11 -7.463 -18.558 6.797 72 HB2 GLN 11 HB2 GLN 11 -7.092 -21.008 6.879 73 HB3 GLN 11 HB3 GLN 11 -7.353 -20.301 8.468 74 HG2 GLN 11 HG2 GLN 11 -9.456 -21.248 8.688 75 HG3 GLN 11 HG3 GLN 11 -9.627 -21.508 6.953 76 HE21 GLN 11 HE21 GLN 11 -10.292 -23.650 7.920 77 HE22 GLN 11 HE22 GLN 11 -9.049 -24.836 8.100 78 H THR 12 H THR 12 -9.570 -17.682 5.334 79 HA THR 12 HA THR 12 -9.320 -19.279 2.941 80 HB THR 12 HB THR 12 -12.028 -18.915 2.833 81 HG1 THR 12 HG1 THR 12 -11.518 -19.933 5.436 82 HG21 THR 12 HG21 THR 12 -11.411 -21.484 4.010 83 HG22 THR 12 HG22 THR 12 -11.927 -21.096 2.369 84 HG23 THR 12 HG23 THR 12 -10.216 -21.034 2.794 85 HA PRO 13 HA PRO 13 -9.687 -15.402 0.919 86 HB2 PRO 13 HB2 PRO 13 -11.000 -16.044 -1.369 87 HB3 PRO 13 HB3 PRO 13 -9.320 -16.502 -1.064 88 HG2 PRO 13 HG2 PRO 13 -11.811 -18.135 -0.771 89 HG3 PRO 13 HG3 PRO 13 -10.245 -18.597 -1.463 90 HD2 PRO 13 HD2 PRO 13 -10.988 -19.286 1.048 91 HD3 PRO 13 HD3 PRO 13 -9.299 -18.969 0.606 92 H LEU 14 H LEU 14 -11.006 -14.082 2.118 93 HA LEU 14 HA LEU 14 -13.904 -14.279 1.653 94 HB2 LEU 14 HB2 LEU 14 -14.256 -13.191 3.715 95 HB3 LEU 14 HB3 LEU 14 -13.027 -14.422 4.004 96 HG LEU 14 HG LEU 14 -12.287 -11.555 3.505 97 HD11 LEU 14 HD11 LEU 14 -12.337 -12.475 6.290 98 HD12 LEU 14 HD12 LEU 14 -12.760 -10.908 5.600 99 HD13 LEU 14 HD13 LEU 14 -13.924 -12.233 5.559 100 HD21 LEU 14 HD21 LEU 14 -10.353 -12.770 3.397 101 HD22 LEU 14 HD22 LEU 14 -10.423 -12.462 5.132 102 HD23 LEU 14 HD23 LEU 14 -10.945 -14.020 4.492 103 H VAL 15 H VAL 15 -14.515 -11.664 2.556 104 HA VAL 15 HA VAL 15 -13.081 -9.707 1.054 105 HB VAL 15 HB VAL 15 -14.157 -10.717 -0.851 106 HG11 VAL 15 HG11 VAL 15 -16.883 -10.267 -0.539 107 HG12 VAL 15 HG12 VAL 15 -16.060 -11.827 -0.537 108 HG13 VAL 15 HG13 VAL 15 -16.371 -10.992 0.985 109 HG21 VAL 15 HG21 VAL 15 -14.195 -8.101 -0.324 110 HG22 VAL 15 HG22 VAL 15 -14.857 -8.781 -1.810 111 HG23 VAL 15 HG23 VAL 15 -15.931 -8.376 -0.471 112 H THR 16 H THR 16 -13.514 -7.708 1.805 113 HA THR 16 HA THR 16 -15.512 -7.475 3.910 114 HB THR 16 HB THR 16 -13.386 -6.585 4.511 115 HG1 THR 16 HG1 THR 16 -14.889 -4.286 3.794 116 HG21 THR 16 HG21 THR 16 -12.027 -5.965 2.843 117 HG22 THR 16 HG22 THR 16 -13.377 -5.644 1.755 118 HG23 THR 16 HG23 THR 16 -12.853 -4.408 2.898 119 H LEU 17 H LEU 17 -17.501 -6.861 3.394 120 HA LEU 17 HA LEU 17 -18.035 -5.405 0.954 121 HB2 LEU 17 HB2 LEU 17 -19.578 -6.916 2.936 122 HB3 LEU 17 HB3 LEU 17 -20.416 -5.509 2.285 123 HG LEU 17 HG LEU 17 -19.220 -7.674 0.563 124 HD11 LEU 17 HD11 LEU 17 -22.060 -7.723 0.566 125 HD12 LEU 17 HD12 LEU 17 -20.932 -8.995 1.036 126 HD13 LEU 17 HD13 LEU 17 -21.501 -7.833 2.235 127 HD21 LEU 17 HD21 LEU 17 -20.773 -6.718 -1.116 128 HD22 LEU 17 HD22 LEU 17 -21.167 -5.434 0.027 129 HD23 LEU 17 HD23 LEU 17 -19.524 -5.587 -0.596 130 H PHE 18 H PHE 18 -17.255 -3.344 1.172 131 HA PHE 18 HA PHE 18 -18.379 -1.730 3.364 132 HB2 PHE 18 HB2 PHE 18 -15.726 -1.816 2.107 133 HB3 PHE 18 HB3 PHE 18 -16.375 -0.190 2.295 134 HD1 PHE 18 HD1 PHE 18 -17.754 -0.178 4.776 135 HD2 PHE 18 HD2 PHE 18 -14.177 -2.239 3.740 136 HE1 PHE 18 HE1 PHE 18 -17.073 -0.179 7.140 137 HE2 PHE 18 HE2 PHE 18 -13.491 -2.245 6.103 138 HZ PHE 18 HZ PHE 18 -14.940 -1.215 7.807 139 H LYS 19 H LYS 19 -20.163 -0.754 2.641 140 HA LYS 19 HA LYS 19 -20.055 0.551 -0.000 141 HB2 LYS 19 HB2 LYS 19 -22.573 -0.290 1.430 142 HB3 LYS 19 HB3 LYS 19 -22.401 0.212 -0.247 143 HG2 LYS 19 HG2 LYS 19 -20.833 -1.869 -0.407 144 HG3 LYS 19 HG3 LYS 19 -21.711 -2.387 1.035 145 HD2 LYS 19 HD2 LYS 19 -23.219 -1.427 -1.361 146 HD3 LYS 19 HD3 LYS 19 -22.571 -3.068 -1.333 147 HE2 LYS 19 HE2 LYS 19 -23.963 -3.733 0.366 148 HE3 LYS 19 HE3 LYS 19 -24.121 -2.104 1.020 149 HZ1 LYS 19 HZ1 LYS 19 -25.887 -1.689 -0.256 150 HZ2 LYS 19 HZ2 LYS 19 -25.204 -2.402 -1.630 151 HZ3 LYS 19 HZ3 LYS 19 -25.980 -3.364 -0.475 152 H ASN 20 H ASN 20 -21.163 2.583 -0.212 153 HA ASN 20 HA ASN 20 -21.463 4.751 0.426 154 HB2 ASN 20 HB2 ASN 20 -22.936 3.202 2.540 155 HB3 ASN 20 HB3 ASN 20 -22.883 4.962 2.587 156 HD21 ASN 20 HD21 ASN 20 -24.814 2.569 1.789 157 HD22 ASN 20 HD22 ASN 20 -25.652 3.243 0.437 158 H ALA 21 H ALA 21 -18.963 3.602 1.175 159 HA ALA 21 HA ALA 21 -18.259 4.223 3.844 160 HB1 ALA 21 HB1 ALA 21 -15.897 4.201 2.893 161 HB2 ALA 21 HB2 ALA 21 -16.844 2.723 2.721 162 HB3 ALA 21 HB3 ALA 21 -16.645 3.808 1.345 163 H ILE 22 H ILE 22 -18.498 6.215 4.642 164 HA ILE 22 HA ILE 22 -17.510 8.480 3.034 165 HB ILE 22 HB ILE 22 -19.678 8.510 5.137 166 HG12 ILE 22 HG12 ILE 22 -20.014 9.206 2.233 167 HG13 ILE 22 HG13 ILE 22 -20.119 7.532 2.769 168 HG21 ILE 22 HG21 ILE 22 -19.885 10.893 3.936 169 HG22 ILE 22 HG22 ILE 22 -18.901 10.623 5.375 170 HG23 ILE 22 HG23 ILE 22 -18.146 10.642 3.781 171 HD11 ILE 22 HD11 ILE 22 -22.071 9.640 2.924 172 HD12 ILE 22 HD12 ILE 22 -22.261 7.904 3.172 173 HD13 ILE 22 HD13 ILE 22 -21.762 8.936 4.512 174 H ILE 23 H ILE 23 -15.633 9.201 3.772 175 HA ILE 23 HA ILE 23 -15.003 8.919 6.622 176 HB ILE 23 HB ILE 23 -13.278 9.361 4.198 177 HG12 ILE 23 HG12 ILE 23 -13.952 7.048 4.804 178 HG13 ILE 23 HG13 ILE 23 -12.214 7.301 4.911 179 HG21 ILE 23 HG21 ILE 23 -12.213 10.812 5.642 180 HG22 ILE 23 HG22 ILE 23 -12.658 9.881 7.072 181 HG23 ILE 23 HG23 ILE 23 -11.395 9.289 5.993 182 HD11 ILE 23 HD11 ILE 23 -12.493 7.627 7.365 183 HD12 ILE 23 HD12 ILE 23 -14.180 7.149 7.177 184 HD13 ILE 23 HD13 ILE 23 -12.892 6.010 6.785 185 H LYS 24 H LYS 24 -15.811 10.634 7.694 186 HA LYS 24 HA LYS 24 -15.237 13.320 6.633 187 HB2 LYS 24 HB2 LYS 24 -17.525 12.161 8.084 188 HB3 LYS 24 HB3 LYS 24 -17.017 13.744 8.656 189 HG2 LYS 24 HG2 LYS 24 -17.061 14.294 6.071 190 HG3 LYS 24 HG3 LYS 24 -18.209 12.953 6.057 191 HD2 LYS 24 HD2 LYS 24 -18.497 15.151 8.066 192 HD3 LYS 24 HD3 LYS 24 -19.065 15.387 6.411 193 HE2 LYS 24 HE2 LYS 24 -20.203 13.046 6.839 194 HE3 LYS 24 HE3 LYS 24 -20.059 13.539 8.525 195 HZ1 LYS 24 HZ1 LYS 24 -21.734 14.959 8.294 196 HZ2 LYS 24 HZ2 LYS 24 -21.085 15.637 6.886 197 HZ3 LYS 24 HZ3 LYS 24 -22.050 14.250 6.790 198 H ASN 25 H ASN 25 -13.210 13.687 7.446 199 HA ASN 25 HA ASN 25 -11.594 14.218 8.956 200 HB2 ASN 25 HB2 ASN 25 -13.747 14.626 11.016 201 HB3 ASN 25 HB3 ASN 25 -12.238 15.510 10.810 202 HD21 ASN 25 HD21 ASN 25 -12.231 17.313 9.626 203 HD22 ASN 25 HD22 ASN 25 -13.577 17.908 8.722 204 H ALA 26 H ALA 26 -12.080 11.506 8.695 205 HA ALA 26 HA ALA 26 -12.566 10.049 11.002 206 HB1 ALA 26 HB1 ALA 26 -10.763 9.465 8.665 207 HB2 ALA 26 HB2 ALA 26 -11.093 8.299 9.946 208 HB3 ALA 26 HB3 ALA 26 -12.411 8.896 8.937 209 H TYR 27 H TYR 27 -9.638 11.690 9.959 210 HA TYR 27 HA TYR 27 -8.367 10.928 12.507 211 HB2 TYR 27 HB2 TYR 27 -7.345 10.251 10.176 212 HB3 TYR 27 HB3 TYR 27 -6.767 11.913 10.179 213 HD1 TYR 27 HD1 TYR 27 -4.710 12.362 11.134 214 HD2 TYR 27 HD2 TYR 27 -6.846 8.904 12.392 215 HE1 TYR 27 HE1 TYR 27 -2.801 11.700 12.536 216 HE2 TYR 27 HE2 TYR 27 -4.943 8.233 13.798 217 HH TYR 27 HH TYR 27 -1.887 9.561 13.510 218 H LYS 28 H LYS 28 -8.060 12.511 13.916 219 HA LYS 28 HA LYS 28 -8.528 15.262 13.117 220 HB2 LYS 28 HB2 LYS 28 -8.377 13.780 15.694 221 HB3 LYS 28 HB3 LYS 28 -7.997 15.497 15.723 222 HG2 LYS 28 HG2 LYS 28 -10.543 14.344 14.605 223 HG3 LYS 28 HG3 LYS 28 -10.363 14.973 16.245 224 HD2 LYS 28 HD2 LYS 28 -9.503 16.737 14.026 225 HD3 LYS 28 HD3 LYS 28 -11.238 16.464 14.205 226 HE2 LYS 28 HE2 LYS 28 -11.015 18.252 15.595 227 HE3 LYS 28 HE3 LYS 28 -10.665 16.965 16.748 228 HZ1 LYS 28 HZ1 LYS 28 -9.087 19.041 16.441 229 HZ2 LYS 28 HZ2 LYS 28 -8.483 17.512 16.840 230 HZ3 LYS 28 HZ3 LYS 28 -8.417 18.057 15.239 231 H LYS 29 H LYS 29 -7.039 16.893 14.412 232 HA LYS 29 HA LYS 29 -4.394 16.519 13.331 233 HB2 LYS 29 HB2 LYS 29 -3.984 18.805 14.110 234 HB3 LYS 29 HB3 LYS 29 -5.485 18.705 13.198 235 HG2 LYS 29 HG2 LYS 29 -6.780 19.163 15.006 236 HG3 LYS 29 HG3 LYS 29 -5.656 18.412 16.141 237 HD2 LYS 29 HD2 LYS 29 -5.535 20.715 16.596 238 HD3 LYS 29 HD3 LYS 29 -4.096 20.363 15.635 239 HE2 LYS 29 HE2 LYS 29 -5.486 21.061 13.613 240 HE3 LYS 29 HE3 LYS 29 -6.637 21.719 14.775 241 HZ1 LYS 29 HZ1 LYS 29 -4.429 22.822 15.685 242 HZ2 LYS 29 HZ2 LYS 29 -3.970 22.661 14.064 243 HZ3 LYS 29 HZ3 LYS 29 -5.358 23.542 14.468 244 H GLY 30 H GLY 30 -2.613 17.569 14.958 245 HA2 GLY 30 HA2 GLY 30 -1.332 17.254 16.842 246 HA3 GLY 30 HA3 GLY 30 -2.801 16.786 17.685 247 H GLU 31 H GLU 31 0.144 15.727 16.460 248 HA GLU 31 HA GLU 31 -0.233 13.089 17.436 249 HB2 GLU 31 HB2 GLU 31 0.085 11.891 15.286 250 HB3 GLU 31 HB3 GLU 31 -1.453 12.738 15.383 251 HG2 GLU 31 HG2 GLU 31 -0.527 14.560 14.034 252 HG3 GLU 31 HG3 GLU 31 0.999 13.686 13.917 253 H1 TYR 1 H TYR 1 -6.131 4.861 12.491 254 HA TYR 1 HA TYR 1 -4.431 5.474 10.248 255 HB2 TYR 1 HB2 TYR 1 -7.003 3.911 10.500 256 HB3 TYR 1 HB3 TYR 1 -6.152 4.129 8.975 257 HD1 TYR 1 HD1 TYR 1 -5.630 2.871 12.446 258 HD2 TYR 1 HD2 TYR 1 -4.506 2.610 8.351 259 HE1 TYR 1 HE1 TYR 1 -4.219 0.924 12.964 260 HE2 TYR 1 HE2 TYR 1 -3.093 0.662 8.857 261 HH TYR 1 HH TYR 1 -2.154 -0.551 10.512 262 H GLY 2 H GLY 2 -5.770 5.975 8.106 263 HA2 GLY 2 HA2 GLY 2 -6.966 8.590 8.597 264 HA3 GLY 2 HA3 GLY 2 -6.444 7.958 7.042 265 H GLY 3 H GLY 3 -7.899 6.978 5.723 266 HA2 GLY 3 HA2 GLY 3 -10.660 7.397 6.235 267 HA3 GLY 3 HA3 GLY 3 -9.984 6.514 4.874 268 H PHE 4 H PHE 4 -10.982 4.614 4.775 269 HA PHE 4 HA PHE 4 -11.933 3.269 7.134 270 HB2 PHE 4 HB2 PHE 4 -12.039 2.737 4.190 271 HB3 PHE 4 HB3 PHE 4 -12.390 1.427 5.312 272 HD1 PHE 4 HD1 PHE 4 -14.619 1.057 5.641 273 HD2 PHE 4 HD2 PHE 4 -13.268 5.048 5.043 274 HE1 PHE 4 HE1 PHE 4 -16.930 1.870 5.870 275 HE2 PHE 4 HE2 PHE 4 -15.576 5.868 5.271 276 HZ PHE 4 HZ PHE 4 -17.411 4.278 5.686 277 H MET 5 H MET 5 -11.334 1.120 7.769 278 HA MET 5 HA MET 5 -8.591 0.377 6.994 279 HB2 MET 5 HB2 MET 5 -8.503 1.352 9.203 280 HB3 MET 5 HB3 MET 5 -9.827 0.333 9.750 281 HG2 MET 5 HG2 MET 5 -7.770 -0.534 10.605 282 HG3 MET 5 HG3 MET 5 -8.401 -1.649 9.395 283 HE1 MET 5 HE1 MET 5 -4.615 -2.141 8.789 284 HE2 MET 5 HE2 MET 5 -5.444 -1.965 10.335 285 HE3 MET 5 HE3 MET 5 -6.177 -2.917 9.044 286 H THR 6 H THR 6 -8.686 -1.470 5.905 287 HA THR 6 HA THR 6 -10.733 -3.450 6.616 288 HB THR 6 HB THR 6 -9.077 -3.099 4.117 289 HG1 THR 6 HG1 THR 6 -11.877 -3.009 4.655 290 HG21 THR 6 HG21 THR 6 -10.310 -5.058 3.231 291 HG22 THR 6 HG22 THR 6 -9.222 -5.477 4.554 292 HG23 THR 6 HG23 THR 6 -10.957 -5.348 4.845 293 H SER 7 H SER 7 -9.949 -4.721 8.201 294 HA SER 7 HA SER 7 -7.218 -5.767 7.942 295 HB2 SER 7 HB2 SER 7 -8.250 -4.624 10.103 296 HB3 SER 7 HB3 SER 7 -8.870 -6.251 10.382 297 HG SER 7 HG SER 7 -6.484 -5.376 10.948 298 H GLU 8 H GLU 8 -7.502 -7.421 6.478 299 HA GLU 8 HA GLU 8 -9.348 -9.572 7.276 300 HB2 GLU 8 HB2 GLU 8 -8.512 -8.497 4.641 301 HB3 GLU 8 HB3 GLU 8 -8.726 -10.239 4.746 302 HG2 GLU 8 HG2 GLU 8 -10.980 -10.084 5.117 303 HG3 GLU 8 HG3 GLU 8 -10.865 -8.466 5.808 304 H LYS 9 H LYS 9 -8.471 -11.370 8.039 305 HA LYS 9 HA LYS 9 -5.651 -11.938 7.399 306 HB2 LYS 9 HB2 LYS 9 -5.977 -11.425 9.762 307 HB3 LYS 9 HB3 LYS 9 -7.233 -12.650 9.876 308 HG2 LYS 9 HG2 LYS 9 -5.546 -14.372 9.320 309 HG3 LYS 9 HG3 LYS 9 -4.306 -13.116 9.347 310 HD2 LYS 9 HD2 LYS 9 -4.419 -12.864 11.626 311 HD3 LYS 9 HD3 LYS 9 -6.096 -13.408 11.711 312 HE2 LYS 9 HE2 LYS 9 -5.480 -15.670 11.511 313 HE3 LYS 9 HE3 LYS 9 -3.855 -15.263 10.962 314 HZ1 LYS 9 HZ1 LYS 9 -3.902 -14.094 13.361 315 HZ2 LYS 9 HZ2 LYS 9 -4.914 -15.418 13.654 316 HZ3 LYS 9 HZ3 LYS 9 -3.337 -15.666 13.093 317 H SER 10 H SER 10 -5.581 -13.459 5.874 318 HA SER 10 HA SER 10 -6.771 -16.033 6.382 319 HB2 SER 10 HB2 SER 10 -8.022 -16.154 4.269 320 HB3 SER 10 HB3 SER 10 -8.645 -14.863 5.296 321 HG SER 10 HG SER 10 -8.344 -14.248 3.076 322 H GLN 11 H GLN 11 -5.634 -17.658 5.445 323 HA GLN 11 HA GLN 11 -3.184 -16.923 4.087 324 HB2 GLN 11 HB2 GLN 11 -2.631 -19.330 4.302 325 HB3 GLN 11 HB3 GLN 11 -3.037 -18.580 5.840 326 HG2 GLN 11 HG2 GLN 11 -5.082 -19.671 5.978 327 HG3 GLN 11 HG3 GLN 11 -5.110 -20.038 4.254 328 HE21 GLN 11 HE21 GLN 11 -5.670 -22.173 5.299 329 HE22 GLN 11 HE22 GLN 11 -4.353 -23.240 5.630 330 H THR 12 H THR 12 -5.310 -16.298 2.492 331 HA THR 12 HA THR 12 -4.784 -17.955 0.183 332 HB THR 12 HB THR 12 -7.502 -17.833 -0.079 333 HG1 THR 12 HG1 THR 12 -7.054 -18.695 2.591 334 HG21 THR 12 HG21 THR 12 -6.742 -20.288 1.246 335 HG22 THR 12 HG22 THR 12 -7.188 -20.014 -0.438 336 HG23 THR 12 HG23 THR 12 -5.517 -19.788 0.080 337 HA PRO 13 HA PRO 13 -5.390 -14.221 -2.041 338 HB2 PRO 13 HB2 PRO 13 -6.579 -15.060 -4.333 339 HB3 PRO 13 HB3 PRO 13 -4.880 -15.377 -3.960 340 HG2 PRO 13 HG2 PRO 13 -7.253 -17.177 -3.661 341 HG3 PRO 13 HG3 PRO 13 -5.636 -17.551 -4.287 342 HD2 PRO 13 HD2 PRO 13 -6.406 -18.182 -1.769 343 HD3 PRO 13 HD3 PRO 13 -4.731 -17.759 -2.177 344 H LEU 14 H LEU 14 -6.838 -12.947 -0.947 345 HA LEU 14 HA LEU 14 -9.698 -13.383 -1.482 346 HB2 LEU 14 HB2 LEU 14 -10.193 -12.235 0.516 347 HB3 LEU 14 HB3 LEU 14 -8.886 -13.354 0.897 348 HG LEU 14 HG LEU 14 -8.334 -10.470 0.277 349 HD11 LEU 14 HD11 LEU 14 -8.451 -11.250 3.105 350 HD12 LEU 14 HD12 LEU 14 -8.928 -9.746 2.317 351 HD13 LEU 14 HD13 LEU 14 -10.013 -11.136 2.293 352 HD21 LEU 14 HD21 LEU 14 -6.320 -11.555 0.314 353 HD22 LEU 14 HD22 LEU 14 -6.484 -11.151 2.022 354 HD23 LEU 14 HD23 LEU 14 -6.872 -12.777 1.460 355 H VAL 15 H VAL 15 -10.518 -10.777 -0.712 356 HA VAL 15 HA VAL 15 -9.188 -8.787 -2.260 357 HB VAL 15 HB VAL 15 -10.112 -9.957 -4.152 358 HG11 VAL 15 HG11 VAL 15 -12.874 -9.710 -3.955 359 HG12 VAL 15 HG12 VAL 15 -11.934 -11.199 -3.852 360 HG13 VAL 15 HG13 VAL 15 -12.366 -10.325 -2.382 361 HG21 VAL 15 HG21 VAL 15 -10.370 -7.332 -3.747 362 HG22 VAL 15 HG22 VAL 15 -10.924 -8.124 -5.222 363 HG23 VAL 15 HG23 VAL 15 -12.073 -7.747 -3.939 364 H THR 16 H THR 16 -9.807 -6.793 -1.629 365 HA THR 16 HA THR 16 -11.889 -6.624 0.399 366 HB THR 16 HB THR 16 -9.860 -5.543 1.023 367 HG1 THR 16 HG1 THR 16 -11.511 -3.403 0.156 368 HG21 THR 16 HG21 THR 16 -8.496 -4.884 -0.627 369 HG22 THR 16 HG22 THR 16 -9.829 -4.730 -1.772 370 HG23 THR 16 HG23 THR 16 -9.450 -3.401 -0.675 371 H LEU 17 H LEU 17 -13.897 -6.122 -0.154 372 HA LEU 17 HA LEU 17 -14.461 -4.854 -2.697 373 HB2 LEU 17 HB2 LEU 17 -15.956 -6.368 -0.678 374 HB3 LEU 17 HB3 LEU 17 -16.868 -5.066 -1.440 375 HG LEU 17 HG LEU 17 -15.467 -7.253 -2.971 376 HD11 LEU 17 HD11 LEU 17 -18.284 -7.473 -3.122 377 HD12 LEU 17 HD12 LEU 17 -17.126 -8.628 -2.463 378 HD13 LEU 17 HD13 LEU 17 -17.842 -7.403 -1.416 379 HD21 LEU 17 HD21 LEU 17 -16.956 -6.490 -4.790 380 HD22 LEU 17 HD22 LEU 17 -17.502 -5.171 -3.755 381 HD23 LEU 17 HD23 LEU 17 -15.817 -5.249 -4.268 382 H PHE 18 H PHE 18 -13.812 -2.736 -2.543 383 HA PHE 18 HA PHE 18 -15.125 -1.104 -0.473 384 HB2 PHE 18 HB2 PHE 18 -12.434 -1.060 -1.648 385 HB3 PHE 18 HB3 PHE 18 -13.200 0.523 -1.559 386 HD1 PHE 18 HD1 PHE 18 -14.650 0.562 0.877 387 HD2 PHE 18 HD2 PHE 18 -10.915 -1.303 0.049 388 HE1 PHE 18 HE1 PHE 18 -14.048 0.720 3.257 389 HE2 PHE 18 HE2 PHE 18 -10.307 -1.149 2.428 390 HZ PHE 18 HZ PHE 18 -11.874 -0.137 4.035 391 H LYS 19 H LYS 19 -16.951 -0.301 -1.298 392 HA LYS 19 HA LYS 19 -16.848 0.887 -3.994 393 HB2 LYS 19 HB2 LYS 19 -19.341 -0.077 -2.595 394 HB3 LYS 19 HB3 LYS 19 -19.162 0.375 -4.285 395 HG2 LYS 19 HG2 LYS 19 -17.434 -1.589 -4.315 396 HG3 LYS 19 HG3 LYS 19 -18.329 -2.120 -2.889 397 HD2 LYS 19 HD2 LYS 19 -19.812 -1.350 -5.368 398 HD3 LYS 19 HD3 LYS 19 -19.044 -2.937 -5.265 399 HE2 LYS 19 HE2 LYS 19 -20.443 -3.654 -3.593 400 HE3 LYS 19 HE3 LYS 19 -20.748 -2.022 -3.000 401 HZ1 LYS 19 HZ1 LYS 19 -22.490 -1.782 -4.352 402 HZ2 LYS 19 HZ2 LYS 19 -21.706 -2.487 -5.675 403 HZ3 LYS 19 HZ3 LYS 19 -22.451 -3.466 -4.514 404 H ASN 20 H ASN 20 -18.080 2.825 -4.337 405 HA ASN 20 HA ASN 20 -18.556 4.992 -3.815 406 HB2 ASN 20 HB2 ASN 20 -19.986 3.443 -1.669 407 HB3 ASN 20 HB3 ASN 20 -20.061 5.202 -1.714 408 HD21 ASN 20 HD21 ASN 20 -21.785 2.635 -2.444 409 HD22 ASN 20 HD22 ASN 20 -22.625 3.178 -3.853 410 H ALA 21 H ALA 21 -16.010 4.055 -2.932 411 HA ALA 21 HA ALA 21 -15.440 4.849 -0.278 412 HB1 ALA 21 HB1 ALA 21 -13.052 4.950 -1.151 413 HB2 ALA 21 HB2 ALA 21 -13.889 3.403 -1.289 414 HB3 ALA 21 HB3 ALA 21 -13.716 4.442 -2.704 415 H ILE 22 H ILE 22 -15.851 6.855 0.413 416 HA ILE 22 HA ILE 22 -14.968 9.107 -1.271 417 HB ILE 22 HB ILE 22 -17.203 9.080 0.760 418 HG12 ILE 22 HG12 ILE 22 -17.489 9.611 -2.184 419 HG13 ILE 22 HG13 ILE 22 -17.493 7.961 -1.569 420 HG21 ILE 22 HG21 ILE 22 -17.535 11.382 -0.568 421 HG22 ILE 22 HG22 ILE 22 -16.590 11.252 0.915 422 HG23 ILE 22 HG23 ILE 22 -15.778 11.249 -0.650 423 HD11 ILE 22 HD11 ILE 22 -19.594 9.927 -1.577 424 HD12 ILE 22 HD12 ILE 22 -19.669 8.195 -1.250 425 HD13 ILE 22 HD13 ILE 22 -19.289 9.322 0.052 426 H ILE 23 H ILE 23 -13.176 10.002 -0.510 427 HA ILE 23 HA ILE 23 -12.630 9.899 2.370 428 HB ILE 23 HB ILE 23 -10.852 10.338 -0.016 429 HG12 ILE 23 HG12 ILE 23 -11.394 8.016 0.695 430 HG13 ILE 23 HG13 ILE 23 -9.680 8.393 0.831 431 HG21 ILE 23 HG21 ILE 23 -9.948 11.932 1.390 432 HG22 ILE 23 HG22 ILE 23 -10.367 11.034 2.849 433 HG23 ILE 23 HG23 ILE 23 -9.031 10.492 1.832 434 HD11 ILE 23 HD11 ILE 23 -10.039 8.817 3.254 435 HD12 ILE 23 HD12 ILE 23 -11.693 8.239 3.056 436 HD13 ILE 23 HD13 ILE 23 -10.338 7.152 2.753 437 H LYS 24 H LYS 24 -13.585 11.605 3.327 438 HA LYS 24 HA LYS 24 -13.159 14.269 2.145 439 HB2 LYS 24 HB2 LYS 24 -15.410 13.026 3.585 440 HB3 LYS 24 HB3 LYS 24 -15.029 14.666 4.092 441 HG2 LYS 24 HG2 LYS 24 -15.026 15.096 1.487 442 HG3 LYS 24 HG3 LYS 24 -16.071 13.672 1.497 443 HD2 LYS 24 HD2 LYS 24 -16.596 15.924 3.395 444 HD3 LYS 24 HD3 LYS 24 -17.114 16.051 1.713 445 HE2 LYS 24 HE2 LYS 24 -18.096 13.652 2.196 446 HE3 LYS 24 HE3 LYS 24 -18.053 14.218 3.864 447 HZ1 LYS 24 HZ1 LYS 24 -19.815 15.499 3.517 448 HZ2 LYS 24 HZ2 LYS 24 -19.164 16.171 2.108 449 HZ3 LYS 24 HZ3 LYS 24 -20.022 14.715 2.032 450 H ASN 25 H ASN 25 -11.185 14.807 2.997 451 HA ASN 25 HA ASN 25 -9.662 15.530 4.524 452 HB2 ASN 25 HB2 ASN 25 -11.899 15.880 6.504 453 HB3 ASN 25 HB3 ASN 25 -10.453 16.862 6.288 454 HD21 ASN 25 HD21 ASN 25 -10.549 18.601 5.016 455 HD22 ASN 25 HD22 ASN 25 -11.909 19.048 4.050 456 H ALA 26 H ALA 26 -9.950 12.780 4.384 457 HA ALA 26 HA ALA 26 -10.405 11.402 6.745 458 HB1 ALA 26 HB1 ALA 26 -8.486 10.841 4.495 459 HB2 ALA 26 HB2 ALA 26 -8.781 9.715 5.820 460 HB3 ALA 26 HB3 ALA 26 -10.099 10.171 4.741 461 H TYR 27 H TYR 27 -7.571 13.205 5.711 462 HA TYR 27 HA TYR 27 -6.335 12.661 8.331 463 HB2 TYR 27 HB2 TYR 27 -5.191 11.943 6.067 464 HB3 TYR 27 HB3 TYR 27 -4.725 13.639 6.008 465 HD1 TYR 27 HD1 TYR 27 -2.739 14.272 7.010 466 HD2 TYR 27 HD2 TYR 27 -4.681 10.735 8.358 467 HE1 TYR 27 HE1 TYR 27 -0.841 13.806 8.503 468 HE2 TYR 27 HE2 TYR 27 -2.789 10.260 9.855 469 HH TYR 27 HH TYR 27 0.179 11.780 9.605 470 H LYS 28 H LYS 28 -6.206 14.331 9.664 471 HA LYS 28 HA LYS 28 -6.828 16.997 8.706 472 HB2 LYS 28 HB2 LYS 28 -6.667 15.661 11.360 473 HB3 LYS 28 HB3 LYS 28 -6.405 17.399 11.312 474 HG2 LYS 28 HG2 LYS 28 -8.826 16.018 10.177 475 HG3 LYS 28 HG3 LYS 28 -8.747 16.742 11.785 476 HD2 LYS 28 HD2 LYS 28 -7.925 18.449 9.509 477 HD3 LYS 28 HD3 LYS 28 -9.643 18.060 9.632 478 HE2 LYS 28 HE2 LYS 28 -9.610 19.924 10.936 479 HE3 LYS 28 HE3 LYS 28 -9.217 18.725 12.167 480 HZ1 LYS 28 HZ1 LYS 28 -7.781 20.895 11.815 481 HZ2 LYS 28 HZ2 LYS 28 -7.085 19.436 12.314 482 HZ3 LYS 28 HZ3 LYS 28 -6.992 19.907 10.691 483 H LYS 29 H LYS 29 -5.502 18.793 9.961 484 HA LYS 29 HA LYS 29 -2.803 18.557 8.982 485 HB2 LYS 29 HB2 LYS 29 -2.579 20.901 9.657 486 HB3 LYS 29 HB3 LYS 29 -4.041 20.651 8.711 487 HG2 LYS 29 HG2 LYS 29 -5.419 21.099 10.459 488 HG3 LYS 29 HG3 LYS 29 -4.279 20.487 11.660 489 HD2 LYS 29 HD2 LYS 29 -4.332 22.811 12.002 490 HD3 LYS 29 HD3 LYS 29 -2.848 22.521 11.092 491 HE2 LYS 29 HE2 LYS 29 -4.233 23.019 9.008 492 HE3 LYS 29 HE3 LYS 29 -5.458 23.644 10.111 493 HZ1 LYS 29 HZ1 LYS 29 -3.360 24.949 11.015 494 HZ2 LYS 29 HZ2 LYS 29 -2.850 24.747 9.415 495 HZ3 LYS 29 HZ3 LYS 29 -4.308 25.540 9.745 496 H GLY 30 H GLY 30 -1.164 19.823 10.617 497 HA2 GLY 30 HA2 GLY 30 0.076 19.683 12.549 498 HA3 GLY 30 HA3 GLY 30 -1.385 19.151 13.369 499 H GLU 31 H GLU 31 1.668 18.249 12.295 500 HA GLU 31 HA GLU 31 1.446 15.643 13.389 501 HB2 GLU 31 HB2 GLU 31 1.909 14.364 11.315 502 HB3 GLU 31 HB3 GLU 31 0.317 15.108 11.322 503 HG2 GLU 31 HG2 GLU 31 1.159 16.915 9.904 504 HG3 GLU 31 HG3 GLU 31 2.747 16.150 9.884 505 H1 TYR 1 H TYR 1 -3.680 6.767 8.695 506 HA TYR 1 HA TYR 1 -1.958 7.389 6.472 507 HB2 TYR 1 HB2 TYR 1 -4.424 5.664 6.730 508 HB3 TYR 1 HB3 TYR 1 -3.542 5.866 5.221 509 HD1 TYR 1 HD1 TYR 1 -3.051 4.814 8.764 510 HD2 TYR 1 HD2 TYR 1 -1.772 4.441 4.723 511 HE1 TYR 1 HE1 TYR 1 -1.527 2.999 9.420 512 HE2 TYR 1 HE2 TYR 1 -0.246 2.624 5.368 513 HH TYR 1 HH TYR 1 0.714 1.556 7.107 514 H GLY 2 H GLY 2 -3.256 7.691 4.271 515 HA2 GLY 2 HA2 GLY 2 -4.648 10.235 4.594 516 HA3 GLY 2 HA3 GLY 2 -4.028 9.571 3.090 517 H GLY 3 H GLY 3 -5.362 8.425 1.776 518 HA2 GLY 3 HA2 GLY 3 -8.162 8.670 2.176 519 HA3 GLY 3 HA3 GLY 3 -7.378 7.772 0.885 520 H PHE 4 H PHE 4 -8.239 5.803 0.851 521 HA PHE 4 HA PHE 4 -9.175 4.512 3.246 522 HB2 PHE 4 HB2 PHE 4 -9.147 3.832 0.331 523 HB3 PHE 4 HB3 PHE 4 -9.444 2.556 1.507 524 HD1 PHE 4 HD1 PHE 4 -11.653 2.045 1.778 525 HD2 PHE 4 HD2 PHE 4 -10.558 6.091 1.038 526 HE1 PHE 4 HE1 PHE 4 -14.021 2.704 1.897 527 HE2 PHE 4 HE2 PHE 4 -12.923 6.757 1.156 528 HZ PHE 4 HZ PHE 4 -14.658 5.063 1.587 529 H MET 5 H MET 5 -8.453 2.439 4.002 530 HA MET 5 HA MET 5 -5.641 1.855 3.349 531 HB2 MET 5 HB2 MET 5 -5.692 2.940 5.507 532 HB3 MET 5 HB3 MET 5 -6.961 1.859 6.066 533 HG2 MET 5 HG2 MET 5 -4.880 1.179 7.025 534 HG3 MET 5 HG3 MET 5 -5.393 -0.034 5.855 535 HE1 MET 5 HE1 MET 5 -1.563 -0.289 5.389 536 HE2 MET 5 HE2 MET 5 -2.454 -0.096 6.899 537 HE3 MET 5 HE3 MET 5 -3.077 -1.159 5.637 538 H THR 6 H THR 6 -5.585 -0.040 2.341 539 HA THR 6 HA THR 6 -7.513 -2.122 3.091 540 HB THR 6 HB THR 6 -5.794 -1.780 0.634 541 HG1 THR 6 HG1 THR 6 -8.611 -1.860 1.074 542 HG21 THR 6 HG21 THR 6 -6.854 -3.861 -0.191 543 HG22 THR 6 HG22 THR 6 -5.794 -4.138 1.190 544 HG23 THR 6 HG23 THR 6 -7.543 -4.116 1.412 545 H SER 7 H SER 7 -6.712 -3.274 4.754 546 HA SER 7 HA SER 7 -3.905 -4.131 4.649 547 HB2 SER 7 HB2 SER 7 -5.102 -2.973 6.714 548 HB3 SER 7 HB3 SER 7 -5.620 -4.626 7.044 549 HG SER 7 HG SER 7 -3.326 -3.561 7.660 550 H GLU 8 H GLU 8 -4.014 -5.861 3.251 551 HA GLU 8 HA GLU 8 -5.739 -8.102 4.073 552 HB2 GLU 8 HB2 GLU 8 -4.869 -7.081 1.430 553 HB3 GLU 8 HB3 GLU 8 -4.951 -8.828 1.602 554 HG2 GLU 8 HG2 GLU 8 -7.223 -8.839 1.862 555 HG3 GLU 8 HG3 GLU 8 -7.268 -7.198 2.503 556 H LYS 9 H LYS 9 -4.774 -9.795 4.959 557 HA LYS 9 HA LYS 9 -1.895 -10.190 4.465 558 HB2 LYS 9 HB2 LYS 9 -2.388 -9.600 6.789 559 HB3 LYS 9 HB3 LYS 9 -3.532 -10.931 6.898 560 HG2 LYS 9 HG2 LYS 9 -1.670 -12.508 6.490 561 HG3 LYS 9 HG3 LYS 9 -0.552 -11.142 6.520 562 HD2 LYS 9 HD2 LYS 9 -0.803 -10.813 8.780 563 HD3 LYS 9 HD3 LYS 9 -2.421 -11.517 8.811 564 HE2 LYS 9 HE2 LYS 9 -1.580 -13.712 8.733 565 HE3 LYS 9 HE3 LYS 9 0.023 -13.168 8.242 566 HZ1 LYS 9 HZ1 LYS 9 -0.252 -11.921 10.585 567 HZ2 LYS 9 HZ2 LYS 9 -1.146 -13.325 10.888 568 HZ3 LYS 9 HZ3 LYS 9 0.473 -13.439 10.410 569 H SER 10 H SER 10 -1.643 -11.767 3.020 570 HA SER 10 HA SER 10 -2.671 -14.395 3.588 571 HB2 SER 10 HB2 SER 10 -3.805 -14.690 1.418 572 HB3 SER 10 HB3 SER 10 -4.580 -13.433 2.383 573 HG SER 10 HG SER 10 -4.236 -12.847 0.161 574 H GLN 11 H GLN 11 -1.384 -15.971 2.768 575 HA GLN 11 HA GLN 11 1.063 -15.113 1.472 576 HB2 GLN 11 HB2 GLN 11 1.784 -17.456 1.825 577 HB3 GLN 11 HB3 GLN 11 1.255 -16.674 3.309 578 HG2 GLN 11 HG2 GLN 11 -0.704 -17.915 3.414 579 HG3 GLN 11 HG3 GLN 11 -0.630 -18.355 1.708 580 HE21 GLN 11 HE21 GLN 11 -1.071 -20.482 2.824 581 HE22 GLN 11 HE22 GLN 11 0.307 -21.429 3.256 582 H THR 12 H THR 12 -1.028 -14.717 -0.232 583 HA THR 12 HA THR 12 -0.291 -16.433 -2.437 584 HB THR 12 HB THR 12 -2.996 -16.531 -2.808 585 HG1 THR 12 HG1 THR 12 -2.598 -17.230 -0.083 586 HG21 THR 12 HG21 THR 12 -2.117 -18.859 -1.337 587 HG22 THR 12 HG22 THR 12 -2.502 -18.695 -3.050 588 HG23 THR 12 HG23 THR 12 -0.879 -18.320 -2.471 589 HA PRO 13 HA PRO 13 -1.081 -12.860 -4.859 590 HB2 PRO 13 HB2 PRO 13 -2.120 -13.887 -7.148 591 HB3 PRO 13 HB3 PRO 13 -0.418 -14.061 -6.702 592 HG2 PRO 13 HG2 PRO 13 -2.665 -16.016 -6.399 593 HG3 PRO 13 HG3 PRO 13 -1.003 -16.298 -6.950 594 HD2 PRO 13 HD2 PRO 13 -1.819 -16.869 -4.432 595 HD3 PRO 13 HD3 PRO 13 -0.165 -16.343 -4.803 596 H LEU 14 H LEU 14 -2.658 -11.651 -3.875 597 HA LEU 14 HA LEU 14 -5.457 -12.318 -4.489 598 HB2 LEU 14 HB2 LEU 14 -6.111 -11.127 -2.565 599 HB3 LEU 14 HB3 LEU 14 -4.739 -12.125 -2.087 600 HG LEU 14 HG LEU 14 -4.379 -9.238 -2.823 601 HD11 LEU 14 HD11 LEU 14 -4.550 -9.899 0.033 602 HD12 LEU 14 HD12 LEU 14 -5.102 -8.470 -0.841 603 HD13 LEU 14 HD13 LEU 14 -6.082 -9.936 -0.840 604 HD21 LEU 14 HD21 LEU 14 -2.294 -10.171 -2.664 605 HD22 LEU 14 HD22 LEU 14 -2.552 -9.693 -0.986 606 HD23 LEU 14 HD23 LEU 14 -2.799 -11.370 -1.474 607 H VAL 15 H VAL 15 -6.496 -9.752 -3.874 608 HA VAL 15 HA VAL 15 -5.253 -7.738 -5.463 609 HB VAL 15 HB VAL 15 -6.016 -9.056 -7.330 610 HG11 VAL 15 HG11 VAL 15 -8.795 -9.000 -7.242 611 HG12 VAL 15 HG12 VAL 15 -7.757 -10.411 -7.040 612 HG13 VAL 15 HG13 VAL 15 -8.305 -9.509 -5.627 613 HG21 VAL 15 HG21 VAL 15 -6.478 -6.441 -7.056 614 HG22 VAL 15 HG22 VAL 15 -6.907 -7.335 -8.513 615 HG23 VAL 15 HG23 VAL 15 -8.136 -6.990 -7.297 616 H THR 16 H THR 16 -6.035 -5.771 -4.940 617 HA THR 16 HA THR 16 -8.201 -5.668 -2.999 618 HB THR 16 HB THR 16 -6.279 -4.412 -2.360 619 HG1 THR 16 HG1 THR 16 -8.057 -2.445 -3.378 620 HG21 THR 16 HG21 THR 16 -4.912 -3.730 -3.999 621 HG22 THR 16 HG22 THR 16 -6.215 -3.711 -5.187 622 HG23 THR 16 HG23 THR 16 -5.962 -2.320 -4.133 623 H LEU 17 H LEU 17 -10.219 -5.322 -3.629 624 HA LEU 17 HA LEU 17 -10.780 -4.224 -6.252 625 HB2 LEU 17 HB2 LEU 17 -12.231 -5.753 -4.215 626 HB3 LEU 17 HB3 LEU 17 -13.209 -4.552 -5.058 627 HG LEU 17 HG LEU 17 -11.610 -6.696 -6.450 628 HD11 LEU 17 HD11 LEU 17 -14.394 -7.122 -6.685 629 HD12 LEU 17 HD12 LEU 17 -13.186 -8.159 -5.925 630 HD13 LEU 17 HD13 LEU 17 -14.028 -6.939 -4.969 631 HD21 LEU 17 HD21 LEU 17 -13.075 -6.114 -8.348 632 HD22 LEU 17 HD22 LEU 17 -13.759 -4.800 -7.390 633 HD23 LEU 17 HD23 LEU 17 -12.054 -4.769 -7.839 634 H PHE 18 H PHE 18 -10.281 -2.060 -6.174 635 HA PHE 18 HA PHE 18 -11.780 -0.433 -4.231 636 HB2 PHE 18 HB2 PHE 18 -9.062 -0.247 -5.327 637 HB3 PHE 18 HB3 PHE 18 -9.942 1.278 -5.335 638 HD1 PHE 18 HD1 PHE 18 -11.467 1.328 -2.949 639 HD2 PHE 18 HD2 PHE 18 -7.588 -0.309 -3.576 640 HE1 PHE 18 HE1 PHE 18 -10.955 1.637 -0.562 641 HE2 PHE 18 HE2 PHE 18 -7.070 -0.003 -1.190 642 HZ PHE 18 HZ PHE 18 -8.754 0.970 0.320 643 H LYS 19 H LYS 19 -13.630 0.200 -5.146 644 HA LYS 19 HA LYS 19 -13.523 1.264 -7.893 645 HB2 LYS 19 HB2 LYS 19 -15.990 0.196 -6.525 646 HB3 LYS 19 HB3 LYS 19 -15.779 0.569 -8.230 647 HG2 LYS 19 HG2 LYS 19 -13.919 -1.268 -8.088 648 HG3 LYS 19 HG3 LYS 19 -14.837 -1.784 -6.671 649 HD2 LYS 19 HD2 LYS 19 -16.265 -1.246 -9.239 650 HD3 LYS 19 HD3 LYS 19 -15.390 -2.765 -9.032 651 HE2 LYS 19 HE2 LYS 19 -16.799 -3.507 -7.378 652 HE3 LYS 19 HE3 LYS 19 -17.244 -1.876 -6.877 653 HZ1 LYS 19 HZ1 LYS 19 -18.943 -1.827 -8.303 654 HZ2 LYS 19 HZ2 LYS 19 -18.058 -2.535 -9.559 655 HZ3 LYS 19 HZ3 LYS 19 -18.778 -3.509 -8.378 656 H ASN 20 H ASN 20 -14.877 3.090 -8.366 657 HA ASN 20 HA ASN 20 -15.520 5.239 -7.965 658 HB2 ASN 20 HB2 ASN 20 -16.909 3.691 -5.794 659 HB3 ASN 20 HB3 ASN 20 -17.104 5.437 -5.920 660 HD21 ASN 20 HD21 ASN 20 -18.620 2.724 -6.588 661 HD22 ASN 20 HD22 ASN 20 -19.448 3.148 -8.044 662 H ALA 21 H ALA 21 -12.945 4.528 -6.960 663 HA ALA 21 HA ALA 21 -12.522 5.484 -4.332 664 HB1 ALA 21 HB1 ALA 21 -10.118 5.717 -5.140 665 HB2 ALA 21 HB2 ALA 21 -10.838 4.109 -5.219 666 HB3 ALA 21 HB3 ALA 21 -10.695 5.083 -6.682 667 H ILE 22 H ILE 22 -13.097 7.485 -3.754 668 HA ILE 22 HA ILE 22 -12.315 9.714 -5.518 669 HB ILE 22 HB ILE 22 -14.613 9.619 -3.560 670 HG12 ILE 22 HG12 ILE 22 -14.828 9.997 -6.534 671 HG13 ILE 22 HG13 ILE 22 -14.743 8.381 -5.841 672 HG21 ILE 22 HG21 ILE 22 -15.056 11.831 -5.006 673 HG22 ILE 22 HG22 ILE 22 -14.162 11.835 -3.485 674 HG23 ILE 22 HG23 ILE 22 -13.292 11.821 -5.019 675 HD11 ILE 22 HD11 ILE 22 -16.969 10.195 -6.013 676 HD12 ILE 22 HD12 ILE 22 -16.940 8.479 -5.607 677 HD13 ILE 22 HD13 ILE 22 -16.685 9.688 -4.348 678 H ILE 23 H ILE 23 -10.622 10.775 -4.747 679 HA ILE 23 HA ILE 23 -10.168 10.844 -1.849 680 HB ILE 23 HB ILE 23 -8.344 11.297 -4.197 681 HG12 ILE 23 HG12 ILE 23 -8.744 8.979 -3.390 682 HG13 ILE 23 HG13 ILE 23 -7.067 9.484 -3.216 683 HG21 ILE 23 HG21 ILE 23 -7.602 13.017 -2.847 684 HG22 ILE 23 HG22 ILE 23 -8.009 12.164 -1.358 685 HG23 ILE 23 HG23 ILE 23 -6.604 11.669 -2.302 686 HD11 ILE 23 HD11 ILE 23 -7.541 9.994 -0.831 687 HD12 ILE 23 HD12 ILE 23 -9.143 9.292 -1.053 688 HD13 ILE 23 HD13 ILE 23 -7.706 8.291 -1.258 689 H LYS 24 H LYS 24 -11.271 12.520 -1.006 690 HA LYS 24 HA LYS 24 -10.997 15.149 -2.305 691 HB2 LYS 24 HB2 LYS 24 -13.198 13.816 -0.871 692 HB3 LYS 24 HB3 LYS 24 -12.951 15.502 -0.434 693 HG2 LYS 24 HG2 LYS 24 -12.897 15.809 -3.054 694 HG3 LYS 24 HG3 LYS 24 -13.834 14.314 -3.007 695 HD2 LYS 24 HD2 LYS 24 -14.583 16.605 -1.236 696 HD3 LYS 24 HD3 LYS 24 -15.056 16.615 -2.937 697 HE2 LYS 24 HE2 LYS 24 -15.873 14.173 -2.364 698 HE3 LYS 24 HE3 LYS 24 -15.927 14.821 -0.725 699 HZ1 LYS 24 HZ1 LYS 24 -17.766 15.949 -1.189 700 HZ2 LYS 24 HZ2 LYS 24 -17.120 16.597 -2.612 701 HZ3 LYS 24 HZ3 LYS 24 -17.866 15.078 -2.636 702 H ASN 25 H ASN 25 -9.095 15.870 -1.425 703 HA ASN 25 HA ASN 25 -7.676 16.771 0.107 704 HB2 ASN 25 HB2 ASN 25 -9.995 17.053 2.001 705 HB3 ASN 25 HB3 ASN 25 -8.615 18.125 1.780 706 HD21 ASN 25 HD21 ASN 25 -8.790 19.792 0.424 707 HD22 ASN 25 HD22 ASN 25 -10.145 20.094 -0.605 708 H ALA 26 H ALA 26 -7.770 14.002 0.097 709 HA ALA 26 HA ALA 26 -8.201 12.710 2.508 710 HB1 ALA 26 HB1 ALA 26 -6.181 12.185 0.341 711 HB2 ALA 26 HB2 ALA 26 -6.422 11.108 1.717 712 HB3 ALA 26 HB3 ALA 26 -7.743 11.404 0.587 713 H TYR 27 H TYR 27 -5.468 14.660 1.471 714 HA TYR 27 HA TYR 27 -4.288 14.334 4.152 715 HB2 TYR 27 HB2 TYR 27 -3.020 13.590 1.963 716 HB3 TYR 27 HB3 TYR 27 -2.670 15.310 1.833 717 HD1 TYR 27 HD1 TYR 27 -0.772 16.133 2.866 718 HD2 TYR 27 HD2 TYR 27 -2.504 12.530 4.324 719 HE1 TYR 27 HE1 TYR 27 1.102 15.875 4.439 720 HE2 TYR 27 HE2 TYR 27 -0.636 12.263 5.901 721 HH TYR 27 HH TYR 27 2.224 13.981 5.670 722 H LYS 28 H LYS 28 -4.320 16.072 5.402 723 HA LYS 28 HA LYS 28 -5.092 18.637 4.288 724 HB2 LYS 28 HB2 LYS 28 -4.935 17.447 7.011 725 HB3 LYS 28 HB3 LYS 28 -4.794 19.196 6.883 726 HG2 LYS 28 HG2 LYS 28 -7.069 17.590 5.740 727 HG3 LYS 28 HG3 LYS 28 -7.099 18.394 7.311 728 HD2 LYS 28 HD2 LYS 28 -6.318 20.044 4.980 729 HD3 LYS 28 HD3 LYS 28 -8.008 19.540 5.068 730 HE2 LYS 28 HE2 LYS 28 -8.150 21.461 6.277 731 HE3 LYS 28 HE3 LYS 28 -7.716 20.356 7.579 732 HZ1 LYS 28 HZ1 LYS 28 -6.426 22.603 7.162 733 HZ2 LYS 28 HZ2 LYS 28 -5.645 21.223 7.751 734 HZ3 LYS 28 HZ3 LYS 28 -5.533 21.624 6.111 735 H LYS 29 H LYS 29 -3.940 20.581 5.496 736 HA LYS 29 HA LYS 29 -1.198 20.493 4.617 737 HB2 LYS 29 HB2 LYS 29 -1.161 22.874 5.187 738 HB3 LYS 29 HB3 LYS 29 -2.568 22.479 4.208 739 HG2 LYS 29 HG2 LYS 29 -4.035 22.901 5.891 740 HG3 LYS 29 HG3 LYS 29 -2.893 22.436 7.153 741 HD2 LYS 29 HD2 LYS 29 -3.127 24.762 7.377 742 HD3 LYS 29 HD3 LYS 29 -1.598 24.542 6.524 743 HE2 LYS 29 HE2 LYS 29 -2.949 24.833 4.380 744 HE3 LYS 29 HE3 LYS 29 -4.252 25.416 5.415 745 HZ1 LYS 29 HZ1 LYS 29 -2.284 26.917 6.311 746 HZ2 LYS 29 HZ2 LYS 29 -1.712 26.678 4.737 747 HZ3 LYS 29 HZ3 LYS 29 -3.234 27.374 4.987 748 H GLY 30 H GLY 30 0.285 21.952 6.245 749 HA2 GLY 30 HA2 GLY 30 1.466 21.986 8.218 750 HA3 GLY 30 HA3 GLY 30 0.018 21.389 9.015 751 H GLU 31 H GLU 31 3.162 20.660 8.090 752 HA GLU 31 HA GLU 31 3.086 18.098 9.298 753 HB2 GLU 31 HB2 GLU 31 3.705 16.759 7.304 754 HB3 GLU 31 HB3 GLU 31 2.066 17.389 7.227 755 HG2 GLU 31 HG2 GLU 31 2.828 19.182 5.748 756 HG3 GLU 31 HG3 GLU 31 4.465 18.531 5.813 757 H1 TYR 1 H TYR 1 -1.245 8.649 4.898 758 HA TYR 1 HA TYR 1 0.504 9.289 2.702 759 HB2 TYR 1 HB2 TYR 1 -1.844 7.408 2.965 760 HB3 TYR 1 HB3 TYR 1 -0.922 7.599 1.478 761 HD1 TYR 1 HD1 TYR 1 -0.497 6.753 5.084 762 HD2 TYR 1 HD2 TYR 1 0.962 6.285 1.114 763 HE1 TYR 1 HE1 TYR 1 1.123 5.083 5.883 764 HE2 TYR 1 HE2 TYR 1 2.585 4.613 1.902 765 HH TYR 1 HH TYR 1 3.550 3.701 3.726 766 H GLY 2 H GLY 2 -0.735 9.392 0.448 767 HA2 GLY 2 HA2 GLY 2 -2.311 11.843 0.600 768 HA3 GLY 2 HA3 GLY 2 -1.591 11.156 -0.849 769 H GLY 3 H GLY 3 -2.791 9.854 -2.148 770 HA2 GLY 3 HA2 GLY 3 -5.614 9.916 -1.858 771 HA3 GLY 3 HA3 GLY 3 -4.721 9.015 -3.073 772 H PHE 4 H PHE 4 -5.446 6.991 -3.035 773 HA PHE 4 HA PHE 4 -6.375 5.755 -0.609 774 HB2 PHE 4 HB2 PHE 4 -6.200 4.942 -3.484 775 HB3 PHE 4 HB3 PHE 4 -6.443 3.703 -2.258 776 HD1 PHE 4 HD1 PHE 4 -8.618 3.045 -2.027 777 HD2 PHE 4 HD2 PHE 4 -7.792 7.122 -2.930 778 HE1 PHE 4 HE1 PHE 4 -11.030 3.534 -2.011 779 HE2 PHE 4 HE2 PHE 4 -10.202 7.617 -2.915 780 HZ PHE 4 HZ PHE 4 -11.824 5.822 -2.454 781 H MET 5 H MET 5 -5.540 3.776 0.273 782 HA MET 5 HA MET 5 -2.674 3.359 -0.259 783 HB2 MET 5 HB2 MET 5 -2.877 4.543 1.838 784 HB3 MET 5 HB3 MET 5 -4.085 3.400 2.412 785 HG2 MET 5 HG2 MET 5 -1.997 2.919 3.468 786 HG3 MET 5 HG3 MET 5 -2.378 1.619 2.341 787 HE1 MET 5 HE1 MET 5 1.476 1.629 2.017 788 HE2 MET 5 HE2 MET 5 0.517 1.823 3.484 789 HE3 MET 5 HE3 MET 5 0.022 0.660 2.254 790 H THR 6 H THR 6 -2.459 1.427 -1.172 791 HA THR 6 HA THR 6 -4.264 -0.745 -0.377 792 HB THR 6 HB THR 6 -2.488 -0.400 -2.792 793 HG1 THR 6 HG1 THR 6 -5.305 -0.670 -2.438 794 HG21 THR 6 HG21 THR 6 -3.358 -2.592 -3.544 795 HG22 THR 6 HG22 THR 6 -2.336 -2.722 -2.113 796 HG23 THR 6 HG23 THR 6 -4.089 -2.820 -1.956 797 H SER 7 H SER 7 -3.451 -1.767 1.360 798 HA SER 7 HA SER 7 -0.589 -2.425 1.396 799 HB2 SER 7 HB2 SER 7 -1.941 -1.261 3.360 800 HB3 SER 7 HB3 SER 7 -2.356 -2.930 3.751 801 HG SER 7 HG SER 7 -0.166 -1.679 4.395 802 H GLU 8 H GLU 8 -0.517 -4.223 0.087 803 HA GLU 8 HA GLU 8 -2.117 -6.540 0.953 804 HB2 GLU 8 HB2 GLU 8 -1.210 -5.586 -1.705 805 HB3 GLU 8 HB3 GLU 8 -1.189 -7.325 -1.448 806 HG2 GLU 8 HG2 GLU 8 -3.463 -7.472 -1.274 807 HG3 GLU 8 HG3 GLU 8 -3.638 -5.809 -0.716 808 H LYS 9 H LYS 9 -1.074 -8.119 1.952 809 HA LYS 9 HA LYS 9 1.844 -8.327 1.589 810 HB2 LYS 9 HB2 LYS 9 1.197 -7.675 3.864 811 HB3 LYS 9 HB3 LYS 9 0.167 -9.095 3.986 812 HG2 LYS 9 HG2 LYS 9 2.168 -10.522 3.727 813 HG3 LYS 9 HG3 LYS 9 3.167 -9.066 3.730 814 HD2 LYS 9 HD2 LYS 9 2.805 -8.660 5.961 815 HD3 LYS 9 HD3 LYS 9 1.246 -9.489 5.969 816 HE2 LYS 9 HE2 LYS 9 2.259 -11.611 6.029 817 HE3 LYS 9 HE3 LYS 9 3.832 -10.964 5.566 818 HZ1 LYS 9 HZ1 LYS 9 3.376 -9.636 7.834 819 HZ2 LYS 9 HZ2 LYS 9 2.578 -11.088 8.176 820 HZ3 LYS 9 HZ3 LYS 9 4.218 -11.102 7.759 821 H SER 10 H SER 10 2.268 -9.942 0.227 822 HA SER 10 HA SER 10 1.408 -12.612 0.873 823 HB2 SER 10 HB2 SER 10 0.388 -13.077 -1.327 824 HB3 SER 10 HB3 SER 10 -0.519 -11.854 -0.437 825 HG SER 10 HG SER 10 -0.140 -11.320 -2.666 826 H GLN 11 H GLN 11 2.843 -14.117 0.178 827 HA GLN 11 HA GLN 11 5.264 -13.135 -1.076 828 HB2 GLN 11 HB2 GLN 11 6.148 -15.393 -0.583 829 HB3 GLN 11 HB3 GLN 11 5.500 -14.593 0.842 830 HG2 GLN 11 HG2 GLN 11 3.640 -15.980 0.931 831 HG3 GLN 11 HG3 GLN 11 3.818 -16.486 -0.748 832 HE21 GLN 11 HE21 GLN 11 3.499 -18.591 0.446 833 HE22 GLN 11 HE22 GLN 11 4.928 -19.406 0.973 834 H THR 12 H THR 12 3.237 -12.965 -2.876 835 HA THR 12 HA THR 12 4.174 -14.724 -4.965 836 HB THR 12 HB THR 12 1.500 -15.043 -5.425 837 HG1 THR 12 HG1 THR 12 1.842 -15.588 -2.658 838 HG21 THR 12 HG21 THR 12 2.488 -17.229 -3.815 839 HG22 THR 12 HG22 THR 12 2.162 -17.171 -5.547 840 HG23 THR 12 HG23 THR 12 3.729 -16.650 -4.926 841 HA PRO 13 HA PRO 13 3.214 -11.336 -7.584 842 HB2 PRO 13 HB2 PRO 13 2.338 -12.542 -9.853 843 HB3 PRO 13 HB3 PRO 13 4.030 -12.568 -9.343 844 HG2 PRO 13 HG2 PRO 13 1.923 -14.669 -9.021 845 HG3 PRO 13 HG3 PRO 13 3.620 -14.852 -9.502 846 HD2 PRO 13 HD2 PRO 13 2.755 -15.365 -6.988 847 HD3 PRO 13 HD3 PRO 13 4.379 -14.735 -7.328 848 H LEU 14 H LEU 14 1.518 -10.204 -6.713 849 HA LEU 14 HA LEU 14 -1.200 -11.105 -7.387 850 HB2 LEU 14 HB2 LEU 14 -2.009 -9.878 -5.546 851 HB3 LEU 14 HB3 LEU 14 -0.587 -10.750 -4.975 852 HG LEU 14 HG LEU 14 -0.410 -7.880 -5.836 853 HD11 LEU 14 HD11 LEU 14 -0.639 -8.421 -2.959 854 HD12 LEU 14 HD12 LEU 14 -1.260 -7.079 -3.919 855 HD13 LEU 14 HD13 LEU 14 -2.130 -8.612 -3.879 856 HD21 LEU 14 HD21 LEU 14 1.729 -8.652 -5.563 857 HD22 LEU 14 HD22 LEU 14 1.377 -8.114 -3.921 858 HD23 LEU 14 HD23 LEU 14 1.268 -9.826 -4.330 859 H VAL 15 H VAL 15 -2.443 -8.595 -6.930 860 HA VAL 15 HA VAL 15 -1.292 -6.570 -8.572 861 HB VAL 15 HB VAL 15 -1.889 -8.026 -10.397 862 HG11 VAL 15 HG11 VAL 15 -4.668 -8.167 -10.403 863 HG12 VAL 15 HG12 VAL 15 -3.540 -9.489 -10.102 864 HG13 VAL 15 HG13 VAL 15 -4.200 -8.567 -8.750 865 HG21 VAL 15 HG21 VAL 15 -2.549 -5.441 -10.264 866 HG22 VAL 15 HG22 VAL 15 -2.854 -6.430 -11.691 867 HG23 VAL 15 HG23 VAL 15 -4.152 -6.122 -10.538 868 H THR 16 H THR 16 -2.235 -4.644 -8.177 869 HA THR 16 HA THR 16 -4.471 -4.612 -6.312 870 HB THR 16 HB THR 16 -2.670 -3.188 -5.673 871 HG1 THR 16 HG1 THR 16 -4.548 -1.409 -6.845 872 HG21 THR 16 HG21 THR 16 -1.297 -2.491 -7.301 873 HG22 THR 16 HG22 THR 16 -2.557 -2.614 -8.529 874 HG23 THR 16 HG23 THR 16 -2.436 -1.164 -7.532 875 H LEU 17 H LEU 17 -6.485 -4.442 -7.021 876 HA LEU 17 HA LEU 17 -7.029 -3.513 -9.713 877 HB2 LEU 17 HB2 LEU 17 -8.436 -5.053 -7.654 878 HB3 LEU 17 HB3 LEU 17 -9.469 -3.966 -8.580 879 HG LEU 17 HG LEU 17 -7.672 -6.044 -9.823 880 HD11 LEU 17 HD11 LEU 17 -10.404 -6.689 -10.129 881 HD12 LEU 17 HD12 LEU 17 -9.155 -7.594 -9.274 882 HD13 LEU 17 HD13 LEU 17 -10.121 -6.396 -8.413 883 HD21 LEU 17 HD21 LEU 17 -9.110 -5.654 -11.791 884 HD22 LEU 17 HD22 LEU 17 -9.918 -4.353 -10.916 885 HD23 LEU 17 HD23 LEU 17 -8.205 -4.217 -11.312 886 H PHE 18 H PHE 18 -6.687 -1.315 -9.717 887 HA PHE 18 HA PHE 18 -8.370 0.282 -7.904 888 HB2 PHE 18 HB2 PHE 18 -5.637 0.619 -8.923 889 HB3 PHE 18 HB3 PHE 18 -6.624 2.073 -9.034 890 HD1 PHE 18 HD1 PHE 18 -8.231 2.126 -6.704 891 HD2 PHE 18 HD2 PHE 18 -4.227 0.745 -7.124 892 HE1 PHE 18 HE1 PHE 18 -7.826 2.584 -4.320 893 HE2 PHE 18 HE2 PHE 18 -3.816 1.199 -4.741 894 HZ PHE 18 HZ PHE 18 -5.617 2.119 -3.336 895 H LYS 19 H LYS 19 -10.227 0.742 -8.902 896 HA LYS 19 HA LYS 19 -10.105 1.678 -11.695 897 HB2 LYS 19 HB2 LYS 19 -12.530 0.493 -10.347 898 HB3 LYS 19 HB3 LYS 19 -12.299 0.810 -12.061 899 HG2 LYS 19 HG2 LYS 19 -10.313 -0.875 -11.793 900 HG3 LYS 19 HG3 LYS 19 -11.230 -1.400 -10.379 901 HD2 LYS 19 HD2 LYS 19 -12.624 -1.075 -13.001 902 HD3 LYS 19 HD3 LYS 19 -11.643 -2.513 -12.711 903 HE2 LYS 19 HE2 LYS 19 -13.035 -3.295 -11.063 904 HE3 LYS 19 HE3 LYS 19 -13.614 -1.685 -10.639 905 HZ1 LYS 19 HZ1 LYS 19 -15.275 -1.822 -12.104 906 HZ2 LYS 19 HZ2 LYS 19 -14.306 -2.506 -13.310 907 HZ3 LYS 19 HZ3 LYS 19 -14.980 -3.488 -12.108 908 H ASN 20 H ASN 20 -11.564 3.379 -12.298 909 HA ASN 20 HA ASN 20 -12.373 5.492 -12.023 910 HB2 ASN 20 HB2 ASN 20 -13.722 3.950 -9.822 911 HB3 ASN 20 HB3 ASN 20 -14.035 5.669 -10.039 912 HD21 ASN 20 HD21 ASN 20 -15.332 2.826 -10.618 913 HD22 ASN 20 HD22 ASN 20 -16.139 3.120 -12.118 914 H ALA 21 H ALA 21 -9.789 5.023 -10.911 915 HA ALA 21 HA ALA 21 -9.525 6.127 -8.319 916 HB1 ALA 21 HB1 ALA 21 -7.117 6.501 -9.074 917 HB2 ALA 21 HB2 ALA 21 -7.716 4.842 -9.078 918 HB3 ALA 21 HB3 ALA 21 -7.599 5.741 -10.591 919 H ILE 22 H ILE 22 -10.261 8.105 -7.859 920 HA ILE 22 HA ILE 22 -9.580 10.300 -9.705 921 HB ILE 22 HB ILE 22 -11.933 10.131 -7.819 922 HG12 ILE 22 HG12 ILE 22 -12.073 10.351 -10.812 923 HG13 ILE 22 HG13 ILE 22 -11.891 8.780 -10.040 924 HG21 ILE 22 HG21 ILE 22 -12.479 12.233 -9.390 925 HG22 ILE 22 HG22 ILE 22 -11.648 12.374 -7.841 926 HG23 ILE 22 HG23 ILE 22 -10.720 12.351 -9.341 927 HD11 ILE 22 HD11 ILE 22 -14.239 10.412 -10.364 928 HD12 ILE 22 HD12 ILE 22 -14.096 8.722 -9.881 929 HD13 ILE 22 HD13 ILE 22 -13.974 9.999 -8.670 930 H ILE 23 H ILE 23 -7.989 11.509 -8.932 931 HA ILE 23 HA ILE 23 -7.647 11.750 -6.029 932 HB ILE 23 HB ILE 23 -5.775 12.226 -8.335 933 HG12 ILE 23 HG12 ILE 23 -6.044 9.921 -7.437 934 HG13 ILE 23 HG13 ILE 23 -4.413 10.551 -7.233 935 HG21 ILE 23 HG21 ILE 23 -5.200 14.049 -7.041 936 HG22 ILE 23 HG22 ILE 23 -5.607 13.237 -5.530 937 HG23 ILE 23 HG23 ILE 23 -4.136 12.798 -6.398 938 HD11 ILE 23 HD11 ILE 23 -5.006 11.128 -4.889 939 HD12 ILE 23 HD12 ILE 23 -6.547 10.305 -5.131 940 HD13 ILE 23 HD13 ILE 23 -5.037 9.401 -5.244 941 H LYS 24 H LYS 24 -8.895 13.381 -5.307 942 HA LYS 24 HA LYS 24 -8.761 15.957 -6.726 943 HB2 LYS 24 HB2 LYS 24 -10.910 14.540 -5.293 944 HB3 LYS 24 HB3 LYS 24 -10.797 16.259 -4.936 945 HG2 LYS 24 HG2 LYS 24 -10.676 16.439 -7.566 946 HG3 LYS 24 HG3 LYS 24 -11.509 14.885 -7.469 947 HD2 LYS 24 HD2 LYS 24 -12.473 17.202 -5.842 948 HD3 LYS 24 HD3 LYS 24 -12.887 17.096 -7.555 949 HE2 LYS 24 HE2 LYS 24 -13.553 14.634 -6.883 950 HE3 LYS 24 HE3 LYS 24 -13.708 15.355 -5.282 951 HZ1 LYS 24 HZ1 LYS 24 -15.603 16.328 -5.859 952 HZ2 LYS 24 HZ2 LYS 24 -14.955 16.949 -7.294 953 HZ3 LYS 24 HZ3 LYS 24 -15.593 15.382 -7.262 954 H ASN 25 H ASN 25 -6.942 16.851 -5.826 955 HA ASN 25 HA ASN 25 -5.644 17.927 -4.300 956 HB2 ASN 25 HB2 ASN 25 -8.040 18.129 -2.493 957 HB3 ASN 25 HB3 ASN 25 -6.732 19.286 -2.723 958 HD21 ASN 25 HD21 ASN 25 -6.976 20.869 -4.167 959 HD22 ASN 25 HD22 ASN 25 -8.314 21.026 -5.249 960 H ALA 26 H ALA 26 -5.545 15.159 -4.175 961 HA ALA 26 HA ALA 26 -5.962 13.954 -1.717 962 HB1 ALA 26 HB1 ALA 26 -3.836 13.477 -3.793 963 HB2 ALA 26 HB2 ALA 26 -4.048 12.450 -2.375 964 HB3 ALA 26 HB3 ALA 26 -5.347 12.597 -3.559 965 H TYR 27 H TYR 27 -3.338 16.044 -2.767 966 HA TYR 27 HA TYR 27 -2.231 15.934 -0.038 967 HB2 TYR 27 HB2 TYR 27 -0.839 15.177 -2.145 968 HB3 TYR 27 HB3 TYR 27 -0.608 16.909 -2.353 969 HD1 TYR 27 HD1 TYR 27 1.190 17.918 -1.305 970 HD2 TYR 27 HD2 TYR 27 -0.329 14.274 0.281 971 HE1 TYR 27 HE1 TYR 27 3.022 17.876 0.335 972 HE2 TYR 27 HE2 TYR 27 1.498 14.222 1.926 973 HH TYR 27 HH TYR 27 4.233 16.130 1.696 974 H LYS 28 H LYS 28 -2.426 17.724 1.120 975 HA LYS 28 HA LYS 28 -3.336 20.171 -0.146 976 HB2 LYS 28 HB2 LYS 28 -3.193 19.129 2.637 977 HB3 LYS 28 HB3 LYS 28 -3.170 20.874 2.424 978 HG2 LYS 28 HG2 LYS 28 -5.286 19.057 1.293 979 HG3 LYS 28 HG3 LYS 28 -5.428 19.932 2.820 980 HD2 LYS 28 HD2 LYS 28 -4.681 21.519 0.435 981 HD3 LYS 28 HD3 LYS 28 -6.332 20.899 0.492 982 HE2 LYS 28 HE2 LYS 28 -6.657 22.859 1.597 983 HE3 LYS 28 HE3 LYS 28 -6.191 21.852 2.967 984 HZ1 LYS 28 HZ1 LYS 28 -5.053 24.167 2.479 985 HZ2 LYS 28 HZ2 LYS 28 -4.196 22.878 3.163 986 HZ3 LYS 28 HZ3 LYS 28 -4.054 23.206 1.509 987 H LYS 29 H LYS 29 -2.366 22.248 0.995 988 HA LYS 29 HA LYS 29 0.405 22.313 0.210 989 HB2 LYS 29 HB2 LYS 29 0.256 24.716 0.658 990 HB3 LYS 29 HB3 LYS 29 -1.085 24.174 -0.343 991 HG2 LYS 29 HG2 LYS 29 -2.635 24.574 1.269 992 HG3 LYS 29 HG3 LYS 29 -1.509 24.250 2.590 993 HD2 LYS 29 HD2 LYS 29 -1.907 26.562 2.690 994 HD3 LYS 29 HD3 LYS 29 -0.338 26.409 1.895 995 HE2 LYS 29 HE2 LYS 29 -1.635 26.504 -0.299 996 HE3 LYS 29 HE3 LYS 29 -3.008 27.042 0.667 997 HZ1 LYS 29 HZ1 LYS 29 -1.179 28.718 1.545 998 HZ2 LYS 29 HZ2 LYS 29 -0.538 28.445 0.003 999 HZ3 LYS 29 HZ3 LYS 29 -2.112 29.044 0.171 1000 H GLY 30 H GLY 30 1.726 23.950 1.807 1001 HA2 GLY 30 HA2 GLY 30 2.833 24.162 3.812 1002 HA3 GLY 30 HA3 GLY 30 1.401 23.507 4.593 1003 H GLU 31 H GLU 31 4.618 22.953 3.815 1004 HA GLU 31 HA GLU 31 4.668 20.451 5.146 1005 HB2 GLU 31 HB2 GLU 31 5.461 19.071 3.241 1006 HB3 GLU 31 HB3 GLU 31 3.784 19.571 3.081 1007 HG2 GLU 31 HG2 GLU 31 4.464 21.346 1.541 1008 HG3 GLU 31 HG3 GLU 31 6.141 20.826 1.692 1009 H1 TYR 1 H TYR 1 1.184 10.534 1.082 1010 HA TYR 1 HA TYR 1 2.965 11.175 -1.091 1011 HB2 TYR 1 HB2 TYR 1 0.743 9.151 -0.797 1012 HB3 TYR 1 HB3 TYR 1 1.698 9.331 -2.265 1013 HD1 TYR 1 HD1 TYR 1 2.060 8.695 1.391 1014 HD2 TYR 1 HD2 TYR 1 3.681 8.138 -2.504 1015 HE1 TYR 1 HE1 TYR 1 3.762 7.184 2.322 1016 HE2 TYR 1 HE2 TYR 1 5.387 6.624 -1.583 1017 HH TYR 1 HH TYR 1 6.352 5.874 0.314 1018 H GLY 2 H GLY 2 1.798 11.081 -3.382 1019 HA2 GLY 2 HA2 GLY 2 0.048 13.417 -3.400 1020 HA3 GLY 2 HA3 GLY 2 0.866 12.718 -4.790 1021 H GLY 3 H GLY 3 -0.190 11.270 -6.059 1022 HA2 GLY 3 HA2 GLY 3 -3.019 11.140 -5.864 1023 HA3 GLY 3 HA3 GLY 3 -2.020 10.248 -7.003 1024 H PHE 4 H PHE 4 -2.614 8.184 -6.886 1025 HA PHE 4 HA PHE 4 -3.531 7.001 -4.431 1026 HB2 PHE 4 HB2 PHE 4 -3.207 6.067 -7.255 1027 HB3 PHE 4 HB3 PHE 4 -3.404 4.874 -5.976 1028 HD1 PHE 4 HD1 PHE 4 -5.535 4.076 -5.778 1029 HD2 PHE 4 HD2 PHE 4 -4.963 8.153 -6.856 1030 HE1 PHE 4 HE1 PHE 4 -7.974 4.394 -5.857 1031 HE2 PHE 4 HE2 PHE 4 -7.400 8.478 -6.936 1032 HZ PHE 4 HZ PHE 4 -8.909 6.598 -6.435 1033 H MET 5 H MET 5 -2.588 5.142 -3.417 1034 HA MET 5 HA MET 5 0.315 4.898 -3.849 1035 HB2 MET 5 HB2 MET 5 -0.031 6.166 -1.823 1036 HB3 MET 5 HB3 MET 5 -1.181 4.978 -1.226 1037 HG2 MET 5 HG2 MET 5 0.894 4.684 -0.083 1038 HG3 MET 5 HG3 MET 5 0.639 3.310 -1.156 1039 HE1 MET 5 HE1 MET 5 4.495 3.573 -1.347 1040 HE2 MET 5 HE2 MET 5 3.472 3.776 0.074 1041 HE3 MET 5 HE3 MET 5 3.104 2.517 -1.106 1042 H THR 6 H THR 6 0.694 2.944 -4.652 1043 HA THR 6 HA THR 6 -0.985 0.692 -3.802 1044 HB THR 6 HB THR 6 0.855 1.033 -6.171 1045 HG1 THR 6 HG1 THR 6 -1.952 0.607 -5.902 1046 HG21 THR 6 HG21 THR 6 0.151 -1.243 -6.838 1047 HG22 THR 6 HG22 THR 6 1.118 -1.239 -5.362 1048 HG23 THR 6 HG23 THR 6 -0.633 -1.437 -5.270 1049 H SER 7 H SER 7 -0.168 -0.188 -1.991 1050 HA SER 7 HA SER 7 2.730 -0.636 -1.824 1051 HB2 SER 7 HB2 SER 7 1.220 0.516 0.032 1052 HB3 SER 7 HB3 SER 7 0.919 -1.159 0.492 1053 HG SER 7 HG SER 7 2.984 0.288 1.143 1054 H GLU 8 H GLU 8 2.977 -2.484 -3.039 1055 HA GLU 8 HA GLU 8 1.512 -4.866 -2.116 1056 HB2 GLU 8 HB2 GLU 8 2.451 -3.976 -4.784 1057 HB3 GLU 8 HB3 GLU 8 2.585 -5.695 -4.440 1058 HG2 GLU 8 HG2 GLU 8 0.322 -5.997 -4.340 1059 HG3 GLU 8 HG3 GLU 8 0.009 -4.327 -3.871 1060 H LYS 9 H LYS 9 2.622 -6.332 -1.018 1061 HA LYS 9 HA LYS 9 5.560 -6.338 -1.258 1062 HB2 LYS 9 HB2 LYS 9 4.768 -5.642 0.960 1063 HB3 LYS 9 HB3 LYS 9 3.847 -7.133 1.105 1064 HG2 LYS 9 HG2 LYS 9 5.959 -8.408 0.991 1065 HG3 LYS 9 HG3 LYS 9 6.844 -6.881 0.954 1066 HD2 LYS 9 HD2 LYS 9 6.370 -6.397 3.149 1067 HD3 LYS 9 HD3 LYS 9 4.880 -7.343 3.147 1068 HE2 LYS 9 HE2 LYS 9 6.046 -9.375 3.348 1069 HE3 LYS 9 HE3 LYS 9 7.582 -8.632 2.904 1070 HZ1 LYS 9 HZ1 LYS 9 6.944 -7.236 5.086 1071 HZ2 LYS 9 HZ2 LYS 9 6.248 -8.728 5.474 1072 HZ3 LYS 9 HZ3 LYS 9 7.898 -8.633 5.113 1073 H SER 10 H SER 10 6.155 -7.971 -2.530 1074 HA SER 10 HA SER 10 5.468 -10.669 -1.800 1075 HB2 SER 10 HB2 SER 10 4.574 -11.296 -4.019 1076 HB3 SER 10 HB3 SER 10 3.540 -10.123 -3.203 1077 HG SER 10 HG SER 10 3.954 -9.634 -5.437 1078 H GLN 11 H GLN 11 7.049 -12.075 -2.354 1079 HA GLN 11 HA GLN 11 9.429 -10.971 -3.578 1080 HB2 GLN 11 HB2 GLN 11 10.462 -13.130 -2.950 1081 HB3 GLN 11 HB3 GLN 11 9.701 -12.320 -1.587 1082 HG2 GLN 11 HG2 GLN 11 7.955 -13.844 -1.491 1083 HG3 GLN 11 HG3 GLN 11 8.223 -14.401 -3.142 1084 HE21 GLN 11 HE21 GLN 11 8.024 -16.475 -1.869 1085 HE22 GLN 11 HE22 GLN 11 9.493 -17.158 -1.269 1086 H THR 12 H THR 12 7.477 -11.029 -5.457 1087 HA THR 12 HA THR 12 8.618 -12.805 -7.426 1088 HB THR 12 HB THR 12 5.992 -13.345 -7.962 1089 HG1 THR 12 HG1 THR 12 6.274 -13.746 -5.164 1090 HG21 THR 12 HG21 THR 12 7.081 -15.381 -6.225 1091 HG22 THR 12 HG22 THR 12 6.817 -15.419 -7.969 1092 HG23 THR 12 HG23 THR 12 8.316 -14.755 -7.318 1093 HA PRO 13 HA PRO 13 7.508 -9.618 -10.232 1094 HB2 PRO 13 HB2 PRO 13 6.813 -10.986 -12.472 1095 HB3 PRO 13 HB3 PRO 13 8.482 -10.860 -11.902 1096 HG2 PRO 13 HG2 PRO 13 6.527 -13.100 -11.556 1097 HG3 PRO 13 HG3 PRO 13 8.250 -13.173 -11.968 1098 HD2 PRO 13 HD2 PRO 13 7.329 -13.640 -9.465 1099 HD3 PRO 13 HD3 PRO 13 8.914 -12.903 -9.777 1100 H LEU 14 H LEU 14 5.702 -8.573 -9.491 1101 HA LEU 14 HA LEU 14 3.086 -9.711 -10.213 1102 HB2 LEU 14 HB2 LEU 14 2.116 -8.473 -8.460 1103 HB3 LEU 14 HB3 LEU 14 3.575 -9.208 -7.799 1104 HG LEU 14 HG LEU 14 3.563 -6.371 -8.780 1105 HD11 LEU 14 HD11 LEU 14 3.280 -6.823 -5.890 1106 HD12 LEU 14 HD12 LEU 14 2.601 -5.561 -6.918 1107 HD13 LEU 14 HD13 LEU 14 1.838 -7.150 -6.852 1108 HD21 LEU 14 HD21 LEU 14 5.746 -6.950 -8.411 1109 HD22 LEU 14 HD22 LEU 14 5.298 -6.391 -6.799 1110 HD23 LEU 14 HD23 LEU 14 5.341 -8.118 -7.154 1111 H VAL 15 H VAL 15 1.638 -7.293 -9.922 1112 HA VAL 15 HA VAL 15 2.702 -5.259 -11.616 1113 HB VAL 15 HB VAL 15 2.272 -6.831 -13.390 1114 HG11 VAL 15 HG11 VAL 15 -0.483 -7.186 -13.475 1115 HG12 VAL 15 HG12 VAL 15 0.728 -8.402 -13.069 1116 HG13 VAL 15 HG13 VAL 15 -0.048 -7.469 -11.789 1117 HG21 VAL 15 HG21 VAL 15 1.422 -4.301 -13.397 1118 HG22 VAL 15 HG22 VAL 15 1.230 -5.373 -14.784 1119 HG23 VAL 15 HG23 VAL 15 -0.120 -5.109 -13.679 1120 H THR 16 H THR 16 1.605 -3.390 -11.354 1121 HA THR 16 HA THR 16 -0.684 -3.435 -9.556 1122 HB THR 16 HB THR 16 0.980 -1.852 -8.931 1123 HG1 THR 16 HG1 THR 16 -0.969 -0.274 -10.263 1124 HG21 THR 16 HG21 THR 16 2.365 -1.164 -10.558 1125 HG22 THR 16 HG22 THR 16 1.148 -1.399 -11.813 1126 HG23 THR 16 HG23 THR 16 1.164 0.091 -10.869 1127 H LEU 17 H LEU 17 -2.682 -3.449 -10.330 1128 HA LEU 17 HA LEU 17 -3.203 -2.689 -13.079 1129 HB2 LEU 17 HB2 LEU 17 -4.560 -4.233 -10.991 1130 HB3 LEU 17 HB3 LEU 17 -5.639 -3.270 -11.998 1131 HG LEU 17 HG LEU 17 -3.656 -5.268 -13.079 1132 HD11 LEU 17 HD11 LEU 17 -6.322 -6.118 -13.451 1133 HD12 LEU 17 HD12 LEU 17 -5.050 -6.890 -12.504 1134 HD13 LEU 17 HD13 LEU 17 -6.131 -5.722 -11.743 1135 HD21 LEU 17 HD21 LEU 17 -5.042 -5.071 -15.113 1136 HD22 LEU 17 HD22 LEU 17 -5.968 -3.790 -14.331 1137 HD23 LEU 17 HD23 LEU 17 -4.254 -3.555 -14.674 1138 H PHE 18 H PHE 18 -3.027 -0.475 -13.184 1139 HA PHE 18 HA PHE 18 -4.879 1.075 -11.500 1140 HB2 PHE 18 HB2 PHE 18 -2.148 1.570 -12.460 1141 HB3 PHE 18 HB3 PHE 18 -3.237 2.938 -12.663 1142 HD1 PHE 18 HD1 PHE 18 -4.909 2.978 -10.382 1143 HD2 PHE 18 HD2 PHE 18 -0.806 1.873 -10.630 1144 HE1 PHE 18 HE1 PHE 18 -4.610 3.569 -8.013 1145 HE2 PHE 18 HE2 PHE 18 -0.501 2.461 -8.261 1146 HZ PHE 18 HZ PHE 18 -2.404 3.310 -6.949 1147 H LYS 19 H LYS 19 -6.732 1.347 -12.571 1148 HA LYS 19 HA LYS 19 -6.591 2.156 -15.403 1149 HB2 LYS 19 HB2 LYS 19 -8.959 0.855 -14.060 1150 HB3 LYS 19 HB3 LYS 19 -8.710 1.116 -15.781 1151 HG2 LYS 19 HG2 LYS 19 -6.608 -0.401 -15.387 1152 HG3 LYS 19 HG3 LYS 19 -7.532 -0.939 -13.982 1153 HD2 LYS 19 HD2 LYS 19 -8.852 -0.819 -16.660 1154 HD3 LYS 19 HD3 LYS 19 -7.783 -2.170 -16.275 1155 HE2 LYS 19 HE2 LYS 19 -9.176 -2.982 -14.641 1156 HE3 LYS 19 HE3 LYS 19 -9.884 -1.402 -14.309 1157 HZ1 LYS 19 HZ1 LYS 19 -11.476 -1.722 -15.821 1158 HZ2 LYS 19 HZ2 LYS 19 -10.415 -2.379 -16.964 1159 HZ3 LYS 19 HZ3 LYS 19 -11.059 -3.361 -15.746 1160 H ASN 20 H ASN 20 -8.152 3.712 -16.130 1161 HA ASN 20 HA ASN 20 -9.119 5.770 -15.984 1162 HB2 ASN 20 HB2 ASN 20 -10.421 4.239 -13.748 1163 HB3 ASN 20 HB3 ASN 20 -10.850 5.919 -14.056 1164 HD21 ASN 20 HD21 ASN 20 -11.920 2.964 -14.534 1165 HD22 ASN 20 HD22 ASN 20 -12.699 3.129 -16.067 1166 H ALA 21 H ALA 21 -6.544 5.541 -14.773 1167 HA ALA 21 HA ALA 21 -6.442 6.787 -12.236 1168 HB1 ALA 21 HB1 ALA 21 -4.045 7.300 -12.939 1169 HB2 ALA 21 HB2 ALA 21 -4.522 5.603 -12.878 1170 HB3 ALA 21 HB3 ALA 21 -4.422 6.436 -14.430 1171 H ILE 22 H ILE 22 -7.312 8.731 -11.883 1172 HA ILE 22 HA ILE 22 -6.737 10.878 -13.821 1173 HB ILE 22 HB ILE 22 -9.133 10.627 -11.999 1174 HG12 ILE 22 HG12 ILE 22 -9.186 10.692 -15.003 1175 HG13 ILE 22 HG13 ILE 22 -8.925 9.178 -14.145 1176 HG21 ILE 22 HG21 ILE 22 -9.774 12.607 -13.691 1177 HG22 ILE 22 HG22 ILE 22 -9.011 12.881 -12.124 1178 HG23 ILE 22 HG23 ILE 22 -8.031 12.855 -13.590 1179 HD11 ILE 22 HD11 ILE 22 -11.366 10.623 -14.628 1180 HD12 ILE 22 HD12 ILE 22 -11.125 8.974 -14.051 1181 HD13 ILE 22 HD13 ILE 22 -11.133 10.316 -12.907 1182 H ILE 23 H ILE 23 -5.255 12.225 -13.060 1183 HA ILE 23 HA ILE 23 -5.029 12.629 -10.165 1184 HB ILE 23 HB ILE 23 -3.123 13.128 -12.438 1185 HG12 ILE 23 HG12 ILE 23 -3.248 10.859 -11.432 1186 HG13 ILE 23 HG13 ILE 23 -1.677 11.620 -11.202 1187 HG21 ILE 23 HG21 ILE 23 -2.725 15.052 -11.226 1188 HG22 ILE 23 HG22 ILE 23 -3.117 14.289 -9.685 1189 HG23 ILE 23 HG23 ILE 23 -1.592 13.918 -10.490 1190 HD11 ILE 23 HD11 ILE 23 -2.409 12.265 -8.913 1191 HD12 ILE 23 HD12 ILE 23 -3.868 11.307 -9.169 1192 HD13 ILE 23 HD13 ILE 23 -2.286 10.526 -9.180 1193 H LYS 24 H LYS 24 -6.425 14.192 -9.568 1194 HA LYS 24 HA LYS 24 -6.428 16.703 -11.104 1195 HB2 LYS 24 HB2 LYS 24 -8.512 15.199 -9.668 1196 HB3 LYS 24 HB3 LYS 24 -8.533 16.933 -9.381 1197 HG2 LYS 24 HG2 LYS 24 -8.344 17.015 -12.013 1198 HG3 LYS 24 HG3 LYS 24 -9.070 15.412 -11.871 1199 HD2 LYS 24 HD2 LYS 24 -10.242 17.718 -10.370 1200 HD3 LYS 24 HD3 LYS 24 -10.593 17.518 -12.088 1201 HE2 LYS 24 HE2 LYS 24 -11.110 15.042 -11.338 1202 HE3 LYS 24 HE3 LYS 24 -11.363 15.811 -9.772 1203 HZ1 LYS 24 HZ1 LYS 24 -13.301 16.628 -10.441 1204 HZ2 LYS 24 HZ2 LYS 24 -12.653 17.236 -11.881 1205 HZ3 LYS 24 HZ3 LYS 24 -13.184 15.631 -11.803 1206 H ASN 25 H ASN 25 -4.706 17.769 -10.201 1207 HA ASN 25 HA ASN 25 -3.535 19.007 -8.694 1208 HB2 ASN 25 HB2 ASN 25 -5.995 19.127 -6.969 1209 HB3 ASN 25 HB3 ASN 25 -4.765 20.361 -7.223 1210 HD21 ASN 25 HD21 ASN 25 -5.074 21.850 -8.752 1211 HD22 ASN 25 HD22 ASN 25 -6.385 21.855 -9.878 1212 H ALA 26 H ALA 26 -3.241 16.266 -8.425 1213 HA ALA 26 HA ALA 26 -3.655 15.154 -5.923 1214 HB1 ALA 26 HB1 ALA 26 -1.432 14.732 -7.906 1215 HB2 ALA 26 HB2 ALA 26 -1.618 13.762 -6.445 1216 HB3 ALA 26 HB3 ALA 26 -2.884 13.757 -7.673 1217 H TYR 27 H TYR 27 -1.149 17.372 -6.999 1218 HA TYR 27 HA TYR 27 -0.131 17.477 -4.235 1219 HB2 TYR 27 HB2 TYR 27 1.381 16.721 -6.259 1220 HB3 TYR 27 HB3 TYR 27 1.498 18.453 -6.545 1221 HD1 TYR 27 HD1 TYR 27 3.186 19.634 -5.494 1222 HD2 TYR 27 HD2 TYR 27 1.868 15.971 -3.777 1223 HE1 TYR 27 HE1 TYR 27 4.959 19.798 -3.798 1224 HE2 TYR 27 HE2 TYR 27 3.637 16.126 -2.076 1225 HH TYR 27 HH TYR 27 6.240 18.211 -2.316 1226 H LYS 28 H LYS 28 -0.488 19.303 -3.177 1227 HA LYS 28 HA LYS 28 -1.526 21.613 -4.594 1228 HB2 LYS 28 HB2 LYS 28 -1.402 20.723 -1.756 1229 HB3 LYS 28 HB3 LYS 28 -1.499 22.453 -2.061 1230 HG2 LYS 28 HG2 LYS 28 -3.437 20.430 -3.161 1231 HG3 LYS 28 HG3 LYS 28 -3.693 21.361 -1.683 1232 HD2 LYS 28 HD2 LYS 28 -2.988 22.885 -4.123 1233 HD3 LYS 28 HD3 LYS 28 -4.592 22.150 -4.077 1234 HE2 LYS 28 HE2 LYS 28 -5.089 24.132 -3.080 1235 HE3 LYS 28 HE3 LYS 28 -4.591 23.229 -1.650 1236 HZ1 LYS 28 HZ1 LYS 28 -3.608 25.594 -2.225 1237 HZ2 LYS 28 HZ2 LYS 28 -2.680 24.406 -1.457 1238 HZ3 LYS 28 HZ3 LYS 28 -2.516 24.663 -3.121 1239 H LYS 29 H LYS 29 -0.743 23.807 -3.520 1240 HA LYS 29 HA LYS 29 2.040 24.035 -4.230 1241 HB2 LYS 29 HB2 LYS 29 1.707 26.440 -3.898 1242 HB3 LYS 29 HB3 LYS 29 0.443 25.759 -4.913 1243 HG2 LYS 29 HG2 LYS 29 -1.186 26.112 -3.368 1244 HG3 LYS 29 HG3 LYS 29 -0.083 25.936 -2.001 1245 HD2 LYS 29 HD2 LYS 29 -0.653 28.214 -2.026 1246 HD3 LYS 29 HD3 LYS 29 0.948 28.142 -2.766 1247 HE2 LYS 29 HE2 LYS 29 -0.279 28.036 -5.000 1248 HE3 LYS 29 HE3 LYS 29 -1.718 28.516 -4.103 1249 HZ1 LYS 29 HZ1 LYS 29 -0.046 30.362 -3.254 1250 HZ2 LYS 29 HZ2 LYS 29 0.663 30.066 -4.762 1251 HZ3 LYS 29 HZ3 LYS 29 -0.955 30.553 -4.669 1252 H GLY 30 H GLY 30 3.182 25.843 -2.672 1253 HA2 GLY 30 HA2 GLY 30 4.211 26.221 -0.651 1254 HA3 GLY 30 HA3 GLY 30 2.805 25.503 0.120 1255 H GLU 31 H GLU 31 6.075 25.146 -0.528 1256 HA GLU 31 HA GLU 31 6.258 22.719 0.921 1257 HB2 GLU 31 HB2 GLU 31 7.199 21.305 -0.888 1258 HB3 GLU 31 HB3 GLU 31 5.499 21.685 -1.125 1259 HG2 GLU 31 HG2 GLU 31 6.113 23.424 -2.731 1260 HG3 GLU 31 HG3 GLU 31 7.815 23.027 -2.501 1261 H1 TYR 1 H TYR 1 3.590 12.385 -2.763 1262 HA TYR 1 HA TYR 1 5.400 13.064 -4.896 1263 HB2 TYR 1 HB2 TYR 1 3.318 10.898 -4.590 1264 HB3 TYR 1 HB3 TYR 1 4.314 11.081 -6.029 1265 HD1 TYR 1 HD1 TYR 1 4.580 10.643 -2.336 1266 HD2 TYR 1 HD2 TYR 1 6.382 10.022 -6.140 1267 HE1 TYR 1 HE1 TYR 1 6.348 9.305 -1.273 1268 HE2 TYR 1 HE2 TYR 1 8.155 8.680 -5.087 1269 HH TYR 1 HH TYR 1 9.095 8.088 -3.124 1270 H GLY 2 H GLY 2 4.339 12.779 -7.224 1271 HA2 GLY 2 HA2 GLY 2 2.436 14.981 -7.426 1272 HA3 GLY 2 HA3 GLY 2 3.354 14.275 -8.747 1273 H GLY 3 H GLY 3 2.459 12.682 -9.971 1274 HA2 GLY 3 HA2 GLY 3 -0.362 12.372 -9.886 1275 HA3 GLY 3 HA3 GLY 3 0.743 11.489 -10.929 1276 H PHE 4 H PHE 4 0.290 9.398 -10.716 1277 HA PHE 4 HA PHE 4 -0.659 8.293 -8.235 1278 HB2 PHE 4 HB2 PHE 4 -0.163 7.235 -10.988 1279 HB3 PHE 4 HB3 PHE 4 -0.324 6.098 -9.654 1280 HD1 PHE 4 HD1 PHE 4 -2.400 5.159 -9.494 1281 HD2 PHE 4 HD2 PHE 4 -2.073 9.212 -10.752 1282 HE1 PHE 4 HE1 PHE 4 -4.850 5.297 -9.672 1283 HE2 PHE 4 HE2 PHE 4 -4.522 9.357 -10.931 1284 HZ PHE 4 HZ PHE 4 -5.914 7.399 -10.390 1285 H MET 5 H MET 5 0.354 6.500 -7.129 1286 HA MET 5 HA MET 5 3.285 6.459 -7.410 1287 HB2 MET 5 HB2 MET 5 2.720 7.786 -5.456 1288 HB3 MET 5 HB3 MET 5 1.681 6.503 -4.849 1289 HG2 MET 5 HG2 MET 5 3.747 6.488 -3.639 1290 HG3 MET 5 HG3 MET 5 3.652 5.043 -4.642 1291 HE1 MET 5 HE1 MET 5 7.465 5.639 -4.793 1292 HE2 MET 5 HE2 MET 5 6.397 5.794 -3.398 1293 HE3 MET 5 HE3 MET 5 6.166 4.472 -4.542 1294 H THR 6 H THR 6 3.876 4.503 -8.059 1295 HA THR 6 HA THR 6 2.305 2.174 -7.201 1296 HB THR 6 HB THR 6 4.236 2.528 -9.496 1297 HG1 THR 6 HG1 THR 6 1.441 1.980 -9.348 1298 HG21 THR 6 HG21 THR 6 3.688 0.197 -10.097 1299 HG22 THR 6 HG22 THR 6 4.556 0.306 -8.565 1300 HG23 THR 6 HG23 THR 6 2.814 0.028 -8.574 1301 H SER 7 H SER 7 3.105 1.476 -5.299 1302 HA SER 7 HA SER 7 6.015 1.232 -4.999 1303 HB2 SER 7 HB2 SER 7 4.341 2.352 -3.265 1304 HB3 SER 7 HB3 SER 7 4.148 0.681 -2.735 1305 HG SER 7 HG SER 7 6.068 2.312 -2.075 1306 H GLU 8 H GLU 8 6.429 -0.645 -6.130 1307 HA GLU 8 HA GLU 8 5.100 -3.084 -5.152 1308 HB2 GLU 8 HB2 GLU 8 6.113 -2.251 -7.814 1309 HB3 GLU 8 HB3 GLU 8 6.332 -3.941 -7.380 1310 HG2 GLU 8 HG2 GLU 8 4.087 -4.377 -7.368 1311 HG3 GLU 8 HG3 GLU 8 3.653 -2.707 -7.007 1312 H LYS 9 H LYS 9 6.254 -4.419 -3.939 1313 HA LYS 9 HA LYS 9 9.192 -4.210 -4.027 1314 HB2 LYS 9 HB2 LYS 9 8.180 -3.522 -1.880 1315 HB3 LYS 9 HB3 LYS 9 7.437 -5.109 -1.734 1316 HG2 LYS 9 HG2 LYS 9 9.687 -6.123 -1.699 1317 HG3 LYS 9 HG3 LYS 9 10.386 -4.503 -1.741 1318 HD2 LYS 9 HD2 LYS 9 9.731 -4.018 0.409 1319 HD3 LYS 9 HD3 LYS 9 8.376 -5.148 0.364 1320 HE2 LYS 9 HE2 LYS 9 9.784 -7.007 0.686 1321 HE3 LYS 9 HE3 LYS 9 11.233 -6.077 0.305 1322 HZ1 LYS 9 HZ1 LYS 9 10.288 -4.728 2.405 1323 HZ2 LYS 9 HZ2 LYS 9 9.777 -6.292 2.800 1324 HZ3 LYS 9 HZ3 LYS 9 11.418 -5.982 2.525 1325 H SER 10 H SER 10 9.962 -5.820 -5.238 1326 HA SER 10 HA SER 10 9.457 -8.545 -4.453 1327 HB2 SER 10 HB2 SER 10 8.729 -9.303 -6.690 1328 HB3 SER 10 HB3 SER 10 7.569 -8.187 -5.969 1329 HG SER 10 HG SER 10 8.067 -7.738 -8.195 1330 H GLN 11 H GLN 11 11.132 -9.882 -4.964 1331 HA GLN 11 HA GLN 11 13.489 -8.609 -6.092 1332 HB2 GLN 11 HB2 GLN 11 14.664 -10.648 -5.324 1333 HB3 GLN 11 HB3 GLN 11 13.782 -9.846 -4.032 1334 HG2 GLN 11 HG2 GLN 11 12.160 -11.502 -3.937 1335 HG3 GLN 11 HG3 GLN 11 12.545 -12.106 -5.547 1336 HE21 GLN 11 HE21 GLN 11 12.455 -14.131 -4.183 1337 HE22 GLN 11 HE22 GLN 11 13.945 -14.665 -3.493 1338 H THR 12 H THR 12 11.612 -8.926 -8.036 1339 HA THR 12 HA THR 12 12.986 -10.681 -9.874 1340 HB THR 12 HB THR 12 10.440 -11.450 -10.498 1341 HG1 THR 12 HG1 THR 12 10.612 -11.696 -7.673 1342 HG21 THR 12 HG21 THR 12 11.585 -13.315 -8.615 1343 HG22 THR 12 HG22 THR 12 11.424 -13.448 -10.366 1344 HG23 THR 12 HG23 THR 12 12.830 -12.643 -9.669 1345 HA PRO 13 HA PRO 13 11.758 -7.735 -12.885 1346 HB2 PRO 13 HB2 PRO 13 11.217 -9.256 -15.068 1347 HB3 PRO 13 HB3 PRO 13 12.857 -8.996 -14.461 1348 HG2 PRO 13 HG2 PRO 13 11.034 -11.334 -14.050 1349 HG3 PRO 13 HG3 PRO 13 12.770 -11.319 -14.411 1350 HD2 PRO 13 HD2 PRO 13 11.804 -11.716 -11.913 1351 HD3 PRO 13 HD3 PRO 13 13.349 -10.897 -12.220 1352 H LEU 14 H LEU 14 9.866 -6.783 -12.220 1353 HA LEU 14 HA LEU 14 7.351 -8.110 -12.980 1354 HB2 LEU 14 HB2 LEU 14 6.251 -6.904 -11.293 1355 HB3 LEU 14 HB3 LEU 14 7.749 -7.483 -10.568 1356 HG LEU 14 HG LEU 14 7.535 -4.701 -11.672 1357 HD11 LEU 14 HD11 LEU 14 7.164 -5.078 -8.774 1358 HD12 LEU 14 HD12 LEU 14 6.461 -3.886 -9.867 1359 HD13 LEU 14 HD13 LEU 14 5.791 -5.516 -9.791 1360 HD21 LEU 14 HD21 LEU 14 9.746 -5.135 -11.206 1361 HD22 LEU 14 HD22 LEU 14 9.197 -4.459 -9.672 1362 HD23 LEU 14 HD23 LEU 14 9.365 -6.205 -9.856 1363 H VAL 15 H VAL 15 5.691 -5.877 -12.903 1364 HA VAL 15 HA VAL 15 6.686 -3.788 -14.589 1365 HB VAL 15 HB VAL 15 6.476 -5.438 -16.328 1366 HG11 VAL 15 HG11 VAL 15 3.764 -6.029 -16.524 1367 HG12 VAL 15 HG12 VAL 15 5.055 -7.126 -16.033 1368 HG13 VAL 15 HG13 VAL 15 4.147 -6.232 -14.814 1369 HG21 VAL 15 HG21 VAL 15 5.427 -2.994 -16.468 1370 HG22 VAL 15 HG22 VAL 15 5.369 -4.125 -17.819 1371 HG23 VAL 15 HG23 VAL 15 3.963 -3.929 -16.772 1372 H THR 16 H THR 16 5.432 -2.008 -14.439 1373 HA THR 16 HA THR 16 3.071 -2.183 -12.747 1374 HB THR 16 HB THR 16 4.574 -0.442 -12.123 1375 HG1 THR 16 HG1 THR 16 2.552 0.920 -13.578 1376 HG21 THR 16 HG21 THR 16 5.944 0.379 -13.688 1377 HG22 THR 16 HG22 THR 16 4.868 -0.123 -14.992 1378 HG23 THR 16 HG23 THR 16 4.611 1.422 -14.182 1379 H LEU 17 H LEU 17 1.097 -2.322 -13.568 1380 HA LEU 17 HA LEU 17 0.642 -1.750 -16.378 1381 HB2 LEU 17 HB2 LEU 17 -0.689 -3.290 -14.268 1382 HB3 LEU 17 HB3 LEU 17 -1.788 -2.460 -15.367 1383 HG LEU 17 HG LEU 17 0.381 -4.349 -16.270 1384 HD11 LEU 17 HD11 LEU 17 -2.200 -5.422 -16.683 1385 HD12 LEU 17 HD12 LEU 17 -0.903 -6.049 -15.666 1386 HD13 LEU 17 HD13 LEU 17 -2.093 -4.937 -14.990 1387 HD21 LEU 17 HD21 LEU 17 -0.941 -4.363 -18.356 1388 HD22 LEU 17 HD22 LEU 17 -1.991 -3.122 -17.672 1389 HD23 LEU 17 HD23 LEU 17 -0.288 -2.771 -17.971 1390 H PHE 18 H PHE 18 0.660 0.463 -16.587 1391 HA PHE 18 HA PHE 18 -1.359 1.950 -15.044 1392 HB2 PHE 18 HB2 PHE 18 1.359 2.600 -15.950 1393 HB3 PHE 18 HB3 PHE 18 0.179 3.871 -16.254 1394 HD1 PHE 18 HD1 PHE 18 -1.557 3.926 -14.035 1395 HD2 PHE 18 HD2 PHE 18 2.611 3.064 -14.093 1396 HE1 PHE 18 HE1 PHE 18 -1.377 4.653 -11.691 1397 HE2 PHE 18 HE2 PHE 18 2.797 3.789 -11.749 1398 HZ PHE 18 HZ PHE 18 0.802 4.584 -10.545 1399 H LYS 19 H LYS 19 -3.191 2.047 -16.176 1400 HA LYS 19 HA LYS 19 -3.017 2.716 -19.042 1401 HB2 LYS 19 HB2 LYS 19 -5.325 1.310 -17.699 1402 HB3 LYS 19 HB3 LYS 19 -5.046 1.508 -19.424 1403 HG2 LYS 19 HG2 LYS 19 -2.849 0.172 -18.898 1404 HG3 LYS 19 HG3 LYS 19 -3.778 -0.369 -17.498 1405 HD2 LYS 19 HD2 LYS 19 -5.009 -0.468 -20.219 1406 HD3 LYS 19 HD3 LYS 19 -3.862 -1.719 -19.734 1407 HE2 LYS 19 HE2 LYS 19 -5.252 -2.552 -18.108 1408 HE3 LYS 19 HE3 LYS 19 -6.081 -1.014 -17.877 1409 HZ1 LYS 19 HZ1 LYS 19 -7.592 -1.518 -19.420 1410 HZ2 LYS 19 HZ2 LYS 19 -6.448 -2.148 -20.497 1411 HZ3 LYS 19 HZ3 LYS 19 -7.063 -3.117 -19.254 1412 H ASN 20 H ASN 20 -4.648 4.124 -19.893 1413 HA ASN 20 HA ASN 20 -5.765 6.111 -19.880 1414 HB2 ASN 20 HB2 ASN 20 -7.037 4.596 -17.615 1415 HB3 ASN 20 HB3 ASN 20 -7.573 6.224 -18.022 1416 HD21 ASN 20 HD21 ASN 20 -8.408 3.177 -18.387 1417 HD22 ASN 20 HD22 ASN 20 -9.141 3.212 -19.951 1418 H ALA 21 H ALA 21 -3.226 6.119 -18.569 1419 HA ALA 21 HA ALA 21 -3.306 7.489 -16.096 1420 HB1 ALA 21 HB1 ALA 21 -0.926 8.140 -16.745 1421 HB2 ALA 21 HB2 ALA 21 -1.285 6.418 -16.611 1422 HB3 ALA 21 HB3 ALA 21 -1.187 7.177 -18.200 1423 H ILE 22 H ILE 22 -4.331 9.377 -15.875 1424 HA ILE 22 HA ILE 22 -3.836 11.466 -17.895 1425 HB ILE 22 HB ILE 22 -6.270 11.132 -16.139 1426 HG12 ILE 22 HG12 ILE 22 -6.228 11.052 -19.142 1427 HG13 ILE 22 HG13 ILE 22 -5.884 9.602 -18.205 1428 HG21 ILE 22 HG21 ILE 22 -6.987 12.977 -17.950 1429 HG22 ILE 22 HG22 ILE 22 -6.305 13.379 -16.374 1430 HG23 ILE 22 HG23 ILE 22 -5.270 13.355 -17.801 1431 HD11 ILE 22 HD11 ILE 22 -8.407 10.836 -18.827 1432 HD12 ILE 22 HD12 ILE 22 -8.065 9.238 -18.164 1433 HD13 ILE 22 HD13 ILE 22 -8.208 10.628 -17.087 1434 H ILE 23 H ILE 23 -2.486 12.958 -17.160 1435 HA ILE 23 HA ILE 23 -2.388 13.513 -14.281 1436 HB ILE 23 HB ILE 23 -0.443 14.068 -16.511 1437 HG12 ILE 23 HG12 ILE 23 -0.446 11.814 -15.473 1438 HG13 ILE 23 HG13 ILE 23 1.058 12.685 -15.191 1439 HG21 ILE 23 HG21 ILE 23 -0.205 16.034 -15.328 1440 HG22 ILE 23 HG22 ILE 23 -0.613 15.279 -13.787 1441 HG23 ILE 23 HG23 ILE 23 0.964 14.988 -14.522 1442 HD11 ILE 23 HD11 ILE 23 0.212 13.297 -12.944 1443 HD12 ILE 23 HD12 ILE 23 -1.192 12.272 -13.241 1444 HD13 ILE 23 HD13 ILE 23 0.422 11.563 -13.183 1445 H LYS 24 H LYS 24 -3.906 15.001 -13.807 1446 HA LYS 24 HA LYS 24 -4.032 17.427 -15.470 1447 HB2 LYS 24 HB2 LYS 24 -6.053 15.857 -14.007 1448 HB3 LYS 24 HB3 LYS 24 -6.205 17.600 -13.833 1449 HG2 LYS 24 HG2 LYS 24 -5.932 17.528 -16.460 1450 HG3 LYS 24 HG3 LYS 24 -6.553 15.891 -16.233 1451 HD2 LYS 24 HD2 LYS 24 -7.927 18.201 -14.922 1452 HD3 LYS 24 HD3 LYS 24 -8.206 17.869 -16.633 1453 HE2 LYS 24 HE2 LYS 24 -8.579 15.416 -15.737 1454 HE3 LYS 24 HE3 LYS 24 -8.938 16.264 -14.234 1455 HZ1 LYS 24 HZ1 LYS 24 -10.902 16.903 -15.015 1456 HZ2 LYS 24 HZ2 LYS 24 -10.247 17.455 -16.474 1457 HZ3 LYS 24 HZ3 LYS 24 -10.672 15.827 -16.300 1458 H ASN 25 H ASN 25 -2.402 18.637 -14.567 1459 HA ASN 25 HA ASN 25 -1.376 20.035 -13.096 1460 HB2 ASN 25 HB2 ASN 25 -3.889 20.063 -11.445 1461 HB3 ASN 25 HB3 ASN 25 -2.742 21.369 -11.732 1462 HD21 ASN 25 HD21 ASN 25 -3.108 22.750 -13.348 1463 HD22 ASN 25 HD22 ASN 25 -4.384 22.606 -14.504 1464 H ALA 26 H ALA 26 -0.894 17.341 -12.682 1465 HA ALA 26 HA ALA 26 -1.308 16.319 -10.142 1466 HB1 ALA 26 HB1 ALA 26 1.008 15.974 -12.032 1467 HB2 ALA 26 HB2 ALA 26 0.840 15.060 -10.533 1468 HB3 ALA 26 HB3 ALA 26 -0.377 14.907 -11.801 1469 H TYR 27 H TYR 27 1.077 18.655 -11.251 1470 HA TYR 27 HA TYR 27 1.982 18.970 -8.464 1471 HB2 TYR 27 HB2 TYR 27 3.614 18.228 -10.399 1472 HB3 TYR 27 HB3 TYR 27 3.621 19.949 -10.766 1473 HD1 TYR 27 HD1 TYR 27 5.175 21.302 -9.712 1474 HD2 TYR 27 HD2 TYR 27 4.071 17.625 -7.876 1475 HE1 TYR 27 HE1 TYR 27 6.870 21.670 -7.969 1476 HE2 TYR 27 HE2 TYR 27 5.763 17.984 -6.127 1477 HH TYR 27 HH TYR 27 8.212 20.247 -6.377 1478 H LYS 28 H LYS 28 1.458 20.815 -7.513 1479 HA LYS 28 HA LYS 28 0.310 22.971 -9.078 1480 HB2 LYS 28 HB2 LYS 28 0.404 22.237 -6.195 1481 HB3 LYS 28 HB3 LYS 28 0.189 23.937 -6.594 1482 HG2 LYS 28 HG2 LYS 28 -1.556 21.720 -7.643 1483 HG3 LYS 28 HG3 LYS 28 -1.930 22.700 -6.223 1484 HD2 LYS 28 HD2 LYS 28 -1.260 24.150 -8.718 1485 HD3 LYS 28 HD3 LYS 28 -2.808 23.303 -8.676 1486 HE2 LYS 28 HE2 LYS 28 -3.476 25.290 -7.797 1487 HE3 LYS 28 HE3 LYS 28 -2.956 24.500 -6.309 1488 HZ1 LYS 28 HZ1 LYS 28 -2.131 26.899 -6.983 1489 HZ2 LYS 28 HZ2 LYS 28 -1.142 25.823 -6.130 1490 HZ3 LYS 28 HZ3 LYS 28 -0.948 26.007 -7.801 1491 H LYS 29 H LYS 29 0.899 25.266 -8.087 1492 HA LYS 29 HA LYS 29 3.680 25.661 -8.729 1493 HB2 LYS 29 HB2 LYS 29 3.167 28.049 -8.524 1494 HB3 LYS 29 HB3 LYS 29 1.992 27.231 -9.545 1495 HG2 LYS 29 HG2 LYS 29 0.287 27.540 -8.076 1496 HG3 LYS 29 HG3 LYS 29 1.348 27.500 -6.665 1497 HD2 LYS 29 HD2 LYS 29 0.627 29.730 -6.811 1498 HD3 LYS 29 HD3 LYS 29 2.253 29.739 -7.498 1499 HE2 LYS 29 HE2 LYS 29 1.110 29.450 -9.761 1500 HE3 LYS 29 HE3 LYS 29 -0.387 29.866 -8.929 1501 HZ1 LYS 29 HZ1 LYS 29 1.125 31.861 -8.117 1502 HZ2 LYS 29 HZ2 LYS 29 1.903 31.549 -9.587 1503 HZ3 LYS 29 HZ3 LYS 29 0.253 31.926 -9.565 1504 H GLY 30 H GLY 30 4.637 27.623 -7.230 1505 HA2 GLY 30 HA2 GLY 30 5.576 28.167 -5.203 1506 HA3 GLY 30 HA3 GLY 30 4.195 27.395 -4.438 1507 H GLU 31 H GLU 31 7.499 27.238 -4.934 1508 HA GLU 31 HA GLU 31 7.788 24.896 -3.371 1509 HB2 GLU 31 HB2 GLU 31 8.903 23.476 -5.077 1510 HB3 GLU 31 HB3 GLU 31 7.188 23.713 -5.385 1511 HG2 GLU 31 HG2 GLU 31 7.726 25.420 -7.052 1512 HG3 GLU 31 HG3 GLU 31 9.444 25.163 -6.752 Start of MODEL 4 1 H1 TYR 1 H TYR 1 -9.472 2.179 14.604 2 HA TYR 1 HA TYR 1 -7.171 3.824 15.431 3 HB2 TYR 1 HB2 TYR 1 -7.418 1.684 13.331 4 HB3 TYR 1 HB3 TYR 1 -6.139 2.891 13.257 5 HD1 TYR 1 HD1 TYR 1 -6.480 -0.335 13.951 6 HD2 TYR 1 HD2 TYR 1 -5.278 3.201 15.989 7 HE1 TYR 1 HE1 TYR 1 -5.120 -1.690 15.488 8 HE2 TYR 1 HE2 TYR 1 -3.914 1.855 17.531 9 HH TYR 1 HH TYR 1 -2.766 -0.781 17.151 10 H GLY 2 H GLY 2 -9.658 3.304 12.988 11 HA2 GLY 2 HA2 GLY 2 -9.844 6.085 12.415 12 HA3 GLY 2 HA3 GLY 2 -8.982 5.246 11.134 13 H GLY 3 H GLY 3 -11.868 6.459 11.805 14 HA2 GLY 3 HA2 GLY 3 -14.020 6.065 11.100 15 HA3 GLY 3 HA3 GLY 3 -13.251 5.252 9.745 16 H PHE 4 H PHE 4 -14.273 3.387 9.438 17 HA PHE 4 HA PHE 4 -15.448 1.922 11.619 18 HB2 PHE 4 HB2 PHE 4 -15.296 1.526 8.647 19 HB3 PHE 4 HB3 PHE 4 -15.859 0.224 9.689 20 HD1 PHE 4 HD1 PHE 4 -18.069 0.156 10.404 21 HD2 PHE 4 HD2 PHE 4 -16.495 3.771 8.802 22 HE1 PHE 4 HE1 PHE 4 -20.325 1.139 10.416 23 HE2 PHE 4 HE2 PHE 4 -18.747 4.760 8.812 24 HZ PHE 4 HZ PHE 4 -20.666 3.445 9.620 25 H MET 5 H MET 5 -14.819 -0.054 12.440 26 HA MET 5 HA MET 5 -12.030 -0.789 11.895 27 HB2 MET 5 HB2 MET 5 -12.970 -0.198 14.260 28 HB3 MET 5 HB3 MET 5 -13.612 -1.835 14.218 29 HG2 MET 5 HG2 MET 5 -11.559 -1.981 15.339 30 HG3 MET 5 HG3 MET 5 -11.265 -2.609 13.720 31 HE1 MET 5 HE1 MET 5 -8.078 -1.685 13.972 32 HE2 MET 5 HE2 MET 5 -8.282 -0.840 15.507 33 HE3 MET 5 HE3 MET 5 -9.136 -2.355 15.214 34 H THR 6 H THR 6 -12.092 -2.201 10.220 35 HA THR 6 HA THR 6 -14.004 -4.414 10.290 36 HB THR 6 HB THR 6 -12.038 -4.124 8.068 37 HG1 THR 6 HG1 THR 6 -12.749 -2.209 7.546 38 HG21 THR 6 HG21 THR 6 -14.838 -4.449 7.401 39 HG22 THR 6 HG22 THR 6 -13.464 -5.486 7.018 40 HG23 THR 6 HG23 THR 6 -14.301 -5.665 8.560 41 H SER 7 H SER 7 -13.074 -5.630 11.978 42 HA SER 7 HA SER 7 -10.400 -6.730 11.463 43 HB2 SER 7 HB2 SER 7 -11.267 -5.681 13.752 44 HB3 SER 7 HB3 SER 7 -11.871 -7.321 13.990 45 HG SER 7 HG SER 7 -9.757 -8.082 13.698 46 H GLU 8 H GLU 8 -10.651 -8.401 10.078 47 HA GLU 8 HA GLU 8 -12.609 -10.480 10.802 48 HB2 GLU 8 HB2 GLU 8 -11.580 -9.530 8.151 49 HB3 GLU 8 HB3 GLU 8 -12.178 -11.174 8.320 50 HG2 GLU 8 HG2 GLU 8 -13.930 -9.758 7.491 51 HG3 GLU 8 HG3 GLU 8 -14.326 -10.291 9.124 52 H LYS 9 H LYS 9 -11.620 -12.057 11.878 53 HA LYS 9 HA LYS 9 -8.895 -12.827 11.099 54 HB2 LYS 9 HB2 LYS 9 -9.050 -12.295 13.428 55 HB3 LYS 9 HB3 LYS 9 -10.482 -13.296 13.623 56 HG2 LYS 9 HG2 LYS 9 -9.196 -15.297 13.296 57 HG3 LYS 9 HG3 LYS 9 -7.755 -14.353 12.912 58 HD2 LYS 9 HD2 LYS 9 -7.538 -13.588 15.127 59 HD3 LYS 9 HD3 LYS 9 -9.180 -14.083 15.545 60 HE2 LYS 9 HE2 LYS 9 -8.605 -16.335 15.648 61 HE3 LYS 9 HE3 LYS 9 -7.150 -16.107 14.679 62 HZ1 LYS 9 HZ1 LYS 9 -6.048 -16.027 16.587 63 HZ2 LYS 9 HZ2 LYS 9 -6.789 -14.539 16.904 64 HZ3 LYS 9 HZ3 LYS 9 -7.470 -15.968 17.502 65 H SER 10 H SER 10 -8.932 -14.359 9.577 66 HA SER 10 HA SER 10 -10.113 -16.909 10.171 67 HB2 SER 10 HB2 SER 10 -11.078 -15.525 7.665 68 HB3 SER 10 HB3 SER 10 -11.627 -17.064 8.328 69 HG SER 10 HG SER 10 -12.987 -16.005 9.512 70 H GLN 11 H GLN 11 -9.091 -18.554 9.120 71 HA GLN 11 HA GLN 11 -6.738 -17.832 7.585 72 HB2 GLN 11 HB2 GLN 11 -6.193 -20.250 7.760 73 HB3 GLN 11 HB3 GLN 11 -6.447 -19.480 9.321 74 HG2 GLN 11 HG2 GLN 11 -8.337 -20.657 9.755 75 HG3 GLN 11 HG3 GLN 11 -8.783 -20.784 8.054 76 HE21 GLN 11 HE21 GLN 11 -9.244 -23.017 8.671 77 HE22 GLN 11 HE22 GLN 11 -7.957 -24.168 8.648 78 H THR 12 H THR 12 -9.021 -17.223 6.182 79 HA THR 12 HA THR 12 -8.708 -18.948 3.864 80 HB THR 12 HB THR 12 -11.432 -18.616 3.803 81 HG1 THR 12 HG1 THR 12 -11.304 -17.978 6.069 82 HG21 THR 12 HG21 THR 12 -11.059 -21.124 4.955 83 HG22 THR 12 HG22 THR 12 -11.045 -20.741 3.233 84 HG23 THR 12 HG23 THR 12 -9.533 -20.777 4.140 85 HA PRO 13 HA PRO 13 -9.173 -15.230 1.580 86 HB2 PRO 13 HB2 PRO 13 -10.501 -16.058 -0.638 87 HB3 PRO 13 HB3 PRO 13 -8.809 -16.461 -0.325 88 HG2 PRO 13 HG2 PRO 13 -11.263 -18.117 0.118 89 HG3 PRO 13 HG3 PRO 13 -9.697 -18.597 -0.561 90 HD2 PRO 13 HD2 PRO 13 -10.394 -19.119 2.003 91 HD3 PRO 13 HD3 PRO 13 -8.717 -18.802 1.515 92 H LEU 14 H LEU 14 -10.484 -13.773 2.566 93 HA LEU 14 HA LEU 14 -13.391 -14.104 2.252 94 HB2 LEU 14 HB2 LEU 14 -13.703 -12.775 4.177 95 HB3 LEU 14 HB3 LEU 14 -12.443 -13.943 4.569 96 HG LEU 14 HG LEU 14 -11.750 -11.159 3.693 97 HD11 LEU 14 HD11 LEU 14 -11.524 -11.254 6.467 98 HD12 LEU 14 HD12 LEU 14 -12.678 -10.312 5.523 99 HD13 LEU 14 HD13 LEU 14 -13.121 -11.914 6.114 100 HD21 LEU 14 HD21 LEU 14 -9.815 -12.385 3.724 101 HD22 LEU 14 HD22 LEU 14 -9.855 -11.812 5.391 102 HD23 LEU 14 HD23 LEU 14 -10.379 -13.452 5.010 103 H VAL 15 H VAL 15 -14.052 -11.418 2.850 104 HA VAL 15 HA VAL 15 -12.722 -9.617 1.083 105 HB VAL 15 HB VAL 15 -13.828 -10.916 -0.640 106 HG11 VAL 15 HG11 VAL 15 -16.565 -10.310 -0.191 107 HG12 VAL 15 HG12 VAL 15 -15.790 -11.891 -0.288 108 HG13 VAL 15 HG13 VAL 15 -15.925 -11.069 1.267 109 HG21 VAL 15 HG21 VAL 15 -14.004 -8.182 -0.323 110 HG22 VAL 15 HG22 VAL 15 -14.306 -9.076 -1.813 111 HG23 VAL 15 HG23 VAL 15 -15.649 -8.651 -0.752 112 H THR 16 H THR 16 -13.148 -7.579 1.682 113 HA THR 16 HA THR 16 -15.143 -7.151 3.754 114 HB THR 16 HB THR 16 -12.993 -6.189 4.203 115 HG1 THR 16 HG1 THR 16 -14.009 -4.519 4.992 116 HG21 THR 16 HG21 THR 16 -13.041 -5.576 1.400 117 HG22 THR 16 HG22 THR 16 -12.723 -4.108 2.326 118 HG23 THR 16 HG23 THR 16 -11.685 -5.520 2.528 119 H LEU 17 H LEU 17 -17.155 -6.751 3.095 120 HA LEU 17 HA LEU 17 -17.668 -5.414 0.576 121 HB2 LEU 17 HB2 LEU 17 -18.968 -7.390 1.721 122 HB3 LEU 17 HB3 LEU 17 -19.813 -6.076 2.537 123 HG LEU 17 HG LEU 17 -19.679 -6.508 -0.447 124 HD11 LEU 17 HD11 LEU 17 -22.295 -6.635 0.261 125 HD12 LEU 17 HD12 LEU 17 -21.250 -8.036 0.029 126 HD13 LEU 17 HD13 LEU 17 -21.525 -7.400 1.651 127 HD21 LEU 17 HD21 LEU 17 -21.502 -4.734 -0.381 128 HD22 LEU 17 HD22 LEU 17 -20.942 -4.376 1.252 129 HD23 LEU 17 HD23 LEU 17 -19.847 -4.187 -0.117 130 H PHE 18 H PHE 18 -17.117 -3.288 0.749 131 HA PHE 18 HA PHE 18 -18.502 -1.730 2.831 132 HB2 PHE 18 HB2 PHE 18 -15.754 -1.580 1.741 133 HB3 PHE 18 HB3 PHE 18 -16.557 -0.038 2.018 134 HD1 PHE 18 HD1 PHE 18 -17.934 -0.119 4.399 135 HD2 PHE 18 HD2 PHE 18 -14.366 -2.229 3.434 136 HE1 PHE 18 HE1 PHE 18 -17.371 -0.254 6.790 137 HE2 PHE 18 HE2 PHE 18 -13.798 -2.368 5.823 138 HZ PHE 18 HZ PHE 18 -15.301 -1.380 7.505 139 H LYS 19 H LYS 19 -20.261 -0.858 1.943 140 HA LYS 19 HA LYS 19 -19.999 0.398 -0.711 141 HB2 LYS 19 HB2 LYS 19 -22.435 0.024 -0.975 142 HB3 LYS 19 HB3 LYS 19 -21.527 -1.475 -0.823 143 HG2 LYS 19 HG2 LYS 19 -22.143 -1.446 1.629 144 HG3 LYS 19 HG3 LYS 19 -23.272 -0.149 1.230 145 HD2 LYS 19 HD2 LYS 19 -23.312 -2.720 -0.305 146 HD3 LYS 19 HD3 LYS 19 -24.116 -2.602 1.263 147 HE2 LYS 19 HE2 LYS 19 -25.799 -2.085 -0.265 148 HE3 LYS 19 HE3 LYS 19 -25.245 -0.508 0.298 149 HZ1 LYS 19 HZ1 LYS 19 -24.630 0.045 -1.747 150 HZ2 LYS 19 HZ2 LYS 19 -23.768 -1.393 -1.972 151 HZ3 LYS 19 HZ3 LYS 19 -25.426 -1.339 -2.306 152 H ASN 20 H ASN 20 -20.911 2.429 -1.029 153 HA ASN 20 HA ASN 20 -21.407 4.575 -0.455 154 HB2 ASN 20 HB2 ASN 20 -23.215 2.966 1.320 155 HB3 ASN 20 HB3 ASN 20 -23.186 4.722 1.450 156 HD21 ASN 20 HD21 ASN 20 -25.368 4.741 0.776 157 HD22 ASN 20 HD22 ASN 20 -25.784 4.553 -0.890 158 H ALA 21 H ALA 21 -19.070 3.431 0.746 159 HA ALA 21 HA ALA 21 -18.905 4.142 3.498 160 HB1 ALA 21 HB1 ALA 21 -16.316 4.165 2.617 161 HB2 ALA 21 HB2 ALA 21 -17.195 2.737 3.166 162 HB3 ALA 21 HB3 ALA 21 -17.102 3.107 1.444 163 H ILE 22 H ILE 22 -18.942 6.138 4.275 164 HA ILE 22 HA ILE 22 -17.694 8.288 2.692 165 HB ILE 22 HB ILE 22 -20.091 8.533 4.514 166 HG12 ILE 22 HG12 ILE 22 -19.925 8.873 1.513 167 HG13 ILE 22 HG13 ILE 22 -20.505 7.414 2.309 168 HG21 ILE 22 HG21 ILE 22 -18.709 10.521 4.593 169 HG22 ILE 22 HG22 ILE 22 -18.672 10.594 2.832 170 HG23 ILE 22 HG23 ILE 22 -20.190 10.852 3.693 171 HD11 ILE 22 HD11 ILE 22 -21.894 9.682 3.348 172 HD12 ILE 22 HD12 ILE 22 -21.971 9.688 1.586 173 HD13 ILE 22 HD13 ILE 22 -22.528 8.279 2.488 174 H ILE 23 H ILE 23 -15.892 8.963 3.632 175 HA ILE 23 HA ILE 23 -15.603 8.730 6.537 176 HB ILE 23 HB ILE 23 -13.610 9.130 4.320 177 HG12 ILE 23 HG12 ILE 23 -14.357 6.830 4.814 178 HG13 ILE 23 HG13 ILE 23 -12.654 7.059 5.195 179 HG21 ILE 23 HG21 ILE 23 -13.210 9.472 7.281 180 HG22 ILE 23 HG22 ILE 23 -11.886 9.151 6.161 181 HG23 ILE 23 HG23 ILE 23 -12.846 10.620 5.993 182 HD11 ILE 23 HD11 ILE 23 -13.374 7.432 7.582 183 HD12 ILE 23 HD12 ILE 23 -14.967 6.856 7.092 184 HD13 ILE 23 HD13 ILE 23 -13.565 5.796 6.953 185 H LYS 24 H LYS 24 -16.279 10.452 7.633 186 HA LYS 24 HA LYS 24 -15.626 13.125 6.577 187 HB2 LYS 24 HB2 LYS 24 -18.054 12.046 7.898 188 HB3 LYS 24 HB3 LYS 24 -17.574 13.678 8.344 189 HG2 LYS 24 HG2 LYS 24 -17.492 14.155 5.840 190 HG3 LYS 24 HG3 LYS 24 -18.369 12.634 5.649 191 HD2 LYS 24 HD2 LYS 24 -20.176 13.457 7.027 192 HD3 LYS 24 HD3 LYS 24 -19.281 14.940 7.370 193 HE2 LYS 24 HE2 LYS 24 -19.349 15.513 4.982 194 HE3 LYS 24 HE3 LYS 24 -20.269 14.044 4.663 195 HZ1 LYS 24 HZ1 LYS 24 -21.143 16.561 5.788 196 HZ2 LYS 24 HZ2 LYS 24 -22.018 15.397 4.927 197 HZ3 LYS 24 HZ3 LYS 24 -21.738 15.192 6.583 198 H ASN 25 H ASN 25 -13.798 13.708 7.597 199 HA ASN 25 HA ASN 25 -12.309 14.181 9.254 200 HB2 ASN 25 HB2 ASN 25 -14.963 14.706 10.570 201 HB3 ASN 25 HB3 ASN 25 -13.456 14.939 11.452 202 HD21 ASN 25 HD21 ASN 25 -12.893 16.979 11.497 203 HD22 ASN 25 HD22 ASN 25 -13.068 18.119 10.210 204 H ALA 26 H ALA 26 -12.358 11.558 8.920 205 HA ALA 26 HA ALA 26 -13.028 10.095 11.291 206 HB1 ALA 26 HB1 ALA 26 -11.794 8.237 10.165 207 HB2 ALA 26 HB2 ALA 26 -13.099 8.935 9.205 208 HB3 ALA 26 HB3 ALA 26 -11.422 9.354 8.852 209 H TYR 27 H TYR 27 -9.850 10.467 9.715 210 HA TYR 27 HA TYR 27 -8.546 10.110 12.287 211 HB2 TYR 27 HB2 TYR 27 -7.833 9.072 10.006 212 HB3 TYR 27 HB3 TYR 27 -7.097 10.644 9.713 213 HD1 TYR 27 HD1 TYR 27 -4.938 11.054 10.467 214 HD2 TYR 27 HD2 TYR 27 -7.176 7.895 12.232 215 HE1 TYR 27 HE1 TYR 27 -2.949 10.364 11.740 216 HE2 TYR 27 HE2 TYR 27 -5.194 7.197 13.510 217 HH TYR 27 HH TYR 27 -2.713 7.403 13.316 218 H LYS 28 H LYS 28 -8.937 12.003 13.404 219 HA LYS 28 HA LYS 28 -8.697 14.601 12.392 220 HB2 LYS 28 HB2 LYS 28 -8.400 13.510 15.190 221 HB3 LYS 28 HB3 LYS 28 -8.349 15.231 14.828 222 HG2 LYS 28 HG2 LYS 28 -10.635 14.715 13.637 223 HG3 LYS 28 HG3 LYS 28 -10.639 13.338 14.741 224 HD2 LYS 28 HD2 LYS 28 -11.685 14.884 16.058 225 HD3 LYS 28 HD3 LYS 28 -10.008 15.210 16.502 226 HE2 LYS 28 HE2 LYS 28 -11.341 16.674 14.249 227 HE3 LYS 28 HE3 LYS 28 -11.532 17.200 15.921 228 HZ1 LYS 28 HZ1 LYS 28 -9.712 18.400 15.334 229 HZ2 LYS 28 HZ2 LYS 28 -8.926 17.000 15.868 230 HZ3 LYS 28 HZ3 LYS 28 -9.159 17.260 14.212 231 H LYS 29 H LYS 29 -7.007 16.146 13.597 232 HA LYS 29 HA LYS 29 -4.425 15.329 12.569 233 HB2 LYS 29 HB2 LYS 29 -3.748 17.643 13.057 234 HB3 LYS 29 HB3 LYS 29 -5.219 17.583 12.095 235 HG2 LYS 29 HG2 LYS 29 -6.499 18.466 13.740 236 HG3 LYS 29 HG3 LYS 29 -5.549 17.724 15.030 237 HD2 LYS 29 HD2 LYS 29 -3.888 19.385 14.906 238 HD3 LYS 29 HD3 LYS 29 -4.463 19.959 13.339 239 HE2 LYS 29 HE2 LYS 29 -5.291 21.580 14.747 240 HE3 LYS 29 HE3 LYS 29 -6.658 20.471 14.655 241 HZ1 LYS 29 HZ1 LYS 29 -4.658 20.146 16.789 242 HZ2 LYS 29 HZ2 LYS 29 -5.859 21.328 16.943 243 HZ3 LYS 29 HZ3 LYS 29 -6.290 19.700 16.775 244 H GLY 30 H GLY 30 -4.808 13.630 14.523 245 HA2 GLY 30 HA2 GLY 30 -3.528 14.730 16.935 246 HA3 GLY 30 HA3 GLY 30 -4.436 13.227 16.861 247 H GLU 31 H GLU 31 -1.405 14.496 17.092 248 HA GLU 31 HA GLU 31 -0.191 11.928 16.528 249 HB2 GLU 31 HB2 GLU 31 0.467 14.415 14.968 250 HB3 GLU 31 HB3 GLU 31 1.645 13.127 15.177 251 HG2 GLU 31 HG2 GLU 31 -1.062 12.868 13.889 252 HG3 GLU 31 HG3 GLU 31 0.492 12.910 13.059 253 H1 TYR 1 H TYR 1 -6.726 3.965 10.790 254 HA TYR 1 HA TYR 1 -4.565 5.800 11.598 255 HB2 TYR 1 HB2 TYR 1 -4.619 3.565 9.584 256 HB3 TYR 1 HB3 TYR 1 -3.418 4.847 9.492 257 HD1 TYR 1 HD1 TYR 1 -3.586 1.635 10.321 258 HD2 TYR 1 HD2 TYR 1 -2.640 5.322 12.220 259 HE1 TYR 1 HE1 TYR 1 -2.186 0.431 11.946 260 HE2 TYR 1 HE2 TYR 1 -1.236 4.130 13.850 261 HH TYR 1 HH TYR 1 0.071 1.552 13.615 262 H GLY 2 H GLY 2 -6.940 5.014 9.112 263 HA2 GLY 2 HA2 GLY 2 -7.288 7.754 8.419 264 HA3 GLY 2 HA3 GLY 2 -6.346 6.916 7.195 265 H GLY 3 H GLY 3 -9.316 7.975 7.752 266 HA2 GLY 3 HA2 GLY 3 -11.422 7.419 7.017 267 HA3 GLY 3 HA3 GLY 3 -10.573 6.595 5.718 268 H PHE 4 H PHE 4 -11.479 4.661 5.477 269 HA PHE 4 HA PHE 4 -12.616 3.227 7.697 270 HB2 PHE 4 HB2 PHE 4 -12.371 2.718 4.749 271 HB3 PHE 4 HB3 PHE 4 -12.862 1.419 5.832 272 HD1 PHE 4 HD1 PHE 4 -15.070 1.240 6.556 273 HD2 PHE 4 HD2 PHE 4 -13.735 4.855 4.749 274 HE1 PHE 4 HE1 PHE 4 -17.390 2.059 6.488 275 HE2 PHE 4 HE2 PHE 4 -16.051 5.680 4.679 276 HZ PHE 4 HZ PHE 4 -17.882 4.282 5.550 277 H MET 5 H MET 5 -11.896 1.324 8.616 278 HA MET 5 HA MET 5 -9.054 0.736 8.170 279 HB2 MET 5 HB2 MET 5 -10.080 1.387 10.482 280 HB3 MET 5 HB3 MET 5 -10.623 -0.285 10.511 281 HG2 MET 5 HG2 MET 5 -8.592 -0.255 11.678 282 HG3 MET 5 HG3 MET 5 -8.224 -0.942 10.097 283 HE1 MET 5 HE1 MET 5 -5.101 0.190 10.380 284 HE2 MET 5 HE2 MET 5 -5.401 1.092 11.865 285 HE3 MET 5 HE3 MET 5 -6.151 -0.486 11.625 286 H THR 6 H THR 6 -9.008 -0.752 6.558 287 HA THR 6 HA THR 6 -10.790 -3.065 6.696 288 HB THR 6 HB THR 6 -8.770 -2.780 4.521 289 HG1 THR 6 HG1 THR 6 -9.561 -0.932 3.886 290 HG21 THR 6 HG21 THR 6 -11.519 -3.290 3.777 291 HG22 THR 6 HG22 THR 6 -10.083 -4.278 3.512 292 HG23 THR 6 HG23 THR 6 -10.975 -4.408 5.027 293 H SER 7 H SER 7 -9.889 -4.205 8.426 294 HA SER 7 HA SER 7 -7.128 -5.149 8.080 295 HB2 SER 7 HB2 SER 7 -8.158 -4.076 10.288 296 HB3 SER 7 HB3 SER 7 -8.680 -5.738 10.560 297 HG SER 7 HG SER 7 -6.516 -6.387 10.392 298 H GLU 8 H GLU 8 -7.222 -6.875 6.743 299 HA GLU 8 HA GLU 8 -9.086 -9.042 7.459 300 HB2 GLU 8 HB2 GLU 8 -8.006 -8.116 4.821 301 HB3 GLU 8 HB3 GLU 8 -8.505 -9.789 5.021 302 HG2 GLU 8 HG2 GLU 8 -10.308 -8.523 4.076 303 HG3 GLU 8 HG3 GLU 8 -10.736 -9.015 5.714 304 H LYS 9 H LYS 9 -8.066 -10.541 8.610 305 HA LYS 9 HA LYS 9 -5.263 -11.160 7.986 306 HB2 LYS 9 HB2 LYS 9 -5.622 -10.563 10.297 307 HB3 LYS 9 HB3 LYS 9 -6.934 -11.725 10.440 308 HG2 LYS 9 HG2 LYS 9 -5.418 -13.563 10.248 309 HG3 LYS 9 HG3 LYS 9 -4.078 -12.479 9.862 310 HD2 LYS 9 HD2 LYS 9 -4.012 -11.614 12.050 311 HD3 LYS 9 HD3 LYS 9 -5.598 -12.278 12.448 312 HE2 LYS 9 HE2 LYS 9 -4.776 -14.441 12.660 313 HE3 LYS 9 HE3 LYS 9 -3.337 -14.092 11.704 314 HZ1 LYS 9 HZ1 LYS 9 -2.284 -13.811 13.620 315 HZ2 LYS 9 HZ2 LYS 9 -3.195 -12.407 13.868 316 HZ3 LYS 9 HZ3 LYS 9 -3.719 -13.881 14.513 317 H SER 10 H SER 10 -5.137 -12.727 6.504 318 HA SER 10 HA SER 10 -6.205 -15.327 7.109 319 HB2 SER 10 HB2 SER 10 -7.076 -14.098 4.494 320 HB3 SER 10 HB3 SER 10 -7.615 -15.614 5.216 321 HG SER 10 HG SER 10 -9.074 -14.536 6.256 322 H GLN 11 H GLN 11 -5.020 -16.934 6.189 323 HA GLN 11 HA GLN 11 -2.630 -16.122 4.759 324 HB2 GLN 11 HB2 GLN 11 -1.951 -18.494 5.060 325 HB3 GLN 11 HB3 GLN 11 -2.338 -17.684 6.572 326 HG2 GLN 11 HG2 GLN 11 -4.183 -18.953 6.947 327 HG3 GLN 11 HG3 GLN 11 -4.510 -19.184 5.230 328 HE21 GLN 11 HE21 GLN 11 -4.870 -21.413 5.930 329 HE22 GLN 11 HE22 GLN 11 -3.515 -22.478 6.039 330 H THR 12 H THR 12 -4.933 -15.753 3.245 331 HA THR 12 HA THR 12 -4.350 -17.507 0.997 332 HB THR 12 HB THR 12 -7.087 -17.403 0.800 333 HG1 THR 12 HG1 THR 12 -7.113 -16.693 3.051 334 HG21 THR 12 HG21 THR 12 -6.569 -19.838 2.044 335 HG22 THR 12 HG22 THR 12 -6.499 -19.502 0.314 336 HG23 THR 12 HG23 THR 12 -5.037 -19.389 1.294 337 HA PRO 13 HA PRO 13 -5.027 -13.929 -1.451 338 HB2 PRO 13 HB2 PRO 13 -6.244 -14.925 -3.664 339 HB3 PRO 13 HB3 PRO 13 -4.537 -15.201 -3.300 340 HG2 PRO 13 HG2 PRO 13 -6.886 -17.001 -2.847 341 HG3 PRO 13 HG3 PRO 13 -5.275 -17.399 -3.474 342 HD2 PRO 13 HD2 PRO 13 -5.998 -17.873 -0.908 343 HD3 PRO 13 HD3 PRO 13 -4.335 -17.462 -1.371 344 H LEU 14 H LEU 14 -6.454 -12.519 -0.570 345 HA LEU 14 HA LEU 14 -9.325 -13.059 -0.924 346 HB2 LEU 14 HB2 LEU 14 -9.768 -11.673 0.936 347 HB3 LEU 14 HB3 LEU 14 -8.449 -12.744 1.403 348 HG LEU 14 HG LEU 14 -7.902 -9.962 0.426 349 HD11 LEU 14 HD11 LEU 14 -7.753 -9.930 3.209 350 HD12 LEU 14 HD12 LEU 14 -8.925 -9.091 2.193 351 HD13 LEU 14 HD13 LEU 14 -9.300 -10.690 2.837 352 HD21 LEU 14 HD21 LEU 14 -5.899 -11.069 0.563 353 HD22 LEU 14 HD22 LEU 14 -6.020 -10.422 2.200 354 HD23 LEU 14 HD23 LEU 14 -6.436 -12.107 1.884 355 H VAL 15 H VAL 15 -10.165 -10.394 -0.444 356 HA VAL 15 HA VAL 15 -8.920 -8.583 -2.258 357 HB VAL 15 HB VAL 15 -9.898 -10.021 -3.949 358 HG11 VAL 15 HG11 VAL 15 -12.678 -9.580 -3.586 359 HG12 VAL 15 HG12 VAL 15 -11.799 -11.109 -3.594 360 HG13 VAL 15 HG13 VAL 15 -12.027 -10.231 -2.082 361 HG21 VAL 15 HG21 VAL 15 -10.266 -7.291 -3.743 362 HG22 VAL 15 HG22 VAL 15 -10.456 -8.261 -5.204 363 HG23 VAL 15 HG23 VAL 15 -11.859 -7.892 -4.202 364 H THR 16 H THR 16 -9.505 -6.552 -1.772 365 HA THR 16 HA THR 16 -11.569 -6.177 0.245 366 HB THR 16 HB THR 16 -9.496 -5.057 0.700 367 HG1 THR 16 HG1 THR 16 -10.642 -3.433 1.401 368 HG21 THR 16 HG21 THR 16 -9.518 -4.559 -2.126 369 HG22 THR 16 HG22 THR 16 -9.324 -3.037 -1.255 370 HG23 THR 16 HG23 THR 16 -8.197 -4.364 -0.973 371 H LEU 17 H LEU 17 -13.587 -5.908 -0.452 372 HA LEU 17 HA LEU 17 -14.125 -4.722 -3.043 373 HB2 LEU 17 HB2 LEU 17 -15.324 -6.728 -1.844 374 HB3 LEU 17 HB3 LEU 17 -16.267 -5.440 -1.097 375 HG LEU 17 HG LEU 17 -16.043 -5.976 -4.058 376 HD11 LEU 17 HD11 LEU 17 -18.658 -6.251 -3.402 377 HD12 LEU 17 HD12 LEU 17 -17.517 -7.589 -3.546 378 HD13 LEU 17 HD13 LEU 17 -17.876 -6.903 -1.961 379 HD21 LEU 17 HD21 LEU 17 -17.977 -4.325 -4.097 380 HD22 LEU 17 HD22 LEU 17 -17.481 -3.871 -2.467 381 HD23 LEU 17 HD23 LEU 17 -16.367 -3.660 -3.818 382 H PHE 18 H PHE 18 -13.711 -2.559 -2.946 383 HA PHE 18 HA PHE 18 -15.237 -1.009 -0.959 384 HB2 PHE 18 HB2 PHE 18 -12.481 -0.730 -2.002 385 HB3 PHE 18 HB3 PHE 18 -13.386 0.768 -1.810 386 HD1 PHE 18 HD1 PHE 18 -14.801 0.714 0.545 387 HD2 PHE 18 HD2 PHE 18 -11.099 -1.226 -0.256 388 HE1 PHE 18 HE1 PHE 18 -14.283 0.719 2.950 389 HE2 PHE 18 HE2 PHE 18 -10.575 -1.226 2.148 390 HZ PHE 18 HZ PHE 18 -12.168 -0.253 3.754 391 H LYS 19 H LYS 19 -17.030 -0.294 -1.917 392 HA LYS 19 HA LYS 19 -16.793 0.869 -4.615 393 HB2 LYS 19 HB2 LYS 19 -19.195 0.327 -4.906 394 HB3 LYS 19 HB3 LYS 19 -18.194 -1.101 -4.681 395 HG2 LYS 19 HG2 LYS 19 -18.859 -1.030 -2.246 396 HG3 LYS 19 HG3 LYS 19 -20.055 0.185 -2.705 397 HD2 LYS 19 HD2 LYS 19 -19.917 -2.435 -4.151 398 HD3 LYS 19 HD3 LYS 19 -20.755 -2.310 -2.602 399 HE2 LYS 19 HE2 LYS 19 -22.435 -1.947 -4.179 400 HE3 LYS 19 HE3 LYS 19 -21.990 -0.324 -3.655 401 HZ1 LYS 19 HZ1 LYS 19 -21.357 0.206 -5.702 402 HZ2 LYS 19 HZ2 LYS 19 -20.420 -1.193 -5.872 403 HZ3 LYS 19 HZ3 LYS 19 -22.072 -1.232 -6.234 404 H ASN 20 H ASN 20 -17.810 2.827 -5.031 405 HA ASN 20 HA ASN 20 -18.468 4.954 -4.560 406 HB2 ASN 20 HB2 ASN 20 -20.194 3.303 -2.742 407 HB3 ASN 20 HB3 ASN 20 -20.280 5.061 -2.682 408 HD21 ASN 20 HD21 ASN 20 -22.451 4.904 -3.380 409 HD22 ASN 20 HD22 ASN 20 -22.828 4.627 -5.043 410 H ALA 21 H ALA 21 -16.082 4.005 -3.271 411 HA ALA 21 HA ALA 21 -16.005 4.846 -0.555 412 HB1 ALA 21 HB1 ALA 21 -13.411 5.003 -1.402 413 HB2 ALA 21 HB2 ALA 21 -14.202 3.545 -0.805 414 HB3 ALA 21 HB3 ALA 21 -14.106 3.849 -2.539 415 H ILE 22 H ILE 22 -16.182 6.865 0.139 416 HA ILE 22 HA ILE 22 -15.051 9.025 -1.517 417 HB ILE 22 HB ILE 22 -17.495 9.185 0.250 418 HG12 ILE 22 HG12 ILE 22 -17.289 9.415 -2.758 419 HG13 ILE 22 HG13 ILE 22 -17.790 7.954 -1.914 420 HG21 ILE 22 HG21 ILE 22 -16.249 11.262 0.273 421 HG22 ILE 22 HG22 ILE 22 -16.180 11.267 -1.489 422 HG23 ILE 22 HG23 ILE 22 -17.728 11.458 -0.667 423 HD11 ILE 22 HD11 ILE 22 -19.345 10.167 -0.996 424 HD12 ILE 22 HD12 ILE 22 -19.385 10.097 -2.757 425 HD13 ILE 22 HD13 ILE 22 -19.868 8.691 -1.808 426 H ILE 23 H ILE 23 -13.319 9.862 -0.576 427 HA ILE 23 HA ILE 23 -13.076 9.773 2.341 428 HB ILE 23 HB ILE 23 -11.063 10.199 0.146 429 HG12 ILE 23 HG12 ILE 23 -11.677 7.880 0.724 430 HG13 ILE 23 HG13 ILE 23 -10.001 8.231 1.132 431 HG21 ILE 23 HG21 ILE 23 -10.747 10.688 3.097 432 HG22 ILE 23 HG22 ILE 23 -9.383 10.409 2.014 433 HG23 ILE 23 HG23 ILE 23 -10.433 11.805 1.769 434 HD11 ILE 23 HD11 ILE 23 -10.799 8.659 3.485 435 HD12 ILE 23 HD12 ILE 23 -12.343 7.966 2.987 436 HD13 ILE 23 HD13 ILE 23 -10.876 6.988 2.924 437 H LYS 24 H LYS 24 -13.882 11.497 3.342 438 HA LYS 24 HA LYS 24 -13.373 14.155 2.175 439 HB2 LYS 24 HB2 LYS 24 -15.754 12.988 3.511 440 HB3 LYS 24 HB3 LYS 24 -15.387 14.669 3.876 441 HG2 LYS 24 HG2 LYS 24 -15.290 15.019 1.353 442 HG3 LYS 24 HG3 LYS 24 -16.062 13.436 1.228 443 HD2 LYS 24 HD2 LYS 24 -17.946 14.207 2.527 444 HD3 LYS 24 HD3 LYS 24 -17.156 15.759 2.814 445 HE2 LYS 24 HE2 LYS 24 -17.209 16.212 0.400 446 HE3 LYS 24 HE3 LYS 24 -18.030 14.674 0.137 447 HZ1 LYS 24 HZ1 LYS 24 -19.080 17.182 1.123 448 HZ2 LYS 24 HZ2 LYS 24 -19.864 15.926 0.304 449 HZ3 LYS 24 HZ3 LYS 24 -19.606 15.817 1.973 450 H ASN 25 H ASN 25 -11.600 14.887 3.197 451 HA ASN 25 HA ASN 25 -10.178 15.531 4.855 452 HB2 ASN 25 HB2 ASN 25 -12.883 15.947 6.104 453 HB3 ASN 25 HB3 ASN 25 -11.409 16.320 6.993 454 HD21 ASN 25 HD21 ASN 25 -10.973 18.390 6.944 455 HD22 ASN 25 HD22 ASN 25 -11.201 19.454 5.601 456 H ALA 26 H ALA 26 -10.078 12.889 4.641 457 HA ALA 26 HA ALA 26 -10.701 11.499 7.063 458 HB1 ALA 26 HB1 ALA 26 -9.323 9.675 6.048 459 HB2 ALA 26 HB2 ALA 26 -10.652 10.241 5.037 460 HB3 ALA 26 HB3 ALA 26 -9.001 10.754 4.691 461 H TYR 27 H TYR 27 -7.518 12.009 5.536 462 HA TYR 27 HA TYR 27 -6.254 11.849 8.150 463 HB2 TYR 27 HB2 TYR 27 -5.426 10.753 5.934 464 HB3 TYR 27 HB3 TYR 27 -4.778 12.352 5.585 465 HD1 TYR 27 HD1 TYR 27 -2.669 12.929 6.372 466 HD2 TYR 27 HD2 TYR 27 -4.754 9.714 8.221 467 HE1 TYR 27 HE1 TYR 27 -0.675 12.419 7.718 468 HE2 TYR 27 HE2 TYR 27 -2.766 9.196 9.574 469 HH TYR 27 HH TYR 27 -0.298 9.548 9.428 470 H LYS 28 H LYS 28 -6.787 13.765 9.165 471 HA LYS 28 HA LYS 28 -6.688 16.322 8.037 472 HB2 LYS 28 HB2 LYS 28 -6.371 15.384 10.888 473 HB3 LYS 28 HB3 LYS 28 -6.426 17.085 10.445 474 HG2 LYS 28 HG2 LYS 28 -8.652 16.370 9.249 475 HG3 LYS 28 HG3 LYS 28 -8.586 15.042 10.410 476 HD2 LYS 28 HD2 LYS 28 -9.753 16.570 11.645 477 HD3 LYS 28 HD3 LYS 28 -8.109 17.023 12.100 478 HE2 LYS 28 HE2 LYS 28 -9.484 18.304 9.763 479 HE3 LYS 28 HE3 LYS 28 -9.754 18.881 11.407 480 HZ1 LYS 28 HZ1 LYS 28 -8.004 20.179 10.810 481 HZ2 LYS 28 HZ2 LYS 28 -7.142 18.860 11.428 482 HZ3 LYS 28 HZ3 LYS 28 -7.344 19.031 9.756 483 H LYS 29 H LYS 29 -5.116 18.016 9.235 484 HA LYS 29 HA LYS 29 -2.470 17.319 8.273 485 HB2 LYS 29 HB2 LYS 29 -1.948 19.693 8.664 486 HB3 LYS 29 HB3 LYS 29 -3.389 19.494 7.676 487 HG2 LYS 29 HG2 LYS 29 -4.756 20.379 9.245 488 HG3 LYS 29 HG3 LYS 29 -3.805 19.747 10.591 489 HD2 LYS 29 HD2 LYS 29 -2.235 21.492 10.439 490 HD3 LYS 29 HD3 LYS 29 -2.797 21.967 8.834 491 HE2 LYS 29 HE2 LYS 29 -3.751 23.596 10.153 492 HE3 LYS 29 HE3 LYS 29 -5.053 22.410 10.067 493 HZ1 LYS 29 HZ1 LYS 29 -3.105 22.280 12.268 494 HZ2 LYS 29 HZ2 LYS 29 -4.372 23.399 12.340 495 HZ3 LYS 29 HZ3 LYS 29 -4.710 21.745 12.226 496 H GLY 30 H GLY 30 -2.788 15.694 10.301 497 HA2 GLY 30 HA2 GLY 30 -1.623 16.985 12.677 498 HA3 GLY 30 HA3 GLY 30 -2.440 15.429 12.663 499 H GLU 31 H GLU 31 0.505 16.881 12.886 500 HA GLU 31 HA GLU 31 1.876 14.365 12.457 501 HB2 GLU 31 HB2 GLU 31 2.424 16.822 10.811 502 HB3 GLU 31 HB3 GLU 31 3.674 15.620 11.101 503 HG2 GLU 31 HG2 GLU 31 1.020 15.141 9.764 504 HG3 GLU 31 HG3 GLU 31 2.590 15.244 8.969 505 H1 TYR 1 H TYR 1 -4.026 5.776 7.003 506 HA TYR 1 HA TYR 1 -1.985 7.763 7.759 507 HB2 TYR 1 HB2 TYR 1 -1.872 5.434 5.858 508 HB3 TYR 1 HB3 TYR 1 -0.745 6.779 5.720 509 HD1 TYR 1 HD1 TYR 1 -0.726 3.609 6.693 510 HD2 TYR 1 HD2 TYR 1 -0.064 7.429 8.446 511 HE1 TYR 1 HE1 TYR 1 0.710 2.571 8.399 512 HE2 TYR 1 HE2 TYR 1 1.374 6.402 10.156 513 HH TYR 1 HH TYR 1 2.851 3.908 10.063 514 H GLY 2 H GLY 2 -4.251 6.720 5.265 515 HA2 GLY 2 HA2 GLY 2 -4.749 9.399 4.438 516 HA3 GLY 2 HA3 GLY 2 -3.728 8.567 3.275 517 H GLY 3 H GLY 3 -6.771 9.462 3.719 518 HA2 GLY 3 HA2 GLY 3 -8.820 8.744 2.966 519 HA3 GLY 3 HA3 GLY 3 -7.891 7.917 1.725 520 H PHE 4 H PHE 4 -8.668 5.921 1.553 521 HA PHE 4 HA PHE 4 -9.769 4.519 3.811 522 HB2 PHE 4 HB2 PHE 4 -9.417 3.891 0.897 523 HB3 PHE 4 HB3 PHE 4 -9.860 2.618 2.029 524 HD1 PHE 4 HD1 PHE 4 -12.074 2.335 2.695 525 HD2 PHE 4 HD2 PHE 4 -10.902 5.947 0.772 526 HE1 PHE 4 HE1 PHE 4 -14.435 3.011 2.533 527 HE2 PHE 4 HE2 PHE 4 -13.260 6.629 0.607 528 HZ PHE 4 HZ PHE 4 -15.030 5.160 1.489 529 H MET 5 H MET 5 -8.961 2.694 4.820 530 HA MET 5 HA MET 5 -6.076 2.268 4.465 531 HB2 MET 5 HB2 MET 5 -7.187 2.963 6.723 532 HB3 MET 5 HB3 MET 5 -7.635 1.266 6.822 533 HG2 MET 5 HG2 MET 5 -5.635 1.465 8.024 534 HG3 MET 5 HG3 MET 5 -5.191 0.734 6.483 535 HE1 MET 5 HE1 MET 5 -2.147 2.064 6.794 536 HE2 MET 5 HE2 MET 5 -2.542 3.015 8.226 537 HE3 MET 5 HE3 MET 5 -3.190 1.385 8.044 538 H THR 6 H THR 6 -5.911 0.713 2.923 539 HA THR 6 HA THR 6 -7.556 -1.692 3.131 540 HB THR 6 HB THR 6 -5.488 -1.402 1.004 541 HG1 THR 6 HG1 THR 6 -6.350 0.372 0.259 542 HG21 THR 6 HG21 THR 6 -8.185 -2.087 0.209 543 HG22 THR 6 HG22 THR 6 -6.693 -3.010 0.030 544 HG23 THR 6 HG23 THR 6 -7.622 -3.117 1.525 545 H SER 7 H SER 7 -6.657 -2.714 4.927 546 HA SER 7 HA SER 7 -3.833 -3.499 4.722 547 HB2 SER 7 HB2 SER 7 -5.011 -2.408 6.846 548 HB3 SER 7 HB3 SER 7 -5.444 -4.088 7.164 549 HG SER 7 HG SER 7 -3.241 -4.610 7.103 550 H GLU 8 H GLU 8 -3.771 -5.277 3.452 551 HA GLU 8 HA GLU 8 -5.522 -7.529 4.191 552 HB2 GLU 8 HB2 GLU 8 -4.419 -6.632 1.553 553 HB3 GLU 8 HB3 GLU 8 -4.821 -8.325 1.802 554 HG2 GLU 8 HG2 GLU 8 -6.669 -7.213 0.758 555 HG3 GLU 8 HG3 GLU 8 -7.116 -7.665 2.402 556 H LYS 9 H LYS 9 -4.444 -8.909 5.434 557 HA LYS 9 HA LYS 9 -1.591 -9.374 4.913 558 HB2 LYS 9 HB2 LYS 9 -2.084 -8.709 7.191 559 HB3 LYS 9 HB3 LYS 9 -3.292 -9.979 7.338 560 HG2 LYS 9 HG2 LYS 9 -1.617 -11.679 7.261 561 HG3 LYS 9 HG3 LYS 9 -0.366 -10.498 6.865 562 HD2 LYS 9 HD2 LYS 9 -0.443 -9.543 9.019 563 HD3 LYS 9 HD3 LYS 9 -1.969 -10.342 9.405 564 HE2 LYS 9 HE2 LYS 9 -0.951 -12.406 9.720 565 HE3 LYS 9 HE3 LYS 9 0.473 -11.957 8.783 566 HZ1 LYS 9 HZ1 LYS 9 1.445 -11.503 10.708 567 HZ2 LYS 9 HZ2 LYS 9 0.395 -10.188 10.885 568 HZ3 LYS 9 HZ3 LYS 9 0.002 -11.684 11.572 569 H SER 10 H SER 10 -1.310 -10.988 3.507 570 HA SER 10 HA SER 10 -2.233 -13.625 4.179 571 HB2 SER 10 HB2 SER 10 -3.103 -12.551 1.495 572 HB3 SER 10 HB3 SER 10 -3.563 -14.073 2.258 573 HG SER 10 HG SER 10 -5.120 -13.058 3.218 574 H GLN 11 H GLN 11 -0.917 -15.183 3.361 575 HA GLN 11 HA GLN 11 1.455 -14.271 1.960 576 HB2 GLN 11 HB2 GLN 11 2.281 -16.577 2.382 577 HB3 GLN 11 HB3 GLN 11 1.799 -15.731 3.847 578 HG2 GLN 11 HG2 GLN 11 0.036 -17.106 4.233 579 HG3 GLN 11 HG3 GLN 11 -0.233 -17.427 2.521 580 HE21 GLN 11 HE21 GLN 11 -0.464 -19.645 3.302 581 HE22 GLN 11 HE22 GLN 11 0.955 -20.612 3.487 582 H THR 12 H THR 12 -0.801 -14.107 0.361 583 HA THR 12 HA THR 12 -0.045 -15.913 -1.788 584 HB THR 12 HB THR 12 -2.778 -16.004 -2.057 585 HG1 THR 12 HG1 THR 12 -2.902 -15.220 0.170 586 HG21 THR 12 HG21 THR 12 -2.132 -18.354 -0.719 587 HG22 THR 12 HG22 THR 12 -2.028 -18.071 -2.457 588 HG23 THR 12 HG23 THR 12 -0.610 -17.826 -1.437 589 HA PRO 13 HA PRO 13 -0.899 -12.497 -4.406 590 HB2 PRO 13 HB2 PRO 13 -1.993 -13.663 -6.600 591 HB3 PRO 13 HB3 PRO 13 -0.281 -13.810 -6.187 592 HG2 PRO 13 HG2 PRO 13 -2.517 -15.742 -5.708 593 HG3 PRO 13 HG3 PRO 13 -0.869 -16.058 -6.282 594 HD2 PRO 13 HD2 PRO 13 -1.622 -16.471 -3.714 595 HD3 PRO 13 HD3 PRO 13 0.022 -15.970 -4.158 596 H LEU 14 H LEU 14 -2.436 -11.149 -3.619 597 HA LEU 14 HA LEU 14 -5.256 -11.894 -4.011 598 HB2 LEU 14 HB2 LEU 14 -5.834 -10.461 -2.224 599 HB3 LEU 14 HB3 LEU 14 -4.460 -11.423 -1.681 600 HG LEU 14 HG LEU 14 -4.072 -8.654 -2.766 601 HD11 LEU 14 HD11 LEU 14 -3.990 -8.502 0.018 602 HD12 LEU 14 HD12 LEU 14 -5.186 -7.779 -1.058 603 HD13 LEU 14 HD13 LEU 14 -5.478 -9.371 -0.358 604 HD21 LEU 14 HD21 LEU 14 -2.006 -9.625 -2.542 605 HD22 LEU 14 HD22 LEU 14 -2.204 -8.913 -0.940 606 HD23 LEU 14 HD23 LEU 14 -2.505 -10.634 -1.184 607 H VAL 15 H VAL 15 -6.277 -9.269 -3.663 608 HA VAL 15 HA VAL 15 -5.110 -7.461 -5.531 609 HB VAL 15 HB VAL 15 -5.960 -9.034 -7.173 610 HG11 VAL 15 HG11 VAL 15 -8.769 -8.746 -6.885 611 HG12 VAL 15 HG12 VAL 15 -7.801 -10.218 -6.807 612 HG13 VAL 15 HG13 VAL 15 -8.114 -9.289 -5.341 613 HG21 VAL 15 HG21 VAL 15 -6.492 -6.325 -7.102 614 HG22 VAL 15 HG22 VAL 15 -6.597 -7.370 -8.519 615 HG23 VAL 15 HG23 VAL 15 -8.039 -7.039 -7.559 616 H THR 16 H THR 16 -5.842 -5.451 -5.160 617 HA THR 16 HA THR 16 -7.968 -5.125 -3.197 618 HB THR 16 HB THR 16 -5.981 -3.858 -2.746 619 HG1 THR 16 HG1 THR 16 -7.242 -2.280 -2.143 620 HG21 THR 16 HG21 THR 16 -5.961 -3.485 -5.590 621 HG22 THR 16 HG22 THR 16 -5.888 -1.917 -4.786 622 HG23 THR 16 HG23 THR 16 -4.687 -3.154 -4.417 623 H LEU 17 H LEU 17 -9.981 -5.016 -3.950 624 HA LEU 17 HA LEU 17 -10.530 -3.973 -6.600 625 HB2 LEU 17 HB2 LEU 17 -11.629 -6.002 -5.344 626 HB3 LEU 17 HB3 LEU 17 -12.669 -4.747 -4.672 627 HG LEU 17 HG LEU 17 -12.340 -5.390 -7.603 628 HD11 LEU 17 HD11 LEU 17 -14.949 -5.797 -6.987 629 HD12 LEU 17 HD12 LEU 17 -13.727 -7.066 -7.058 630 HD13 LEU 17 HD13 LEU 17 -14.159 -6.344 -5.508 631 HD21 LEU 17 HD21 LEU 17 -14.368 -3.864 -7.756 632 HD22 LEU 17 HD22 LEU 17 -13.942 -3.313 -6.136 633 HD23 LEU 17 HD23 LEU 17 -12.810 -3.090 -7.470 634 H PHE 18 H PHE 18 -10.251 -1.786 -6.582 635 HA PHE 18 HA PHE 18 -11.920 -0.257 -4.696 636 HB2 PHE 18 HB2 PHE 18 -9.164 0.155 -5.694 637 HB3 PHE 18 HB3 PHE 18 -10.166 1.599 -5.587 638 HD1 PHE 18 HD1 PHE 18 -11.629 1.559 -3.263 639 HD2 PHE 18 HD2 PHE 18 -7.797 -0.181 -3.898 640 HE1 PHE 18 HE1 PHE 18 -11.169 1.700 -0.850 641 HE2 PHE 18 HE2 PHE 18 -7.331 -0.044 -1.486 642 HZ PHE 18 HZ PHE 18 -9.018 0.897 0.042 643 H LYS 19 H LYS 19 -13.732 0.303 -5.718 644 HA LYS 19 HA LYS 19 -13.509 1.365 -8.459 645 HB2 LYS 19 HB2 LYS 19 -15.869 0.663 -8.768 646 HB3 LYS 19 HB3 LYS 19 -14.783 -0.687 -8.472 647 HG2 LYS 19 HG2 LYS 19 -15.495 -0.565 -6.052 648 HG3 LYS 19 HG3 LYS 19 -16.760 0.548 -6.579 649 HD2 LYS 19 HD2 LYS 19 -16.418 -2.117 -7.906 650 HD3 LYS 19 HD3 LYS 19 -17.305 -1.976 -6.386 651 HE2 LYS 19 HE2 LYS 19 -18.960 -1.793 -8.019 652 HE3 LYS 19 HE3 LYS 19 -18.632 -0.122 -7.563 653 HZ1 LYS 19 HZ1 LYS 19 -17.978 0.350 -9.617 654 HZ2 LYS 19 HZ2 LYS 19 -16.950 -0.991 -9.696 655 HZ3 LYS 19 HZ3 LYS 19 -18.586 -1.155 -10.096 656 H ASN 20 H ASN 20 -14.639 3.235 -8.979 657 HA ASN 20 HA ASN 20 -15.437 5.335 -8.613 658 HB2 ASN 20 HB2 ASN 20 -17.095 3.655 -6.760 659 HB3 ASN 20 HB3 ASN 20 -17.292 5.405 -6.775 660 HD21 ASN 20 HD21 ASN 20 -19.434 5.082 -7.506 661 HD22 ASN 20 HD22 ASN 20 -19.757 4.716 -9.164 662 H ALA 21 H ALA 21 -13.025 4.597 -7.242 663 HA ALA 21 HA ALA 21 -13.058 5.553 -4.563 664 HB1 ALA 21 HB1 ALA 21 -10.461 5.840 -5.371 665 HB2 ALA 21 HB2 ALA 21 -11.171 4.362 -4.722 666 HB3 ALA 21 HB3 ALA 21 -11.060 4.595 -6.467 667 H ILE 22 H ILE 22 -13.382 7.584 -3.965 668 HA ILE 22 HA ILE 22 -12.353 9.741 -5.691 669 HB ILE 22 HB ILE 22 -14.838 9.821 -3.974 670 HG12 ILE 22 HG12 ILE 22 -14.583 9.925 -6.986 671 HG13 ILE 22 HG13 ILE 22 -15.017 8.479 -6.082 672 HG21 ILE 22 HG21 ILE 22 -13.724 11.971 -4.025 673 HG22 ILE 22 HG22 ILE 22 -13.623 11.904 -5.784 674 HG23 ILE 22 HG23 ILE 22 -15.195 12.031 -4.996 675 HD11 ILE 22 HD11 ILE 22 -16.717 10.636 -5.300 676 HD12 ILE 22 HD12 ILE 22 -16.715 10.480 -7.057 677 HD13 ILE 22 HD13 ILE 22 -17.136 9.095 -6.050 678 H ILE 23 H ILE 23 -10.697 10.727 -4.756 679 HA ILE 23 HA ILE 23 -10.511 10.778 -1.833 680 HB ILE 23 HB ILE 23 -8.481 11.231 -4.007 681 HG12 ILE 23 HG12 ILE 23 -8.966 8.907 -3.334 682 HG13 ILE 23 HG13 ILE 23 -7.322 9.378 -2.914 683 HG21 ILE 23 HG21 ILE 23 -8.258 11.867 -1.075 684 HG22 ILE 23 HG22 ILE 23 -6.858 11.628 -2.121 685 HG23 ILE 23 HG23 ILE 23 -7.987 12.943 -2.446 686 HD11 ILE 23 HD11 ILE 23 -8.193 9.860 -0.597 687 HD12 ILE 23 HD12 ILE 23 -9.681 9.052 -1.090 688 HD13 ILE 23 HD13 ILE 23 -8.157 8.165 -1.083 689 H LYS 24 H LYS 24 -11.447 12.491 -0.929 690 HA LYS 24 HA LYS 24 -11.075 15.122 -2.205 691 HB2 LYS 24 HB2 LYS 24 -13.407 13.871 -0.858 692 HB3 LYS 24 HB3 LYS 24 -13.151 15.586 -0.568 693 HG2 LYS 24 HG2 LYS 24 -13.025 15.822 -3.104 694 HG3 LYS 24 HG3 LYS 24 -13.696 14.190 -3.165 695 HD2 LYS 24 HD2 LYS 24 -15.649 14.904 -1.937 696 HD3 LYS 24 HD3 LYS 24 -14.961 16.514 -1.713 697 HE2 LYS 24 HE2 LYS 24 -14.994 16.848 -4.146 698 HE3 LYS 24 HE3 LYS 24 -15.711 15.251 -4.349 699 HZ1 LYS 24 HZ1 LYS 24 -16.936 17.731 -3.505 700 HZ2 LYS 24 HZ2 LYS 24 -17.623 16.390 -4.275 701 HZ3 LYS 24 HZ3 LYS 24 -17.393 16.377 -2.598 702 H ASN 25 H ASN 25 -9.373 16.010 -1.186 703 HA ASN 25 HA ASN 25 -8.028 16.812 0.467 704 HB2 ASN 25 HB2 ASN 25 -10.778 17.115 1.649 705 HB3 ASN 25 HB3 ASN 25 -9.347 17.621 2.542 706 HD21 ASN 25 HD21 ASN 25 -9.038 19.710 2.400 707 HD22 ASN 25 HD22 ASN 25 -9.309 20.693 1.004 708 H ALA 26 H ALA 26 -7.763 14.175 0.376 709 HA ALA 26 HA ALA 26 -8.352 12.857 2.847 710 HB1 ALA 26 HB1 ALA 26 -6.837 11.082 1.943 711 HB2 ALA 26 HB2 ALA 26 -8.178 11.514 0.883 712 HB3 ALA 26 HB3 ALA 26 -6.556 12.118 0.544 713 H TYR 27 H TYR 27 -5.172 13.502 1.363 714 HA TYR 27 HA TYR 27 -3.963 13.538 4.007 715 HB2 TYR 27 HB2 TYR 27 -3.018 12.396 1.862 716 HB3 TYR 27 HB3 TYR 27 -2.459 14.014 1.454 717 HD1 TYR 27 HD1 TYR 27 -0.406 14.751 2.255 718 HD2 TYR 27 HD2 TYR 27 -2.343 11.508 4.213 719 HE1 TYR 27 HE1 TYR 27 1.582 14.424 3.666 720 HE2 TYR 27 HE2 TYR 27 -0.361 11.173 5.631 721 HH TYR 27 HH TYR 27 2.084 11.664 5.522 722 H LYS 28 H LYS 28 -4.633 15.462 4.920 723 HA LYS 28 HA LYS 28 -4.663 17.966 3.674 724 HB2 LYS 28 HB2 LYS 28 -4.355 17.187 6.573 725 HB3 LYS 28 HB3 LYS 28 -4.513 18.857 6.043 726 HG2 LYS 28 HG2 LYS 28 -6.658 17.938 4.843 727 HG3 LYS 28 HG3 LYS 28 -6.531 16.673 6.067 728 HD2 LYS 28 HD2 LYS 28 -7.825 18.175 7.203 729 HD3 LYS 28 HD3 LYS 28 -6.225 18.755 7.670 730 HE2 LYS 28 HE2 LYS 28 -7.624 19.835 5.248 731 HE3 LYS 28 HE3 LYS 28 -7.971 20.467 6.857 732 HZ1 LYS 28 HZ1 LYS 28 -6.295 21.849 6.239 733 HZ2 LYS 28 HZ2 LYS 28 -5.363 20.619 6.933 734 HZ3 LYS 28 HZ3 LYS 28 -5.537 20.703 5.252 735 H LYS 29 H LYS 29 -3.227 19.806 4.832 736 HA LYS 29 HA LYS 29 -0.521 19.233 3.956 737 HB2 LYS 29 HB2 LYS 29 -0.153 21.649 4.253 738 HB3 LYS 29 HB3 LYS 29 -1.554 21.319 3.243 739 HG2 LYS 29 HG2 LYS 29 -3.013 22.183 4.739 740 HG3 LYS 29 HG3 LYS 29 -2.058 21.672 6.133 741 HD2 LYS 29 HD2 LYS 29 -0.595 23.504 5.935 742 HD3 LYS 29 HD3 LYS 29 -1.147 23.873 4.299 743 HE2 LYS 29 HE2 LYS 29 -2.230 25.494 5.525 744 HE3 LYS 29 HE3 LYS 29 -3.454 24.226 5.463 745 HZ1 LYS 29 HZ1 LYS 29 -1.556 24.311 7.709 746 HZ2 LYS 29 HZ2 LYS 29 -2.890 25.352 7.705 747 HZ3 LYS 29 HZ3 LYS 29 -3.124 23.677 7.656 748 H GLY 30 H GLY 30 -0.791 17.682 6.049 749 HA2 GLY 30 HA2 GLY 30 0.237 19.143 8.389 750 HA3 GLY 30 HA3 GLY 30 -0.481 17.539 8.426 751 H GLU 31 H GLU 31 2.361 19.182 8.652 752 HA GLU 31 HA GLU 31 3.897 16.743 8.371 753 HB2 GLU 31 HB2 GLU 31 4.328 19.145 6.611 754 HB3 GLU 31 HB3 GLU 31 5.641 18.037 6.983 755 HG2 GLU 31 HG2 GLU 31 3.050 17.333 5.624 756 HG3 GLU 31 HG3 GLU 31 4.629 17.490 4.855 757 H1 TYR 1 H TYR 1 -1.358 7.580 3.192 758 HA TYR 1 HA TYR 1 0.554 9.713 3.889 759 HB2 TYR 1 HB2 TYR 1 0.840 7.305 2.107 760 HB3 TYR 1 HB3 TYR 1 1.893 8.705 1.926 761 HD1 TYR 1 HD1 TYR 1 2.075 5.592 3.049 762 HD2 TYR 1 HD2 TYR 1 2.469 9.521 4.634 763 HE1 TYR 1 HE1 TYR 1 3.529 4.721 4.831 764 HE2 TYR 1 HE2 TYR 1 3.924 8.660 6.420 765 HH TYR 1 HH TYR 1 5.547 6.257 6.475 766 H GLY 2 H GLY 2 -1.590 8.418 1.404 767 HA2 GLY 2 HA2 GLY 2 -2.230 11.019 0.438 768 HA3 GLY 2 HA3 GLY 2 -1.130 10.200 -0.661 769 H GLY 3 H GLY 3 -4.232 10.922 -0.332 770 HA2 GLY 3 HA2 GLY 3 -6.213 10.042 -1.096 771 HA3 GLY 3 HA3 GLY 3 -5.202 9.218 -2.274 772 H PHE 4 H PHE 4 -5.855 7.173 -2.369 773 HA PHE 4 HA PHE 4 -6.923 5.810 -0.070 774 HB2 PHE 4 HB2 PHE 4 -6.462 5.072 -2.943 775 HB3 PHE 4 HB3 PHE 4 -6.854 3.827 -1.762 776 HD1 PHE 4 HD1 PHE 4 -9.063 3.437 -1.134 777 HD2 PHE 4 HD2 PHE 4 -8.066 7.026 -3.194 778 HE1 PHE 4 HE1 PHE 4 -11.455 3.957 -1.379 779 HE2 PHE 4 HE2 PHE 4 -10.456 7.552 -3.442 780 HZ PHE 4 HZ PHE 4 -12.155 6.017 -2.533 781 H MET 5 H MET 5 -6.031 4.083 1.037 782 HA MET 5 HA MET 5 -3.117 3.820 0.762 783 HB2 MET 5 HB2 MET 5 -4.314 4.557 2.961 784 HB3 MET 5 HB3 MET 5 -4.667 2.843 3.136 785 HG2 MET 5 HG2 MET 5 -2.709 3.217 4.366 786 HG3 MET 5 HG3 MET 5 -2.191 2.437 2.873 787 HE1 MET 5 HE1 MET 5 0.766 3.954 3.180 788 HE2 MET 5 HE2 MET 5 0.284 4.954 4.551 789 HE3 MET 5 HE3 MET 5 -0.266 3.282 4.442 790 H THR 6 H THR 6 -2.828 2.205 -0.697 791 HA THR 6 HA THR 6 -4.332 -0.281 -0.405 792 HB THR 6 HB THR 6 -2.229 0.018 -2.493 793 HG1 THR 6 HG1 THR 6 -3.158 1.706 -3.349 794 HG21 THR 6 HG21 THR 6 -4.871 -0.841 -3.312 795 HG22 THR 6 HG22 THR 6 -3.329 -1.690 -3.422 796 HG23 THR 6 HG23 THR 6 -4.282 -1.779 -1.940 797 H SER 7 H SER 7 -3.432 -1.181 1.448 798 HA SER 7 HA SER 7 -0.560 -1.793 1.362 799 HB2 SER 7 HB2 SER 7 -1.870 -0.693 3.401 800 HB3 SER 7 HB3 SER 7 -2.210 -2.382 3.777 801 HG SER 7 HG SER 7 0.023 -2.768 3.803 802 H GLU 8 H GLU 8 -0.351 -3.613 0.168 803 HA GLU 8 HA GLU 8 -1.979 -5.940 0.954 804 HB2 GLU 8 HB2 GLU 8 -0.860 -5.081 -1.692 805 HB3 GLU 8 HB3 GLU 8 -1.164 -6.785 -1.381 806 HG2 GLU 8 HG2 GLU 8 -3.046 -5.829 -2.519 807 HG3 GLU 8 HG3 GLU 8 -3.511 -6.249 -0.871 808 H LYS 9 H LYS 9 -0.849 -7.195 2.282 809 HA LYS 9 HA LYS 9 2.040 -7.497 1.854 810 HB2 LYS 9 HB2 LYS 9 1.426 -6.777 4.091 811 HB3 LYS 9 HB3 LYS 9 0.316 -8.132 4.255 812 HG2 LYS 9 HG2 LYS 9 2.119 -9.697 4.287 813 HG3 LYS 9 HG3 LYS 9 3.286 -8.437 3.879 814 HD2 LYS 9 HD2 LYS 9 3.070 -7.413 5.992 815 HD3 LYS 9 HD3 LYS 9 1.602 -8.318 6.368 816 HE2 LYS 9 HE2 LYS 9 2.772 -10.281 6.787 817 HE3 LYS 9 HE3 LYS 9 4.182 -9.751 5.872 818 HZ1 LYS 9 HZ1 LYS 9 5.058 -9.152 7.803 819 HZ2 LYS 9 HZ2 LYS 9 3.900 -7.922 7.904 820 HZ3 LYS 9 HZ3 LYS 9 3.609 -9.420 8.635 821 H SER 10 H SER 10 2.477 -9.146 0.534 822 HA SER 10 HA SER 10 1.702 -11.808 1.281 823 HB2 SER 10 HB2 SER 10 0.840 -10.901 -1.466 824 HB3 SER 10 HB3 SER 10 0.455 -12.416 -0.650 825 HG SER 10 HG SER 10 -1.188 -11.462 0.226 826 H GLN 11 H GLN 11 3.139 -13.306 0.559 827 HA GLN 11 HA GLN 11 5.482 -12.293 -0.822 828 HB2 GLN 11 HB2 GLN 11 6.454 -14.511 -0.278 829 HB3 GLN 11 HB3 GLN 11 5.866 -13.649 1.137 830 HG2 GLN 11 HG2 GLN 11 4.193 -15.133 1.525 831 HG3 GLN 11 HG3 GLN 11 4.005 -15.538 -0.180 832 HE21 GLN 11 HE21 GLN 11 3.908 -17.735 0.683 833 HE22 GLN 11 HE22 GLN 11 5.386 -18.588 0.950 834 H THR 12 H THR 12 3.280 -12.336 -2.489 835 HA THR 12 HA THR 12 4.206 -14.180 -4.536 836 HB THR 12 HB THR 12 1.492 -14.463 -4.867 837 HG1 THR 12 HG1 THR 12 1.255 -13.599 -2.681 838 HG21 THR 12 HG21 THR 12 2.255 -16.708 -3.414 839 HG22 THR 12 HG22 THR 12 2.387 -16.491 -5.160 840 HG23 THR 12 HG23 THR 12 3.757 -16.110 -4.117 841 HA PRO 13 HA PRO 13 3.201 -10.939 -7.318 842 HB2 PRO 13 HB2 PRO 13 2.245 -12.265 -9.486 843 HB3 PRO 13 HB3 PRO 13 3.952 -12.280 -9.025 844 HG2 PRO 13 HG2 PRO 13 1.835 -14.335 -8.518 845 HG3 PRO 13 HG3 PRO 13 3.515 -14.564 -9.037 846 HD2 PRO 13 HD2 PRO 13 2.721 -14.921 -6.473 847 HD3 PRO 13 HD3 PRO 13 4.340 -14.330 -6.898 848 H LEU 14 H LEU 14 1.558 -9.668 -6.620 849 HA LEU 14 HA LEU 14 -1.196 -10.615 -7.048 850 HB2 LEU 14 HB2 LEU 14 -1.913 -9.148 -5.341 851 HB3 LEU 14 HB3 LEU 14 -0.494 -9.991 -4.724 852 HG LEU 14 HG LEU 14 -0.259 -7.252 -5.924 853 HD11 LEU 14 HD11 LEU 14 -0.268 -6.983 -3.144 854 HD12 LEU 14 HD12 LEU 14 -1.465 -6.371 -4.285 855 HD13 LEU 14 HD13 LEU 14 -1.692 -7.949 -3.531 856 HD21 LEU 14 HD21 LEU 14 1.858 -8.078 -5.604 857 HD22 LEU 14 HD22 LEU 14 1.570 -7.302 -4.046 858 HD23 LEU 14 HD23 LEU 14 1.389 -9.049 -4.209 859 H VAL 15 H VAL 15 -2.396 -8.051 -6.842 860 HA VAL 15 HA VAL 15 -1.302 -6.255 -8.766 861 HB VAL 15 HB VAL 15 -2.015 -7.955 -10.347 862 HG11 VAL 15 HG11 VAL 15 -4.842 -7.819 -10.134 863 HG12 VAL 15 HG12 VAL 15 -3.793 -9.227 -9.969 864 HG13 VAL 15 HG13 VAL 15 -4.193 -8.254 -8.553 865 HG21 VAL 15 HG21 VAL 15 -2.698 -5.284 -10.424 866 HG22 VAL 15 HG22 VAL 15 -2.720 -6.401 -11.788 867 HG23 VAL 15 HG23 VAL 15 -4.195 -6.103 -10.869 868 H THR 16 H THR 16 -2.169 -4.281 -8.503 869 HA THR 16 HA THR 16 -4.358 -4.007 -6.603 870 HB THR 16 HB THR 16 -2.466 -2.599 -6.164 871 HG1 THR 16 HG1 THR 16 -3.836 -1.079 -5.659 872 HG21 THR 16 HG21 THR 16 -2.398 -2.348 -9.020 873 HG22 THR 16 HG22 THR 16 -2.448 -0.744 -8.287 874 HG23 THR 16 HG23 THR 16 -1.178 -1.881 -7.834 875 H LEU 17 H LEU 17 -6.357 -4.050 -7.399 876 HA LEU 17 HA LEU 17 -6.902 -3.159 -10.105 877 HB2 LEU 17 HB2 LEU 17 -7.901 -5.201 -8.793 878 HB3 LEU 17 HB3 LEU 17 -9.034 -3.991 -8.195 879 HG LEU 17 HG LEU 17 -8.597 -4.728 -11.088 880 HD11 LEU 17 HD11 LEU 17 -11.191 -5.269 -10.509 881 HD12 LEU 17 HD12 LEU 17 -9.893 -6.462 -10.506 882 HD13 LEU 17 HD13 LEU 17 -10.402 -5.708 -8.995 883 HD21 LEU 17 HD21 LEU 17 -10.710 -3.338 -11.349 884 HD22 LEU 17 HD22 LEU 17 -10.357 -2.696 -9.745 885 HD23 LEU 17 HD23 LEU 17 -9.209 -2.458 -11.062 886 H PHE 18 H PHE 18 -6.764 -0.960 -10.176 887 HA PHE 18 HA PHE 18 -8.573 0.535 -8.393 888 HB2 PHE 18 HB2 PHE 18 -5.825 1.081 -9.347 889 HB3 PHE 18 HB3 PHE 18 -6.918 2.461 -9.328 890 HD1 PHE 18 HD1 PHE 18 -8.434 2.432 -7.040 891 HD2 PHE 18 HD2 PHE 18 -4.486 0.910 -7.506 892 HE1 PHE 18 HE1 PHE 18 -8.046 2.707 -4.625 893 HE2 PHE 18 HE2 PHE 18 -4.093 1.182 -5.093 894 HZ PHE 18 HZ PHE 18 -5.873 2.081 -3.649 895 H LYS 19 H LYS 19 -10.392 0.932 -9.478 896 HA LYS 19 HA LYS 19 -10.171 1.890 -12.257 897 HB2 LYS 19 HB2 LYS 19 -12.474 1.026 -12.585 898 HB3 LYS 19 HB3 LYS 19 -11.313 -0.239 -12.203 899 HG2 LYS 19 HG2 LYS 19 -12.092 -0.061 -9.810 900 HG3 LYS 19 HG3 LYS 19 -13.405 0.954 -10.408 901 HD2 LYS 19 HD2 LYS 19 -12.882 -1.739 -11.614 902 HD3 LYS 19 HD3 LYS 19 -13.812 -1.586 -10.122 903 HE2 LYS 19 HE2 LYS 19 -15.435 -1.566 -11.796 904 HE3 LYS 19 HE3 LYS 19 -15.212 0.139 -11.406 905 HZ1 LYS 19 HZ1 LYS 19 -14.537 0.562 -13.463 906 HZ2 LYS 19 HZ2 LYS 19 -13.433 -0.720 -13.462 907 HZ3 LYS 19 HZ3 LYS 19 -15.046 -0.994 -13.891 908 H ASN 20 H ASN 20 -11.404 3.661 -12.882 909 HA ASN 20 HA ASN 20 -12.342 5.718 -12.626 910 HB2 ASN 20 HB2 ASN 20 -13.931 4.019 -10.730 911 HB3 ASN 20 HB3 ASN 20 -14.238 5.750 -10.830 912 HD21 ASN 20 HD21 ASN 20 -16.338 5.254 -11.586 913 HD22 ASN 20 HD22 ASN 20 -16.601 4.794 -13.231 914 H ALA 21 H ALA 21 -9.918 5.199 -11.180 915 HA ALA 21 HA ALA 21 -10.069 6.264 -8.547 916 HB1 ALA 21 HB1 ALA 21 -7.480 6.688 -9.322 917 HB2 ALA 21 HB2 ALA 21 -8.105 5.196 -8.618 918 HB3 ALA 21 HB3 ALA 21 -7.975 5.358 -10.370 919 H ILE 22 H ILE 22 -10.535 8.293 -8.041 920 HA ILE 22 HA ILE 22 -9.613 10.438 -9.840 921 HB ILE 22 HB ILE 22 -12.134 10.423 -8.176 922 HG12 ILE 22 HG12 ILE 22 -11.817 10.423 -11.184 923 HG13 ILE 22 HG13 ILE 22 -12.183 8.991 -10.229 924 HG21 ILE 22 HG21 ILE 22 -11.162 12.639 -8.291 925 HG22 ILE 22 HG22 ILE 22 -11.019 12.510 -10.044 926 HG23 ILE 22 HG23 ILE 22 -12.613 12.564 -9.292 927 HD11 ILE 22 HD11 ILE 22 -14.030 11.070 -9.577 928 HD12 ILE 22 HD12 ILE 22 -13.977 10.840 -11.325 929 HD13 ILE 22 HD13 ILE 22 -14.336 9.476 -10.267 930 H ILE 23 H ILE 23 -8.041 11.562 -8.918 931 HA ILE 23 HA ILE 23 -7.924 11.753 -5.998 932 HB ILE 23 HB ILE 23 -5.877 12.236 -8.149 933 HG12 ILE 23 HG12 ILE 23 -6.232 9.918 -7.382 934 HG13 ILE 23 HG13 ILE 23 -4.631 10.509 -6.950 935 HG21 ILE 23 HG21 ILE 23 -5.760 13.013 -5.245 936 HG22 ILE 23 HG22 ILE 23 -4.324 12.817 -6.250 937 HG23 ILE 23 HG23 ILE 23 -5.525 14.043 -6.657 938 HD11 ILE 23 HD11 ILE 23 -5.582 11.036 -4.676 939 HD12 ILE 23 HD12 ILE 23 -7.007 10.117 -5.162 940 HD13 ILE 23 HD13 ILE 23 -5.432 9.327 -5.084 941 H LYS 24 H LYS 24 -8.989 13.441 -5.194 942 HA LYS 24 HA LYS 24 -8.751 16.032 -6.579 943 HB2 LYS 24 HB2 LYS 24 -11.029 14.697 -5.220 944 HB3 LYS 24 HB3 LYS 24 -10.886 16.436 -5.004 945 HG2 LYS 24 HG2 LYS 24 -10.720 16.567 -7.545 946 HG3 LYS 24 HG3 LYS 24 -11.287 14.895 -7.544 947 HD2 LYS 24 HD2 LYS 24 -13.306 15.538 -6.383 948 HD3 LYS 24 HD3 LYS 24 -12.726 17.198 -6.227 949 HE2 LYS 24 HE2 LYS 24 -12.729 17.409 -8.675 950 HE3 LYS 24 HE3 LYS 24 -13.343 15.762 -8.809 951 HZ1 LYS 24 HZ1 LYS 24 -14.734 18.200 -8.112 952 HZ2 LYS 24 HZ2 LYS 24 -15.322 16.782 -8.823 953 HZ3 LYS 24 HZ3 LYS 24 -15.124 16.868 -7.145 954 H ASN 25 H ASN 25 -7.129 17.069 -5.569 955 HA ASN 25 HA ASN 25 -5.871 18.026 -3.929 956 HB2 ASN 25 HB2 ASN 25 -8.660 18.209 -2.814 957 HB3 ASN 25 HB3 ASN 25 -7.282 18.843 -1.919 958 HD21 ASN 25 HD21 ASN 25 -7.095 20.938 -2.155 959 HD22 ASN 25 HD22 ASN 25 -7.398 21.839 -3.598 960 H ALA 26 H ALA 26 -5.444 15.408 -3.895 961 HA ALA 26 HA ALA 26 -6.006 14.166 -1.380 962 HB1 ALA 26 HB1 ALA 26 -4.359 12.454 -2.171 963 HB2 ALA 26 HB2 ALA 26 -5.702 12.751 -3.274 964 HB3 ALA 26 HB3 ALA 26 -4.116 13.443 -3.610 965 H TYR 27 H TYR 27 -2.836 14.937 -2.822 966 HA TYR 27 HA TYR 27 -1.697 15.171 -0.158 967 HB2 TYR 27 HB2 TYR 27 -0.632 13.992 -2.225 968 HB3 TYR 27 HB3 TYR 27 -0.162 15.622 -2.697 969 HD1 TYR 27 HD1 TYR 27 1.817 16.526 -1.882 970 HD2 TYR 27 HD2 TYR 27 0.043 13.250 0.172 971 HE1 TYR 27 HE1 TYR 27 3.786 16.389 -0.414 972 HE2 TYR 27 HE2 TYR 27 2.006 13.104 1.647 973 HH TYR 27 HH TYR 27 4.417 13.747 1.571 974 H LYS 28 H LYS 28 -2.503 17.089 0.650 975 HA LYS 28 HA LYS 28 -2.656 19.527 -0.713 976 HB2 LYS 28 HB2 LYS 28 -2.368 18.904 2.226 977 HB3 LYS 28 HB3 LYS 28 -2.620 20.533 1.613 978 HG2 LYS 28 HG2 LYS 28 -4.675 19.425 0.416 979 HG3 LYS 28 HG3 LYS 28 -4.494 18.225 1.698 980 HD2 LYS 28 HD2 LYS 28 -5.909 19.689 2.737 981 HD3 LYS 28 HD3 LYS 28 -4.360 20.388 3.214 982 HE2 LYS 28 HE2 LYS 28 -5.765 21.275 0.717 983 HE3 LYS 28 HE3 LYS 28 -6.188 21.951 2.289 984 HZ1 LYS 28 HZ1 LYS 28 -4.586 23.408 1.647 985 HZ2 LYS 28 HZ2 LYS 28 -3.597 22.269 2.413 986 HZ3 LYS 28 HZ3 LYS 28 -3.735 22.271 0.727 987 H LYS 29 H LYS 29 -1.362 21.501 0.397 988 HA LYS 29 HA LYS 29 1.393 21.059 -0.398 989 HB2 LYS 29 HB2 LYS 29 1.606 23.505 -0.202 990 HB3 LYS 29 HB3 LYS 29 0.254 23.044 -1.228 991 HG2 LYS 29 HG2 LYS 29 -1.293 23.881 0.194 992 HG3 LYS 29 HG3 LYS 29 -0.346 23.490 1.631 993 HD2 LYS 29 HD2 LYS 29 1.007 25.400 1.387 994 HD3 LYS 29 HD3 LYS 29 0.479 25.662 -0.277 995 HE2 LYS 29 HE2 LYS 29 -0.734 27.264 0.847 996 HE3 LYS 29 HE3 LYS 29 -1.876 25.923 0.812 997 HZ1 LYS 29 HZ1 LYS 29 -0.050 26.219 3.099 998 HZ2 LYS 29 HZ2 LYS 29 -1.442 27.177 3.014 999 HZ3 LYS 29 HZ3 LYS 29 -1.576 25.491 3.035 1000 H GLY 30 H GLY 30 1.170 19.588 1.756 1001 HA2 GLY 30 HA2 GLY 30 2.049 21.211 4.050 1002 HA3 GLY 30 HA3 GLY 30 1.432 19.568 4.143 1003 H GLU 31 H GLU 31 4.160 21.401 4.347 1004 HA GLU 31 HA GLU 31 5.853 19.055 4.216 1005 HB2 GLU 31 HB2 GLU 31 6.169 21.390 2.346 1006 HB3 GLU 31 HB3 GLU 31 7.542 20.390 2.798 1007 HG2 GLU 31 HG2 GLU 31 5.032 19.453 1.427 1008 HG3 GLU 31 HG3 GLU 31 6.615 19.671 0.682 1009 H1 TYR 1 H TYR 1 1.296 9.344 -0.659 1010 HA TYR 1 HA TYR 1 3.047 11.626 -0.013 1011 HB2 TYR 1 HB2 TYR 1 3.534 9.169 -1.681 1012 HB3 TYR 1 HB3 TYR 1 4.501 10.624 -1.893 1013 HD1 TYR 1 HD1 TYR 1 4.841 7.577 -0.631 1014 HD2 TYR 1 HD2 TYR 1 4.952 11.586 0.789 1015 HE1 TYR 1 HE1 TYR 1 6.294 6.873 1.225 1016 HE2 TYR 1 HE2 TYR 1 6.406 10.894 2.647 1017 HH TYR 1 HH TYR 1 8.169 8.600 2.849 1018 H GLY 2 H GLY 2 1.054 10.091 -2.487 1019 HA2 GLY 2 HA2 GLY 2 0.284 12.604 -3.585 1020 HA3 GLY 2 HA3 GLY 2 1.457 11.803 -4.620 1021 H GLY 3 H GLY 3 -1.692 12.350 -4.385 1022 HA2 GLY 3 HA2 GLY 3 -3.598 11.319 -5.149 1023 HA3 GLY 3 HA3 GLY 3 -2.514 10.508 -6.270 1024 H PHE 4 H PHE 4 -3.035 8.424 -6.285 1025 HA PHE 4 HA PHE 4 -4.074 7.099 -3.951 1026 HB2 PHE 4 HB2 PHE 4 -3.501 6.267 -6.777 1027 HB3 PHE 4 HB3 PHE 4 -3.844 5.053 -5.550 1028 HD1 PHE 4 HD1 PHE 4 -6.038 4.555 -4.948 1029 HD2 PHE 4 HD2 PHE 4 -5.216 8.102 -7.153 1030 HE1 PHE 4 HE1 PHE 4 -8.452 4.913 -5.266 1031 HE2 PHE 4 HE2 PHE 4 -7.627 8.466 -7.473 1032 HZ PHE 4 HZ PHE 4 -9.249 6.871 -6.529 1033 H MET 5 H MET 5 -3.106 5.483 -2.746 1034 HA MET 5 HA MET 5 -0.176 5.385 -2.951 1035 HB2 MET 5 HB2 MET 5 -1.459 6.155 -0.814 1036 HB3 MET 5 HB3 MET 5 -1.719 4.435 -0.561 1037 HG2 MET 5 HG2 MET 5 0.187 4.976 0.685 1038 HG3 MET 5 HG3 MET 5 0.783 4.160 -0.758 1039 HE1 MET 5 HE1 MET 5 3.639 5.862 -0.454 1040 HE2 MET 5 HE2 MET 5 3.064 6.899 0.852 1041 HE3 MET 5 HE3 MET 5 2.614 5.194 0.817 1042 H THR 6 H THR 6 0.235 3.722 -4.326 1043 HA THR 6 HA THR 6 -1.129 1.169 -3.945 1044 HB THR 6 HB THR 6 1.013 1.491 -5.990 1045 HG1 THR 6 HG1 THR 6 0.010 3.072 -6.958 1046 HG21 THR 6 HG21 THR 6 -1.550 0.436 -6.832 1047 HG22 THR 6 HG22 THR 6 0.042 -0.322 -6.863 1048 HG23 THR 6 HG23 THR 6 -0.943 -0.399 -5.402 1049 H SER 7 H SER 7 -0.234 0.412 -2.027 1050 HA SER 7 HA SER 7 2.670 -0.028 -1.999 1051 HB2 SER 7 HB2 SER 7 1.222 1.064 -0.050 1052 HB3 SER 7 HB3 SER 7 0.975 -0.628 0.382 1053 HG SER 7 HG SER 7 3.224 -0.870 0.499 1054 H GLU 8 H GLU 8 3.049 -1.878 -3.095 1055 HA GLU 8 HA GLU 8 1.544 -4.273 -2.267 1056 HB2 GLU 8 HB2 GLU 8 2.670 -3.444 -4.918 1057 HB3 GLU 8 HB3 GLU 8 2.475 -5.151 -4.547 1058 HG2 GLU 8 HG2 GLU 8 0.560 -4.380 -5.762 1059 HG3 GLU 8 HG3 GLU 8 0.084 -4.751 -4.106 1060 H LYS 9 H LYS 9 2.716 -5.405 -0.868 1061 HA LYS 9 HA LYS 9 5.630 -5.530 -1.215 1062 HB2 LYS 9 HB2 LYS 9 4.913 -4.767 0.976 1063 HB3 LYS 9 HB3 LYS 9 3.890 -6.185 1.169 1064 HG2 LYS 9 HG2 LYS 9 5.785 -7.623 1.315 1065 HG3 LYS 9 HG3 LYS 9 6.881 -6.314 0.867 1066 HD2 LYS 9 HD2 LYS 9 6.560 -5.206 2.923 1067 HD3 LYS 9 HD3 LYS 9 5.144 -6.183 3.319 1068 HE2 LYS 9 HE2 LYS 9 6.423 -8.044 3.856 1069 HE3 LYS 9 HE3 LYS 9 7.814 -7.478 2.933 1070 HZ1 LYS 9 HZ1 LYS 9 8.622 -6.727 4.840 1071 HZ2 LYS 9 HZ2 LYS 9 7.389 -5.569 4.866 1072 HZ3 LYS 9 HZ3 LYS 9 7.181 -7.044 5.668 1073 H SER 10 H SER 10 6.207 -7.196 -2.458 1074 HA SER 10 HA SER 10 5.589 -9.873 -1.622 1075 HB2 SER 10 HB2 SER 10 4.739 -9.137 -4.422 1076 HB3 SER 10 HB3 SER 10 4.428 -10.637 -3.549 1077 HG SER 10 HG SER 10 2.709 -9.752 -2.750 1078 H GLN 11 H GLN 11 7.159 -11.279 -2.218 1079 HA GLN 11 HA GLN 11 9.454 -10.173 -3.600 1080 HB2 GLN 11 HB2 GLN 11 10.559 -12.297 -2.941 1081 HB3 GLN 11 HB3 GLN 11 9.879 -11.419 -1.577 1082 HG2 GLN 11 HG2 GLN 11 8.309 -13.000 -1.157 1083 HG3 GLN 11 HG3 GLN 11 8.174 -13.475 -2.850 1084 HE21 GLN 11 HE21 GLN 11 8.205 -15.642 -1.906 1085 HE22 GLN 11 HE22 GLN 11 9.731 -16.388 -1.590 1086 H THR 12 H THR 12 7.324 -10.419 -5.324 1087 HA THR 12 HA THR 12 8.417 -12.282 -7.265 1088 HB THR 12 HB THR 12 5.739 -12.764 -7.650 1089 HG1 THR 12 HG1 THR 12 5.383 -11.828 -5.510 1090 HG21 THR 12 HG21 THR 12 6.612 -14.888 -6.081 1091 HG22 THR 12 HG22 THR 12 6.772 -14.737 -7.831 1092 HG23 THR 12 HG23 THR 12 8.088 -14.219 -6.777 1093 HA PRO 13 HA PRO 13 7.274 -9.227 -10.201 1094 HB2 PRO 13 HB2 PRO 13 6.478 -10.701 -12.338 1095 HB3 PRO 13 HB3 PRO 13 8.167 -10.577 -11.832 1096 HG2 PRO 13 HG2 PRO 13 6.184 -12.755 -11.298 1097 HG3 PRO 13 HG3 PRO 13 7.890 -12.885 -11.763 1098 HD2 PRO 13 HD2 PRO 13 7.048 -13.197 -9.208 1099 HD3 PRO 13 HD3 PRO 13 8.634 -12.510 -9.613 1100 H LEU 14 H LEU 14 5.528 -8.042 -9.621 1101 HA LEU 14 HA LEU 14 2.860 -9.199 -10.078 1102 HB2 LEU 14 HB2 LEU 14 1.991 -7.716 -8.454 1103 HB3 LEU 14 HB3 LEU 14 3.440 -8.442 -7.762 1104 HG LEU 14 HG LEU 14 3.526 -5.736 -9.056 1105 HD11 LEU 14 HD11 LEU 14 3.442 -5.416 -6.269 1106 HD12 LEU 14 HD12 LEU 14 2.263 -4.863 -7.458 1107 HD13 LEU 14 HD13 LEU 14 2.071 -6.440 -6.692 1108 HD21 LEU 14 HD21 LEU 14 5.688 -6.380 -8.670 1109 HD22 LEU 14 HD22 LEU 14 5.312 -5.617 -7.126 1110 HD23 LEU 14 HD23 LEU 14 5.263 -7.373 -7.277 1111 H VAL 15 H VAL 15 1.483 -6.717 -10.006 1112 HA VAL 15 HA VAL 15 2.511 -4.931 -11.979 1113 HB VAL 15 HB VAL 15 1.943 -6.731 -13.504 1114 HG11 VAL 15 HG11 VAL 15 -0.889 -6.785 -13.350 1115 HG12 VAL 15 HG12 VAL 15 0.250 -8.107 -13.098 1116 HG13 VAL 15 HG13 VAL 15 -0.250 -7.103 -11.738 1117 HG21 VAL 15 HG21 VAL 15 1.078 -4.118 -13.697 1118 HG22 VAL 15 HG22 VAL 15 1.166 -5.284 -15.017 1119 HG23 VAL 15 HG23 VAL 15 -0.347 -5.057 -14.141 1120 H THR 16 H THR 16 1.507 -3.008 -11.837 1121 HA THR 16 HA THR 16 -0.731 -2.790 -9.984 1122 HB THR 16 HB THR 16 1.059 -1.244 -9.579 1123 HG1 THR 16 HG1 THR 16 -0.420 0.201 -9.166 1124 HG21 THR 16 HG21 THR 16 1.162 -1.114 -12.444 1125 HG22 THR 16 HG22 THR 16 1.005 0.513 -11.780 1126 HG23 THR 16 HG23 THR 16 2.332 -0.527 -11.262 1127 H LEU 17 H LEU 17 -2.703 -3.008 -10.817 1128 HA LEU 17 HA LEU 17 -3.250 -2.273 -13.569 1129 HB2 LEU 17 HB2 LEU 17 -4.141 -4.317 -12.181 1130 HB3 LEU 17 HB3 LEU 17 -5.363 -3.158 -11.660 1131 HG LEU 17 HG LEU 17 -4.818 -3.996 -14.508 1132 HD11 LEU 17 HD11 LEU 17 -7.384 -4.676 -13.952 1133 HD12 LEU 17 HD12 LEU 17 -6.013 -5.782 -13.866 1134 HD13 LEU 17 HD13 LEU 17 -6.602 -4.992 -12.403 1135 HD21 LEU 17 HD21 LEU 17 -7.008 -2.759 -14.874 1136 HD22 LEU 17 HD22 LEU 17 -6.733 -2.024 -13.295 1137 HD23 LEU 17 HD23 LEU 17 -5.573 -1.771 -14.599 1138 H PHE 18 H PHE 18 -3.257 -0.076 -13.740 1139 HA PHE 18 HA PHE 18 -5.197 1.373 -12.061 1140 HB2 PHE 18 HB2 PHE 18 -2.470 2.058 -12.982 1141 HB3 PHE 18 HB3 PHE 18 -3.650 3.362 -13.045 1142 HD1 PHE 18 HD1 PHE 18 -5.206 3.349 -10.792 1143 HD2 PHE 18 HD2 PHE 18 -1.171 2.033 -11.105 1144 HE1 PHE 18 HE1 PHE 18 -4.892 3.751 -8.385 1145 HE2 PHE 18 HE2 PHE 18 -0.850 2.432 -8.699 1146 HZ PHE 18 HZ PHE 18 -2.712 3.292 -7.335 1147 H LYS 19 H LYS 19 -7.012 1.616 -13.195 1148 HA LYS 19 HA LYS 19 -6.788 2.461 -16.010 1149 HB2 LYS 19 HB2 LYS 19 -9.020 1.435 -16.350 1150 HB3 LYS 19 HB3 LYS 19 -7.793 0.265 -15.882 1151 HG2 LYS 19 HG2 LYS 19 -8.642 0.495 -13.520 1152 HG3 LYS 19 HG3 LYS 19 -9.998 1.406 -14.190 1153 HD2 LYS 19 HD2 LYS 19 -9.290 -1.301 -15.264 1154 HD3 LYS 19 HD3 LYS 19 -10.267 -1.138 -13.803 1155 HE2 LYS 19 HE2 LYS 19 -11.843 -1.285 -15.515 1156 HE3 LYS 19 HE3 LYS 19 -11.727 0.446 -15.198 1157 HZ1 LYS 19 HZ1 LYS 19 -11.022 0.814 -17.256 1158 HZ2 LYS 19 HZ2 LYS 19 -9.847 -0.399 -17.169 1159 HZ3 LYS 19 HZ3 LYS 19 -11.430 -0.786 -17.623 1160 H ASN 20 H ASN 20 -8.121 4.116 -16.740 1161 HA ASN 20 HA ASN 20 -9.196 6.117 -16.596 1162 HB2 ASN 20 HB2 ASN 20 -10.710 4.401 -14.654 1163 HB3 ASN 20 HB3 ASN 20 -11.125 6.104 -14.831 1164 HD21 ASN 20 HD21 ASN 20 -13.175 5.440 -15.599 1165 HD22 ASN 20 HD22 ASN 20 -13.376 4.900 -17.228 1166 H ALA 21 H ALA 21 -6.774 5.818 -15.081 1167 HA ALA 21 HA ALA 21 -7.045 6.987 -12.503 1168 HB1 ALA 21 HB1 ALA 21 -4.474 7.552 -13.278 1169 HB2 ALA 21 HB2 ALA 21 -5.008 6.071 -12.483 1170 HB3 ALA 21 HB3 ALA 21 -4.868 6.127 -14.240 1171 H ILE 22 H ILE 22 -7.630 9.005 -12.083 1172 HA ILE 22 HA ILE 22 -6.828 11.125 -13.966 1173 HB ILE 22 HB ILE 22 -9.372 11.014 -12.342 1174 HG12 ILE 22 HG12 ILE 22 -8.997 10.908 -15.341 1175 HG13 ILE 22 HG13 ILE 22 -9.293 9.498 -14.330 1176 HG21 ILE 22 HG21 ILE 22 -8.546 13.282 -12.535 1177 HG22 ILE 22 HG22 ILE 22 -8.360 13.091 -14.278 1178 HG23 ILE 22 HG23 ILE 22 -9.968 13.070 -13.556 1179 HD11 ILE 22 HD11 ILE 22 -11.278 11.482 -13.803 1180 HD12 ILE 22 HD12 ILE 22 -11.175 11.183 -15.538 1181 HD13 ILE 22 HD13 ILE 22 -11.471 9.844 -14.428 1182 H ILE 23 H ILE 23 -5.337 12.374 -13.067 1183 HA ILE 23 HA ILE 23 -5.292 12.704 -10.157 1184 HB ILE 23 HB ILE 23 -3.237 13.221 -12.294 1185 HG12 ILE 23 HG12 ILE 23 -3.464 10.920 -11.430 1186 HG13 ILE 23 HG13 ILE 23 -1.911 11.629 -11.002 1187 HG21 ILE 23 HG21 ILE 23 -3.227 14.130 -9.427 1188 HG22 ILE 23 HG22 ILE 23 -1.761 13.978 -10.395 1189 HG23 ILE 23 HG23 ILE 23 -3.025 15.109 -10.880 1190 HD11 ILE 23 HD11 ILE 23 -2.922 12.190 -8.766 1191 HD12 ILE 23 HD12 ILE 23 -4.289 11.178 -9.230 1192 HD13 ILE 23 HD13 ILE 23 -2.677 10.476 -9.098 1193 H LYS 24 H LYS 24 -6.490 14.350 -9.457 1194 HA LYS 24 HA LYS 24 -6.382 16.889 -10.951 1195 HB2 LYS 24 HB2 LYS 24 -8.598 15.470 -9.576 1196 HB3 LYS 24 HB3 LYS 24 -8.569 17.222 -9.426 1197 HG2 LYS 24 HG2 LYS 24 -8.360 17.263 -11.969 1198 HG3 LYS 24 HG3 LYS 24 -8.827 15.562 -11.908 1199 HD2 LYS 24 HD2 LYS 24 -10.901 16.133 -10.803 1200 HD3 LYS 24 HD3 LYS 24 -10.422 17.830 -10.716 1201 HE2 LYS 24 HE2 LYS 24 -10.396 17.929 -13.170 1202 HE3 LYS 24 HE3 LYS 24 -10.908 16.244 -13.237 1203 HZ1 LYS 24 HZ1 LYS 24 -12.455 18.622 -12.676 1204 HZ2 LYS 24 HZ2 LYS 24 -12.945 17.139 -13.327 1205 HZ3 LYS 24 HZ3 LYS 24 -12.781 17.315 -11.652 1206 H ASN 25 H ASN 25 -4.847 18.069 -9.963 1207 HA ASN 25 HA ASN 25 -3.683 19.174 -8.347 1208 HB2 ASN 25 HB2 ASN 25 -6.500 19.237 -7.292 1209 HB3 ASN 25 HB3 ASN 25 -5.182 19.996 -6.404 1210 HD21 ASN 25 HD21 ASN 25 -5.114 22.086 -6.736 1211 HD22 ASN 25 HD22 ASN 25 -5.443 22.898 -8.225 1212 H ALA 26 H ALA 26 -3.102 16.590 -8.182 1213 HA ALA 26 HA ALA 26 -3.640 15.431 -5.624 1214 HB1 ALA 26 HB1 ALA 26 -1.871 13.794 -6.301 1215 HB2 ALA 26 HB2 ALA 26 -3.205 13.955 -7.444 1216 HB3 ALA 26 HB3 ALA 26 -1.657 14.731 -7.780 1217 H TYR 27 H TYR 27 -0.492 16.334 -7.034 1218 HA TYR 27 HA TYR 27 0.567 16.761 -4.360 1219 HB2 TYR 27 HB2 TYR 27 1.753 15.558 -6.345 1220 HB3 TYR 27 HB3 TYR 27 2.130 17.189 -6.887 1221 HD1 TYR 27 HD1 TYR 27 4.031 18.254 -6.079 1222 HD2 TYR 27 HD2 TYR 27 2.416 14.977 -3.899 1223 HE1 TYR 27 HE1 TYR 27 5.969 18.313 -4.566 1224 HE2 TYR 27 HE2 TYR 27 4.349 15.027 -2.379 1225 HH TYR 27 HH TYR 27 6.718 15.817 -2.441 1226 H LYS 28 H LYS 28 -0.374 18.660 -3.660 1227 HA LYS 28 HA LYS 28 -0.649 21.018 -5.138 1228 HB2 LYS 28 HB2 LYS 28 -0.381 20.551 -2.169 1229 HB3 LYS 28 HB3 LYS 28 -0.723 22.130 -2.862 1230 HG2 LYS 28 HG2 LYS 28 -2.679 20.840 -4.039 1231 HG3 LYS 28 HG3 LYS 28 -2.449 19.714 -2.700 1232 HD2 LYS 28 HD2 LYS 28 -3.974 21.130 -1.755 1233 HD3 LYS 28 HD3 LYS 28 -2.481 21.946 -1.284 1234 HE2 LYS 28 HE2 LYS 28 -3.887 22.630 -3.843 1235 HE3 LYS 28 HE3 LYS 28 -4.384 23.348 -2.311 1236 HZ1 LYS 28 HZ1 LYS 28 -2.863 24.873 -2.993 1237 HZ2 LYS 28 HZ2 LYS 28 -1.822 23.835 -2.156 1238 HZ3 LYS 28 HZ3 LYS 28 -1.924 23.751 -3.842 1239 H LYS 29 H LYS 29 0.499 23.117 -4.077 1240 HA LYS 29 HA LYS 29 3.292 22.814 -4.811 1241 HB2 LYS 29 HB2 LYS 29 3.348 25.275 -4.725 1242 HB3 LYS 29 HB3 LYS 29 2.049 24.683 -5.752 1243 HG2 LYS 29 HG2 LYS 29 0.425 25.487 -4.399 1244 HG3 LYS 29 HG3 LYS 29 1.364 25.220 -2.929 1245 HD2 LYS 29 HD2 LYS 29 2.602 27.197 -3.235 1246 HD3 LYS 29 HD3 LYS 29 2.094 27.351 -4.919 1247 HE2 LYS 29 HE2 LYS 29 0.763 28.925 -3.891 1248 HE3 LYS 29 HE3 LYS 29 -0.295 27.515 -3.888 1249 HZ1 LYS 29 HZ1 LYS 29 1.459 28.024 -1.582 1250 HZ2 LYS 29 HZ2 LYS 29 0.012 28.888 -1.736 1251 HZ3 LYS 29 HZ3 LYS 29 -0.017 27.199 -1.642 1252 H GLY 30 H GLY 30 3.118 21.431 -2.595 1253 HA2 GLY 30 HA2 GLY 30 3.848 23.209 -0.365 1254 HA3 GLY 30 HA3 GLY 30 3.329 21.538 -0.205 1255 H GLU 31 H GLU 31 5.939 23.541 -0.044 1256 HA GLU 31 HA GLU 31 7.771 21.298 -0.036 1257 HB2 GLU 31 HB2 GLU 31 7.981 23.563 -2.003 1258 HB3 GLU 31 HB3 GLU 31 9.405 22.677 -1.478 1259 HG2 GLU 31 HG2 GLU 31 6.995 21.517 -2.855 1260 HG3 GLU 31 HG3 GLU 31 8.578 21.803 -3.575 1261 H1 TYR 1 H TYR 1 3.923 11.131 -4.539 1262 HA TYR 1 HA TYR 1 5.523 13.536 -3.955 1263 HB2 TYR 1 HB2 TYR 1 6.206 11.036 -5.484 1264 HB3 TYR 1 HB3 TYR 1 7.090 12.535 -5.743 1265 HD1 TYR 1 HD1 TYR 1 7.573 9.579 -4.321 1266 HD2 TYR 1 HD2 TYR 1 7.403 13.653 -3.103 1267 HE1 TYR 1 HE1 TYR 1 9.010 9.057 -2.395 1268 HE2 TYR 1 HE2 TYR 1 8.840 13.142 -1.174 1269 HH TYR 1 HH TYR 1 10.730 10.972 -0.810 1270 H GLY 2 H GLY 2 3.686 11.772 -6.393 1271 HA2 GLY 2 HA2 GLY 2 2.810 14.177 -7.639 1272 HA3 GLY 2 HA3 GLY 2 4.055 13.396 -8.603 1273 H GLY 3 H GLY 3 0.872 13.768 -8.466 1274 HA2 GLY 3 HA2 GLY 3 -0.950 12.591 -9.226 1275 HA3 GLY 3 HA3 GLY 3 0.209 11.793 -10.279 1276 H PHE 4 H PHE 4 -0.168 9.681 -10.202 1277 HA PHE 4 HA PHE 4 -1.200 8.411 -7.833 1278 HB2 PHE 4 HB2 PHE 4 -0.503 7.483 -10.600 1279 HB3 PHE 4 HB3 PHE 4 -0.800 6.307 -9.324 1280 HD1 PHE 4 HD1 PHE 4 -2.975 5.705 -8.740 1281 HD2 PHE 4 HD2 PHE 4 -2.318 9.181 -11.108 1282 HE1 PHE 4 HE1 PHE 4 -5.397 5.895 -9.128 1283 HE2 PHE 4 HE2 PHE 4 -4.739 9.376 -11.500 1284 HZ PHE 4 HZ PHE 4 -6.282 7.732 -10.509 1285 H MET 5 H MET 5 -0.173 6.894 -6.539 1286 HA MET 5 HA MET 5 2.763 6.970 -6.662 1287 HB2 MET 5 HB2 MET 5 1.378 7.763 -4.597 1288 HB3 MET 5 HB3 MET 5 1.215 6.044 -4.266 1289 HG2 MET 5 HG2 MET 5 3.051 6.759 -3.003 1290 HG3 MET 5 HG3 MET 5 3.733 5.913 -4.390 1291 HE1 MET 5 HE1 MET 5 6.474 7.800 -4.103 1292 HE2 MET 5 HE2 MET 5 5.803 8.858 -2.861 1293 HE3 MET 5 HE3 MET 5 5.458 7.129 -2.827 1294 H THR 6 H THR 6 3.324 5.269 -7.928 1295 HA THR 6 HA THR 6 2.090 2.663 -7.471 1296 HB THR 6 HB THR 6 4.289 2.994 -9.449 1297 HG1 THR 6 HG1 THR 6 3.265 4.492 -10.522 1298 HG21 THR 6 HG21 THR 6 1.792 1.796 -10.319 1299 HG22 THR 6 HG22 THR 6 3.418 1.114 -10.291 1300 HG23 THR 6 HG23 THR 6 2.407 1.045 -8.847 1301 H SER 7 H SER 7 2.951 2.040 -5.492 1302 HA SER 7 HA SER 7 5.872 1.780 -5.332 1303 HB2 SER 7 HB2 SER 7 4.276 2.856 -3.490 1304 HB3 SER 7 HB3 SER 7 4.123 1.170 -2.994 1305 HG SER 7 HG SER 7 6.378 1.085 -2.785 1306 H GLU 8 H GLU 8 6.408 -0.085 -6.332 1307 HA GLU 8 HA GLU 8 5.023 -2.534 -5.453 1308 HB2 GLU 8 HB2 GLU 8 6.182 -1.747 -8.102 1309 HB3 GLU 8 HB3 GLU 8 6.077 -3.446 -7.664 1310 HG2 GLU 8 HG2 GLU 8 4.159 -2.855 -8.964 1311 HG3 GLU 8 HG3 GLU 8 3.650 -3.165 -7.305 1312 H LYS 9 H LYS 9 6.220 -3.516 -3.961 1313 HA LYS 9 HA LYS 9 9.144 -3.454 -4.198 1314 HB2 LYS 9 HB2 LYS 9 8.240 -2.709 -2.057 1315 HB3 LYS 9 HB3 LYS 9 7.369 -4.227 -1.874 1316 HG2 LYS 9 HG2 LYS 9 9.386 -5.448 -1.600 1317 HG3 LYS 9 HG3 LYS 9 10.365 -4.058 -2.075 1318 HD2 LYS 9 HD2 LYS 9 9.865 -2.901 -0.076 1319 HD3 LYS 9 HD3 LYS 9 8.556 -4.015 0.329 1320 HE2 LYS 9 HE2 LYS 9 10.019 -5.697 0.972 1321 HE3 LYS 9 HE3 LYS 9 11.360 -5.021 0.050 1322 HZ1 LYS 9 HZ1 LYS 9 12.040 -4.109 1.937 1323 HZ2 LYS 9 HZ2 LYS 9 10.688 -3.091 1.890 1324 HZ3 LYS 9 HZ3 LYS 9 10.623 -4.546 2.752 1325 H SER 10 H SER 10 9.881 -5.091 -5.398 1326 HA SER 10 HA SER 10 9.436 -7.793 -4.528 1327 HB2 SER 10 HB2 SER 10 8.633 -7.148 -7.368 1328 HB3 SER 10 HB3 SER 10 8.433 -8.674 -6.505 1329 HG SER 10 HG SER 10 6.612 -7.954 -5.768 1330 H GLN 11 H GLN 11 11.092 -9.130 -5.101 1331 HA GLN 11 HA GLN 11 13.358 -7.864 -6.417 1332 HB2 GLN 11 HB2 GLN 11 14.606 -9.871 -5.641 1333 HB3 GLN 11 HB3 GLN 11 13.828 -8.984 -4.337 1334 HG2 GLN 11 HG2 GLN 11 12.373 -10.658 -3.873 1335 HG3 GLN 11 HG3 GLN 11 12.310 -11.218 -5.543 1336 HE21 GLN 11 HE21 GLN 11 12.478 -13.332 -4.500 1337 HE22 GLN 11 HE22 GLN 11 14.047 -13.948 -4.122 1338 H THR 12 H THR 12 11.284 -8.380 -8.173 1339 HA THR 12 HA THR 12 12.594 -10.221 -10.004 1340 HB THR 12 HB THR 12 9.992 -10.939 -10.460 1341 HG1 THR 12 HG1 THR 12 9.452 -9.909 -8.404 1342 HG21 THR 12 HG21 THR 12 10.940 -12.890 -8.719 1343 HG22 THR 12 HG22 THR 12 11.180 -12.832 -10.465 1344 HG23 THR 12 HG23 THR 12 12.395 -12.149 -9.385 1345 HA PRO 13 HA PRO 13 11.310 -7.411 -13.120 1346 HB2 PRO 13 HB2 PRO 13 10.643 -9.036 -15.190 1347 HB3 PRO 13 HB3 PRO 13 12.312 -8.785 -14.666 1348 HG2 PRO 13 HG2 PRO 13 10.455 -11.050 -14.051 1349 HG3 PRO 13 HG3 PRO 13 12.174 -11.099 -14.482 1350 HD2 PRO 13 HD2 PRO 13 11.306 -11.333 -11.928 1351 HD3 PRO 13 HD3 PRO 13 12.855 -10.571 -12.344 1352 H LEU 14 H LEU 14 9.484 -6.316 -12.601 1353 HA LEU 14 HA LEU 14 6.901 -7.651 -13.057 1354 HB2 LEU 14 HB2 LEU 14 5.913 -6.174 -11.504 1355 HB3 LEU 14 HB3 LEU 14 7.399 -6.765 -10.764 1356 HG LEU 14 HG LEU 14 7.326 -4.119 -12.174 1357 HD11 LEU 14 HD11 LEU 14 7.139 -3.700 -9.397 1358 HD12 LEU 14 HD12 LEU 14 5.979 -3.248 -10.646 1359 HD13 LEU 14 HD13 LEU 14 5.839 -4.808 -9.834 1360 HD21 LEU 14 HD21 LEU 14 9.515 -4.597 -11.704 1361 HD22 LEU 14 HD22 LEU 14 9.045 -3.787 -10.209 1362 HD23 LEU 14 HD23 LEU 14 9.117 -5.548 -10.273 1363 H VAL 15 H VAL 15 5.336 -5.319 -13.148 1364 HA VAL 15 HA VAL 15 6.300 -3.523 -15.155 1365 HB VAL 15 HB VAL 15 5.891 -5.415 -16.618 1366 HG11 VAL 15 HG11 VAL 15 3.067 -5.661 -16.521 1367 HG12 VAL 15 HG12 VAL 15 4.289 -6.890 -16.192 1368 HG13 VAL 15 HG13 VAL 15 3.688 -5.870 -14.884 1369 HG21 VAL 15 HG21 VAL 15 4.859 -2.879 -16.937 1370 HG22 VAL 15 HG22 VAL 15 5.048 -4.089 -18.205 1371 HG23 VAL 15 HG23 VAL 15 3.506 -3.927 -17.364 1372 H THR 16 H THR 16 5.156 -1.672 -15.127 1373 HA THR 16 HA THR 16 2.864 -1.539 -13.331 1374 HB THR 16 HB THR 16 4.522 0.140 -12.928 1375 HG1 THR 16 HG1 THR 16 2.950 1.514 -12.641 1376 HG21 THR 16 HG21 THR 16 4.749 0.151 -15.784 1377 HG22 THR 16 HG22 THR 16 4.443 1.792 -15.213 1378 HG23 THR 16 HG23 THR 16 5.816 0.881 -14.583 1379 H LEU 17 H LEU 17 0.923 -1.884 -14.189 1380 HA LEU 17 HA LEU 17 0.409 -1.302 -16.986 1381 HB2 LEU 17 HB2 LEU 17 -0.395 -3.338 -15.530 1382 HB3 LEU 17 HB3 LEU 17 -1.701 -2.235 -15.099 1383 HG LEU 17 HG LEU 17 -1.014 -3.163 -17.888 1384 HD11 LEU 17 HD11 LEU 17 -3.553 -3.972 -17.374 1385 HD12 LEU 17 HD12 LEU 17 -2.122 -4.988 -17.207 1386 HD13 LEU 17 HD13 LEU 17 -2.796 -4.178 -15.794 1387 HD21 LEU 17 HD21 LEU 17 -3.267 -2.082 -18.370 1388 HD22 LEU 17 HD22 LEU 17 -3.078 -1.256 -16.823 1389 HD23 LEU 17 HD23 LEU 17 -1.900 -0.998 -18.111 1390 H PHE 18 H PHE 18 0.265 0.879 -17.255 1391 HA PHE 18 HA PHE 18 -1.795 2.275 -15.677 1392 HB2 PHE 18 HB2 PHE 18 0.904 3.088 -16.576 1393 HB3 PHE 18 HB3 PHE 18 -0.352 4.313 -16.717 1394 HD1 PHE 18 HD1 PHE 18 -1.952 4.294 -14.493 1395 HD2 PHE 18 HD2 PHE 18 2.164 3.225 -14.678 1396 HE1 PHE 18 HE1 PHE 18 -1.713 4.815 -12.100 1397 HE2 PHE 18 HE2 PHE 18 2.409 3.743 -12.285 1398 HZ PHE 18 HZ PHE 18 0.469 4.538 -10.993 1399 H LYS 19 H LYS 19 -3.595 2.314 -16.866 1400 HA LYS 19 HA LYS 19 -3.364 3.065 -19.707 1401 HB2 LYS 19 HB2 LYS 19 -5.519 1.885 -20.043 1402 HB3 LYS 19 HB3 LYS 19 -4.230 0.817 -19.501 1403 HG2 LYS 19 HG2 LYS 19 -5.144 1.097 -17.167 1404 HG3 LYS 19 HG3 LYS 19 -6.541 1.883 -17.905 1405 HD2 LYS 19 HD2 LYS 19 -5.633 -0.813 -18.844 1406 HD3 LYS 19 HD3 LYS 19 -6.644 -0.655 -17.405 1407 HE2 LYS 19 HE2 LYS 19 -8.175 -0.983 -19.134 1408 HE3 LYS 19 HE3 LYS 19 -8.185 0.762 -18.887 1409 HZ1 LYS 19 HZ1 LYS 19 -7.470 1.097 -20.948 1410 HZ2 LYS 19 HZ2 LYS 19 -6.217 -0.030 -20.794 1411 HZ3 LYS 19 HZ3 LYS 19 -7.763 -0.541 -21.255 1412 H ASN 20 H ASN 20 -4.776 4.602 -20.534 1413 HA ASN 20 HA ASN 20 -5.978 6.535 -20.500 1414 HB2 ASN 20 HB2 ASN 20 -7.430 4.810 -18.518 1415 HB3 ASN 20 HB3 ASN 20 -7.946 6.473 -18.783 1416 HD21 ASN 20 HD21 ASN 20 -9.930 5.641 -19.565 1417 HD22 ASN 20 HD22 ASN 20 -10.054 5.018 -21.172 1418 H ALA 21 H ALA 21 -3.580 6.469 -18.934 1419 HA ALA 21 HA ALA 21 -3.990 7.723 -16.412 1420 HB1 ALA 21 HB1 ALA 21 -1.440 8.408 -17.120 1421 HB2 ALA 21 HB2 ALA 21 -1.908 6.910 -16.315 1422 HB3 ALA 21 HB3 ALA 21 -1.711 6.946 -18.068 1423 H ILE 22 H ILE 22 -4.727 9.712 -16.110 1424 HA ILE 22 HA ILE 22 -4.000 11.793 -18.068 1425 HB ILE 22 HB ILE 22 -6.569 11.595 -16.491 1426 HG12 ILE 22 HG12 ILE 22 -6.123 11.395 -19.476 1427 HG13 ILE 22 HG13 ILE 22 -6.347 10.008 -18.415 1428 HG21 ILE 22 HG21 ILE 22 -5.881 13.901 -16.760 1429 HG22 ILE 22 HG22 ILE 22 -5.640 13.652 -18.490 1430 HG23 ILE 22 HG23 ILE 22 -7.262 13.559 -17.803 1431 HD11 ILE 22 HD11 ILE 22 -8.468 11.876 -18.003 1432 HD12 ILE 22 HD12 ILE 22 -8.310 11.519 -19.722 1433 HD13 ILE 22 HD13 ILE 22 -8.540 10.206 -18.567 1434 H ILE 23 H ILE 23 -2.613 13.177 -17.201 1435 HA ILE 23 HA ILE 23 -2.651 13.639 -14.309 1436 HB ILE 23 HB ILE 23 -0.584 14.202 -16.425 1437 HG12 ILE 23 HG12 ILE 23 -0.691 11.916 -15.503 1438 HG13 ILE 23 HG13 ILE 23 0.806 12.728 -15.058 1439 HG21 ILE 23 HG21 ILE 23 -0.705 15.198 -13.590 1440 HG22 ILE 23 HG22 ILE 23 0.800 15.087 -14.503 1441 HG23 ILE 23 HG23 ILE 23 -0.500 16.136 -15.070 1442 HD11 ILE 23 HD11 ILE 23 -0.281 13.281 -12.862 1443 HD12 ILE 23 HD12 ILE 23 -1.587 12.192 -13.328 1444 HD13 ILE 23 HD13 ILE 23 0.054 11.573 -13.146 1445 H LYS 24 H LYS 24 -3.956 15.241 -13.707 1446 HA LYS 24 HA LYS 24 -3.973 17.709 -15.318 1447 HB2 LYS 24 HB2 LYS 24 -6.126 16.228 -13.905 1448 HB3 LYS 24 HB3 LYS 24 -6.205 17.984 -13.856 1449 HG2 LYS 24 HG2 LYS 24 -5.951 17.897 -16.392 1450 HG3 LYS 24 HG3 LYS 24 -6.309 16.175 -16.245 1451 HD2 LYS 24 HD2 LYS 24 -8.439 16.664 -15.214 1452 HD3 LYS 24 HD3 LYS 24 -8.071 18.391 -15.200 1453 HE2 LYS 24 HE2 LYS 24 -7.997 18.376 -17.656 1454 HE3 LYS 24 HE3 LYS 24 -8.401 16.660 -17.650 1455 HZ1 LYS 24 HZ1 LYS 24 -10.105 18.960 -17.232 1456 HZ2 LYS 24 HZ2 LYS 24 -10.487 17.421 -17.822 1457 HZ3 LYS 24 HZ3 LYS 24 -10.372 17.683 -16.155 1458 H ASN 25 H ASN 25 -2.515 19.009 -14.359 1459 HA ASN 25 HA ASN 25 -1.454 20.260 -12.779 1460 HB2 ASN 25 HB2 ASN 25 -4.291 20.209 -11.777 1461 HB3 ASN 25 HB3 ASN 25 -3.036 21.088 -10.907 1462 HD21 ASN 25 HD21 ASN 25 -3.081 23.158 -11.343 1463 HD22 ASN 25 HD22 ASN 25 -3.429 23.875 -12.876 1464 H ALA 26 H ALA 26 -0.723 17.731 -12.476 1465 HA ALA 26 HA ALA 26 -1.251 16.659 -9.878 1466 HB1 ALA 26 HB1 ALA 26 0.634 15.107 -10.442 1467 HB2 ALA 26 HB2 ALA 26 -0.685 15.128 -11.612 1468 HB3 ALA 26 HB3 ALA 26 0.817 15.984 -11.961 1469 H TYR 27 H TYR 27 1.868 17.694 -11.265 1470 HA TYR 27 HA TYR 27 2.837 18.304 -8.592 1471 HB2 TYR 27 HB2 TYR 27 4.139 17.088 -10.494 1472 HB3 TYR 27 HB3 TYR 27 4.430 18.713 -11.103 1473 HD1 TYR 27 HD1 TYR 27 6.246 19.925 -10.310 1474 HD2 TYR 27 HD2 TYR 27 4.775 16.664 -8.007 1475 HE1 TYR 27 HE1 TYR 27 8.142 20.171 -8.762 1476 HE2 TYR 27 HE2 TYR 27 6.666 16.902 -6.452 1477 HH TYR 27 HH TYR 27 8.985 17.828 -6.502 1478 H LYS 28 H LYS 28 1.752 20.170 -8.010 1479 HA LYS 28 HA LYS 28 1.371 22.436 -9.598 1480 HB2 LYS 28 HB2 LYS 28 1.607 22.127 -6.605 1481 HB3 LYS 28 HB3 LYS 28 1.179 23.646 -7.381 1482 HG2 LYS 28 HG2 LYS 28 -0.668 22.180 -8.526 1483 HG3 LYS 28 HG3 LYS 28 -0.392 21.132 -7.133 1484 HD2 LYS 28 HD2 LYS 28 -2.023 22.489 -6.280 1485 HD3 LYS 28 HD3 LYS 28 -0.594 23.420 -5.823 1486 HE2 LYS 28 HE2 LYS 28 -1.987 23.895 -8.435 1487 HE3 LYS 28 HE3 LYS 28 -2.565 24.645 -6.948 1488 HZ1 LYS 28 HZ1 LYS 28 -1.133 26.237 -7.671 1489 HZ2 LYS 28 HZ2 LYS 28 -0.046 25.311 -6.763 1490 HZ3 LYS 28 HZ3 LYS 28 -0.101 25.143 -8.446 1491 H LYS 29 H LYS 29 2.366 24.649 -8.597 1492 HA LYS 29 HA LYS 29 5.188 24.487 -9.270 1493 HB2 LYS 29 HB2 LYS 29 5.090 26.949 -9.301 1494 HB3 LYS 29 HB3 LYS 29 3.857 26.228 -10.327 1495 HG2 LYS 29 HG2 LYS 29 2.154 27.000 -9.060 1496 HG3 LYS 29 HG3 LYS 29 3.059 26.843 -7.552 1497 HD2 LYS 29 HD2 LYS 29 4.194 28.874 -7.900 1498 HD3 LYS 29 HD3 LYS 29 3.732 28.936 -9.602 1499 HE2 LYS 29 HE2 LYS 29 2.282 30.468 -8.678 1500 HE3 LYS 29 HE3 LYS 29 1.305 29.000 -8.648 1501 HZ1 LYS 29 HZ1 LYS 29 2.957 29.701 -6.315 1502 HZ2 LYS 29 HZ2 LYS 29 1.468 30.471 -6.546 1503 HZ3 LYS 29 HZ3 LYS 29 1.534 28.788 -6.384 1504 H GLY 30 H GLY 30 5.032 23.203 -6.987 1505 HA2 GLY 30 HA2 GLY 30 5.608 25.128 -4.836 1506 HA3 GLY 30 HA3 GLY 30 5.185 23.438 -4.603 1507 H GLU 31 H GLU 31 7.666 25.600 -4.487 1508 HA GLU 31 HA GLU 31 9.628 23.475 -4.330 1509 HB2 GLU 31 HB2 GLU 31 9.745 25.649 -6.405 1510 HB3 GLU 31 HB3 GLU 31 11.211 24.886 -5.804 1511 HG2 GLU 31 HG2 GLU 31 8.914 23.501 -7.169 1512 HG3 GLU 31 HG3 GLU 31 10.492 23.856 -7.870 Start of MODEL 5 1 H1 TYR 1 H TYR 1 -7.400 1.571 15.565 2 HA TYR 1 HA TYR 1 -5.547 3.142 14.524 3 HB2 TYR 1 HB2 TYR 1 -7.424 1.239 13.235 4 HB3 TYR 1 HB3 TYR 1 -6.498 2.280 12.160 5 HD1 TYR 1 HD1 TYR 1 -5.467 0.759 15.399 6 HD2 TYR 1 HD2 TYR 1 -4.940 0.847 11.177 7 HE1 TYR 1 HE1 TYR 1 -3.535 -0.747 15.615 8 HE2 TYR 1 HE2 TYR 1 -3.007 -0.660 11.382 9 HH TYR 1 HH TYR 1 -2.357 -2.544 13.491 10 H GLY 2 H GLY 2 -8.656 3.193 12.794 11 HA2 GLY 2 HA2 GLY 2 -9.163 5.938 13.037 12 HA3 GLY 2 HA3 GLY 2 -8.183 5.699 11.597 13 H GLY 3 H GLY 3 -11.065 6.519 12.086 14 HA2 GLY 3 HA2 GLY 3 -13.110 6.196 11.093 15 HA3 GLY 3 HA3 GLY 3 -12.194 5.480 9.775 16 H PHE 4 H PHE 4 -13.273 3.689 9.235 17 HA PHE 4 HA PHE 4 -14.581 2.048 11.206 18 HB2 PHE 4 HB2 PHE 4 -14.308 1.986 8.226 19 HB3 PHE 4 HB3 PHE 4 -14.850 0.539 9.070 20 HD1 PHE 4 HD1 PHE 4 -17.028 0.401 10.016 21 HD2 PHE 4 HD2 PHE 4 -15.648 4.045 8.304 22 HE1 PHE 4 HE1 PHE 4 -19.320 1.294 10.076 23 HE2 PHE 4 HE2 PHE 4 -17.937 4.944 8.362 24 HZ PHE 4 HZ PHE 4 -19.777 3.568 9.250 25 H MET 5 H MET 5 -13.998 0.026 11.911 26 HA MET 5 HA MET 5 -11.278 -0.854 11.194 27 HB2 MET 5 HB2 MET 5 -11.779 0.031 13.586 28 HB3 MET 5 HB3 MET 5 -12.580 -1.518 13.816 29 HG2 MET 5 HG2 MET 5 -10.273 -2.407 12.843 30 HG3 MET 5 HG3 MET 5 -9.706 -0.887 13.530 31 HE1 MET 5 HE1 MET 5 -9.943 -4.706 15.519 32 HE2 MET 5 HE2 MET 5 -9.751 -4.212 13.838 33 HE3 MET 5 HE3 MET 5 -8.519 -3.791 15.027 34 H THR 6 H THR 6 -11.409 -2.576 9.915 35 HA THR 6 HA THR 6 -13.543 -4.542 10.389 36 HB THR 6 HB THR 6 -11.829 -4.146 7.928 37 HG1 THR 6 HG1 THR 6 -14.226 -3.694 7.238 38 HG21 THR 6 HG21 THR 6 -14.212 -5.952 8.362 39 HG22 THR 6 HG22 THR 6 -13.308 -5.756 6.860 40 HG23 THR 6 HG23 THR 6 -12.533 -6.486 8.267 41 H SER 7 H SER 7 -12.631 -5.790 11.996 42 HA SER 7 HA SER 7 -10.028 -7.027 11.438 43 HB2 SER 7 HB2 SER 7 -10.863 -5.871 13.728 44 HB3 SER 7 HB3 SER 7 -11.383 -7.529 14.029 45 HG SER 7 HG SER 7 -8.808 -6.489 13.735 46 H GLU 8 H GLU 8 -10.471 -8.689 10.065 47 HA GLU 8 HA GLU 8 -12.443 -10.682 10.969 48 HB2 GLU 8 HB2 GLU 8 -11.575 -9.796 8.247 49 HB3 GLU 8 HB3 GLU 8 -12.156 -11.440 8.468 50 HG2 GLU 8 HG2 GLU 8 -14.293 -10.791 8.810 51 HG3 GLU 8 HG3 GLU 8 -13.828 -9.283 9.594 52 H LYS 9 H LYS 9 -11.458 -12.285 12.006 53 HA LYS 9 HA LYS 9 -8.813 -13.171 11.084 54 HB2 LYS 9 HB2 LYS 9 -8.959 -12.522 13.446 55 HB3 LYS 9 HB3 LYS 9 -10.240 -13.701 13.698 56 HG2 LYS 9 HG2 LYS 9 -8.355 -15.322 12.715 57 HG3 LYS 9 HG3 LYS 9 -7.325 -14.088 13.445 58 HD2 LYS 9 HD2 LYS 9 -9.608 -15.184 15.021 59 HD3 LYS 9 HD3 LYS 9 -8.148 -16.160 14.839 60 HE2 LYS 9 HE2 LYS 9 -7.637 -15.005 16.750 61 HE3 LYS 9 HE3 LYS 9 -6.959 -13.922 15.536 62 HZ1 LYS 9 HZ1 LYS 9 -8.616 -13.121 17.447 63 HZ2 LYS 9 HZ2 LYS 9 -8.502 -12.355 15.942 64 HZ3 LYS 9 HZ3 LYS 9 -9.742 -13.468 16.232 65 H SER 10 H SER 10 -9.008 -14.727 9.598 66 HA SER 10 HA SER 10 -10.251 -17.216 10.322 67 HB2 SER 10 HB2 SER 10 -11.692 -17.291 8.257 68 HB3 SER 10 HB3 SER 10 -12.234 -16.146 9.484 69 HG SER 10 HG SER 10 -11.061 -15.663 6.985 70 H GLN 11 H GLN 11 -9.356 -18.925 9.260 71 HA GLN 11 HA GLN 11 -7.055 -18.344 7.596 72 HB2 GLN 11 HB2 GLN 11 -6.576 -20.749 7.805 73 HB3 GLN 11 HB3 GLN 11 -6.819 -19.990 9.373 74 HG2 GLN 11 HG2 GLN 11 -8.822 -21.059 9.734 75 HG3 GLN 11 HG3 GLN 11 -9.116 -21.315 8.015 76 HE21 GLN 11 HE21 GLN 11 -9.555 -23.502 8.393 77 HE22 GLN 11 HE22 GLN 11 -8.294 -24.639 8.708 78 H THR 12 H THR 12 -9.309 -17.612 6.258 79 HA THR 12 HA THR 12 -9.206 -19.376 3.961 80 HB THR 12 HB THR 12 -11.903 -18.970 3.994 81 HG1 THR 12 HG1 THR 12 -11.276 -19.780 6.640 82 HG21 THR 12 HG21 THR 12 -12.016 -21.381 4.775 83 HG22 THR 12 HG22 THR 12 -10.978 -21.065 3.384 84 HG23 THR 12 HG23 THR 12 -10.266 -21.298 4.980 85 HA PRO 13 HA PRO 13 -9.632 -15.654 1.676 86 HB2 PRO 13 HB2 PRO 13 -11.090 -16.444 -0.474 87 HB3 PRO 13 HB3 PRO 13 -9.402 -16.909 -0.236 88 HG2 PRO 13 HG2 PRO 13 -11.893 -18.468 0.330 89 HG3 PRO 13 HG3 PRO 13 -10.379 -19.011 -0.416 90 HD2 PRO 13 HD2 PRO 13 -10.979 -19.492 2.180 91 HD3 PRO 13 HD3 PRO 13 -9.315 -19.241 1.615 92 H LEU 14 H LEU 14 -10.833 -14.075 2.567 93 HA LEU 14 HA LEU 14 -13.766 -14.311 2.409 94 HB2 LEU 14 HB2 LEU 14 -13.958 -12.969 4.350 95 HB3 LEU 14 HB3 LEU 14 -12.768 -14.220 4.701 96 HG LEU 14 HG LEU 14 -11.930 -11.468 3.843 97 HD11 LEU 14 HD11 LEU 14 -11.595 -11.564 6.578 98 HD12 LEU 14 HD12 LEU 14 -12.816 -10.635 5.708 99 HD13 LEU 14 HD13 LEU 14 -13.207 -12.236 6.335 100 HD21 LEU 14 HD21 LEU 14 -10.067 -12.797 3.786 101 HD22 LEU 14 HD22 LEU 14 -10.024 -12.274 5.469 102 HD23 LEU 14 HD23 LEU 14 -10.654 -13.869 5.058 103 H VAL 15 H VAL 15 -14.266 -11.593 3.064 104 HA VAL 15 HA VAL 15 -12.912 -9.838 1.278 105 HB VAL 15 HB VAL 15 -14.105 -11.055 -0.439 106 HG11 VAL 15 HG11 VAL 15 -16.810 -10.376 0.090 107 HG12 VAL 15 HG12 VAL 15 -16.086 -11.977 -0.055 108 HG13 VAL 15 HG13 VAL 15 -16.157 -11.181 1.517 109 HG21 VAL 15 HG21 VAL 15 -14.173 -8.329 -0.083 110 HG22 VAL 15 HG22 VAL 15 -14.576 -9.185 -1.571 111 HG23 VAL 15 HG23 VAL 15 -15.853 -8.724 -0.445 112 H THR 16 H THR 16 -13.253 -7.781 1.881 113 HA THR 16 HA THR 16 -15.156 -7.291 4.024 114 HB THR 16 HB THR 16 -12.962 -6.397 4.392 115 HG1 THR 16 HG1 THR 16 -14.665 -4.235 3.648 116 HG21 THR 16 HG21 THR 16 -13.087 -5.793 1.593 117 HG22 THR 16 HG22 THR 16 -12.703 -4.327 2.496 118 HG23 THR 16 HG23 THR 16 -11.694 -5.762 2.673 119 H LEU 17 H LEU 17 -17.172 -6.781 3.480 120 HA LEU 17 HA LEU 17 -17.754 -5.463 0.965 121 HB2 LEU 17 HB2 LEU 17 -19.084 -7.362 2.158 122 HB3 LEU 17 HB3 LEU 17 -19.798 -6.033 3.068 123 HG LEU 17 HG LEU 17 -21.213 -6.735 1.197 124 HD11 LEU 17 HD11 LEU 17 -21.839 -4.616 0.601 125 HD12 LEU 17 HD12 LEU 17 -20.838 -4.268 2.010 126 HD13 LEU 17 HD13 LEU 17 -20.178 -4.064 0.387 127 HD21 LEU 17 HD21 LEU 17 -20.411 -7.188 -0.824 128 HD22 LEU 17 HD22 LEU 17 -19.663 -5.595 -0.942 129 HD23 LEU 17 HD23 LEU 17 -18.789 -6.925 -0.182 130 H PHE 18 H PHE 18 -17.068 -3.366 1.094 131 HA PHE 18 HA PHE 18 -18.221 -1.720 3.246 132 HB2 PHE 18 HB2 PHE 18 -15.607 -1.707 1.884 133 HB3 PHE 18 HB3 PHE 18 -16.328 -0.118 2.115 134 HD1 PHE 18 HD1 PHE 18 -17.522 -0.049 4.628 135 HD2 PHE 18 HD2 PHE 18 -14.040 -2.205 3.470 136 HE1 PHE 18 HE1 PHE 18 -16.740 -0.031 6.961 137 HE2 PHE 18 HE2 PHE 18 -13.252 -2.192 5.800 138 HZ PHE 18 HZ PHE 18 -14.603 -1.105 7.549 139 H LYS 19 H LYS 19 -20.128 -1.020 2.450 140 HA LYS 19 HA LYS 19 -20.208 0.079 -0.268 141 HB2 LYS 19 HB2 LYS 19 -22.261 -1.001 1.612 142 HB3 LYS 19 HB3 LYS 19 -22.762 0.196 0.424 143 HG2 LYS 19 HG2 LYS 19 -21.945 -1.228 -1.374 144 HG3 LYS 19 HG3 LYS 19 -21.407 -2.423 -0.192 145 HD2 LYS 19 HD2 LYS 19 -23.535 -3.098 -1.125 146 HD3 LYS 19 HD3 LYS 19 -23.742 -2.669 0.575 147 HE2 LYS 19 HE2 LYS 19 -24.685 -0.549 -0.008 148 HE3 LYS 19 HE3 LYS 19 -24.288 -0.781 -1.710 149 HZ1 LYS 19 HZ1 LYS 19 -25.948 -2.356 -1.966 150 HZ2 LYS 19 HZ2 LYS 19 -26.071 -2.667 -0.307 151 HZ3 LYS 19 HZ3 LYS 19 -26.676 -1.221 -0.944 152 H ASN 20 H ASN 20 -20.839 2.178 -0.693 153 HA ASN 20 HA ASN 20 -20.863 4.430 -0.341 154 HB2 ASN 20 HB2 ASN 20 -22.634 3.377 1.851 155 HB3 ASN 20 HB3 ASN 20 -22.349 5.105 1.670 156 HD21 ASN 20 HD21 ASN 20 -22.464 5.680 -0.848 157 HD22 ASN 20 HD22 ASN 20 -23.945 5.181 -1.585 158 H ALA 21 H ALA 21 -18.596 3.045 0.723 159 HA ALA 21 HA ALA 21 -17.944 3.917 3.332 160 HB1 ALA 21 HB1 ALA 21 -16.415 2.797 1.037 161 HB2 ALA 21 HB2 ALA 21 -15.528 3.537 2.369 162 HB3 ALA 21 HB3 ALA 21 -16.608 2.177 2.677 163 H ILE 22 H ILE 22 -17.939 6.013 3.857 164 HA ILE 22 HA ILE 22 -16.380 7.846 2.162 165 HB ILE 22 HB ILE 22 -18.667 8.431 1.771 166 HG12 ILE 22 HG12 ILE 22 -16.819 10.201 2.583 167 HG13 ILE 22 HG13 ILE 22 -18.446 10.677 2.109 168 HG21 ILE 22 HG21 ILE 22 -18.960 8.400 4.768 169 HG22 ILE 22 HG22 ILE 22 -20.167 9.062 3.665 170 HG23 ILE 22 HG23 ILE 22 -19.757 7.348 3.599 171 HD11 ILE 22 HD11 ILE 22 -17.462 11.616 4.283 172 HD12 ILE 22 HD12 ILE 22 -19.118 11.010 4.301 173 HD13 ILE 22 HD13 ILE 22 -17.811 10.024 4.955 174 H ILE 23 H ILE 23 -14.822 8.903 3.204 175 HA ILE 23 HA ILE 23 -14.769 8.760 6.134 176 HB ILE 23 HB ILE 23 -12.577 9.254 4.123 177 HG12 ILE 23 HG12 ILE 23 -13.276 6.912 4.420 178 HG13 ILE 23 HG13 ILE 23 -11.647 7.178 5.029 179 HG21 ILE 23 HG21 ILE 23 -11.904 10.649 5.836 180 HG22 ILE 23 HG22 ILE 23 -12.623 9.634 7.086 181 HG23 ILE 23 HG23 ILE 23 -11.138 9.124 6.282 182 HD11 ILE 23 HD11 ILE 23 -12.629 7.372 7.316 183 HD12 ILE 23 HD12 ILE 23 -14.171 6.866 6.626 184 HD13 ILE 23 HD13 ILE 23 -12.782 5.781 6.572 185 H LYS 24 H LYS 24 -15.117 10.512 7.322 186 HA LYS 24 HA LYS 24 -14.705 13.159 6.103 187 HB2 LYS 24 HB2 LYS 24 -17.172 12.241 6.435 188 HB3 LYS 24 HB3 LYS 24 -16.904 12.786 8.085 189 HG2 LYS 24 HG2 LYS 24 -16.202 15.013 7.029 190 HG3 LYS 24 HG3 LYS 24 -16.970 14.400 5.563 191 HD2 LYS 24 HD2 LYS 24 -18.372 14.504 8.226 192 HD3 LYS 24 HD3 LYS 24 -18.418 15.833 7.065 193 HE2 LYS 24 HE2 LYS 24 -19.157 13.050 6.240 194 HE3 LYS 24 HE3 LYS 24 -20.326 14.083 7.060 195 HZ1 LYS 24 HZ1 LYS 24 -19.525 14.116 4.350 196 HZ2 LYS 24 HZ2 LYS 24 -20.765 14.986 5.102 197 HZ3 LYS 24 HZ3 LYS 24 -19.196 15.618 5.055 198 H ASN 25 H ASN 25 -12.923 13.835 7.150 199 HA ASN 25 HA ASN 25 -11.529 14.481 8.827 200 HB2 ASN 25 HB2 ASN 25 -13.990 14.628 10.568 201 HB3 ASN 25 HB3 ASN 25 -12.515 15.582 10.697 202 HD21 ASN 25 HD21 ASN 25 -15.642 15.545 9.599 203 HD22 ASN 25 HD22 ASN 25 -15.568 16.888 8.514 204 H ALA 26 H ALA 26 -11.925 11.675 8.492 205 HA ALA 26 HA ALA 26 -12.390 10.209 10.789 206 HB1 ALA 26 HB1 ALA 26 -10.608 8.623 9.741 207 HB2 ALA 26 HB2 ALA 26 -12.132 8.913 8.901 208 HB3 ALA 26 HB3 ALA 26 -10.670 9.757 8.391 209 H TYR 27 H TYR 27 -9.083 10.763 9.601 210 HA TYR 27 HA TYR 27 -8.126 10.682 12.355 211 HB2 TYR 27 HB2 TYR 27 -7.117 9.423 10.279 212 HB3 TYR 27 HB3 TYR 27 -6.310 10.960 9.991 213 HD1 TYR 27 HD1 TYR 27 -4.615 11.786 11.538 214 HD2 TYR 27 HD2 TYR 27 -6.528 8.039 12.177 215 HE1 TYR 27 HE1 TYR 27 -2.872 11.181 13.164 216 HE2 TYR 27 HE2 TYR 27 -4.791 7.424 13.807 217 HH TYR 27 HH TYR 27 -2.570 7.984 14.429 218 H LYS 28 H LYS 28 -6.752 12.281 13.233 219 HA LYS 28 HA LYS 28 -6.700 14.859 11.831 220 HB2 LYS 28 HB2 LYS 28 -7.429 14.581 14.749 221 HB3 LYS 28 HB3 LYS 28 -7.415 16.058 13.794 222 HG2 LYS 28 HG2 LYS 28 -9.236 15.121 12.402 223 HG3 LYS 28 HG3 LYS 28 -9.293 13.726 13.482 224 HD2 LYS 28 HD2 LYS 28 -9.849 15.176 15.355 225 HD3 LYS 28 HD3 LYS 28 -9.729 16.595 14.313 226 HE2 LYS 28 HE2 LYS 28 -11.506 15.263 12.887 227 HE3 LYS 28 HE3 LYS 28 -11.834 14.494 14.439 228 HZ1 LYS 28 HZ1 LYS 28 -12.958 16.780 13.622 229 HZ2 LYS 28 HZ2 LYS 28 -12.776 16.344 15.247 230 HZ3 LYS 28 HZ3 LYS 28 -11.655 17.381 14.519 231 H LYS 29 H LYS 29 -5.271 16.452 13.124 232 HA LYS 29 HA LYS 29 -3.115 15.166 14.588 233 HB2 LYS 29 HB2 LYS 29 -2.752 15.245 11.951 234 HB3 LYS 29 HB3 LYS 29 -2.248 16.889 12.318 235 HG2 LYS 29 HG2 LYS 29 -1.106 14.603 13.862 236 HG3 LYS 29 HG3 LYS 29 -0.493 14.983 12.251 237 HD2 LYS 29 HD2 LYS 29 0.307 17.062 12.908 238 HD3 LYS 29 HD3 LYS 29 -0.758 17.137 14.314 239 HE2 LYS 29 HE2 LYS 29 1.278 16.686 15.297 240 HE3 LYS 29 HE3 LYS 29 0.609 15.066 15.110 241 HZ1 LYS 29 HZ1 LYS 29 2.042 14.574 13.402 242 HZ2 LYS 29 HZ2 LYS 29 2.297 16.192 12.981 243 HZ3 LYS 29 HZ3 LYS 29 3.026 15.554 14.368 244 H GLY 30 H GLY 30 -2.628 16.419 16.261 245 HA2 GLY 30 HA2 GLY 30 -2.523 18.261 17.632 246 HA3 GLY 30 HA3 GLY 30 -1.922 19.086 16.202 247 H GLU 31 H GLU 31 -5.133 17.696 16.440 248 HA GLU 31 HA GLU 31 -6.442 19.973 15.514 249 HB2 GLU 31 HB2 GLU 31 -7.236 17.478 15.806 250 HB3 GLU 31 HB3 GLU 31 -7.858 18.074 17.339 251 HG2 GLU 31 HG2 GLU 31 -8.548 19.156 14.617 252 HG3 GLU 31 HG3 GLU 31 -9.564 18.110 15.607 253 H1 TYR 1 H TYR 1 -4.815 3.222 11.840 254 HA TYR 1 HA TYR 1 -3.027 4.869 10.803 255 HB2 TYR 1 HB2 TYR 1 -4.746 2.816 9.529 256 HB3 TYR 1 HB3 TYR 1 -3.862 3.880 8.441 257 HD1 TYR 1 HD1 TYR 1 -2.816 2.529 11.750 258 HD2 TYR 1 HD2 TYR 1 -2.192 2.521 7.541 259 HE1 TYR 1 HE1 TYR 1 -0.798 1.159 12.058 260 HE2 TYR 1 HE2 TYR 1 -0.173 1.149 7.837 261 HH TYR 1 HH TYR 1 0.545 -0.623 10.018 262 H GLY 2 H GLY 2 -6.075 4.680 8.977 263 HA2 GLY 2 HA2 GLY 2 -6.753 7.395 9.120 264 HA3 GLY 2 HA3 GLY 2 -5.716 7.174 7.719 265 H GLY 3 H GLY 3 -8.658 7.829 8.102 266 HA2 GLY 3 HA2 GLY 3 -10.647 7.354 7.058 267 HA3 GLY 3 HA3 GLY 3 -9.649 6.655 5.791 268 H PHE 4 H PHE 4 -10.627 4.797 5.277 269 HA PHE 4 HA PHE 4 -11.888 3.138 7.259 270 HB2 PHE 4 HB2 PHE 4 -11.520 3.005 4.292 271 HB3 PHE 4 HB3 PHE 4 -11.996 1.551 5.163 272 HD1 PHE 4 HD1 PHE 4 -14.187 1.313 6.074 273 HD2 PHE 4 HD2 PHE 4 -12.990 4.966 4.246 274 HE1 PHE 4 HE1 PHE 4 -16.531 2.061 6.042 275 HE2 PHE 4 HE2 PHE 4 -15.331 5.720 4.212 276 HZ PHE 4 HZ PHE 4 -17.105 4.268 5.111 277 H MET 5 H MET 5 -11.217 1.164 8.032 278 HA MET 5 HA MET 5 -8.428 0.428 7.428 279 HB2 MET 5 HB2 MET 5 -9.044 1.357 9.774 280 HB3 MET 5 HB3 MET 5 -9.769 -0.224 10.033 281 HG2 MET 5 HG2 MET 5 -7.383 -1.008 9.146 282 HG3 MET 5 HG3 MET 5 -6.928 0.553 9.824 283 HE1 MET 5 HE1 MET 5 -7.008 -3.236 11.873 284 HE2 MET 5 HE2 MET 5 -6.770 -2.751 10.194 285 HE3 MET 5 HE3 MET 5 -5.624 -2.237 11.432 286 H THR 6 H THR 6 -8.420 -1.338 6.204 287 HA THR 6 HA THR 6 -10.452 -3.409 6.681 288 HB THR 6 HB THR 6 -8.692 -2.981 4.259 289 HG1 THR 6 HG1 THR 6 -11.088 -2.714 3.484 290 HG21 THR 6 HG21 THR 6 -10.958 -4.933 4.684 291 HG22 THR 6 HG22 THR 6 -10.025 -4.720 3.202 292 HG23 THR 6 HG23 THR 6 -9.245 -5.353 4.652 293 H SER 7 H SER 7 -9.532 -4.567 8.343 294 HA SER 7 HA SER 7 -6.839 -5.655 7.914 295 HB2 SER 7 HB2 SER 7 -7.820 -4.496 10.140 296 HB3 SER 7 HB3 SER 7 -8.265 -6.171 10.467 297 HG SER 7 HG SER 7 -5.739 -5.003 10.244 298 H GLU 8 H GLU 8 -7.123 -7.378 6.576 299 HA GLU 8 HA GLU 8 -9.014 -9.460 7.451 300 HB2 GLU 8 HB2 GLU 8 -8.089 -8.575 4.752 301 HB3 GLU 8 HB3 GLU 8 -8.533 -10.261 4.979 302 HG2 GLU 8 HG2 GLU 8 -10.730 -9.801 5.183 303 HG3 GLU 8 HG3 GLU 8 -10.447 -8.264 5.999 304 H LYS 9 H LYS 9 -8.025 -11.025 8.531 305 HA LYS 9 HA LYS 9 -5.275 -11.753 7.790 306 HB2 LYS 9 HB2 LYS 9 -5.661 -11.070 10.141 307 HB3 LYS 9 HB3 LYS 9 -6.803 -12.396 10.320 308 HG2 LYS 9 HG2 LYS 9 -4.712 -13.803 9.490 309 HG3 LYS 9 HG3 LYS 9 -3.844 -12.438 10.197 310 HD2 LYS 9 HD2 LYS 9 -6.041 -13.690 11.768 311 HD3 LYS 9 HD3 LYS 9 -4.505 -14.550 11.639 312 HE2 LYS 9 HE2 LYS 9 -4.124 -13.295 13.518 313 HE3 LYS 9 HE3 LYS 9 -3.510 -12.204 12.277 314 HZ1 LYS 9 HZ1 LYS 9 -5.255 -11.466 14.131 315 HZ2 LYS 9 HZ2 LYS 9 -5.183 -10.752 12.599 316 HZ3 LYS 9 HZ3 LYS 9 -6.333 -11.951 12.920 317 H SER 10 H SER 10 -5.307 -13.327 6.307 318 HA SER 10 HA SER 10 -6.442 -15.879 7.002 319 HB2 SER 10 HB2 SER 10 -7.789 -16.086 4.920 320 HB3 SER 10 HB3 SER 10 -8.415 -14.855 6.017 321 HG SER 10 HG SER 10 -7.118 -14.559 3.551 322 H GLN 11 H GLN 11 -5.365 -17.539 6.050 323 HA GLN 11 HA GLN 11 -3.019 -16.846 4.496 324 HB2 GLN 11 HB2 GLN 11 -2.393 -19.205 4.800 325 HB3 GLN 11 HB3 GLN 11 -2.777 -18.429 6.330 326 HG2 GLN 11 HG2 GLN 11 -4.722 -19.622 6.606 327 HG3 GLN 11 HG3 GLN 11 -4.897 -19.940 4.881 328 HE21 GLN 11 HE21 GLN 11 -5.208 -22.143 5.291 329 HE22 GLN 11 HE22 GLN 11 -3.894 -23.182 5.711 330 H THR 12 H THR 12 -5.287 -16.323 3.044 331 HA THR 12 HA THR 12 -4.917 -18.112 0.791 332 HB THR 12 HB THR 12 -7.634 -17.929 0.677 333 HG1 THR 12 HG1 THR 12 -7.089 -18.616 3.376 334 HG21 THR 12 HG21 THR 12 -7.595 -20.321 1.525 335 HG22 THR 12 HG22 THR 12 -6.514 -19.957 0.180 336 HG23 THR 12 HG23 THR 12 -5.871 -20.090 1.817 337 HA PRO 13 HA PRO 13 -5.547 -14.498 -1.616 338 HB2 PRO 13 HB2 PRO 13 -6.897 -15.433 -3.778 339 HB3 PRO 13 HB3 PRO 13 -5.188 -15.781 -3.488 340 HG2 PRO 13 HG2 PRO 13 -7.589 -17.484 -2.940 341 HG3 PRO 13 HG3 PRO 13 -6.025 -17.946 -3.635 342 HD2 PRO 13 HD2 PRO 13 -6.657 -18.401 -1.042 343 HD3 PRO 13 HD3 PRO 13 -4.999 -18.057 -1.574 344 H LEU 14 H LEU 14 -6.868 -12.976 -0.799 345 HA LEU 14 HA LEU 14 -9.775 -13.406 -1.015 346 HB2 LEU 14 HB2 LEU 14 -10.098 -12.022 0.880 347 HB3 LEU 14 HB3 LEU 14 -8.846 -13.190 1.294 348 HG LEU 14 HG LEU 14 -8.144 -10.420 0.377 349 HD11 LEU 14 HD11 LEU 14 -7.894 -10.448 3.137 350 HD12 LEU 14 HD12 LEU 14 -9.098 -9.567 2.195 351 HD13 LEU 14 HD13 LEU 14 -9.477 -11.166 2.835 352 HD21 LEU 14 HD21 LEU 14 -6.210 -11.645 0.414 353 HD22 LEU 14 HD22 LEU 14 -6.243 -11.062 2.078 354 HD23 LEU 14 HD23 LEU 14 -6.771 -12.703 1.708 355 H VAL 15 H VAL 15 -10.456 -10.704 -0.443 356 HA VAL 15 HA VAL 15 -9.177 -8.914 -2.247 357 HB VAL 15 HB VAL 15 -10.241 -10.251 -3.959 358 HG11 VAL 15 HG11 VAL 15 -12.999 -9.740 -3.513 359 HG12 VAL 15 HG12 VAL 15 -12.167 -11.293 -3.602 360 HG13 VAL 15 HG13 VAL 15 -12.330 -10.467 -2.052 361 HG21 VAL 15 HG21 VAL 15 -10.502 -7.527 -3.677 362 HG22 VAL 15 HG22 VAL 15 -10.801 -8.446 -5.152 363 HG23 VAL 15 HG23 VAL 15 -12.140 -8.046 -4.076 364 H THR 16 H THR 16 -9.681 -6.864 -1.729 365 HA THR 16 HA THR 16 -11.665 -6.447 0.357 366 HB THR 16 HB THR 16 -9.549 -5.399 0.761 367 HG1 THR 16 HG1 THR 16 -11.357 -3.371 -0.102 368 HG21 THR 16 HG21 THR 16 -9.629 -4.881 -2.060 369 HG22 THR 16 HG22 THR 16 -9.357 -3.373 -1.186 370 HG23 THR 16 HG23 THR 16 -8.272 -4.742 -0.943 371 H LEU 17 H LEU 17 -13.694 -6.076 -0.248 372 HA LEU 17 HA LEU 17 -14.290 -4.870 -2.816 373 HB2 LEU 17 HB2 LEU 17 -15.528 -6.820 -1.605 374 HB3 LEU 17 HB3 LEU 17 -16.350 -5.516 -0.751 375 HG LEU 17 HG LEU 17 -17.665 -6.358 -2.637 376 HD11 LEU 17 HD11 LEU 17 -18.412 -4.302 -3.305 377 HD12 LEU 17 HD12 LEU 17 -17.470 -3.850 -1.884 378 HD13 LEU 17 HD13 LEU 17 -16.786 -3.648 -3.497 379 HD21 LEU 17 HD21 LEU 17 -16.780 -6.810 -4.624 380 HD22 LEU 17 HD22 LEU 17 -16.134 -5.175 -4.767 381 HD23 LEU 17 HD23 LEU 17 -15.197 -6.425 -3.948 382 H PHE 18 H PHE 18 -13.726 -2.731 -2.714 383 HA PHE 18 HA PHE 18 -15.047 -1.107 -0.644 384 HB2 PHE 18 HB2 PHE 18 -12.403 -0.963 -1.939 385 HB3 PHE 18 HB3 PHE 18 -13.231 0.583 -1.779 386 HD1 PHE 18 HD1 PHE 18 -14.494 0.656 0.699 387 HD2 PHE 18 HD2 PHE 18 -10.855 -1.315 -0.298 388 HE1 PHE 18 HE1 PHE 18 -13.779 0.795 3.049 389 HE2 PHE 18 HE2 PHE 18 -10.135 -1.180 2.051 390 HZ PHE 18 HZ PHE 18 -11.598 -0.124 3.728 391 H LYS 19 H LYS 19 -16.971 -0.543 -1.500 392 HA LYS 19 HA LYS 19 -17.051 0.475 -4.249 393 HB2 LYS 19 HB2 LYS 19 -19.077 -0.694 -2.395 394 HB3 LYS 19 HB3 LYS 19 -19.626 0.441 -3.621 395 HG2 LYS 19 HG2 LYS 19 -18.669 -0.964 -5.366 396 HG3 LYS 19 HG3 LYS 19 -18.090 -2.097 -4.142 397 HD2 LYS 19 HD2 LYS 19 -20.142 -2.930 -5.110 398 HD3 LYS 19 HD3 LYS 19 -20.429 -2.467 -3.431 399 HE2 LYS 19 HE2 LYS 19 -21.483 -0.427 -4.108 400 HE3 LYS 19 HE3 LYS 19 -21.020 -0.685 -5.789 401 HZ1 LYS 19 HZ1 LYS 19 -22.570 -2.369 -6.041 402 HZ2 LYS 19 HZ2 LYS 19 -22.726 -2.635 -4.378 403 HZ3 LYS 19 HZ3 LYS 19 -23.398 -1.250 -5.080 404 H ASN 20 H ASN 20 -17.803 2.517 -4.745 405 HA ASN 20 HA ASN 20 -17.987 4.770 -4.453 406 HB2 ASN 20 HB2 ASN 20 -19.738 3.656 -2.276 407 HB3 ASN 20 HB3 ASN 20 -19.560 5.395 -2.491 408 HD21 ASN 20 HD21 ASN 20 -19.652 5.905 -5.025 409 HD22 ASN 20 HD22 ASN 20 -21.080 5.294 -5.783 410 H ALA 21 H ALA 21 -15.661 3.562 -3.300 411 HA ALA 21 HA ALA 21 -15.132 4.548 -0.702 412 HB1 ALA 21 HB1 ALA 21 -13.482 3.453 -2.924 413 HB2 ALA 21 HB2 ALA 21 -12.673 4.291 -1.600 414 HB3 ALA 21 HB3 ALA 21 -13.673 2.877 -1.268 415 H ILE 22 H ILE 22 -15.288 6.657 -0.254 416 HA ILE 22 HA ILE 22 -13.797 8.532 -1.966 417 HB ILE 22 HB ILE 22 -16.110 8.956 -2.421 418 HG12 ILE 22 HG12 ILE 22 -14.392 10.864 -1.644 419 HG13 ILE 22 HG13 ILE 22 -16.037 11.222 -2.157 420 HG21 ILE 22 HG21 ILE 22 -16.465 9.024 0.569 421 HG22 ILE 22 HG22 ILE 22 -17.689 9.550 -0.586 422 HG23 ILE 22 HG23 ILE 22 -17.160 7.868 -0.567 423 HD11 ILE 22 HD11 ILE 22 -15.148 12.293 -0.003 424 HD12 ILE 22 HD12 ILE 22 -16.764 11.587 0.011 425 HD13 ILE 22 HD13 ILE 22 -15.410 10.706 0.719 426 H ILE 23 H ILE 23 -12.338 9.725 -0.924 427 HA ILE 23 HA ILE 23 -12.352 9.677 2.011 428 HB ILE 23 HB ILE 23 -10.136 10.223 0.040 429 HG12 ILE 23 HG12 ILE 23 -10.726 7.855 0.409 430 HG13 ILE 23 HG13 ILE 23 -9.121 8.231 1.025 431 HG21 ILE 23 HG21 ILE 23 -9.591 11.710 1.723 432 HG22 ILE 23 HG22 ILE 23 -10.281 10.692 2.988 433 HG23 ILE 23 HG23 ILE 23 -8.750 10.247 2.234 434 HD11 ILE 23 HD11 ILE 23 -10.133 8.450 3.293 435 HD12 ILE 23 HD12 ILE 23 -11.643 7.847 2.609 436 HD13 ILE 23 HD13 ILE 23 -10.204 6.828 2.603 437 H LYS 24 H LYS 24 -12.828 11.447 3.125 438 HA LYS 24 HA LYS 24 -12.523 14.068 1.823 439 HB2 LYS 24 HB2 LYS 24 -14.948 13.026 2.117 440 HB3 LYS 24 HB3 LYS 24 -14.760 13.650 3.751 441 HG2 LYS 24 HG2 LYS 24 -14.148 15.869 2.626 442 HG3 LYS 24 HG3 LYS 24 -14.834 15.157 1.163 443 HD2 LYS 24 HD2 LYS 24 -16.321 15.296 3.779 444 HD3 LYS 24 HD3 LYS 24 -16.409 16.562 2.552 445 HE2 LYS 24 HE2 LYS 24 -16.961 13.704 1.846 446 HE3 LYS 24 HE3 LYS 24 -18.212 14.704 2.583 447 HZ1 LYS 24 HZ1 LYS 24 -17.330 14.657 -0.103 448 HZ2 LYS 24 HZ2 LYS 24 -18.645 15.482 0.570 449 HZ3 LYS 24 HZ3 LYS 24 -17.117 16.208 0.537 450 H ASN 25 H ASN 25 -10.815 14.875 2.898 451 HA ASN 25 HA ASN 25 -9.516 15.662 4.592 452 HB2 ASN 25 HB2 ASN 25 -12.030 15.710 6.261 453 HB3 ASN 25 HB3 ASN 25 -10.621 16.757 6.397 454 HD21 ASN 25 HD21 ASN 25 -13.707 16.488 5.215 455 HD22 ASN 25 HD22 ASN 25 -13.685 17.800 4.091 456 H ALA 26 H ALA 26 -9.745 12.824 4.335 457 HA ALA 26 HA ALA 26 -10.184 11.404 6.664 458 HB1 ALA 26 HB1 ALA 26 -8.276 9.901 5.714 459 HB2 ALA 26 HB2 ALA 26 -9.792 10.067 4.829 460 HB3 ALA 26 HB3 ALA 26 -8.373 10.986 4.327 461 H TYR 27 H TYR 27 -6.882 12.125 5.550 462 HA TYR 27 HA TYR 27 -6.004 12.185 8.332 463 HB2 TYR 27 HB2 TYR 27 -4.861 10.926 6.327 464 HB3 TYR 27 HB3 TYR 27 -4.139 12.500 6.011 465 HD1 TYR 27 HD1 TYR 27 -2.545 13.476 7.578 466 HD2 TYR 27 HD2 TYR 27 -4.243 9.639 8.282 467 HE1 TYR 27 HE1 TYR 27 -0.818 13.030 9.271 468 HE2 TYR 27 HE2 TYR 27 -2.521 9.182 9.978 469 HH TYR 27 HH TYR 27 -0.357 9.897 10.643 470 H LYS 28 H LYS 28 -4.754 13.890 9.196 471 HA LYS 28 HA LYS 28 -4.816 16.422 7.713 472 HB2 LYS 28 HB2 LYS 28 -5.611 16.191 10.618 473 HB3 LYS 28 HB3 LYS 28 -5.659 17.635 9.615 474 HG2 LYS 28 HG2 LYS 28 -7.382 16.551 8.210 475 HG3 LYS 28 HG3 LYS 28 -7.380 15.181 9.324 476 HD2 LYS 28 HD2 LYS 28 -8.075 16.638 11.145 477 HD3 LYS 28 HD3 LYS 28 -8.019 18.036 10.069 478 HE2 LYS 28 HE2 LYS 28 -9.669 16.554 8.636 479 HE3 LYS 28 HE3 LYS 28 -9.988 15.808 10.201 480 HZ1 LYS 28 HZ1 LYS 28 -11.235 17.993 9.293 481 HZ2 LYS 28 HZ2 LYS 28 -11.065 17.615 10.934 482 HZ3 LYS 28 HZ3 LYS 28 -9.995 18.702 10.201 483 H LYS 29 H LYS 29 -3.520 18.138 8.985 484 HA LYS 29 HA LYS 29 -1.334 17.028 10.547 485 HB2 LYS 29 HB2 LYS 29 -0.902 17.055 7.921 486 HB3 LYS 29 HB3 LYS 29 -0.512 18.738 8.249 487 HG2 LYS 29 HG2 LYS 29 0.728 16.569 9.886 488 HG3 LYS 29 HG3 LYS 29 1.363 16.953 8.284 489 HD2 LYS 29 HD2 LYS 29 2.008 19.093 8.916 490 HD3 LYS 29 HD3 LYS 29 0.897 19.130 10.287 491 HE2 LYS 29 HE2 LYS 29 2.926 18.835 11.339 492 HE3 LYS 29 HE3 LYS 29 2.367 17.171 11.175 493 HZ1 LYS 29 HZ1 LYS 29 3.880 16.730 9.524 494 HZ2 LYS 29 HZ2 LYS 29 4.045 18.351 9.068 495 HZ3 LYS 29 HZ3 LYS 29 4.770 17.796 10.492 496 H GLY 30 H GLY 30 -0.971 18.355 12.196 497 HA2 GLY 30 HA2 GLY 30 -1.021 20.236 13.515 498 HA3 GLY 30 HA3 GLY 30 -0.424 21.056 12.080 499 H GLU 31 H GLU 31 -3.554 19.484 12.265 500 HA GLU 31 HA GLU 31 -4.970 21.639 11.225 501 HB2 GLU 31 HB2 GLU 31 -5.627 19.117 11.606 502 HB3 GLU 31 HB3 GLU 31 -6.318 19.738 13.098 503 HG2 GLU 31 HG2 GLU 31 -7.003 20.673 10.321 504 HG3 GLU 31 HG3 GLU 31 -7.978 19.599 11.322 505 H1 TYR 1 H TYR 1 -2.230 4.947 8.163 506 HA TYR 1 HA TYR 1 -0.515 6.657 7.107 507 HB2 TYR 1 HB2 TYR 1 -2.078 4.462 5.872 508 HB3 TYR 1 HB3 TYR 1 -1.236 5.539 4.764 509 HD1 TYR 1 HD1 TYR 1 -0.191 4.363 8.139 510 HD2 TYR 1 HD2 TYR 1 0.538 4.264 3.949 511 HE1 TYR 1 HE1 TYR 1 1.900 3.129 8.538 512 HE2 TYR 1 HE2 TYR 1 2.630 3.029 4.336 513 HH TYR 1 HH TYR 1 3.400 1.373 6.586 514 H GLY 2 H GLY 2 -3.497 6.227 5.216 515 HA2 GLY 2 HA2 GLY 2 -4.340 8.898 5.245 516 HA3 GLY 2 HA3 GLY 2 -3.250 8.695 3.881 517 H GLY 3 H GLY 3 -6.240 9.176 4.168 518 HA2 GLY 3 HA2 GLY 3 -8.163 8.548 3.084 519 HA3 GLY 3 HA3 GLY 3 -7.088 7.874 1.868 520 H PHE 4 H PHE 4 -7.949 5.947 1.389 521 HA PHE 4 HA PHE 4 -9.157 4.274 3.390 522 HB2 PHE 4 HB2 PHE 4 -8.700 4.076 0.439 523 HB3 PHE 4 HB3 PHE 4 -9.107 2.620 1.342 524 HD1 PHE 4 HD1 PHE 4 -11.303 2.260 2.187 525 HD2 PHE 4 HD2 PHE 4 -10.288 5.945 0.313 526 HE1 PHE 4 HE1 PHE 4 -13.688 2.855 2.072 527 HE2 PHE 4 HE2 PHE 4 -12.671 6.546 0.196 528 HZ PHE 4 HZ PHE 4 -14.375 5.000 1.077 529 H MET 5 H MET 5 -8.392 2.368 4.241 530 HA MET 5 HA MET 5 -5.546 1.788 3.737 531 HB2 MET 5 HB2 MET 5 -6.281 2.748 6.034 532 HB3 MET 5 HB3 MET 5 -6.924 1.137 6.325 533 HG2 MET 5 HG2 MET 5 -4.472 0.464 5.528 534 HG3 MET 5 HG3 MET 5 -4.125 2.069 6.170 535 HE1 MET 5 HE1 MET 5 -4.060 -1.660 8.332 536 HE2 MET 5 HE2 MET 5 -3.803 -1.214 6.645 537 HE3 MET 5 HE3 MET 5 -2.719 -0.602 7.894 538 H THR 6 H THR 6 -5.402 -0.009 2.566 539 HA THR 6 HA THR 6 -7.319 -2.184 3.051 540 HB THR 6 HB THR 6 -5.505 -1.728 0.674 541 HG1 THR 6 HG1 THR 6 -7.888 -1.632 -0.183 542 HG21 THR 6 HG21 THR 6 -7.664 -3.799 1.093 543 HG22 THR 6 HG22 THR 6 -6.700 -3.575 -0.367 544 HG23 THR 6 HG23 THR 6 -5.929 -4.114 1.125 545 H SER 7 H SER 7 -6.399 -3.249 4.770 546 HA SER 7 HA SER 7 -3.629 -4.176 4.474 547 HB2 SER 7 HB2 SER 7 -4.759 -3.023 6.627 548 HB3 SER 7 HB3 SER 7 -5.125 -4.711 6.983 549 HG SER 7 HG SER 7 -2.659 -3.411 6.825 550 H GLU 8 H GLU 8 -3.760 -5.943 3.167 551 HA GLU 8 HA GLU 8 -5.551 -8.117 4.029 552 HB2 GLU 8 HB2 GLU 8 -4.577 -7.244 1.344 553 HB3 GLU 8 HB3 GLU 8 -4.925 -8.948 1.599 554 HG2 GLU 8 HG2 GLU 8 -7.152 -8.622 1.705 555 HG3 GLU 8 HG3 GLU 8 -6.997 -7.053 2.493 556 H LYS 9 H LYS 9 -4.512 -9.591 5.187 557 HA LYS 9 HA LYS 9 -1.695 -10.165 4.572 558 HB2 LYS 9 HB2 LYS 9 -2.234 -9.449 6.889 559 HB3 LYS 9 HB3 LYS 9 -3.274 -10.857 7.056 560 HG2 LYS 9 HG2 LYS 9 -1.052 -12.115 6.346 561 HG3 LYS 9 HG3 LYS 9 -0.317 -10.668 7.039 562 HD2 LYS 9 HD2 LYS 9 -2.467 -12.036 8.577 563 HD3 LYS 9 HD3 LYS 9 -0.870 -12.787 8.521 564 HE2 LYS 9 HE2 LYS 9 -0.637 -11.457 10.371 565 HE3 LYS 9 HE3 LYS 9 -0.066 -10.357 9.118 566 HZ1 LYS 9 HZ1 LYS 9 -1.920 -9.705 10.900 567 HZ2 LYS 9 HZ2 LYS 9 -1.848 -9.023 9.354 568 HZ3 LYS 9 HZ3 LYS 9 -2.919 -10.294 9.668 569 H SER 10 H SER 10 -1.559 -11.779 3.142 570 HA SER 10 HA SER 10 -2.563 -14.377 3.856 571 HB2 SER 10 HB2 SER 10 -3.817 -14.721 1.736 572 HB3 SER 10 HB3 SER 10 -4.558 -13.502 2.773 573 HG SER 10 HG SER 10 -3.188 -13.192 0.348 574 H GLN 11 H GLN 11 -1.349 -15.988 2.988 575 HA GLN 11 HA GLN 11 1.003 -15.182 1.497 576 HB2 GLN 11 HB2 GLN 11 1.772 -17.485 1.894 577 HB3 GLN 11 HB3 GLN 11 1.284 -16.693 3.386 578 HG2 GLN 11 HG2 GLN 11 -0.589 -18.004 3.632 579 HG3 GLN 11 HG3 GLN 11 -0.679 -18.384 1.913 580 HE21 GLN 11 HE21 GLN 11 -0.858 -20.589 2.381 581 HE22 GLN 11 HE22 GLN 11 0.505 -21.525 2.881 582 H THR 12 H THR 12 -1.230 -14.848 -0.051 583 HA THR 12 HA THR 12 -0.665 -16.669 -2.235 584 HB THR 12 HB THR 12 -3.386 -16.676 -2.438 585 HG1 THR 12 HG1 THR 12 -2.876 -17.269 0.289 586 HG21 THR 12 HG21 THR 12 -3.207 -19.042 -1.539 587 HG22 THR 12 HG22 THR 12 -2.113 -18.630 -2.859 588 HG23 THR 12 HG23 THR 12 -1.513 -18.686 -1.202 589 HA PRO 13 HA PRO 13 -1.467 -13.178 -4.769 590 HB2 PRO 13 HB2 PRO 13 -2.691 -14.261 -6.937 591 HB3 PRO 13 HB3 PRO 13 -0.973 -14.487 -6.591 592 HG2 PRO 13 HG2 PRO 13 -3.271 -16.329 -6.056 593 HG3 PRO 13 HG3 PRO 13 -1.661 -16.706 -6.696 594 HD2 PRO 13 HD2 PRO 13 -2.336 -17.128 -4.108 595 HD3 PRO 13 HD3 PRO 13 -0.689 -16.691 -4.606 596 H LEU 14 H LEU 14 -2.906 -11.718 -4.053 597 HA LEU 14 HA LEU 14 -5.772 -12.346 -4.327 598 HB2 LEU 14 HB2 LEU 14 -6.240 -10.932 -2.485 599 HB3 LEU 14 HB3 LEU 14 -4.930 -12.006 -2.001 600 HG LEU 14 HG LEU 14 -4.377 -9.224 -2.979 601 HD11 LEU 14 HD11 LEU 14 -4.207 -9.162 -0.213 602 HD12 LEU 14 HD12 LEU 14 -5.433 -8.383 -1.213 603 HD13 LEU 14 HD13 LEU 14 -5.732 -9.985 -0.539 604 HD21 LEU 14 HD21 LEU 14 -2.370 -10.320 -2.853 605 HD22 LEU 14 HD22 LEU 14 -2.491 -9.698 -1.208 606 HD23 LEU 14 HD23 LEU 14 -2.903 -11.379 -1.547 607 H VAL 15 H VAL 15 -6.641 -9.678 -3.854 608 HA VAL 15 HA VAL 15 -5.429 -7.861 -5.676 609 HB VAL 15 HB VAL 15 -6.356 -9.315 -7.374 610 HG11 VAL 15 HG11 VAL 15 -9.153 -8.962 -7.018 611 HG12 VAL 15 HG12 VAL 15 -8.225 -10.462 -7.040 612 HG13 VAL 15 HG13 VAL 15 -8.482 -9.607 -5.520 613 HG21 VAL 15 HG21 VAL 15 -6.789 -6.606 -7.187 614 HG22 VAL 15 HG22 VAL 15 -6.996 -7.585 -8.639 615 HG23 VAL 15 HG23 VAL 15 -8.383 -7.234 -7.608 616 H THR 16 H THR 16 -6.078 -5.834 -5.232 617 HA THR 16 HA THR 16 -8.145 -5.489 -3.215 618 HB THR 16 HB THR 16 -6.113 -4.295 -2.782 619 HG1 THR 16 HG1 THR 16 -8.021 -2.414 -3.757 620 HG21 THR 16 HG21 THR 16 -6.142 -3.862 -5.619 621 HG22 THR 16 HG22 THR 16 -5.989 -2.317 -4.782 622 HG23 THR 16 HG23 THR 16 -4.829 -3.608 -4.469 623 H LEU 17 H LEU 17 -10.175 -5.262 -3.884 624 HA LEU 17 HA LEU 17 -10.770 -4.169 -6.503 625 HB2 LEU 17 HB2 LEU 17 -11.916 -6.161 -5.275 626 HB3 LEU 17 HB3 LEU 17 -12.843 -4.893 -4.475 627 HG LEU 17 HG LEU 17 -14.049 -5.863 -6.373 628 HD11 LEU 17 HD11 LEU 17 -14.909 -3.875 -7.109 629 HD12 LEU 17 HD12 LEU 17 -14.037 -3.331 -5.676 630 HD13 LEU 17 HD13 LEU 17 -13.324 -3.121 -7.275 631 HD21 LEU 17 HD21 LEU 17 -13.083 -6.300 -8.325 632 HD22 LEU 17 HD22 LEU 17 -12.541 -4.630 -8.492 633 HD23 LEU 17 HD23 LEU 17 -11.547 -5.797 -7.620 634 H PHE 18 H PHE 18 -10.341 -1.996 -6.442 635 HA PHE 18 HA PHE 18 -11.823 -0.405 -4.458 636 HB2 PHE 18 HB2 PHE 18 -9.160 -0.126 -5.687 637 HB3 PHE 18 HB3 PHE 18 -10.088 1.367 -5.595 638 HD1 PHE 18 HD1 PHE 18 -11.420 1.435 -3.157 639 HD2 PHE 18 HD2 PHE 18 -7.642 -0.337 -3.994 640 HE1 PHE 18 HE1 PHE 18 -10.782 1.687 -0.794 641 HE2 PHE 18 HE2 PHE 18 -6.998 -0.089 -1.633 642 HZ PHE 18 HZ PHE 18 -8.569 0.923 -0.029 643 H LYS 19 H LYS 19 -13.755 0.013 -5.377 644 HA LYS 19 HA LYS 19 -13.824 0.949 -8.156 645 HB2 LYS 19 HB2 LYS 19 -15.820 -0.302 -6.323 646 HB3 LYS 19 HB3 LYS 19 -16.408 0.764 -7.593 647 HG2 LYS 19 HG2 LYS 19 -15.315 -0.619 -9.275 648 HG3 LYS 19 HG3 LYS 19 -14.699 -1.682 -8.007 649 HD2 LYS 19 HD2 LYS 19 -16.667 -2.668 -9.006 650 HD3 LYS 19 HD3 LYS 19 -17.027 -2.186 -7.347 651 HE2 LYS 19 HE2 LYS 19 -18.191 -0.235 -8.099 652 HE3 LYS 19 HE3 LYS 19 -17.669 -0.502 -9.762 653 HZ1 LYS 19 HZ1 LYS 19 -19.101 -2.288 -10.010 654 HZ2 LYS 19 HZ2 LYS 19 -19.282 -2.525 -8.345 655 HZ3 LYS 19 HZ3 LYS 19 -20.024 -1.203 -9.096 656 H ASN 20 H ASN 20 -14.694 2.923 -8.728 657 HA ASN 20 HA ASN 20 -15.031 5.166 -8.506 658 HB2 ASN 20 HB2 ASN 20 -16.766 3.995 -6.346 659 HB3 ASN 20 HB3 ASN 20 -16.693 5.737 -6.599 660 HD21 ASN 20 HD21 ASN 20 -16.747 6.183 -9.146 661 HD22 ASN 20 HD22 ASN 20 -18.111 5.465 -9.926 662 H ALA 21 H ALA 21 -12.665 4.140 -7.257 663 HA ALA 21 HA ALA 21 -12.274 5.232 -4.677 664 HB1 ALA 21 HB1 ALA 21 -10.496 4.176 -6.817 665 HB2 ALA 21 HB2 ALA 21 -9.778 5.103 -5.499 666 HB3 ALA 21 HB3 ALA 21 -10.699 3.640 -5.149 667 H ILE 22 H ILE 22 -12.578 7.341 -4.304 668 HA ILE 22 HA ILE 22 -11.158 9.253 -6.035 669 HB ILE 22 HB ILE 22 -13.484 9.515 -6.552 670 HG12 ILE 22 HG12 ILE 22 -11.901 11.549 -5.810 671 HG13 ILE 22 HG13 ILE 22 -13.553 11.788 -6.367 672 HG21 ILE 22 HG21 ILE 22 -13.908 9.666 -3.573 673 HG22 ILE 22 HG22 ILE 22 -15.136 10.072 -4.772 674 HG23 ILE 22 HG23 ILE 22 -14.504 8.428 -4.679 675 HD11 ILE 22 HD11 ILE 22 -12.778 12.986 -4.237 676 HD12 ILE 22 HD12 ILE 22 -14.347 12.181 -4.227 677 HD13 ILE 22 HD13 ILE 22 -12.956 11.411 -3.463 678 H ILE 23 H ILE 23 -9.807 10.573 -5.000 679 HA ILE 23 HA ILE 23 -9.887 10.609 -2.065 680 HB ILE 23 HB ILE 23 -7.660 11.226 -4.002 681 HG12 ILE 23 HG12 ILE 23 -8.117 8.840 -3.564 682 HG13 ILE 23 HG13 ILE 23 -6.551 9.333 -2.928 683 HG21 ILE 23 HG21 ILE 23 -7.250 12.800 -2.357 684 HG22 ILE 23 HG22 ILE 23 -7.905 11.781 -1.075 685 HG23 ILE 23 HG23 ILE 23 -6.332 11.409 -1.780 686 HD11 ILE 23 HD11 ILE 23 -7.624 9.563 -0.691 687 HD12 ILE 23 HD12 ILE 23 -9.083 8.854 -1.383 688 HD13 ILE 23 HD13 ILE 23 -7.588 7.919 -1.328 689 H LYS 24 H LYS 24 -10.494 12.381 -1.018 690 HA LYS 24 HA LYS 24 -10.314 14.975 -2.395 691 HB2 LYS 24 HB2 LYS 24 -12.679 13.792 -2.125 692 HB3 LYS 24 HB3 LYS 24 -12.574 14.486 -0.513 693 HG2 LYS 24 HG2 LYS 24 -12.067 16.696 -1.704 694 HG3 LYS 24 HG3 LYS 24 -12.666 15.891 -3.157 695 HD2 LYS 24 HD2 LYS 24 -14.233 16.036 -0.589 696 HD3 LYS 24 HD3 LYS 24 -14.364 17.245 -1.868 697 HE2 LYS 24 HE2 LYS 24 -14.717 14.332 -2.472 698 HE3 LYS 24 HE3 LYS 24 -16.048 15.278 -1.807 699 HZ1 LYS 24 HZ1 LYS 24 -15.093 15.184 -4.467 700 HZ2 LYS 24 HZ2 LYS 24 -16.474 15.951 -3.859 701 HZ3 LYS 24 HZ3 LYS 24 -14.993 16.769 -3.883 702 H ASN 25 H ASN 25 -8.693 15.923 -1.302 703 HA ASN 25 HA ASN 25 -7.490 16.837 0.399 704 HB2 ASN 25 HB2 ASN 25 -10.045 16.775 2.004 705 HB3 ASN 25 HB3 ASN 25 -8.708 17.914 2.139 706 HD21 ASN 25 HD21 ASN 25 -11.741 17.412 0.895 707 HD22 ASN 25 HD22 ASN 25 -11.774 18.687 -0.270 708 H ALA 26 H ALA 26 -7.551 13.979 0.224 709 HA ALA 26 HA ALA 26 -7.960 12.603 2.581 710 HB1 ALA 26 HB1 ALA 26 -5.936 11.197 1.729 711 HB2 ALA 26 HB2 ALA 26 -7.433 11.242 0.799 712 HB3 ALA 26 HB3 ALA 26 -6.060 12.234 0.308 713 H TYR 27 H TYR 27 -4.680 13.503 1.536 714 HA TYR 27 HA TYR 27 -3.890 13.696 4.338 715 HB2 TYR 27 HB2 TYR 27 -2.612 12.452 2.406 716 HB3 TYR 27 HB3 TYR 27 -1.979 14.057 2.061 717 HD1 TYR 27 HD1 TYR 27 -0.498 15.178 3.645 718 HD2 TYR 27 HD2 TYR 27 -1.973 11.262 4.415 719 HE1 TYR 27 HE1 TYR 27 1.202 14.890 5.398 720 HE2 TYR 27 HE2 TYR 27 -0.277 10.963 6.171 721 HH TYR 27 HH TYR 27 1.816 11.832 6.875 722 H LYS 28 H LYS 28 -2.775 15.501 5.184 723 HA LYS 28 HA LYS 28 -2.948 17.979 3.621 724 HB2 LYS 28 HB2 LYS 28 -3.811 17.782 6.509 725 HB3 LYS 28 HB3 LYS 28 -3.916 19.192 5.462 726 HG2 LYS 28 HG2 LYS 28 -5.530 17.968 4.044 727 HG3 LYS 28 HG3 LYS 28 -5.476 16.631 5.195 728 HD2 LYS 28 HD2 LYS 28 -6.305 18.096 6.957 729 HD3 LYS 28 HD3 LYS 28 -6.315 19.459 5.836 730 HE2 LYS 28 HE2 LYS 28 -7.827 17.823 4.417 731 HE3 LYS 28 HE3 LYS 28 -8.137 17.111 6.000 732 HZ1 LYS 28 HZ1 LYS 28 -9.499 19.177 4.985 733 HZ2 LYS 28 HZ2 LYS 28 -9.348 18.867 6.641 734 HZ3 LYS 28 HZ3 LYS 28 -8.332 19.996 5.896 735 H LYS 29 H LYS 29 -1.796 19.808 4.871 736 HA LYS 29 HA LYS 29 0.409 18.883 6.526 737 HB2 LYS 29 HB2 LYS 29 0.913 18.862 3.912 738 HB3 LYS 29 HB3 LYS 29 1.189 20.575 4.200 739 HG2 LYS 29 HG2 LYS 29 2.512 18.534 5.933 740 HG3 LYS 29 HG3 LYS 29 3.168 18.911 4.339 741 HD2 LYS 29 HD2 LYS 29 3.665 21.102 4.922 742 HD3 LYS 29 HD3 LYS 29 2.513 21.112 6.259 743 HE2 LYS 29 HE2 LYS 29 4.524 20.974 7.377 744 HE3 LYS 29 HE3 LYS 29 4.070 19.275 7.251 745 HZ1 LYS 29 HZ1 LYS 29 5.658 18.876 5.660 746 HZ2 LYS 29 HZ2 LYS 29 5.736 20.489 5.153 747 HZ3 LYS 29 HZ3 LYS 29 6.451 20.026 6.615 748 H GLY 30 H GLY 30 0.640 20.276 8.143 749 HA2 GLY 30 HA2 GLY 30 0.437 22.188 9.402 750 HA3 GLY 30 HA3 GLY 30 1.022 23.002 7.959 751 H GLU 31 H GLU 31 -2.008 21.242 8.108 752 HA GLU 31 HA GLU 31 -3.526 23.271 6.966 753 HB2 GLU 31 HB2 GLU 31 -4.034 20.725 7.413 754 HB3 GLU 31 HB3 GLU 31 -4.806 21.348 8.865 755 HG2 GLU 31 HG2 GLU 31 -5.467 22.152 6.041 756 HG3 GLU 31 HG3 GLU 31 -6.400 21.047 7.048 757 H1 TYR 1 H TYR 1 0.354 6.720 4.504 758 HA TYR 1 HA TYR 1 1.994 8.499 3.438 759 HB2 TYR 1 HB2 TYR 1 0.602 6.172 2.240 760 HB3 TYR 1 HB3 TYR 1 1.408 7.262 1.117 761 HD1 TYR 1 HD1 TYR 1 2.423 6.251 4.556 762 HD2 TYR 1 HD2 TYR 1 3.284 6.086 0.392 763 HE1 TYR 1 HE1 TYR 1 4.573 5.163 5.050 764 HE2 TYR 1 HE2 TYR 1 5.436 4.996 0.875 765 HH TYR 1 HH TYR 1 6.238 3.453 3.193 766 H GLY 2 H GLY 2 -0.902 7.823 1.486 767 HA2 GLY 2 HA2 GLY 2 -1.910 10.434 1.404 768 HA3 GLY 2 HA3 GLY 2 -0.770 10.259 0.077 769 H GLY 3 H GLY 3 -3.785 10.567 0.252 770 HA2 GLY 3 HA2 GLY 3 -5.635 9.782 -0.859 771 HA3 GLY 3 HA3 GLY 3 -4.484 9.137 -2.021 772 H PHE 4 H PHE 4 -5.215 7.147 -2.458 773 HA PHE 4 HA PHE 4 -6.375 5.467 -0.434 774 HB2 PHE 4 HB2 PHE 4 -5.825 5.205 -3.363 775 HB3 PHE 4 HB3 PHE 4 -6.165 3.756 -2.424 776 HD1 PHE 4 HD1 PHE 4 -8.358 3.284 -1.627 777 HD2 PHE 4 HD2 PHE 4 -7.521 6.967 -3.588 778 HE1 PHE 4 HE1 PHE 4 -10.771 3.724 -1.822 779 HE2 PHE 4 HE2 PHE 4 -9.933 7.414 -3.785 780 HZ PHE 4 HZ PHE 4 -11.561 5.792 -2.901 781 H MET 5 H MET 5 -5.521 3.632 0.492 782 HA MET 5 HA MET 5 -2.632 3.216 0.085 783 HB2 MET 5 HB2 MET 5 -3.487 4.200 2.329 784 HB3 MET 5 HB3 MET 5 -4.040 2.563 2.656 785 HG2 MET 5 HG2 MET 5 -1.530 2.017 1.946 786 HG3 MET 5 HG3 MET 5 -1.300 3.658 2.544 787 HE1 MET 5 HE1 MET 5 -1.078 0.005 4.826 788 HE2 MET 5 HE2 MET 5 -0.801 0.413 3.132 789 HE3 MET 5 HE3 MET 5 0.212 1.124 4.388 790 H THR 6 H THR 6 -2.347 1.397 -1.025 791 HA THR 6 HA THR 6 -4.143 -0.875 -0.522 792 HB THR 6 HB THR 6 -2.284 -0.387 -2.858 793 HG1 THR 6 HG1 THR 6 -4.640 -0.454 -3.789 794 HG21 THR 6 HG21 THR 6 -4.335 -2.564 -2.436 795 HG22 THR 6 HG22 THR 6 -3.339 -2.332 -3.872 796 HG23 THR 6 HG23 THR 6 -2.587 -2.779 -2.341 797 H SER 7 H SER 7 -3.217 -1.833 1.254 798 HA SER 7 HA SER 7 -0.388 -2.594 1.076 799 HB2 SER 7 HB2 SER 7 -1.664 -1.458 3.156 800 HB3 SER 7 HB3 SER 7 -1.933 -3.156 3.548 801 HG SER 7 HG SER 7 0.448 -1.703 3.435 802 H GLU 8 H GLU 8 -0.357 -4.401 -0.179 803 HA GLU 8 HA GLU 8 -2.039 -6.660 0.685 804 HB2 GLU 8 HB2 GLU 8 -1.030 -5.800 -1.992 805 HB3 GLU 8 HB3 GLU 8 -1.285 -7.514 -1.698 806 HG2 GLU 8 HG2 GLU 8 -3.530 -7.321 -1.674 807 HG3 GLU 8 HG3 GLU 8 -3.495 -5.725 -0.926 808 H LYS 9 H LYS 9 -0.947 -8.030 1.920 809 HA LYS 9 HA LYS 9 1.918 -8.439 1.411 810 HB2 LYS 9 HB2 LYS 9 1.249 -7.701 3.690 811 HB3 LYS 9 HB3 LYS 9 0.305 -9.175 3.861 812 HG2 LYS 9 HG2 LYS 9 2.630 -10.292 3.259 813 HG3 LYS 9 HG3 LYS 9 3.242 -8.778 3.930 814 HD2 LYS 9 HD2 LYS 9 1.144 -10.254 5.441 815 HD3 LYS 9 HD3 LYS 9 2.793 -10.884 5.460 816 HE2 LYS 9 HE2 LYS 9 2.861 -9.488 7.276 817 HE3 LYS 9 HE3 LYS 9 3.395 -8.386 6.008 818 HZ1 LYS 9 HZ1 LYS 9 1.435 -7.821 7.705 819 HZ2 LYS 9 HZ2 LYS 9 1.515 -7.180 6.141 820 HZ3 LYS 9 HZ3 LYS 9 0.527 -8.517 6.457 821 H SER 10 H SER 10 2.212 -10.080 0.037 822 HA SER 10 HA SER 10 1.350 -12.717 0.787 823 HB2 SER 10 HB2 SER 10 0.196 -13.193 -1.367 824 HB3 SER 10 HB3 SER 10 -0.660 -12.009 -0.381 825 HG SER 10 HG SER 10 0.766 -11.651 -2.767 826 H GLN 11 H GLN 11 2.687 -14.271 -0.006 827 HA GLN 11 HA GLN 11 5.033 -13.351 -1.442 828 HB2 GLN 11 HB2 GLN 11 5.938 -15.583 -0.953 829 HB3 GLN 11 HB3 GLN 11 5.345 -14.789 0.499 830 HG2 GLN 11 HG2 GLN 11 3.557 -16.219 0.718 831 HG3 GLN 11 HG3 GLN 11 3.555 -16.646 -0.992 832 HE21 GLN 11 HE21 GLN 11 3.508 -18.846 -0.474 833 HE22 GLN 11 HE22 GLN 11 4.913 -19.674 0.097 834 H THR 12 H THR 12 2.850 -13.195 -3.076 835 HA THR 12 HA THR 12 3.598 -15.036 -5.184 836 HB THR 12 HB THR 12 0.891 -15.229 -5.471 837 HG1 THR 12 HG1 THR 12 1.350 -15.721 -2.715 838 HG21 THR 12 HG21 THR 12 1.196 -17.555 -4.504 839 HG22 THR 12 HG22 THR 12 2.304 -17.104 -5.800 840 HG23 THR 12 HG23 THR 12 2.851 -17.078 -4.124 841 HA PRO 13 HA PRO 13 2.651 -11.673 -7.839 842 HB2 PRO 13 HB2 PRO 13 1.575 -12.892 -10.013 843 HB3 PRO 13 HB3 PRO 13 3.292 -12.993 -9.607 844 HG2 PRO 13 HG2 PRO 13 1.105 -14.971 -9.094 845 HG3 PRO 13 HG3 PRO 13 2.757 -15.255 -9.671 846 HD2 PRO 13 HD2 PRO 13 2.026 -15.655 -7.095 847 HD3 PRO 13 HD3 PRO 13 3.656 -15.120 -7.553 848 H LEU 14 H LEU 14 1.094 -10.297 -7.205 849 HA LEU 14 HA LEU 14 -1.712 -11.125 -7.552 850 HB2 LEU 14 HB2 LEU 14 -2.333 -9.694 -5.768 851 HB3 LEU 14 HB3 LEU 14 -0.971 -10.664 -5.212 852 HG LEU 14 HG LEU 14 -0.569 -7.880 -6.256 853 HD11 LEU 14 HD11 LEU 14 -0.500 -7.730 -3.489 854 HD12 LEU 14 HD12 LEU 14 -1.736 -7.058 -4.553 855 HD13 LEU 14 HD13 LEU 14 -1.958 -8.657 -3.841 856 HD21 LEU 14 HD21 LEU 14 1.499 -8.834 -6.030 857 HD22 LEU 14 HD22 LEU 14 1.280 -8.178 -4.408 858 HD23 LEU 14 HD23 LEU 14 0.992 -9.891 -4.713 859 H VAL 15 H VAL 15 -2.768 -8.505 -7.180 860 HA VAL 15 HA VAL 15 -1.623 -6.666 -9.024 861 HB VAL 15 HB VAL 15 -2.411 -8.233 -10.697 862 HG11 VAL 15 HG11 VAL 15 -5.232 -8.029 -10.434 863 HG12 VAL 15 HG12 VAL 15 -4.222 -9.474 -10.376 864 HG13 VAL 15 HG13 VAL 15 -4.573 -8.582 -8.895 865 HG21 VAL 15 HG21 VAL 15 -3.002 -5.547 -10.613 866 HG22 VAL 15 HG22 VAL 15 -3.104 -6.583 -12.037 867 HG23 VAL 15 HG23 VAL 15 -4.542 -6.281 -11.062 868 H THR 16 H THR 16 -2.414 -4.673 -8.665 869 HA THR 16 HA THR 16 -4.556 -4.404 -6.713 870 HB THR 16 HB THR 16 -2.617 -3.072 -6.258 871 HG1 THR 16 HG1 THR 16 -4.604 -1.340 -7.345 872 HG21 THR 16 HG21 THR 16 -2.585 -2.724 -9.106 873 HG22 THR 16 HG22 THR 16 -2.555 -1.148 -8.314 874 HG23 THR 16 HG23 THR 16 -1.327 -2.353 -7.927 875 H LEU 17 H LEU 17 -6.575 -4.325 -7.444 876 HA LEU 17 HA LEU 17 -7.159 -3.343 -10.109 877 HB2 LEU 17 HB2 LEU 17 -8.212 -5.373 -8.858 878 HB3 LEU 17 HB3 LEU 17 -9.242 -4.146 -8.123 879 HG LEU 17 HG LEU 17 -10.323 -5.245 -10.028 880 HD11 LEU 17 HD11 LEU 17 -11.289 -3.338 -10.844 881 HD12 LEU 17 HD12 LEU 17 -10.499 -2.700 -9.402 882 HD13 LEU 17 HD13 LEU 17 -9.752 -2.485 -10.985 883 HD21 LEU 17 HD21 LEU 17 -9.271 -5.667 -11.938 884 HD22 LEU 17 HD22 LEU 17 -8.833 -3.970 -12.134 885 HD23 LEU 17 HD23 LEU 17 -7.794 -5.047 -11.201 886 H PHE 18 H PHE 18 -6.877 -1.147 -10.102 887 HA PHE 18 HA PHE 18 -8.513 0.397 -8.203 888 HB2 PHE 18 HB2 PHE 18 -5.840 0.816 -9.369 889 HB3 PHE 18 HB3 PHE 18 -6.865 2.247 -9.346 890 HD1 PHE 18 HD1 PHE 18 -8.266 2.301 -6.949 891 HD2 PHE 18 HD2 PHE 18 -4.362 0.747 -7.630 892 HE1 PHE 18 HE1 PHE 18 -7.713 2.660 -4.578 893 HE2 PHE 18 HE2 PHE 18 -3.803 1.102 -5.260 894 HZ PHE 18 HZ PHE 18 -5.480 2.059 -3.731 895 H LYS 19 H LYS 19 -10.442 0.660 -9.185 896 HA LYS 19 HA LYS 19 -10.494 1.513 -11.991 897 HB2 LYS 19 HB2 LYS 19 -12.451 0.182 -10.175 898 HB3 LYS 19 HB3 LYS 19 -13.077 1.179 -11.482 899 HG2 LYS 19 HG2 LYS 19 -11.857 -0.168 -13.107 900 HG3 LYS 19 HG3 LYS 19 -11.204 -1.159 -11.800 901 HD2 LYS 19 HD2 LYS 19 -13.078 -2.296 -12.815 902 HD3 LYS 19 HD3 LYS 19 -13.512 -1.795 -11.179 903 HE2 LYS 19 HE2 LYS 19 -14.779 0.056 -12.014 904 HE3 LYS 19 HE3 LYS 19 -14.197 -0.220 -13.655 905 HZ1 LYS 19 HZ1 LYS 19 -15.506 -2.100 -13.889 906 HZ2 LYS 19 HZ2 LYS 19 -15.714 -2.306 -12.222 907 HZ3 LYS 19 HZ3 LYS 19 -16.519 -1.054 -13.027 908 H ASN 20 H ASN 20 -11.473 3.411 -12.644 909 HA ASN 20 HA ASN 20 -11.959 5.633 -12.496 910 HB2 ASN 20 HB2 ASN 20 -13.675 4.411 -10.349 911 HB3 ASN 20 HB3 ASN 20 -13.706 6.146 -10.649 912 HD21 ASN 20 HD21 ASN 20 -13.716 6.519 -13.209 913 HD22 ASN 20 HD22 ASN 20 -15.010 5.695 -14.003 914 H ALA 21 H ALA 21 -9.568 4.794 -11.153 915 HA ALA 21 HA ALA 21 -9.321 5.984 -8.599 916 HB1 ALA 21 HB1 ALA 21 -7.422 4.975 -10.655 917 HB2 ALA 21 HB2 ALA 21 -6.798 5.990 -9.355 918 HB3 ALA 21 HB3 ALA 21 -7.635 4.485 -8.974 919 H ILE 22 H ILE 22 -9.771 8.079 -8.303 920 HA ILE 22 HA ILE 22 -8.424 10.026 -10.055 921 HB ILE 22 HB ILE 22 -10.749 10.123 -10.634 922 HG12 ILE 22 HG12 ILE 22 -9.313 12.275 -9.923 923 HG13 ILE 22 HG13 ILE 22 -10.962 12.393 -10.526 924 HG21 ILE 22 HG21 ILE 22 -11.255 10.344 -7.672 925 HG22 ILE 22 HG22 ILE 22 -12.476 10.630 -8.912 926 HG23 ILE 22 HG23 ILE 22 -11.744 9.034 -8.747 927 HD11 ILE 22 HD11 ILE 22 -10.319 13.705 -8.421 928 HD12 ILE 22 HD12 ILE 22 -11.833 12.799 -8.417 929 HD13 ILE 22 HD13 ILE 22 -10.413 12.148 -7.598 930 H ILE 23 H ILE 23 -7.187 11.460 -9.030 931 HA ILE 23 HA ILE 23 -7.345 11.577 -6.101 932 HB ILE 23 HB ILE 23 -5.108 12.268 -8.001 933 HG12 ILE 23 HG12 ILE 23 -5.434 9.874 -7.490 934 HG13 ILE 23 HG13 ILE 23 -3.917 10.483 -6.837 935 HG21 ILE 23 HG21 ILE 23 -4.841 13.918 -6.401 936 HG22 ILE 23 HG22 ILE 23 -5.462 12.901 -5.101 937 HG23 ILE 23 HG23 ILE 23 -3.852 12.607 -5.758 938 HD11 ILE 23 HD11 ILE 23 -5.050 10.720 -4.633 939 HD12 ILE 23 HD12 ILE 23 -6.452 9.909 -5.331 940 HD13 ILE 23 HD13 ILE 23 -4.910 9.060 -5.214 941 H LYS 24 H LYS 24 -8.092 13.338 -5.129 942 HA LYS 24 HA LYS 24 -8.030 15.896 -6.581 943 HB2 LYS 24 HB2 LYS 24 -10.326 14.578 -6.333 944 HB3 LYS 24 HB3 LYS 24 -10.307 15.328 -4.742 945 HG2 LYS 24 HG2 LYS 24 -9.904 17.526 -5.991 946 HG3 LYS 24 HG3 LYS 24 -10.409 16.641 -7.433 947 HD2 LYS 24 HD2 LYS 24 -12.056 16.771 -4.915 948 HD3 LYS 24 HD3 LYS 24 -12.227 17.923 -6.241 949 HE2 LYS 24 HE2 LYS 24 -12.377 14.975 -6.745 950 HE3 LYS 24 HE3 LYS 24 -13.784 15.856 -6.151 951 HZ1 LYS 24 HZ1 LYS 24 -12.750 15.729 -8.779 952 HZ2 LYS 24 HZ2 LYS 24 -14.192 16.428 -8.237 953 HZ3 LYS 24 HZ3 LYS 24 -12.765 17.337 -8.253 954 H ASN 25 H ASN 25 -6.504 16.980 -5.479 955 HA ASN 25 HA ASN 25 -5.404 18.014 -3.777 956 HB2 ASN 25 HB2 ASN 25 -7.995 17.846 -2.238 957 HB3 ASN 25 HB3 ASN 25 -6.733 19.068 -2.105 958 HD21 ASN 25 HD21 ASN 25 -9.694 18.343 -3.412 959 HD22 ASN 25 HD22 ASN 25 -9.771 19.578 -4.617 960 H ALA 26 H ALA 26 -5.287 15.154 -3.861 961 HA ALA 26 HA ALA 26 -5.680 13.827 -1.474 962 HB1 ALA 26 HB1 ALA 26 -3.546 12.527 -2.224 963 HB2 ALA 26 HB2 ALA 26 -5.016 12.448 -3.195 964 HB3 ALA 26 HB3 ALA 26 -3.695 13.510 -3.681 965 H TYR 27 H TYR 27 -2.433 14.903 -2.455 966 HA TYR 27 HA TYR 27 -1.739 15.227 0.361 967 HB2 TYR 27 HB2 TYR 27 -0.330 14.009 -1.496 968 HB3 TYR 27 HB3 TYR 27 0.212 15.641 -1.872 969 HD1 TYR 27 HD1 TYR 27 1.579 16.896 -0.290 970 HD2 TYR 27 HD2 TYR 27 0.316 12.925 0.572 971 HE1 TYR 27 HE1 TYR 27 3.241 16.766 1.519 972 HE2 TYR 27 HE2 TYR 27 1.973 12.785 2.384 973 HH TYR 27 HH TYR 27 3.990 13.800 3.115 974 H LYS 28 H LYS 28 -0.764 17.123 1.179 975 HA LYS 28 HA LYS 28 -1.044 19.538 -0.465 976 HB2 LYS 28 HB2 LYS 28 -1.978 19.375 2.403 977 HB3 LYS 28 HB3 LYS 28 -2.142 20.742 1.309 978 HG2 LYS 28 HG2 LYS 28 -3.634 19.376 -0.111 979 HG3 LYS 28 HG3 LYS 28 -3.528 18.078 1.080 980 HD2 LYS 28 HD2 LYS 28 -4.499 19.535 2.774 981 HD3 LYS 28 HD3 LYS 28 -4.562 20.864 1.614 982 HE2 LYS 28 HE2 LYS 28 -5.926 19.096 0.203 983 HE3 LYS 28 HE3 LYS 28 -6.236 18.410 1.797 984 HZ1 LYS 28 HZ1 LYS 28 -7.697 20.356 0.687 985 HZ2 LYS 28 HZ2 LYS 28 -7.573 20.103 2.356 986 HZ3 LYS 28 HZ3 LYS 28 -6.610 21.273 1.604 987 H LYS 29 H LYS 29 -0.042 21.472 0.751 988 HA LYS 29 HA LYS 29 2.165 20.738 2.496 989 HB2 LYS 29 HB2 LYS 29 2.746 20.670 -0.100 990 HB3 LYS 29 HB3 LYS 29 2.904 22.405 0.139 991 HG2 LYS 29 HG2 LYS 29 4.304 20.505 1.970 992 HG3 LYS 29 HG3 LYS 29 4.981 20.883 0.385 993 HD2 LYS 29 HD2 LYS 29 5.315 23.117 0.919 994 HD3 LYS 29 HD3 LYS 29 4.126 23.085 2.223 995 HE2 LYS 29 HE2 LYS 29 6.108 23.111 3.400 996 HE3 LYS 29 HE3 LYS 29 5.772 21.383 3.309 997 HZ1 LYS 29 HZ1 LYS 29 7.427 21.049 1.774 998 HZ2 LYS 29 HZ2 LYS 29 7.415 22.649 1.225 999 HZ3 LYS 29 HZ3 LYS 29 8.115 22.273 2.718 1000 H GLY 30 H GLY 30 2.266 22.190 4.073 1001 HA2 GLY 30 HA2 GLY 30 1.908 24.122 5.267 1002 HA3 GLY 30 HA3 GLY 30 2.480 24.928 3.814 1003 H GLU 31 H GLU 31 -0.436 22.984 3.942 1004 HA GLU 31 HA GLU 31 -2.048 24.872 2.695 1005 HB2 GLU 31 HB2 GLU 31 -2.408 22.316 3.229 1006 HB3 GLU 31 HB3 GLU 31 -3.257 22.945 4.634 1007 HG2 GLU 31 HG2 GLU 31 -3.886 23.597 1.764 1008 HG3 GLU 31 HG3 GLU 31 -4.778 22.476 2.791 1009 H1 TYR 1 H TYR 1 2.911 8.558 0.862 1010 HA TYR 1 HA TYR 1 4.474 10.400 -0.220 1011 HB2 TYR 1 HB2 TYR 1 3.260 7.953 -1.371 1012 HB3 TYR 1 HB3 TYR 1 4.030 9.051 -2.510 1013 HD1 TYR 1 HD1 TYR 1 5.002 8.214 0.988 1014 HD2 TYR 1 HD2 TYR 1 5.998 7.976 -3.141 1015 HE1 TYR 1 HE1 TYR 1 7.198 7.277 1.578 1016 HE2 TYR 1 HE2 TYR 1 8.196 7.037 -2.563 1017 HH TYR 1 HH TYR 1 9.019 5.617 -0.170 1018 H GLY 2 H GLY 2 1.680 9.481 -2.221 1019 HA2 GLY 2 HA2 GLY 2 0.517 12.019 -2.423 1020 HA3 GLY 2 HA3 GLY 2 1.705 11.874 -3.710 1021 H GLY 3 H GLY 3 -1.323 12.001 -3.642 1022 HA2 GLY 3 HA2 GLY 3 -3.086 11.065 -4.778 1023 HA3 GLY 3 HA3 GLY 3 -1.861 10.454 -5.880 1024 H PHE 4 H PHE 4 -2.463 8.411 -6.269 1025 HA PHE 4 HA PHE 4 -3.576 6.731 -4.219 1026 HB2 PHE 4 HB2 PHE 4 -2.935 6.409 -7.123 1027 HB3 PHE 4 HB3 PHE 4 -3.210 4.971 -6.145 1028 HD1 PHE 4 HD1 PHE 4 -5.388 4.385 -5.391 1029 HD2 PHE 4 HD2 PHE 4 -4.731 8.058 -7.440 1030 HE1 PHE 4 HE1 PHE 4 -7.818 4.668 -5.658 1031 HE2 PHE 4 HE2 PHE 4 -7.159 8.347 -7.709 1032 HZ PHE 4 HZ PHE 4 -8.706 6.651 -6.817 1033 H MET 5 H MET 5 -2.638 4.992 -3.200 1034 HA MET 5 HA MET 5 0.280 4.735 -3.523 1035 HB2 MET 5 HB2 MET 5 -0.695 5.736 -1.336 1036 HB3 MET 5 HB3 MET 5 -1.157 4.080 -0.969 1037 HG2 MET 5 HG2 MET 5 1.400 3.666 -1.594 1038 HG3 MET 5 HG3 MET 5 1.515 5.336 -1.046 1039 HE1 MET 5 HE1 MET 5 1.896 1.782 1.363 1040 HE2 MET 5 HE2 MET 5 2.195 2.151 -0.335 1041 HE3 MET 5 HE3 MET 5 3.126 2.966 0.922 1042 H THR 6 H THR 6 0.711 2.901 -4.556 1043 HA THR 6 HA THR 6 -0.960 0.541 -4.027 1044 HB THR 6 HB THR 6 0.935 1.061 -6.326 1045 HG1 THR 6 HG1 THR 6 -1.377 0.840 -7.327 1046 HG21 THR 6 HG21 THR 6 -1.012 -1.209 -5.900 1047 HG22 THR 6 HG22 THR 6 0.032 -0.972 -7.302 1048 HG23 THR 6 HG23 THR 6 0.739 -1.328 -5.726 1049 H SER 7 H SER 7 -0.038 -0.324 -2.208 1050 HA SER 7 HA SER 7 2.840 -0.903 -2.276 1051 HB2 SER 7 HB2 SER 7 1.429 0.206 -0.269 1052 HB3 SER 7 HB3 SER 7 1.255 -1.495 0.164 1053 HG SER 7 HG SER 7 3.543 0.104 0.079 1054 H GLU 8 H GLU 8 3.032 -2.741 -3.466 1055 HA GLU 8 HA GLU 8 1.463 -5.077 -2.592 1056 HB2 GLU 8 HB2 GLU 8 2.512 -4.234 -5.261 1057 HB3 GLU 8 HB3 GLU 8 2.342 -5.950 -4.921 1058 HG2 GLU 8 HG2 GLU 8 0.092 -5.884 -4.984 1059 HG3 GLU 8 HG3 GLU 8 0.010 -4.272 -4.276 1060 H LYS 9 H LYS 9 2.599 -6.332 -1.276 1061 HA LYS 9 HA LYS 9 5.499 -6.572 -1.680 1062 HB2 LYS 9 HB2 LYS 9 4.702 -5.822 0.554 1063 HB3 LYS 9 HB3 LYS 9 3.850 -7.350 0.732 1064 HG2 LYS 9 HG2 LYS 9 6.257 -8.333 0.246 1065 HG3 LYS 9 HG3 LYS 9 6.753 -6.763 0.883 1066 HD2 LYS 9 HD2 LYS 9 4.702 -8.317 2.380 1067 HD3 LYS 9 HD3 LYS 9 6.385 -8.842 2.470 1068 HE2 LYS 9 HE2 LYS 9 6.310 -7.387 4.237 1069 HE3 LYS 9 HE3 LYS 9 6.815 -6.295 2.949 1070 HZ1 LYS 9 HZ1 LYS 9 4.772 -5.799 4.568 1071 HZ2 LYS 9 HZ2 LYS 9 4.860 -5.206 2.986 1072 HZ3 LYS 9 HZ3 LYS 9 3.948 -6.591 3.320 1073 H SER 10 H SER 10 5.942 -8.223 -3.002 1074 HA SER 10 HA SER 10 5.234 -10.892 -2.208 1075 HB2 SER 10 HB2 SER 10 4.178 -11.497 -4.382 1076 HB3 SER 10 HB3 SER 10 3.215 -10.354 -3.446 1077 HG SER 10 HG SER 10 4.678 -9.949 -5.802 1078 H GLN 11 H GLN 11 6.715 -12.355 -2.891 1079 HA GLN 11 HA GLN 11 9.024 -11.319 -4.302 1080 HB2 GLN 11 HB2 GLN 11 10.068 -13.467 -3.722 1081 HB3 GLN 11 HB3 GLN 11 9.379 -12.677 -2.310 1082 HG2 GLN 11 HG2 GLN 11 7.687 -14.222 -2.100 1083 HG3 GLN 11 HG3 GLN 11 7.769 -14.698 -3.795 1084 HE21 GLN 11 HE21 GLN 11 7.858 -16.880 -3.201 1085 HE22 GLN 11 HE22 GLN 11 9.300 -17.589 -2.566 1086 H THR 12 H THR 12 6.897 -11.355 -6.004 1087 HA THR 12 HA THR 12 7.826 -13.204 -8.031 1088 HB THR 12 HB THR 12 5.149 -13.585 -8.391 1089 HG1 THR 12 HG1 THR 12 5.551 -13.963 -5.607 1090 HG21 THR 12 HG21 THR 12 5.573 -15.856 -7.345 1091 HG22 THR 12 HG22 THR 12 6.694 -15.370 -8.617 1092 HG23 THR 12 HG23 THR 12 7.179 -15.260 -6.924 1093 HA PRO 13 HA PRO 13 6.745 -9.989 -10.814 1094 HB2 PRO 13 HB2 PRO 13 5.823 -11.339 -12.982 1095 HB3 PRO 13 HB3 PRO 13 7.530 -11.312 -12.521 1096 HG2 PRO 13 HG2 PRO 13 5.463 -13.418 -12.013 1097 HG3 PRO 13 HG3 PRO 13 7.148 -13.606 -12.532 1098 HD2 PRO 13 HD2 PRO 13 6.362 -13.981 -9.968 1099 HD3 PRO 13 HD3 PRO 13 7.967 -13.351 -10.393 1100 H LEU 14 H LEU 14 5.082 -8.698 -10.287 1101 HA LEU 14 HA LEU 14 2.349 -9.722 -10.691 1102 HB2 LEU 14 HB2 LEU 14 1.574 -8.296 -8.967 1103 HB3 LEU 14 HB3 LEU 14 2.980 -9.155 -8.341 1104 HG LEU 14 HG LEU 14 3.228 -6.378 -9.450 1105 HD11 LEU 14 HD11 LEU 14 3.182 -6.153 -6.685 1106 HD12 LEU 14 HD12 LEU 14 1.948 -5.590 -7.813 1107 HD13 LEU 14 HD13 LEU 14 1.802 -7.182 -7.067 1108 HD21 LEU 14 HD21 LEU 14 5.344 -7.201 -9.125 1109 HD22 LEU 14 HD22 LEU 14 5.028 -6.486 -7.544 1110 HD23 LEU 14 HD23 LEU 14 4.859 -8.226 -7.775 1111 H VAL 15 H VAL 15 1.101 -7.181 -10.434 1112 HA VAL 15 HA VAL 15 2.189 -5.315 -12.291 1113 HB VAL 15 HB VAL 15 1.551 -6.972 -13.939 1114 HG11 VAL 15 HG11 VAL 15 -1.285 -6.940 -13.755 1115 HG12 VAL 15 HG12 VAL 15 -0.188 -8.316 -13.637 1116 HG13 VAL 15 HG13 VAL 15 -0.633 -7.417 -12.187 1117 HG21 VAL 15 HG21 VAL 15 0.791 -4.329 -13.949 1118 HG22 VAL 15 HG22 VAL 15 0.789 -5.408 -15.345 1119 HG23 VAL 15 HG23 VAL 15 -0.689 -5.168 -14.413 1120 H THR 16 H THR 16 1.258 -3.367 -12.022 1121 HA THR 16 HA THR 16 -0.947 -3.182 -10.132 1122 HB THR 16 HB THR 16 0.886 -1.713 -9.667 1123 HG1 THR 16 HG1 THR 16 -1.172 -0.145 -10.865 1124 HG21 THR 16 HG21 THR 16 0.971 -1.441 -12.527 1125 HG22 THR 16 HG22 THR 16 0.897 0.151 -11.772 1126 HG23 THR 16 HG23 THR 16 2.178 -0.977 -11.328 1127 H LEU 17 H LEU 17 -2.948 -3.253 -10.914 1128 HA LEU 17 HA LEU 17 -3.519 -2.388 -13.623 1129 HB2 LEU 17 HB2 LEU 17 -4.473 -4.447 -12.341 1130 HB3 LEU 17 HB3 LEU 17 -5.600 -3.271 -11.668 1131 HG LEU 17 HG LEU 17 -6.555 -4.491 -13.567 1132 HD11 LEU 17 HD11 LEU 17 -7.623 -2.675 -14.458 1133 HD12 LEU 17 HD12 LEU 17 -6.912 -1.946 -13.017 1134 HD13 LEU 17 HD13 LEU 17 -6.142 -1.727 -14.589 1135 HD21 LEU 17 HD21 LEU 17 -5.427 -4.893 -15.437 1136 HD22 LEU 17 HD22 LEU 17 -5.097 -3.176 -15.671 1137 HD23 LEU 17 HD23 LEU 17 -4.014 -4.156 -14.682 1138 H PHE 18 H PHE 18 -3.394 -0.181 -13.685 1139 HA PHE 18 HA PHE 18 -5.174 1.305 -11.872 1140 HB2 PHE 18 HB2 PHE 18 -2.503 1.867 -12.982 1141 HB3 PHE 18 HB3 PHE 18 -3.621 3.227 -13.028 1142 HD1 PHE 18 HD1 PHE 18 -5.083 3.268 -10.672 1143 HD2 PHE 18 HD2 PHE 18 -1.076 1.932 -11.201 1144 HE1 PHE 18 HE1 PHE 18 -4.620 3.730 -8.300 1145 HE2 PHE 18 HE2 PHE 18 -0.607 2.391 -8.830 1146 HZ PHE 18 HZ PHE 18 -2.380 3.290 -7.376 1147 H LYS 19 H LYS 19 -7.088 1.417 -12.908 1148 HA LYS 19 HA LYS 19 -7.119 2.182 -15.740 1149 HB2 LYS 19 HB2 LYS 19 -9.036 0.780 -13.935 1150 HB3 LYS 19 HB3 LYS 19 -9.688 1.692 -15.290 1151 HG2 LYS 19 HG2 LYS 19 -8.334 0.380 -16.836 1152 HG3 LYS 19 HG3 LYS 19 -7.660 -0.527 -15.480 1153 HD2 LYS 19 HD2 LYS 19 -9.429 -1.809 -16.517 1154 HD3 LYS 19 HD3 LYS 19 -9.937 -1.296 -14.906 1155 HE2 LYS 19 HE2 LYS 19 -11.298 0.447 -15.820 1156 HE3 LYS 19 HE3 LYS 19 -10.655 0.172 -17.438 1157 HZ1 LYS 19 HZ1 LYS 19 -11.833 -1.794 -17.659 1158 HZ2 LYS 19 HZ2 LYS 19 -12.072 -1.976 -15.994 1159 HZ3 LYS 19 HZ3 LYS 19 -12.935 -0.797 -16.849 1160 H ASN 20 H ASN 20 -8.200 3.992 -16.475 1161 HA ASN 20 HA ASN 20 -8.835 6.180 -16.408 1162 HB2 ASN 20 HB2 ASN 20 -10.524 4.908 -14.271 1163 HB3 ASN 20 HB3 ASN 20 -10.658 6.629 -14.616 1164 HD21 ASN 20 HD21 ASN 20 -10.628 6.941 -17.182 1165 HD22 ASN 20 HD22 ASN 20 -11.845 6.015 -17.987 1166 H ALA 21 H ALA 21 -6.435 5.525 -14.968 1167 HA ALA 21 HA ALA 21 -6.335 6.813 -12.452 1168 HB1 ALA 21 HB1 ALA 21 -4.318 5.856 -14.419 1169 HB2 ALA 21 HB2 ALA 21 -3.796 6.949 -13.138 1170 HB3 ALA 21 HB3 ALA 21 -4.551 5.408 -12.729 1171 H ILE 22 H ILE 22 -6.907 8.886 -12.232 1172 HA ILE 22 HA ILE 22 -5.634 10.853 -14.016 1173 HB ILE 22 HB ILE 22 -7.944 10.792 -14.657 1174 HG12 ILE 22 HG12 ILE 22 -6.659 13.048 -13.977 1175 HG13 ILE 22 HG13 ILE 22 -8.294 13.047 -14.629 1176 HG21 ILE 22 HG21 ILE 22 -8.545 11.074 -11.719 1177 HG22 ILE 22 HG22 ILE 22 -9.746 11.244 -13.000 1178 HG23 ILE 22 HG23 ILE 22 -8.922 9.702 -12.762 1179 HD11 ILE 22 HD11 ILE 22 -7.795 14.460 -12.551 1180 HD12 ILE 22 HD12 ILE 22 -9.249 13.463 -12.558 1181 HD13 ILE 22 HD13 ILE 22 -7.817 12.926 -11.681 1182 H ILE 23 H ILE 23 -4.519 12.398 -13.011 1183 HA ILE 23 HA ILE 23 -4.759 12.595 -10.091 1184 HB ILE 23 HB ILE 23 -2.521 13.367 -11.959 1185 HG12 ILE 23 HG12 ILE 23 -2.715 10.972 -11.376 1186 HG13 ILE 23 HG13 ILE 23 -1.251 11.695 -10.717 1187 HG21 ILE 23 HG21 ILE 23 -2.408 15.079 -10.404 1188 HG22 ILE 23 HG22 ILE 23 -2.983 14.057 -9.086 1189 HG23 ILE 23 HG23 ILE 23 -1.344 13.858 -9.705 1190 HD11 ILE 23 HD11 ILE 23 -2.437 11.930 -8.543 1191 HD12 ILE 23 HD12 ILE 23 -3.778 11.019 -9.237 1192 HD13 ILE 23 HD13 ILE 23 -2.193 10.264 -9.067 1193 H LYS 24 H LYS 24 -5.637 14.335 -9.194 1194 HA LYS 24 HA LYS 24 -5.696 16.846 -10.727 1195 HB2 LYS 24 HB2 LYS 24 -7.911 15.393 -10.493 1196 HB3 LYS 24 HB3 LYS 24 -7.982 16.195 -8.929 1197 HG2 LYS 24 HG2 LYS 24 -7.682 18.371 -10.243 1198 HG3 LYS 24 HG3 LYS 24 -8.091 17.409 -11.665 1199 HD2 LYS 24 HD2 LYS 24 -9.814 17.511 -9.197 1200 HD3 LYS 24 HD3 LYS 24 -10.015 18.617 -10.557 1201 HE2 LYS 24 HE2 LYS 24 -9.974 15.654 -10.990 1202 HE3 LYS 24 HE3 LYS 24 -11.447 16.460 -10.453 1203 HZ1 LYS 24 HZ1 LYS 24 -10.340 16.335 -13.050 1204 HZ2 LYS 24 HZ2 LYS 24 -11.834 16.960 -12.561 1205 HZ3 LYS 24 HZ3 LYS 24 -10.463 17.951 -12.566 1206 H ASN 25 H ASN 25 -4.268 18.054 -9.621 1207 HA ASN 25 HA ASN 25 -3.281 19.206 -7.926 1208 HB2 ASN 25 HB2 ASN 25 -5.897 18.928 -6.447 1209 HB3 ASN 25 HB3 ASN 25 -4.717 20.230 -6.327 1210 HD21 ASN 25 HD21 ASN 25 -7.591 19.273 -7.680 1211 HD22 ASN 25 HD22 ASN 25 -7.714 20.461 -8.929 1212 H ALA 26 H ALA 26 -2.993 16.355 -7.914 1213 HA ALA 26 HA ALA 26 -3.369 15.081 -5.496 1214 HB1 ALA 26 HB1 ALA 26 -1.140 13.893 -6.147 1215 HB2 ALA 26 HB2 ALA 26 -2.574 13.694 -7.154 1216 HB3 ALA 26 HB3 ALA 26 -1.306 14.821 -7.638 1217 H TYR 27 H TYR 27 -0.168 16.328 -6.425 1218 HA TYR 27 HA TYR 27 0.424 16.779 -3.603 1219 HB2 TYR 27 HB2 TYR 27 1.958 15.596 -5.382 1220 HB3 TYR 27 HB3 TYR 27 2.409 17.246 -5.795 1221 HD1 TYR 27 HD1 TYR 27 3.647 18.632 -4.214 1222 HD2 TYR 27 HD2 TYR 27 2.613 14.615 -3.267 1223 HE1 TYR 27 HE1 TYR 27 5.261 18.660 -2.359 1224 HE2 TYR 27 HE2 TYR 27 4.223 14.632 -1.409 1225 HH TYR 27 HH TYR 27 6.151 15.795 -0.655 1226 H LYS 28 H LYS 28 1.256 18.755 -2.819 1227 HA LYS 28 HA LYS 28 0.875 21.098 -4.546 1228 HB2 LYS 28 HB2 LYS 28 -0.129 20.961 -1.700 1229 HB3 LYS 28 HB3 LYS 28 -0.344 22.283 -2.840 1230 HG2 LYS 28 HG2 LYS 28 -1.708 20.787 -4.258 1231 HG3 LYS 28 HG3 LYS 28 -1.558 19.534 -3.024 1232 HD2 LYS 28 HD2 LYS 28 -2.663 20.982 -1.404 1233 HD3 LYS 28 HD3 LYS 28 -2.777 22.266 -2.610 1234 HE2 LYS 28 HE2 LYS 28 -3.988 20.369 -3.994 1235 HE3 LYS 28 HE3 LYS 28 -4.299 19.718 -2.386 1236 HZ1 LYS 28 HZ1 LYS 28 -5.847 21.528 -3.600 1237 HZ2 LYS 28 HZ2 LYS 28 -5.753 21.341 -1.921 1238 HZ3 LYS 28 HZ3 LYS 28 -4.845 22.544 -2.689 1239 H LYS 29 H LYS 29 1.724 23.125 -3.373 1240 HA LYS 29 HA LYS 29 3.921 22.583 -1.543 1241 HB2 LYS 29 HB2 LYS 29 4.579 22.471 -4.119 1242 HB3 LYS 29 HB3 LYS 29 4.623 24.220 -3.934 1243 HG2 LYS 29 HG2 LYS 29 6.085 22.470 -2.004 1244 HG3 LYS 29 HG3 LYS 29 6.782 22.840 -3.583 1245 HD2 LYS 29 HD2 LYS 29 6.967 25.104 -3.113 1246 HD3 LYS 29 HD3 LYS 29 5.739 25.043 -1.846 1247 HE2 LYS 29 HE2 LYS 29 7.675 25.228 -0.609 1248 HE3 LYS 29 HE3 LYS 29 7.446 23.481 -0.651 1249 HZ1 LYS 29 HZ1 LYS 29 9.170 23.198 -2.118 1250 HZ2 LYS 29 HZ2 LYS 29 9.078 24.775 -2.726 1251 HZ3 LYS 29 HZ3 LYS 29 9.750 24.495 -1.198 1252 H GLY 30 H GLY 30 3.887 24.087 -0.012 1253 HA2 GLY 30 HA2 GLY 30 3.380 26.029 1.108 1254 HA3 GLY 30 HA3 GLY 30 3.940 26.825 -0.356 1255 H GLU 31 H GLU 31 1.147 24.706 -0.236 1256 HA GLU 31 HA GLU 31 -0.544 26.455 -1.581 1257 HB2 GLU 31 HB2 GLU 31 -0.758 23.896 -0.992 1258 HB3 GLU 31 HB3 GLU 31 -1.682 24.502 0.376 1259 HG2 GLU 31 HG2 GLU 31 -2.274 25.044 -2.525 1260 HG3 GLU 31 HG3 GLU 31 -3.121 23.894 -1.492 1261 H1 TYR 1 H TYR 1 5.471 10.459 -2.745 1262 HA TYR 1 HA TYR 1 6.949 12.341 -3.867 1263 HB2 TYR 1 HB2 TYR 1 5.908 9.784 -4.945 1264 HB3 TYR 1 HB3 TYR 1 6.637 10.882 -6.112 1265 HD1 TYR 1 HD1 TYR 1 7.572 10.225 -2.565 1266 HD2 TYR 1 HD2 TYR 1 8.684 9.919 -6.660 1267 HE1 TYR 1 HE1 TYR 1 9.806 9.445 -1.893 1268 HE2 TYR 1 HE2 TYR 1 10.921 9.137 -6.000 1269 HH TYR 1 HH TYR 1 11.768 7.848 -3.540 1270 H GLY 2 H GLY 2 4.266 11.187 -5.898 1271 HA2 GLY 2 HA2 GLY 2 2.950 13.630 -6.225 1272 HA3 GLY 2 HA3 GLY 2 4.193 13.536 -7.463 1273 H GLY 3 H GLY 3 1.175 13.465 -7.535 1274 HA2 GLY 3 HA2 GLY 3 -0.473 12.384 -8.714 1275 HA3 GLY 3 HA3 GLY 3 0.837 11.807 -9.734 1276 H PHE 4 H PHE 4 0.349 9.721 -10.070 1277 HA PHE 4 HA PHE 4 -0.739 8.057 -7.991 1278 HB2 PHE 4 HB2 PHE 4 -0.006 7.675 -10.865 1279 HB3 PHE 4 HB3 PHE 4 -0.218 6.255 -9.846 1280 HD1 PHE 4 HD1 PHE 4 -2.375 5.562 -9.123 1281 HD2 PHE 4 HD2 PHE 4 -1.889 9.203 -11.274 1282 HE1 PHE 4 HE1 PHE 4 -4.810 5.688 -9.452 1283 HE2 PHE 4 HE2 PHE 4 -4.323 9.335 -11.606 1284 HZ PHE 4 HZ PHE 4 -5.787 7.578 -10.694 1285 H MET 5 H MET 5 0.260 6.407 -6.885 1286 HA MET 5 HA MET 5 3.197 6.303 -7.116 1287 HB2 MET 5 HB2 MET 5 2.085 7.304 -4.989 1288 HB3 MET 5 HB3 MET 5 1.726 5.631 -4.587 1289 HG2 MET 5 HG2 MET 5 4.322 5.376 -5.128 1290 HG3 MET 5 HG3 MET 5 4.307 7.065 -4.626 1291 HE1 MET 5 HE1 MET 5 4.853 3.609 -2.107 1292 HE2 MET 5 HE2 MET 5 5.182 3.957 -3.804 1293 HE3 MET 5 HE3 MET 5 6.015 4.863 -2.540 1294 H THR 6 H THR 6 3.796 4.461 -8.039 1295 HA THR 6 HA THR 6 2.233 2.027 -7.503 1296 HB THR 6 HB THR 6 4.168 2.586 -9.759 1297 HG1 THR 6 HG1 THR 6 1.899 2.199 -10.818 1298 HG21 THR 6 HG21 THR 6 2.337 0.223 -9.324 1299 HG22 THR 6 HG22 THR 6 3.415 0.477 -10.696 1300 HG23 THR 6 HG23 THR 6 4.085 0.209 -9.087 1301 H SER 7 H SER 7 3.155 1.309 -5.612 1302 HA SER 7 HA SER 7 6.058 0.889 -5.579 1303 HB2 SER 7 HB2 SER 7 4.513 1.965 -3.653 1304 HB3 SER 7 HB3 SER 7 4.434 0.270 -3.173 1305 HG SER 7 HG SER 7 6.617 2.010 -3.239 1306 H GLU 8 H GLU 8 6.414 -0.969 -6.693 1307 HA GLU 8 HA GLU 8 4.955 -3.369 -5.806 1308 HB2 GLU 8 HB2 GLU 8 6.060 -2.547 -8.460 1309 HB3 GLU 8 HB3 GLU 8 5.968 -4.259 -8.070 1310 HG2 GLU 8 HG2 GLU 8 3.722 -4.316 -8.225 1311 HG3 GLU 8 HG3 GLU 8 3.525 -2.692 -7.570 1312 H LYS 9 H LYS 9 6.111 -4.516 -4.412 1313 HA LYS 9 HA LYS 9 9.035 -4.573 -4.683 1314 HB2 LYS 9 HB2 LYS 9 8.043 -3.859 -2.501 1315 HB3 LYS 9 HB3 LYS 9 7.348 -5.467 -2.339 1316 HG2 LYS 9 HG2 LYS 9 9.853 -6.210 -2.691 1317 HG3 LYS 9 HG3 LYS 9 10.172 -4.582 -2.088 1318 HD2 LYS 9 HD2 LYS 9 8.209 -6.248 -0.606 1319 HD3 LYS 9 HD3 LYS 9 9.917 -6.669 -0.463 1320 HE2 LYS 9 HE2 LYS 9 9.709 -5.181 1.266 1321 HE3 LYS 9 HE3 LYS 9 10.185 -4.092 -0.036 1322 HZ1 LYS 9 HZ1 LYS 9 8.074 -3.677 1.517 1323 HZ2 LYS 9 HZ2 LYS 9 8.171 -3.117 -0.076 1324 HZ3 LYS 9 HZ3 LYS 9 7.331 -4.545 0.269 1325 H SER 10 H SER 10 9.627 -6.196 -5.988 1326 HA SER 10 HA SER 10 9.081 -8.902 -5.180 1327 HB2 SER 10 HB2 SER 10 8.178 -9.592 -7.408 1328 HB3 SER 10 HB3 SER 10 7.086 -8.544 -6.503 1329 HG SER 10 HG SER 10 8.593 -7.998 -8.801 1330 H GLN 11 H GLN 11 10.657 -10.294 -5.833 1331 HA GLN 11 HA GLN 11 12.952 -9.104 -7.160 1332 HB2 GLN 11 HB2 GLN 11 14.133 -11.149 -6.483 1333 HB3 GLN 11 HB3 GLN 11 13.332 -10.381 -5.119 1334 HG2 GLN 11 HG2 GLN 11 11.756 -12.046 -4.929 1335 HG3 GLN 11 HG3 GLN 11 11.941 -12.556 -6.606 1336 HE21 GLN 11 HE21 GLN 11 12.167 -14.710 -5.937 1337 HE22 GLN 11 HE22 GLN 11 13.635 -15.288 -5.234 1338 H THR 12 H THR 12 10.894 -9.345 -8.930 1339 HA THR 12 HA THR 12 12.029 -11.177 -10.868 1340 HB THR 12 HB THR 12 9.404 -11.754 -11.319 1341 HG1 THR 12 HG1 THR 12 9.701 -12.022 -8.512 1342 HG21 THR 12 HG21 THR 12 9.935 -13.954 -10.169 1343 HG22 THR 12 HG22 THR 12 11.068 -13.438 -11.418 1344 HG23 THR 12 HG23 THR 12 11.480 -13.234 -9.715 1345 HA PRO 13 HA PRO 13 10.835 -8.132 -13.794 1346 HB2 PRO 13 HB2 PRO 13 10.051 -9.603 -15.937 1347 HB3 PRO 13 HB3 PRO 13 11.739 -9.463 -15.434 1348 HG2 PRO 13 HG2 PRO 13 9.783 -11.667 -14.909 1349 HG3 PRO 13 HG3 PRO 13 11.490 -11.774 -15.377 1350 HD2 PRO 13 HD2 PRO 13 10.656 -12.110 -12.823 1351 HD3 PRO 13 HD3 PRO 13 12.233 -11.402 -13.227 1352 H LEU 14 H LEU 14 9.084 -6.936 -13.310 1353 HA LEU 14 HA LEU 14 6.427 -8.121 -13.783 1354 HB2 LEU 14 HB2 LEU 14 5.520 -6.734 -12.098 1355 HB3 LEU 14 HB3 LEU 14 6.967 -7.479 -11.423 1356 HG LEU 14 HG LEU 14 7.029 -4.706 -12.571 1357 HD11 LEU 14 HD11 LEU 14 6.937 -4.472 -9.802 1358 HD12 LEU 14 HD12 LEU 14 5.690 -3.988 -10.952 1359 HD13 LEU 14 HD13 LEU 14 5.629 -5.585 -10.205 1360 HD21 LEU 14 HD21 LEU 14 9.199 -5.336 -12.213 1361 HD22 LEU 14 HD22 LEU 14 8.806 -4.672 -10.627 1362 HD23 LEU 14 HD23 LEU 14 8.784 -6.416 -10.882 1363 H VAL 15 H VAL 15 4.964 -5.742 -13.676 1364 HA VAL 15 HA VAL 15 6.015 -3.801 -15.495 1365 HB VAL 15 HB VAL 15 5.555 -5.529 -17.134 1366 HG11 VAL 15 HG11 VAL 15 2.714 -5.665 -17.061 1367 HG12 VAL 15 HG12 VAL 15 3.887 -6.971 -16.888 1368 HG13 VAL 15 HG13 VAL 15 3.336 -6.085 -15.465 1369 HG21 VAL 15 HG21 VAL 15 4.679 -2.945 -17.253 1370 HG22 VAL 15 HG22 VAL 15 4.721 -4.065 -18.614 1371 HG23 VAL 15 HG23 VAL 15 3.230 -3.845 -17.699 1372 H THR 16 H THR 16 4.924 -1.920 -15.325 1373 HA THR 16 HA THR 16 2.650 -1.857 -13.509 1374 HB THR 16 HB THR 16 4.364 -0.248 -13.029 1375 HG1 THR 16 HG1 THR 16 2.230 1.147 -14.303 1376 HG21 THR 16 HG21 THR 16 4.514 -0.034 -15.883 1377 HG22 THR 16 HG22 THR 16 4.264 1.567 -15.184 1378 HG23 THR 16 HG23 THR 16 5.630 0.580 -14.664 1379 H LEU 17 H LEU 17 0.675 -2.046 -14.327 1380 HA LEU 17 HA LEU 17 0.137 -1.313 -17.084 1381 HB2 LEU 17 HB2 LEU 17 -0.720 -3.392 -15.769 1382 HB3 LEU 17 HB3 LEU 17 -1.941 -2.275 -15.163 1383 HG LEU 17 HG LEU 17 -2.756 -3.608 -17.051 1384 HD11 LEU 17 HD11 LEU 17 -3.916 -1.893 -18.020 1385 HD12 LEU 17 HD12 LEU 17 -3.292 -1.076 -16.587 1386 HD13 LEU 17 HD13 LEU 17 -2.497 -0.853 -18.146 1387 HD21 LEU 17 HD21 LEU 17 -1.549 -3.984 -18.877 1388 HD22 LEU 17 HD22 LEU 17 -1.325 -2.256 -19.151 1389 HD23 LEU 17 HD23 LEU 17 -0.211 -3.135 -18.104 1390 H PHE 18 H PHE 18 0.132 0.898 -17.200 1391 HA PHE 18 HA PHE 18 -1.798 2.316 -15.488 1392 HB2 PHE 18 HB2 PHE 18 0.860 3.019 -16.547 1393 HB3 PHE 18 HB3 PHE 18 -0.342 4.300 -16.665 1394 HD1 PHE 18 HD1 PHE 18 -1.867 4.319 -14.351 1395 HD2 PHE 18 HD2 PHE 18 2.230 3.231 -14.733 1396 HE1 PHE 18 HE1 PHE 18 -1.500 4.883 -11.984 1397 HE2 PHE 18 HE2 PHE 18 2.604 3.792 -12.367 1398 HZ PHE 18 HZ PHE 18 0.737 4.618 -10.989 1399 H LYS 19 H LYS 19 -3.686 2.268 -16.575 1400 HA LYS 19 HA LYS 19 -3.690 2.948 -19.429 1401 HB2 LYS 19 HB2 LYS 19 -5.552 1.463 -17.635 1402 HB3 LYS 19 HB3 LYS 19 -6.231 2.295 -19.027 1403 HG2 LYS 19 HG2 LYS 19 -4.751 1.045 -20.507 1404 HG3 LYS 19 HG3 LYS 19 -4.052 0.217 -19.113 1405 HD2 LYS 19 HD2 LYS 19 -5.703 -1.206 -20.162 1406 HD3 LYS 19 HD3 LYS 19 -6.285 -0.693 -18.576 1407 HE2 LYS 19 HE2 LYS 19 -7.737 0.932 -19.564 1408 HE3 LYS 19 HE3 LYS 19 -7.037 0.664 -21.159 1409 HZ1 LYS 19 HZ1 LYS 19 -8.073 -1.382 -21.360 1410 HZ2 LYS 19 HZ2 LYS 19 -8.340 -1.542 -19.697 1411 HZ3 LYS 19 HZ3 LYS 19 -9.260 -0.445 -20.600 1412 H ASN 20 H ASN 20 -4.862 4.662 -20.244 1413 HA ASN 20 HA ASN 20 -5.648 6.801 -20.257 1414 HB2 ASN 20 HB2 ASN 20 -7.311 5.473 -18.134 1415 HB3 ASN 20 HB3 ASN 20 -7.551 7.171 -18.533 1416 HD21 ASN 20 HD21 ASN 20 -7.460 7.412 -21.107 1417 HD22 ASN 20 HD22 ASN 20 -8.587 6.384 -21.919 1418 H ALA 21 H ALA 21 -3.255 6.345 -18.724 1419 HA ALA 21 HA ALA 21 -3.329 7.716 -16.249 1420 HB1 ALA 21 HB1 ALA 21 -1.184 6.819 -18.107 1421 HB2 ALA 21 HB2 ALA 21 -0.778 7.979 -16.842 1422 HB3 ALA 21 HB3 ALA 21 -1.457 6.409 -16.413 1423 H ILE 22 H ILE 22 -4.018 9.759 -16.118 1424 HA ILE 22 HA ILE 22 -2.808 11.734 -17.938 1425 HB ILE 22 HB ILE 22 -5.092 11.522 -18.633 1426 HG12 ILE 22 HG12 ILE 22 -3.956 13.869 -17.994 1427 HG13 ILE 22 HG13 ILE 22 -5.569 13.753 -18.689 1428 HG21 ILE 22 HG21 ILE 22 -5.783 11.856 -15.719 1429 HG22 ILE 22 HG22 ILE 22 -6.959 11.928 -17.032 1430 HG23 ILE 22 HG23 ILE 22 -6.062 10.439 -16.732 1431 HD11 ILE 22 HD11 ILE 22 -5.211 15.257 -16.647 1432 HD12 ILE 22 HD12 ILE 22 -6.605 14.178 -16.660 1433 HD13 ILE 22 HD13 ILE 22 -5.170 13.753 -15.727 1434 H ILE 23 H ILE 23 -1.811 13.377 -16.963 1435 HA ILE 23 HA ILE 23 -2.134 13.657 -14.058 1436 HB ILE 23 HB ILE 23 0.099 14.513 -15.896 1437 HG12 ILE 23 HG12 ILE 23 0.036 12.123 -15.277 1438 HG13 ILE 23 HG13 ILE 23 1.436 12.941 -14.593 1439 HG21 ILE 23 HG21 ILE 23 0.109 16.252 -14.381 1440 HG22 ILE 23 HG22 ILE 23 -0.491 15.246 -13.062 1441 HG23 ILE 23 HG23 ILE 23 1.181 15.090 -13.599 1442 HD11 ILE 23 HD11 ILE 23 0.187 13.136 -12.453 1443 HD12 ILE 23 HD12 ILE 23 -1.085 12.143 -13.165 1444 HD13 ILE 23 HD13 ILE 23 0.534 11.479 -12.946 1445 H LYS 24 H LYS 24 -3.149 15.365 -13.250 1446 HA LYS 24 HA LYS 24 -3.307 17.819 -14.865 1447 HB2 LYS 24 HB2 LYS 24 -5.439 16.250 -14.653 1448 HB3 LYS 24 HB3 LYS 24 -5.603 17.080 -13.111 1449 HG2 LYS 24 HG2 LYS 24 -5.395 19.241 -14.467 1450 HG3 LYS 24 HG3 LYS 24 -5.704 18.225 -15.877 1451 HD2 LYS 24 HD2 LYS 24 -7.500 18.297 -13.459 1452 HD3 LYS 24 HD3 LYS 24 -7.732 19.331 -14.871 1453 HE2 LYS 24 HE2 LYS 24 -7.489 16.362 -15.177 1454 HE3 LYS 24 HE3 LYS 24 -9.025 17.090 -14.709 1455 HZ1 LYS 24 HZ1 LYS 24 -7.845 16.933 -17.272 1456 HZ2 LYS 24 HZ2 LYS 24 -9.388 17.481 -16.844 1457 HZ3 LYS 24 HZ3 LYS 24 -8.082 18.557 -16.858 1458 H ASN 25 H ASN 25 -1.975 19.134 -13.757 1459 HA ASN 25 HA ASN 25 -1.113 20.400 -12.076 1460 HB2 ASN 25 HB2 ASN 25 -3.745 20.013 -10.654 1461 HB3 ASN 25 HB3 ASN 25 -2.652 21.391 -10.557 1462 HD21 ASN 25 HD21 ASN 25 -5.430 20.215 -11.931 1463 HD22 ASN 25 HD22 ASN 25 -5.593 21.343 -13.229 1464 H ALA 26 H ALA 26 -0.661 17.572 -11.962 1465 HA ALA 26 HA ALA 26 -1.032 16.352 -9.517 1466 HB1 ALA 26 HB1 ALA 26 1.281 15.280 -10.064 1467 HB2 ALA 26 HB2 ALA 26 -0.104 14.969 -11.110 1468 HB3 ALA 26 HB3 ALA 26 1.112 16.154 -11.586 1469 H TYR 27 H TYR 27 2.110 17.775 -10.396 1470 HA TYR 27 HA TYR 27 2.590 18.342 -7.573 1471 HB2 TYR 27 HB2 TYR 27 4.247 17.202 -9.264 1472 HB3 TYR 27 HB3 TYR 27 4.607 18.862 -9.724 1473 HD1 TYR 27 HD1 TYR 27 5.704 20.379 -8.158 1474 HD2 TYR 27 HD2 TYR 27 4.905 16.335 -7.103 1475 HE1 TYR 27 HE1 TYR 27 7.258 20.573 -6.261 1476 HE2 TYR 27 HE2 TYR 27 6.456 16.518 -5.203 1477 HH TYR 27 HH TYR 27 8.282 17.828 -4.437 1478 H LYS 28 H LYS 28 3.286 20.390 -6.833 1479 HA LYS 28 HA LYS 28 2.809 22.650 -8.642 1480 HB2 LYS 28 HB2 LYS 28 1.739 22.542 -5.820 1481 HB3 LYS 28 HB3 LYS 28 1.473 23.810 -7.010 1482 HG2 LYS 28 HG2 LYS 28 0.243 22.184 -8.408 1483 HG3 LYS 28 HG3 LYS 28 0.436 20.986 -7.127 1484 HD2 LYS 28 HD2 LYS 28 -0.799 22.415 -5.587 1485 HD3 LYS 28 HD3 LYS 28 -0.959 23.648 -6.840 1486 HE2 LYS 28 HE2 LYS 28 -2.014 21.635 -8.186 1487 HE3 LYS 28 HE3 LYS 28 -2.326 21.018 -6.564 1488 HZ1 LYS 28 HZ1 LYS 28 -3.951 22.687 -7.877 1489 HZ2 LYS 28 HZ2 LYS 28 -3.891 22.559 -6.191 1490 HZ3 LYS 28 HZ3 LYS 28 -3.039 23.792 -6.977 1491 H LYS 29 H LYS 29 3.506 24.760 -7.521 1492 HA LYS 29 HA LYS 29 5.678 24.412 -5.617 1493 HB2 LYS 29 HB2 LYS 29 6.415 24.254 -8.168 1494 HB3 LYS 29 HB3 LYS 29 6.347 26.007 -8.044 1495 HG2 LYS 29 HG2 LYS 29 7.859 24.417 -6.016 1496 HG3 LYS 29 HG3 LYS 29 8.576 24.780 -7.588 1497 HD2 LYS 29 HD2 LYS 29 8.606 27.065 -7.189 1498 HD3 LYS 29 HD3 LYS 29 7.349 26.966 -5.953 1499 HE2 LYS 29 HE2 LYS 29 9.234 27.312 -4.674 1500 HE3 LYS 29 HE3 LYS 29 9.117 25.553 -4.664 1501 HZ1 LYS 29 HZ1 LYS 29 10.897 25.336 -6.074 1502 HZ2 LYS 29 HZ2 LYS 29 10.721 26.882 -6.739 1503 HZ3 LYS 29 HZ3 LYS 29 11.367 26.697 -5.186 1504 H GLY 30 H GLY 30 5.496 25.954 -4.136 1505 HA2 GLY 30 HA2 GLY 30 4.852 27.901 -3.098 1506 HA3 GLY 30 HA3 GLY 30 5.399 28.680 -4.575 1507 H GLU 31 H GLU 31 2.738 26.398 -4.441 1508 HA GLU 31 HA GLU 31 0.978 27.994 -5.887 1509 HB2 GLU 31 HB2 GLU 31 0.907 25.447 -5.221 1510 HB3 GLU 31 HB3 GLU 31 -0.084 26.035 -3.893 1511 HG2 GLU 31 HG2 GLU 31 -0.642 26.454 -6.821 1512 HG3 GLU 31 HG3 GLU 31 -1.438 25.281 -5.773 Start of MODEL 6 1 H1 TYR 1 H TYR 1 -5.019 4.277 11.982 2 HA TYR 1 HA TYR 1 -6.729 2.544 10.377 3 HB2 TYR 1 HB2 TYR 1 -6.300 2.526 13.369 4 HB3 TYR 1 HB3 TYR 1 -7.061 1.266 12.405 5 HD1 TYR 1 HD1 TYR 1 -3.851 2.934 13.157 6 HD2 TYR 1 HD2 TYR 1 -5.757 -0.370 11.272 7 HE1 TYR 1 HE1 TYR 1 -1.665 1.842 12.874 8 HE2 TYR 1 HE2 TYR 1 -3.576 -1.472 10.986 9 HH TYR 1 HH TYR 1 -1.237 -0.927 10.897 10 H GLY 2 H GLY 2 -7.435 5.285 10.423 11 HA2 GLY 2 HA2 GLY 2 -9.513 5.748 12.338 12 HA3 GLY 2 HA3 GLY 2 -9.175 6.718 10.912 13 H GLY 3 H GLY 3 -11.573 6.808 10.860 14 HA2 GLY 3 HA2 GLY 3 -13.579 6.189 9.932 15 HA3 GLY 3 HA3 GLY 3 -12.613 5.253 8.801 16 H PHE 4 H PHE 4 -14.017 3.524 8.689 17 HA PHE 4 HA PHE 4 -14.946 2.201 11.069 18 HB2 PHE 4 HB2 PHE 4 -15.272 1.804 8.132 19 HB3 PHE 4 HB3 PHE 4 -15.569 0.427 9.188 20 HD1 PHE 4 HD1 PHE 4 -17.883 0.165 8.983 21 HD2 PHE 4 HD2 PHE 4 -16.266 3.992 9.909 22 HE1 PHE 4 HE1 PHE 4 -20.149 1.008 9.443 23 HE2 PHE 4 HE2 PHE 4 -18.528 4.841 10.370 24 HZ PHE 4 HZ PHE 4 -20.474 3.348 10.138 25 H MET 5 H MET 5 -14.465 0.009 11.644 26 HA MET 5 HA MET 5 -11.806 -0.886 10.743 27 HB2 MET 5 HB2 MET 5 -11.566 -0.049 12.977 28 HB3 MET 5 HB3 MET 5 -12.988 -0.929 13.520 29 HG2 MET 5 HG2 MET 5 -10.928 -1.983 14.276 30 HG3 MET 5 HG3 MET 5 -11.842 -3.036 13.200 31 HE1 MET 5 HE1 MET 5 -9.266 -3.942 13.844 32 HE2 MET 5 HE2 MET 5 -9.715 -4.682 12.308 33 HE3 MET 5 HE3 MET 5 -8.120 -3.956 12.504 34 H THR 6 H THR 6 -12.068 -2.651 9.547 35 HA THR 6 HA THR 6 -14.209 -4.540 10.225 36 HB THR 6 HB THR 6 -12.593 -4.171 7.702 37 HG1 THR 6 HG1 THR 6 -14.872 -3.933 6.930 38 HG21 THR 6 HG21 THR 6 -12.884 -6.551 8.023 39 HG22 THR 6 HG22 THR 6 -14.598 -6.327 8.375 40 HG23 THR 6 HG23 THR 6 -13.979 -5.998 6.757 41 H SER 7 H SER 7 -13.449 -5.908 11.747 42 HA SER 7 HA SER 7 -10.806 -7.122 11.347 43 HB2 SER 7 HB2 SER 7 -11.725 -6.012 13.591 44 HB3 SER 7 HB3 SER 7 -12.390 -7.629 13.822 45 HG SER 7 HG SER 7 -10.122 -7.084 14.583 46 H GLU 8 H GLU 8 -11.253 -8.685 9.822 47 HA GLU 8 HA GLU 8 -13.169 -10.772 10.632 48 HB2 GLU 8 HB2 GLU 8 -13.023 -9.344 8.232 49 HB3 GLU 8 HB3 GLU 8 -12.347 -10.923 7.857 50 HG2 GLU 8 HG2 GLU 8 -14.574 -11.236 7.403 51 HG3 GLU 8 HG3 GLU 8 -14.453 -11.833 9.057 52 H LYS 9 H LYS 9 -12.278 -12.597 11.299 53 HA LYS 9 HA LYS 9 -9.578 -13.285 10.341 54 HB2 LYS 9 HB2 LYS 9 -9.849 -12.817 12.801 55 HB3 LYS 9 HB3 LYS 9 -10.893 -14.230 12.891 56 HG2 LYS 9 HG2 LYS 9 -8.149 -14.495 11.751 57 HG3 LYS 9 HG3 LYS 9 -8.373 -14.421 13.500 58 HD2 LYS 9 HD2 LYS 9 -10.200 -16.249 13.016 59 HD3 LYS 9 HD3 LYS 9 -9.244 -16.507 11.555 60 HE2 LYS 9 HE2 LYS 9 -8.338 -18.005 13.101 61 HE3 LYS 9 HE3 LYS 9 -7.227 -16.638 13.127 62 HZ1 LYS 9 HZ1 LYS 9 -8.035 -15.923 15.171 63 HZ2 LYS 9 HZ2 LYS 9 -9.455 -16.837 15.056 64 HZ3 LYS 9 HZ3 LYS 9 -7.975 -17.605 15.345 65 H SER 10 H SER 10 -9.662 -14.793 8.815 66 HA SER 10 HA SER 10 -11.007 -17.291 9.326 67 HB2 SER 10 HB2 SER 10 -12.272 -17.230 7.154 68 HB3 SER 10 HB3 SER 10 -12.878 -16.109 8.373 69 HG SER 10 HG SER 10 -12.096 -15.545 5.926 70 H GLN 11 H GLN 11 -10.101 -18.980 8.224 71 HA GLN 11 HA GLN 11 -7.635 -18.395 6.811 72 HB2 GLN 11 HB2 GLN 11 -7.310 -20.863 6.892 73 HB3 GLN 11 HB3 GLN 11 -7.535 -20.130 8.474 74 HG2 GLN 11 HG2 GLN 11 -9.583 -21.096 8.789 75 HG3 GLN 11 HG3 GLN 11 -9.910 -21.224 7.061 76 HE21 GLN 11 HE21 GLN 11 -9.332 -23.037 5.981 77 HE22 GLN 11 HE22 GLN 11 -8.620 -24.422 6.728 78 H THR 12 H THR 12 -9.895 -17.583 5.395 79 HA THR 12 HA THR 12 -9.609 -19.230 3.004 80 HB THR 12 HB THR 12 -12.285 -18.644 2.861 81 HG1 THR 12 HG1 THR 12 -12.201 -18.085 5.143 82 HG21 THR 12 HG21 THR 12 -12.149 -20.790 2.275 83 HG22 THR 12 HG22 THR 12 -10.608 -20.962 3.114 84 HG23 THR 12 HG23 THR 12 -12.119 -21.217 3.986 85 HA PRO 13 HA PRO 13 -9.635 -15.406 0.851 86 HB2 PRO 13 HB2 PRO 13 -10.933 -16.035 -1.449 87 HB3 PRO 13 HB3 PRO 13 -9.298 -16.599 -1.083 88 HG2 PRO 13 HG2 PRO 13 -11.907 -18.041 -0.803 89 HG3 PRO 13 HG3 PRO 13 -10.362 -18.637 -1.436 90 HD2 PRO 13 HD2 PRO 13 -11.215 -19.181 1.076 91 HD3 PRO 13 HD3 PRO 13 -9.496 -19.001 0.669 92 H LEU 14 H LEU 14 -11.222 -14.680 2.621 93 HA LEU 14 HA LEU 14 -13.990 -14.475 1.888 94 HB2 LEU 14 HB2 LEU 14 -14.304 -13.353 3.925 95 HB3 LEU 14 HB3 LEU 14 -13.074 -14.576 4.238 96 HG LEU 14 HG LEU 14 -12.328 -11.730 3.643 97 HD11 LEU 14 HD11 LEU 14 -12.210 -12.306 6.437 98 HD12 LEU 14 HD12 LEU 14 -13.064 -11.008 5.603 99 HD13 LEU 14 HD13 LEU 14 -13.855 -12.564 5.857 100 HD21 LEU 14 HD21 LEU 14 -10.461 -13.132 3.529 101 HD22 LEU 14 HD22 LEU 14 -10.403 -12.470 5.162 102 HD23 LEU 14 HD23 LEU 14 -10.996 -14.109 4.896 103 H VAL 15 H VAL 15 -14.556 -11.839 2.687 104 HA VAL 15 HA VAL 15 -13.058 -9.978 1.100 105 HB VAL 15 HB VAL 15 -14.383 -11.157 -0.647 106 HG11 VAL 15 HG11 VAL 15 -16.396 -11.185 1.170 107 HG12 VAL 15 HG12 VAL 15 -16.886 -9.837 0.143 108 HG13 VAL 15 HG13 VAL 15 -16.614 -11.430 -0.563 109 HG21 VAL 15 HG21 VAL 15 -14.067 -8.389 -0.224 110 HG22 VAL 15 HG22 VAL 15 -14.265 -9.237 -1.757 111 HG23 VAL 15 HG23 VAL 15 -15.679 -8.620 -0.902 112 H THR 16 H THR 16 -13.550 -7.856 1.575 113 HA THR 16 HA THR 16 -15.397 -7.488 3.822 114 HB THR 16 HB THR 16 -13.214 -6.685 4.337 115 HG1 THR 16 HG1 THR 16 -14.680 -4.368 3.578 116 HG21 THR 16 HG21 THR 16 -12.660 -4.581 2.608 117 HG22 THR 16 HG22 THR 16 -11.857 -6.151 2.644 118 HG23 THR 16 HG23 THR 16 -13.215 -5.880 1.551 119 H LEU 17 H LEU 17 -17.394 -7.014 3.126 120 HA LEU 17 HA LEU 17 -17.849 -5.464 0.740 121 HB2 LEU 17 HB2 LEU 17 -19.267 -7.402 1.753 122 HB3 LEU 17 HB3 LEU 17 -19.977 -6.121 2.733 123 HG LEU 17 HG LEU 17 -21.341 -6.661 0.766 124 HD11 LEU 17 HD11 LEU 17 -20.927 -4.262 1.783 125 HD12 LEU 17 HD12 LEU 17 -20.261 -3.956 0.179 126 HD13 LEU 17 HD13 LEU 17 -21.931 -4.498 0.353 127 HD21 LEU 17 HD21 LEU 17 -20.604 -6.358 -1.443 128 HD22 LEU 17 HD22 LEU 17 -19.141 -5.518 -0.930 129 HD23 LEU 17 HD23 LEU 17 -19.307 -7.251 -0.649 130 H PHE 18 H PHE 18 -17.044 -3.416 1.092 131 HA PHE 18 HA PHE 18 -18.237 -1.883 3.300 132 HB2 PHE 18 HB2 PHE 18 -15.589 -1.919 2.081 133 HB3 PHE 18 HB3 PHE 18 -16.258 -0.294 2.179 134 HD1 PHE 18 HD1 PHE 18 -17.726 -0.264 4.646 135 HD2 PHE 18 HD2 PHE 18 -14.025 -2.164 3.745 136 HE1 PHE 18 HE1 PHE 18 -17.091 -0.147 7.020 137 HE2 PHE 18 HE2 PHE 18 -13.385 -2.050 6.118 138 HZ PHE 18 HZ PHE 18 -14.919 -1.041 7.759 139 H LYS 19 H LYS 19 -20.084 -1.002 2.583 140 HA LYS 19 HA LYS 19 -19.992 0.483 0.039 141 HB2 LYS 19 HB2 LYS 19 -22.105 -1.252 1.237 142 HB3 LYS 19 HB3 LYS 19 -22.607 0.130 0.271 143 HG2 LYS 19 HG2 LYS 19 -21.163 -0.739 -1.574 144 HG3 LYS 19 HG3 LYS 19 -20.909 -2.193 -0.605 145 HD2 LYS 19 HD2 LYS 19 -22.674 -2.780 -2.006 146 HD3 LYS 19 HD3 LYS 19 -23.482 -2.314 -0.508 147 HE2 LYS 19 HE2 LYS 19 -24.749 -1.138 -1.994 148 HE3 LYS 19 HE3 LYS 19 -23.492 0.058 -1.682 149 HZ1 LYS 19 HZ1 LYS 19 -22.741 -1.705 -3.784 150 HZ2 LYS 19 HZ2 LYS 19 -24.220 -0.958 -4.126 151 HZ3 LYS 19 HZ3 LYS 19 -22.855 -0.017 -3.791 152 H ASN 20 H ASN 20 -21.321 2.411 -0.066 153 HA ASN 20 HA ASN 20 -21.845 4.486 0.715 154 HB2 ASN 20 HB2 ASN 20 -22.988 3.223 3.181 155 HB3 ASN 20 HB3 ASN 20 -23.618 4.559 2.221 156 HD21 ASN 20 HD21 ASN 20 -23.832 3.699 -0.236 157 HD22 ASN 20 HD22 ASN 20 -24.835 2.297 -0.356 158 H ALA 21 H ALA 21 -19.241 3.573 1.384 159 HA ALA 21 HA ALA 21 -18.622 4.110 4.108 160 HB1 ALA 21 HB1 ALA 21 -16.840 4.089 1.675 161 HB2 ALA 21 HB2 ALA 21 -16.282 4.135 3.347 162 HB3 ALA 21 HB3 ALA 21 -17.165 2.730 2.751 163 H ILE 22 H ILE 22 -19.053 6.053 4.953 164 HA ILE 22 HA ILE 22 -18.297 8.445 3.409 165 HB ILE 22 HB ILE 22 -20.283 8.213 5.673 166 HG12 ILE 22 HG12 ILE 22 -20.770 8.818 2.751 167 HG13 ILE 22 HG13 ILE 22 -20.985 7.227 3.474 168 HG21 ILE 22 HG21 ILE 22 -19.628 10.373 5.930 169 HG22 ILE 22 HG22 ILE 22 -19.074 10.520 4.262 170 HG23 ILE 22 HG23 ILE 22 -20.797 10.607 4.630 171 HD11 ILE 22 HD11 ILE 22 -22.435 9.022 5.068 172 HD12 ILE 22 HD12 ILE 22 -22.790 9.433 3.390 173 HD13 ILE 22 HD13 ILE 22 -23.059 7.790 3.971 174 H ILE 23 H ILE 23 -16.385 9.206 4.019 175 HA ILE 23 HA ILE 23 -15.589 8.979 6.837 176 HB ILE 23 HB ILE 23 -14.031 9.250 4.294 177 HG12 ILE 23 HG12 ILE 23 -14.567 7.022 5.325 178 HG13 ILE 23 HG13 ILE 23 -12.845 7.336 5.131 179 HG21 ILE 23 HG21 ILE 23 -12.880 10.895 5.386 180 HG22 ILE 23 HG22 ILE 23 -13.268 10.259 6.985 181 HG23 ILE 23 HG23 ILE 23 -12.034 9.475 6.000 182 HD11 ILE 23 HD11 ILE 23 -13.832 8.198 7.713 183 HD12 ILE 23 HD12 ILE 23 -14.110 6.482 7.421 184 HD13 ILE 23 HD13 ILE 23 -12.479 7.142 7.310 185 H LYS 24 H LYS 24 -16.186 10.715 7.969 186 HA LYS 24 HA LYS 24 -15.556 13.366 6.854 187 HB2 LYS 24 HB2 LYS 24 -18.074 12.361 8.062 188 HB3 LYS 24 HB3 LYS 24 -17.575 13.985 8.519 189 HG2 LYS 24 HG2 LYS 24 -17.278 14.216 5.890 190 HG3 LYS 24 HG3 LYS 24 -18.504 12.946 5.907 191 HD2 LYS 24 HD2 LYS 24 -19.641 14.568 7.661 192 HD3 LYS 24 HD3 LYS 24 -18.679 15.777 6.807 193 HE2 LYS 24 HE2 LYS 24 -19.674 14.696 4.672 194 HE3 LYS 24 HE3 LYS 24 -20.880 14.029 5.772 195 HZ1 LYS 24 HZ1 LYS 24 -21.206 16.397 6.546 196 HZ2 LYS 24 HZ2 LYS 24 -20.317 16.875 5.188 197 HZ3 LYS 24 HZ3 LYS 24 -21.772 16.033 4.994 198 H ASN 25 H ASN 25 -13.848 14.062 7.969 199 HA ASN 25 HA ASN 25 -12.464 14.604 9.692 200 HB2 ASN 25 HB2 ASN 25 -15.146 14.731 11.069 201 HB3 ASN 25 HB3 ASN 25 -13.647 15.183 11.875 202 HD21 ASN 25 HD21 ASN 25 -12.859 17.166 11.578 203 HD22 ASN 25 HD22 ASN 25 -13.488 18.326 10.463 204 H ALA 26 H ALA 26 -12.754 11.840 9.138 205 HA ALA 26 HA ALA 26 -13.158 10.248 11.413 206 HB1 ALA 26 HB1 ALA 26 -12.896 9.587 8.918 207 HB2 ALA 26 HB2 ALA 26 -11.178 9.489 9.305 208 HB3 ALA 26 HB3 ALA 26 -12.336 8.479 10.170 209 H TYR 27 H TYR 27 -10.007 11.011 9.919 210 HA TYR 27 HA TYR 27 -8.747 10.642 12.535 211 HB2 TYR 27 HB2 TYR 27 -7.997 9.598 10.204 212 HB3 TYR 27 HB3 TYR 27 -7.137 11.128 10.074 213 HD1 TYR 27 HD1 TYR 27 -6.349 11.577 12.890 214 HD2 TYR 27 HD2 TYR 27 -6.308 8.024 10.550 215 HE1 TYR 27 HE1 TYR 27 -4.537 10.682 14.292 216 HE2 TYR 27 HE2 TYR 27 -4.497 7.118 11.946 217 HH TYR 27 HH TYR 27 -3.242 7.421 13.759 218 H LYS 28 H LYS 28 -8.841 12.486 13.677 219 HA LYS 28 HA LYS 28 -8.729 15.084 12.534 220 HB2 LYS 28 HB2 LYS 28 -8.577 14.012 15.334 221 HB3 LYS 28 HB3 LYS 28 -8.266 15.713 15.017 222 HG2 LYS 28 HG2 LYS 28 -10.775 14.343 14.102 223 HG3 LYS 28 HG3 LYS 28 -10.621 15.086 15.696 224 HD2 LYS 28 HD2 LYS 28 -9.865 16.690 13.305 225 HD3 LYS 28 HD3 LYS 28 -11.580 16.428 13.632 226 HE2 LYS 28 HE2 LYS 28 -9.756 17.357 15.813 227 HE3 LYS 28 HE3 LYS 28 -10.374 18.508 14.628 228 HZ1 LYS 28 HZ1 LYS 28 -11.730 17.222 16.816 229 HZ2 LYS 28 HZ2 LYS 28 -12.118 18.647 15.991 230 HZ3 LYS 28 HZ3 LYS 28 -12.591 17.150 15.361 231 H LYS 29 H LYS 29 -7.037 16.657 13.739 232 HA LYS 29 HA LYS 29 -4.414 15.673 12.885 233 HB2 LYS 29 HB2 LYS 29 -3.799 18.138 13.078 234 HB3 LYS 29 HB3 LYS 29 -4.942 17.708 11.813 235 HG2 LYS 29 HG2 LYS 29 -6.666 18.803 12.800 236 HG3 LYS 29 HG3 LYS 29 -6.063 18.510 14.434 237 HD2 LYS 29 HD2 LYS 29 -4.238 20.158 13.963 238 HD3 LYS 29 HD3 LYS 29 -5.050 20.535 12.442 239 HE2 LYS 29 HE2 LYS 29 -7.025 21.259 13.640 240 HE3 LYS 29 HE3 LYS 29 -6.301 20.784 15.176 241 HZ1 LYS 29 HZ1 LYS 29 -6.209 23.233 14.496 242 HZ2 LYS 29 HZ2 LYS 29 -4.794 22.525 15.096 243 HZ3 LYS 29 HZ3 LYS 29 -4.981 22.764 13.431 244 H GLY 30 H GLY 30 -3.489 14.604 14.555 245 HA2 GLY 30 HA2 GLY 30 -2.690 16.174 16.852 246 HA3 GLY 30 HA3 GLY 30 -3.765 14.836 17.229 247 H GLU 31 H GLU 31 -1.371 14.749 14.667 248 HA GLU 31 HA GLU 31 0.108 12.731 16.224 249 HB2 GLU 31 HB2 GLU 31 0.730 11.699 14.098 250 HB3 GLU 31 HB3 GLU 31 -1.017 11.790 14.263 251 HG2 GLU 31 HG2 GLU 31 0.488 13.912 12.791 252 HG3 GLU 31 HG3 GLU 31 0.064 12.392 12.007 253 H1 TYR 1 H TYR 1 -2.439 6.274 8.263 254 HA TYR 1 HA TYR 1 -3.980 4.311 6.750 255 HB2 TYR 1 HB2 TYR 1 -3.614 4.531 9.744 256 HB3 TYR 1 HB3 TYR 1 -4.272 3.158 8.861 257 HD1 TYR 1 HD1 TYR 1 -1.198 5.065 9.582 258 HD2 TYR 1 HD2 TYR 1 -2.838 1.557 7.819 259 HE1 TYR 1 HE1 TYR 1 1.059 4.104 9.409 260 HE2 TYR 1 HE2 TYR 1 -0.585 0.586 7.642 261 HH TYR 1 HH TYR 1 1.715 1.271 7.586 262 H GLY 2 H GLY 2 -4.866 7.008 6.615 263 HA2 GLY 2 HA2 GLY 2 -7.031 7.423 8.447 264 HA3 GLY 2 HA3 GLY 2 -6.712 8.344 6.984 265 H GLY 3 H GLY 3 -9.102 8.272 6.843 266 HA2 GLY 3 HA2 GLY 3 -11.031 7.473 5.889 267 HA3 GLY 3 HA3 GLY 3 -9.967 6.547 4.840 268 H PHE 4 H PHE 4 -11.244 4.722 4.774 269 HA PHE 4 HA PHE 4 -12.171 3.463 7.190 270 HB2 PHE 4 HB2 PHE 4 -12.365 2.898 4.269 271 HB3 PHE 4 HB3 PHE 4 -12.606 1.558 5.385 272 HD1 PHE 4 HD1 PHE 4 -14.891 1.132 5.097 273 HD2 PHE 4 HD2 PHE 4 -13.563 5.092 5.920 274 HE1 PHE 4 HE1 PHE 4 -17.222 1.839 5.440 275 HE2 PHE 4 HE2 PHE 4 -15.893 5.805 6.265 276 HZ PHE 4 HZ PHE 4 -17.726 4.177 6.026 277 H MET 5 H MET 5 -11.585 1.309 7.858 278 HA MET 5 HA MET 5 -8.834 0.565 7.108 279 HB2 MET 5 HB2 MET 5 -8.745 1.523 9.308 280 HB3 MET 5 HB3 MET 5 -10.115 0.559 9.842 281 HG2 MET 5 HG2 MET 5 -7.996 -0.289 10.708 282 HG3 MET 5 HG3 MET 5 -8.806 -1.462 9.673 283 HE1 MET 5 HE1 MET 5 -6.187 -2.140 10.420 284 HE2 MET 5 HE2 MET 5 -6.544 -2.993 8.919 285 HE3 MET 5 HE3 MET 5 -5.010 -2.143 9.107 286 H THR 6 H THR 6 -8.939 -1.265 5.987 287 HA THR 6 HA THR 6 -10.977 -3.259 6.678 288 HB THR 6 HB THR 6 -9.290 -2.888 4.204 289 HG1 THR 6 HG1 THR 6 -11.541 -2.870 3.333 290 HG21 THR 6 HG21 THR 6 -9.398 -5.268 4.632 291 HG22 THR 6 HG22 THR 6 -11.138 -5.172 4.904 292 HG23 THR 6 HG23 THR 6 -10.479 -4.866 3.297 293 H SER 7 H SER 7 -10.216 -4.532 8.272 294 HA SER 7 HA SER 7 -7.478 -5.573 8.053 295 HB2 SER 7 HB2 SER 7 -8.573 -4.435 10.201 296 HB3 SER 7 HB3 SER 7 -9.141 -6.082 10.474 297 HG SER 7 HG SER 7 -6.952 -5.353 11.310 298 H GLU 8 H GLU 8 -7.776 -7.210 6.560 299 HA GLU 8 HA GLU 8 -9.583 -9.389 7.377 300 HB2 GLU 8 HB2 GLU 8 -9.416 -8.055 4.932 301 HB3 GLU 8 HB3 GLU 8 -8.601 -9.588 4.654 302 HG2 GLU 8 HG2 GLU 8 -10.759 -10.116 4.109 303 HG3 GLU 8 HG3 GLU 8 -10.702 -10.603 5.802 304 H LYS 9 H LYS 9 -8.643 -11.163 8.115 305 HA LYS 9 HA LYS 9 -5.845 -11.693 7.357 306 HB2 LYS 9 HB2 LYS 9 -6.371 -11.180 9.795 307 HB3 LYS 9 HB3 LYS 9 -7.225 -12.717 9.836 308 HG2 LYS 9 HG2 LYS 9 -4.404 -12.645 8.881 309 HG3 LYS 9 HG3 LYS 9 -4.740 -12.553 10.611 310 HD2 LYS 9 HD2 LYS 9 -6.297 -14.613 10.066 311 HD3 LYS 9 HD3 LYS 9 -5.197 -14.789 8.697 312 HE2 LYS 9 HE2 LYS 9 -4.228 -16.106 10.356 313 HE3 LYS 9 HE3 LYS 9 -3.323 -14.596 10.443 314 HZ1 LYS 9 HZ1 LYS 9 -4.409 -13.970 12.385 315 HZ2 LYS 9 HZ2 LYS 9 -5.672 -15.075 12.169 316 HZ3 LYS 9 HZ3 LYS 9 -4.134 -15.624 12.612 317 H SER 10 H SER 10 -5.709 -13.262 5.901 318 HA SER 10 HA SER 10 -6.936 -15.818 6.394 319 HB2 SER 10 HB2 SER 10 -8.044 -15.890 4.128 320 HB3 SER 10 HB3 SER 10 -8.816 -14.813 5.292 321 HG SER 10 HG SER 10 -7.919 -14.205 2.895 322 H GLN 11 H GLN 11 -5.822 -17.466 5.451 323 HA GLN 11 HA GLN 11 -3.331 -16.756 4.147 324 HB2 GLN 11 HB2 GLN 11 -2.833 -19.189 4.358 325 HB3 GLN 11 HB3 GLN 11 -3.201 -18.408 5.890 326 HG2 GLN 11 HG2 GLN 11 -5.195 -19.504 6.133 327 HG3 GLN 11 HG3 GLN 11 -5.400 -19.741 4.398 328 HE21 GLN 11 HE21 GLN 11 -4.627 -21.556 3.454 329 HE22 GLN 11 HE22 GLN 11 -3.863 -22.845 4.314 330 H THR 12 H THR 12 -5.596 -16.202 2.588 331 HA THR 12 HA THR 12 -5.029 -17.901 0.284 332 HB THR 12 HB THR 12 -7.739 -17.548 -0.014 333 HG1 THR 12 HG1 THR 12 -7.802 -16.929 2.260 334 HG21 THR 12 HG21 THR 12 -7.389 -19.687 -0.532 335 HG22 THR 12 HG22 THR 12 -5.883 -19.704 0.384 336 HG23 THR 12 HG23 THR 12 -7.409 -20.069 1.190 337 HA PRO 13 HA PRO 13 -5.285 -14.193 -2.048 338 HB2 PRO 13 HB2 PRO 13 -6.466 -15.008 -4.353 339 HB3 PRO 13 HB3 PRO 13 -4.807 -15.437 -3.920 340 HG2 PRO 13 HG2 PRO 13 -7.313 -17.051 -3.648 341 HG3 PRO 13 HG3 PRO 13 -5.711 -17.560 -4.213 342 HD2 PRO 13 HD2 PRO 13 -6.598 -18.061 -1.704 343 HD3 PRO 13 HD3 PRO 13 -4.885 -17.772 -2.071 344 H LEU 14 H LEU 14 -6.962 -13.488 -0.368 345 HA LEU 14 HA LEU 14 -9.718 -13.524 -1.174 346 HB2 LEU 14 HB2 LEU 14 -10.168 -12.334 0.799 347 HB3 LEU 14 HB3 LEU 14 -8.864 -13.450 1.200 348 HG LEU 14 HG LEU 14 -8.293 -10.593 0.483 349 HD11 LEU 14 HD11 LEU 14 -8.235 -10.998 3.303 350 HD12 LEU 14 HD12 LEU 14 -9.163 -9.825 2.369 351 HD13 LEU 14 HD13 LEU 14 -9.836 -11.422 2.696 352 HD21 LEU 14 HD21 LEU 14 -6.338 -11.877 0.508 353 HD22 LEU 14 HD22 LEU 14 -6.381 -11.118 2.099 354 HD23 LEU 14 HD23 LEU 14 -6.857 -12.806 1.914 355 H VAL 15 H VAL 15 -10.494 -10.903 -0.518 356 HA VAL 15 HA VAL 15 -9.088 -9.008 -2.144 357 HB VAL 15 HB VAL 15 -10.249 -10.358 -3.880 358 HG11 VAL 15 HG11 VAL 15 -12.324 -10.463 -2.128 359 HG12 VAL 15 HG12 VAL 15 -12.880 -9.224 -3.253 360 HG13 VAL 15 HG13 VAL 15 -12.446 -10.826 -3.849 361 HG21 VAL 15 HG21 VAL 15 -10.163 -7.564 -3.577 362 HG22 VAL 15 HG22 VAL 15 -10.261 -8.486 -5.077 363 HG23 VAL 15 HG23 VAL 15 -11.736 -7.942 -4.278 364 H THR 16 H THR 16 -9.752 -6.913 -1.779 365 HA THR 16 HA THR 16 -11.710 -6.589 0.378 366 HB THR 16 HB THR 16 -9.617 -5.599 0.936 367 HG1 THR 16 HG1 THR 16 -11.223 -3.440 0.011 368 HG21 THR 16 HG21 THR 16 -9.149 -3.540 -0.871 369 HG22 THR 16 HG22 THR 16 -8.234 -5.041 -0.730 370 HG23 THR 16 HG23 THR 16 -9.562 -4.923 -1.884 371 H LEU 17 H LEU 17 -13.711 -6.235 -0.350 372 HA LEU 17 HA LEU 17 -14.190 -4.856 -2.843 373 HB2 LEU 17 HB2 LEU 17 -15.504 -6.839 -1.786 374 HB3 LEU 17 HB3 LEU 17 -16.331 -5.572 -0.882 375 HG LEU 17 HG LEU 17 -17.596 -6.285 -2.858 376 HD11 LEU 17 HD11 LEU 17 -17.378 -3.824 -1.942 377 HD12 LEU 17 HD12 LEU 17 -16.674 -3.541 -3.534 378 HD13 LEU 17 HD13 LEU 17 -18.310 -4.185 -3.394 379 HD21 LEU 17 HD21 LEU 17 -16.815 -6.032 -5.058 380 HD22 LEU 17 HD22 LEU 17 -15.426 -5.074 -4.546 381 HD23 LEU 17 HD23 LEU 17 -15.487 -6.800 -4.189 382 H PHE 18 H PHE 18 -13.532 -2.744 -2.559 383 HA PHE 18 HA PHE 18 -14.904 -1.197 -0.468 384 HB2 PHE 18 HB2 PHE 18 -12.221 -1.102 -1.606 385 HB3 PHE 18 HB3 PHE 18 -13.003 0.475 -1.601 386 HD1 PHE 18 HD1 PHE 18 -14.540 0.528 0.814 387 HD2 PHE 18 HD2 PHE 18 -10.706 -1.183 0.116 388 HE1 PHE 18 HE1 PHE 18 -13.992 0.793 3.198 389 HE2 PHE 18 HE2 PHE 18 -10.152 -0.922 2.499 390 HZ PHE 18 HZ PHE 18 -11.796 0.067 4.043 391 H LYS 19 H LYS 19 -16.782 -0.484 -1.282 392 HA LYS 19 HA LYS 19 -16.708 0.887 -3.891 393 HB2 LYS 19 HB2 LYS 19 -18.736 -0.935 -2.675 394 HB3 LYS 19 HB3 LYS 19 -19.298 0.362 -3.723 395 HG2 LYS 19 HG2 LYS 19 -17.736 -0.490 -5.477 396 HG3 LYS 19 HG3 LYS 19 -17.415 -1.875 -4.431 397 HD2 LYS 19 HD2 LYS 19 -19.087 -2.654 -5.849 398 HD3 LYS 19 HD3 LYS 19 -19.980 -2.165 -4.407 399 HE2 LYS 19 HE2 LYS 19 -21.264 -1.160 -6.000 400 HE3 LYS 19 HE3 LYS 19 -20.104 0.135 -5.709 401 HZ1 LYS 19 HZ1 LYS 19 -19.156 -1.681 -7.684 402 HZ2 LYS 19 HZ2 LYS 19 -20.668 -1.056 -8.118 403 HZ3 LYS 19 HZ3 LYS 19 -19.382 -0.007 -7.788 404 H ASN 20 H ASN 20 -18.157 2.711 -4.129 405 HA ASN 20 HA ASN 20 -18.850 4.778 -3.465 406 HB2 ASN 20 HB2 ASN 20 -19.987 3.555 -0.975 407 HB3 ASN 20 HB3 ASN 20 -20.674 4.794 -2.021 408 HD21 ASN 20 HD21 ASN 20 -20.755 3.812 -4.434 409 HD22 ASN 20 HD22 ASN 20 -21.649 2.336 -4.515 410 H ALA 21 H ALA 21 -16.213 4.079 -2.671 411 HA ALA 21 HA ALA 21 -15.726 4.782 0.041 412 HB1 ALA 21 HB1 ALA 21 -13.867 4.770 -2.334 413 HB2 ALA 21 HB2 ALA 21 -13.368 4.938 -0.651 414 HB3 ALA 21 HB3 ALA 21 -14.131 3.446 -1.199 415 H ILE 22 H ILE 22 -16.315 6.728 0.778 416 HA ILE 22 HA ILE 22 -15.670 9.092 -0.855 417 HB ILE 22 HB ILE 22 -17.713 8.830 1.354 418 HG12 ILE 22 HG12 ILE 22 -18.142 9.258 -1.608 419 HG13 ILE 22 HG13 ILE 22 -18.268 7.692 -0.815 420 HG21 ILE 22 HG21 ILE 22 -17.216 11.040 1.521 421 HG22 ILE 22 HG22 ILE 22 -16.618 11.145 -0.135 422 HG23 ILE 22 HG23 ILE 22 -18.354 11.129 0.176 423 HD11 ILE 22 HD11 ILE 22 -19.893 9.454 0.644 424 HD12 ILE 22 HD12 ILE 22 -20.221 9.754 -1.063 425 HD13 ILE 22 HD13 ILE 22 -20.392 8.127 -0.405 426 H ILE 23 H ILE 23 -13.839 10.016 -0.221 427 HA ILE 23 HA ILE 23 -13.130 9.974 2.630 428 HB ILE 23 HB ILE 23 -11.502 10.232 0.129 429 HG12 ILE 23 HG12 ILE 23 -11.927 8.022 1.242 430 HG13 ILE 23 HG13 ILE 23 -10.224 8.443 1.097 431 HG21 ILE 23 HG21 ILE 23 -10.509 12.002 1.185 432 HG22 ILE 23 HG22 ILE 23 -10.903 11.404 2.796 433 HG23 ILE 23 HG23 ILE 23 -9.586 10.671 1.881 434 HD11 ILE 23 HD11 ILE 23 -11.365 9.350 3.599 435 HD12 ILE 23 HD12 ILE 23 -11.518 7.607 3.377 436 HD13 ILE 23 HD13 ILE 23 -9.930 8.371 3.294 437 H LYS 24 H LYS 24 -13.887 11.716 3.651 438 HA LYS 24 HA LYS 24 -13.397 14.349 2.426 439 HB2 LYS 24 HB2 LYS 24 -15.878 13.233 3.614 440 HB3 LYS 24 HB3 LYS 24 -15.505 14.910 3.994 441 HG2 LYS 24 HG2 LYS 24 -15.143 15.019 1.365 442 HG3 LYS 24 HG3 LYS 24 -16.279 13.669 1.420 443 HD2 LYS 24 HD2 LYS 24 -17.582 15.298 3.046 444 HD3 LYS 24 HD3 LYS 24 -16.674 16.525 2.160 445 HE2 LYS 24 HE2 LYS 24 -17.520 15.276 0.054 446 HE3 LYS 24 HE3 LYS 24 -18.713 14.578 1.148 447 HZ1 LYS 24 HZ1 LYS 24 -19.231 16.951 1.793 448 HZ2 LYS 24 HZ2 LYS 24 -18.332 17.425 0.440 449 HZ3 LYS 24 HZ3 LYS 24 -19.717 16.473 0.245 450 H ASN 25 H ASN 25 -11.772 15.206 3.554 451 HA ASN 25 HA ASN 25 -10.487 15.929 5.287 452 HB2 ASN 25 HB2 ASN 25 -13.213 15.930 6.580 453 HB3 ASN 25 HB3 ASN 25 -11.775 16.526 7.404 454 HD21 ASN 25 HD21 ASN 25 -11.119 18.543 7.029 455 HD22 ASN 25 HD22 ASN 25 -11.793 19.602 5.842 456 H ALA 26 H ALA 26 -10.570 13.127 4.861 457 HA ALA 26 HA ALA 26 -10.935 11.619 7.198 458 HB1 ALA 26 HB1 ALA 26 -10.547 10.863 4.747 459 HB2 ALA 26 HB2 ALA 26 -8.840 10.907 5.187 460 HB3 ALA 26 HB3 ALA 26 -9.950 9.857 6.067 461 H TYR 27 H TYR 27 -7.800 12.541 5.762 462 HA TYR 27 HA TYR 27 -6.605 12.387 8.432 463 HB2 TYR 27 HB2 TYR 27 -5.709 11.281 6.178 464 HB3 TYR 27 HB3 TYR 27 -4.944 12.856 6.003 465 HD1 TYR 27 HD1 TYR 27 -4.290 13.486 8.819 466 HD2 TYR 27 HD2 TYR 27 -3.939 9.837 6.658 467 HE1 TYR 27 HE1 TYR 27 -2.478 12.776 10.323 468 HE2 TYR 27 HE2 TYR 27 -2.127 9.117 8.157 469 HH TYR 27 HH TYR 27 -0.962 9.584 9.995 470 H LYS 28 H LYS 28 -6.868 14.278 9.467 471 HA LYS 28 HA LYS 28 -6.887 16.814 8.190 472 HB2 LYS 28 HB2 LYS 28 -6.755 15.905 11.049 473 HB3 LYS 28 HB3 LYS 28 -6.561 17.606 10.644 474 HG2 LYS 28 HG2 LYS 28 -8.928 16.009 9.721 475 HG3 LYS 28 HG3 LYS 28 -8.887 16.821 11.288 476 HD2 LYS 28 HD2 LYS 28 -8.169 18.388 8.861 477 HD3 LYS 28 HD3 LYS 28 -9.870 18.009 9.143 478 HE2 LYS 28 HE2 LYS 28 -8.195 19.156 11.341 479 HE3 LYS 28 HE3 LYS 28 -8.860 20.210 10.094 480 HZ1 LYS 28 HZ1 LYS 28 -10.184 18.906 12.289 481 HZ2 LYS 28 HZ2 LYS 28 -10.653 20.264 11.396 482 HZ3 LYS 28 HZ3 LYS 28 -10.989 18.712 10.814 483 H LYS 29 H LYS 29 -5.346 18.554 9.385 484 HA LYS 29 HA LYS 29 -2.635 17.713 8.659 485 HB2 LYS 29 HB2 LYS 29 -2.193 20.220 8.744 486 HB3 LYS 29 HB3 LYS 29 -3.259 19.651 7.466 487 HG2 LYS 29 HG2 LYS 29 -5.083 20.679 8.336 488 HG3 LYS 29 HG3 LYS 29 -4.528 20.498 10.002 489 HD2 LYS 29 HD2 LYS 29 -2.794 22.240 9.521 490 HD3 LYS 29 HD3 LYS 29 -3.571 22.497 7.957 491 HE2 LYS 29 HE2 LYS 29 -5.632 23.140 9.053 492 HE3 LYS 29 HE3 LYS 29 -4.936 22.781 10.632 493 HZ1 LYS 29 HZ1 LYS 29 -4.978 25.199 9.846 494 HZ2 LYS 29 HZ2 LYS 29 -3.542 24.613 10.522 495 HZ3 LYS 29 HZ3 LYS 29 -3.686 24.767 8.843 496 H GLY 30 H GLY 30 -1.706 16.789 10.413 497 HA2 GLY 30 HA2 GLY 30 -1.097 18.523 12.651 498 HA3 GLY 30 HA3 GLY 30 -2.088 17.131 13.059 499 H GLU 31 H GLU 31 0.390 17.084 10.580 500 HA GLU 31 HA GLU 31 1.956 15.264 12.288 501 HB2 GLU 31 HB2 GLU 31 2.711 14.159 10.246 502 HB3 GLU 31 HB3 GLU 31 0.956 14.144 10.349 503 HG2 GLU 31 HG2 GLU 31 2.377 16.273 8.806 504 HG3 GLU 31 HG3 GLU 31 2.072 14.688 8.098 505 H1 TYR 1 H TYR 1 0.113 8.271 4.612 506 HA TYR 1 HA TYR 1 -1.211 6.144 3.114 507 HB2 TYR 1 HB2 TYR 1 -0.984 6.496 6.108 508 HB3 TYR 1 HB3 TYR 1 -1.513 5.050 5.256 509 HD1 TYR 1 HD1 TYR 1 1.397 7.195 5.997 510 HD2 TYR 1 HD2 TYR 1 0.063 3.506 4.349 511 HE1 TYR 1 HE1 TYR 1 3.719 6.386 5.944 512 HE2 TYR 1 HE2 TYR 1 2.381 2.686 4.293 513 HH TYR 1 HH TYR 1 4.631 3.529 4.278 514 H GLY 2 H GLY 2 -2.279 8.768 2.848 515 HA2 GLY 2 HA2 GLY 2 -4.540 9.095 4.572 516 HA3 GLY 2 HA3 GLY 2 -4.232 9.971 3.081 517 H GLY 3 H GLY 3 -6.613 9.709 2.884 518 HA2 GLY 3 HA2 GLY 3 -8.436 8.734 1.887 519 HA3 GLY 3 HA3 GLY 3 -7.269 7.835 0.929 520 H PHE 4 H PHE 4 -8.428 5.928 0.912 521 HA PHE 4 HA PHE 4 -9.351 4.726 3.358 522 HB2 PHE 4 HB2 PHE 4 -9.410 4.011 0.464 523 HB3 PHE 4 HB3 PHE 4 -9.600 2.712 1.638 524 HD1 PHE 4 HD1 PHE 4 -11.841 2.124 1.290 525 HD2 PHE 4 HD2 PHE 4 -10.804 6.193 1.981 526 HE1 PHE 4 HE1 PHE 4 -14.225 2.688 1.526 527 HE2 PHE 4 HE2 PHE 4 -13.185 6.764 2.220 528 HZ PHE 4 HZ PHE 4 -14.899 5.010 1.993 529 H MET 5 H MET 5 -8.648 2.651 4.152 530 HA MET 5 HA MET 5 -5.831 2.058 3.523 531 HB2 MET 5 HB2 MET 5 -5.880 3.126 5.674 532 HB3 MET 5 HB3 MET 5 -7.199 2.096 6.214 533 HG2 MET 5 HG2 MET 5 -5.065 1.432 7.188 534 HG3 MET 5 HG3 MET 5 -5.748 0.162 6.175 535 HE1 MET 5 HE1 MET 5 -3.125 -0.298 7.044 536 HE2 MET 5 HE2 MET 5 -3.354 -1.231 5.566 537 HE3 MET 5 HE3 MET 5 -1.895 -0.265 5.781 538 H THR 6 H THR 6 -5.791 0.179 2.481 539 HA THR 6 HA THR 6 -7.714 -1.912 3.209 540 HB THR 6 HB THR 6 -5.966 -1.544 0.777 541 HG1 THR 6 HG1 THR 6 -8.181 -1.733 -0.166 542 HG21 THR 6 HG21 THR 6 -5.919 -3.902 1.315 543 HG22 THR 6 HG22 THR 6 -7.669 -3.921 1.532 544 HG23 THR 6 HG23 THR 6 -6.982 -3.644 -0.068 545 H SER 7 H SER 7 -6.941 -3.072 4.877 546 HA SER 7 HA SER 7 -4.131 -3.928 4.814 547 HB2 SER 7 HB2 SER 7 -5.394 -2.781 6.865 548 HB3 SER 7 HB3 SER 7 -5.856 -4.451 7.189 549 HG SER 7 HG SER 7 -3.761 -3.534 8.077 550 H GLU 8 H GLU 8 -4.243 -5.648 3.395 551 HA GLU 8 HA GLU 8 -5.941 -7.906 4.230 552 HB2 GLU 8 HB2 GLU 8 -5.738 -6.672 1.733 553 HB3 GLU 8 HB3 GLU 8 -4.820 -8.162 1.567 554 HG2 GLU 8 HG2 GLU 8 -6.919 -8.837 0.946 555 HG3 GLU 8 HG3 GLU 8 -6.903 -9.261 2.657 556 H LYS 9 H LYS 9 -4.927 -9.591 5.076 557 HA LYS 9 HA LYS 9 -2.064 -9.953 4.482 558 HB2 LYS 9 HB2 LYS 9 -2.778 -9.388 6.872 559 HB3 LYS 9 HB3 LYS 9 -3.483 -10.999 6.927 560 HG2 LYS 9 HG2 LYS 9 -0.631 -10.675 6.120 561 HG3 LYS 9 HG3 LYS 9 -1.076 -10.581 7.825 562 HD2 LYS 9 HD2 LYS 9 -2.386 -12.795 7.257 563 HD3 LYS 9 HD3 LYS 9 -1.209 -12.889 5.945 564 HE2 LYS 9 HE2 LYS 9 -0.192 -14.069 7.675 565 HE3 LYS 9 HE3 LYS 9 0.550 -12.473 7.774 566 HZ1 LYS 9 HZ1 LYS 9 -0.694 -11.930 9.647 567 HZ2 LYS 9 HZ2 LYS 9 -1.822 -13.166 9.394 568 HZ3 LYS 9 HZ3 LYS 9 -0.259 -13.542 9.923 569 H SER 10 H SER 10 -1.756 -11.559 3.092 570 HA SER 10 HA SER 10 -2.826 -14.176 3.633 571 HB2 SER 10 HB2 SER 10 -3.823 -14.412 1.330 572 HB3 SER 10 HB3 SER 10 -4.716 -13.341 2.409 573 HG SER 10 HG SER 10 -3.744 -12.777 0.029 574 H GLN 11 H GLN 11 -1.554 -15.773 2.812 575 HA GLN 11 HA GLN 11 0.935 -14.935 1.581 576 HB2 GLN 11 HB2 GLN 11 1.607 -17.305 1.934 577 HB3 GLN 11 HB3 GLN 11 1.101 -16.494 3.410 578 HG2 GLN 11 HG2 GLN 11 -0.810 -17.736 3.606 579 HG3 GLN 11 HG3 GLN 11 -0.907 -18.061 1.876 580 HE21 GLN 11 HE21 GLN 11 0.056 -19.844 1.053 581 HE22 GLN 11 HE22 GLN 11 0.873 -21.030 2.007 582 H THR 12 H THR 12 -1.286 -14.619 -0.096 583 HA THR 12 HA THR 12 -0.497 -16.372 -2.290 584 HB THR 12 HB THR 12 -3.210 -16.247 -2.711 585 HG1 THR 12 HG1 THR 12 -3.414 -15.538 -0.471 586 HG21 THR 12 HG21 THR 12 -2.678 -18.373 -3.115 587 HG22 THR 12 HG22 THR 12 -1.212 -18.230 -2.145 588 HG23 THR 12 HG23 THR 12 -2.735 -18.679 -1.379 589 HA PRO 13 HA PRO 13 -0.945 -12.807 -4.809 590 HB2 PRO 13 HB2 PRO 13 -1.982 -13.810 -7.109 591 HB3 PRO 13 HB3 PRO 13 -0.312 -14.095 -6.603 592 HG2 PRO 13 HG2 PRO 13 -2.704 -15.876 -6.334 593 HG3 PRO 13 HG3 PRO 13 -1.050 -16.289 -6.823 594 HD2 PRO 13 HD2 PRO 13 -1.986 -16.741 -4.323 595 HD3 PRO 13 HD3 PRO 13 -0.286 -16.344 -4.649 596 H LEU 14 H LEU 14 -2.720 -12.136 -3.227 597 HA LEU 14 HA LEU 14 -5.439 -12.417 -4.114 598 HB2 LEU 14 HB2 LEU 14 -6.042 -11.173 -2.216 599 HB3 LEU 14 HB3 LEU 14 -4.677 -12.172 -1.720 600 HG LEU 14 HG LEU 14 -4.280 -9.319 -2.559 601 HD11 LEU 14 HD11 LEU 14 -4.301 -9.564 0.275 602 HD12 LEU 14 HD12 LEU 14 -5.290 -8.529 -0.754 603 HD13 LEU 14 HD13 LEU 14 -5.839 -10.156 -0.353 604 HD21 LEU 14 HD21 LEU 14 -2.244 -10.463 -2.397 605 HD22 LEU 14 HD22 LEU 14 -2.401 -9.627 -0.852 606 HD23 LEU 14 HD23 LEU 14 -2.754 -11.351 -0.961 607 H VAL 15 H VAL 15 -6.418 -9.828 -3.606 608 HA VAL 15 HA VAL 15 -5.096 -7.914 -5.278 609 HB VAL 15 HB VAL 15 -6.096 -9.424 -6.983 610 HG11 VAL 15 HG11 VAL 15 -8.220 -9.596 -5.294 611 HG12 VAL 15 HG12 VAL 15 -8.822 -8.457 -6.498 612 HG13 VAL 15 HG13 VAL 15 -8.253 -10.050 -6.998 613 HG21 VAL 15 HG21 VAL 15 -6.221 -6.619 -6.812 614 HG22 VAL 15 HG22 VAL 15 -6.198 -7.614 -8.268 615 HG23 VAL 15 HG23 VAL 15 -7.737 -7.144 -7.545 616 H THR 16 H THR 16 -5.915 -5.859 -5.029 617 HA THR 16 HA THR 16 -7.967 -5.581 -2.955 618 HB THR 16 HB THR 16 -5.971 -4.416 -2.381 619 HG1 THR 16 HG1 THR 16 -7.695 -2.425 -3.458 620 HG21 THR 16 HG21 THR 16 -5.585 -2.413 -4.266 621 HG22 THR 16 HG22 THR 16 -4.575 -3.839 -4.029 622 HG23 THR 16 HG23 THR 16 -5.869 -3.864 -5.227 623 H LEU 17 H LEU 17 -9.964 -5.387 -3.746 624 HA LEU 17 HA LEU 17 -10.454 -4.169 -6.322 625 HB2 LEU 17 HB2 LEU 17 -11.660 -6.192 -5.210 626 HB3 LEU 17 HB3 LEU 17 -12.605 -4.946 -4.397 627 HG LEU 17 HG LEU 17 -13.748 -5.839 -6.373 628 HD11 LEU 17 HD11 LEU 17 -13.733 -3.328 -5.577 629 HD12 LEU 17 HD12 LEU 17 -12.992 -3.073 -7.157 630 HD13 LEU 17 HD13 LEU 17 -14.584 -3.822 -7.041 631 HD21 LEU 17 HD21 LEU 17 -12.910 -5.636 -8.558 632 HD22 LEU 17 HD22 LEU 17 -11.606 -4.564 -8.050 633 HD23 LEU 17 HD23 LEU 17 -11.565 -6.271 -7.610 634 H PHE 18 H PHE 18 -9.949 -2.004 -6.113 635 HA PHE 18 HA PHE 18 -11.499 -0.467 -4.143 636 HB2 PHE 18 HB2 PHE 18 -8.791 -0.232 -5.201 637 HB3 PHE 18 HB3 PHE 18 -9.682 1.283 -5.296 638 HD1 PHE 18 HD1 PHE 18 -11.300 1.340 -2.936 639 HD2 PHE 18 HD2 PHE 18 -7.336 -0.129 -3.429 640 HE1 PHE 18 HE1 PHE 18 -10.854 1.753 -0.552 641 HE2 PHE 18 HE2 PHE 18 -6.884 0.280 -1.046 642 HZ PHE 18 HZ PHE 18 -8.645 1.221 0.397 643 H LYS 19 H LYS 19 -13.393 0.078 -5.045 644 HA LYS 19 HA LYS 19 -13.325 1.330 -7.714 645 HB2 LYS 19 HB2 LYS 19 -15.262 -0.575 -6.476 646 HB3 LYS 19 HB3 LYS 19 -15.878 0.630 -7.599 647 HG2 LYS 19 HG2 LYS 19 -14.206 -0.184 -9.266 648 HG3 LYS 19 HG3 LYS 19 -13.818 -1.492 -8.147 649 HD2 LYS 19 HD2 LYS 19 -15.383 -2.456 -9.575 650 HD3 LYS 19 HD3 LYS 19 -16.352 -1.975 -8.180 651 HE2 LYS 19 HE2 LYS 19 -17.661 -1.138 -9.847 652 HE3 LYS 19 HE3 LYS 19 -16.607 0.252 -9.588 653 HZ1 LYS 19 HZ1 LYS 19 -15.473 -1.572 -11.453 654 HZ2 LYS 19 HZ2 LYS 19 -17.013 -1.082 -11.953 655 HZ3 LYS 19 HZ3 LYS 19 -15.819 0.074 -11.638 656 H ASN 20 H ASN 20 -14.881 3.039 -8.082 657 HA ASN 20 HA ASN 20 -15.742 5.077 -7.538 658 HB2 ASN 20 HB2 ASN 20 -16.870 3.881 -5.030 659 HB3 ASN 20 HB3 ASN 20 -17.605 5.032 -6.142 660 HD21 ASN 20 HD21 ASN 20 -17.552 3.959 -8.515 661 HD22 ASN 20 HD22 ASN 20 -18.342 2.423 -8.563 662 H ALA 21 H ALA 21 -13.090 4.597 -6.632 663 HA ALA 21 HA ALA 21 -12.741 5.459 -3.945 664 HB1 ALA 21 HB1 ALA 21 -10.809 5.471 -6.260 665 HB2 ALA 21 HB2 ALA 21 -10.378 5.750 -4.573 666 HB3 ALA 21 HB3 ALA 21 -11.018 4.184 -5.072 667 H ILE 22 H ILE 22 -13.489 7.390 -3.319 668 HA ILE 22 HA ILE 22 -12.957 9.717 -5.045 669 HB ILE 22 HB ILE 22 -15.048 9.411 -2.887 670 HG12 ILE 22 HG12 ILE 22 -15.406 9.675 -5.878 671 HG13 ILE 22 HG13 ILE 22 -15.451 8.141 -5.016 672 HG21 ILE 22 HG21 ILE 22 -14.712 11.656 -2.808 673 HG22 ILE 22 HG22 ILE 22 -14.066 11.729 -4.448 674 HG23 ILE 22 HG23 ILE 22 -15.806 11.604 -4.191 675 HD11 ILE 22 HD11 ILE 22 -17.242 9.848 -3.692 676 HD12 ILE 22 HD12 ILE 22 -17.532 10.048 -5.420 677 HD13 ILE 22 HD13 ILE 22 -17.613 8.444 -4.692 678 H ILE 23 H ILE 23 -11.215 10.794 -4.401 679 HA ILE 23 HA ILE 23 -10.600 10.935 -1.532 680 HB ILE 23 HB ILE 23 -8.911 11.191 -3.992 681 HG12 ILE 23 HG12 ILE 23 -9.217 9.009 -2.791 682 HG13 ILE 23 HG13 ILE 23 -7.544 9.544 -2.896 683 HG21 ILE 23 HG21 ILE 23 -8.080 13.074 -2.992 684 HG22 ILE 23 HG22 ILE 23 -8.480 12.521 -1.366 685 HG23 ILE 23 HG23 ILE 23 -7.088 11.843 -2.210 686 HD11 ILE 23 HD11 ILE 23 -8.838 10.478 -0.482 687 HD12 ILE 23 HD12 ILE 23 -8.864 8.721 -0.626 688 HD13 ILE 23 HD13 ILE 23 -7.330 9.589 -0.690 689 H LYS 24 H LYS 24 -11.506 12.666 -0.619 690 HA LYS 24 HA LYS 24 -11.159 15.267 -1.957 691 HB2 LYS 24 HB2 LYS 24 -13.593 14.037 -0.783 692 HB3 LYS 24 HB3 LYS 24 -13.349 15.752 -0.480 693 HG2 LYS 24 HG2 LYS 24 -12.913 15.755 -3.101 694 HG3 LYS 24 HG3 LYS 24 -13.958 14.335 -3.007 695 HD2 LYS 24 HD2 LYS 24 -15.417 15.949 -1.505 696 HD3 LYS 24 HD3 LYS 24 -14.564 17.192 -2.424 697 HE2 LYS 24 HE2 LYS 24 -15.257 15.790 -4.488 698 HE3 LYS 24 HE3 LYS 24 -16.436 15.065 -3.397 699 HZ1 LYS 24 HZ1 LYS 24 -17.130 17.426 -2.884 700 HZ2 LYS 24 HZ2 LYS 24 -16.223 17.894 -4.234 701 HZ3 LYS 24 HZ3 LYS 24 -17.534 16.842 -4.420 702 H ASN 25 H ASN 25 -9.632 16.286 -0.828 703 HA ASN 25 HA ASN 25 -8.455 17.178 0.903 704 HB2 ASN 25 HB2 ASN 25 -11.214 17.051 2.119 705 HB3 ASN 25 HB3 ASN 25 -9.846 17.786 2.949 706 HD21 ASN 25 HD21 ASN 25 -9.319 19.824 2.490 707 HD22 ASN 25 HD22 ASN 25 -10.029 20.773 1.232 708 H ALA 26 H ALA 26 -8.335 14.360 0.614 709 HA ALA 26 HA ALA 26 -8.670 12.942 3.011 710 HB1 ALA 26 HB1 ALA 26 -8.153 12.099 0.613 711 HB2 ALA 26 HB2 ALA 26 -6.467 12.284 1.099 712 HB3 ALA 26 HB3 ALA 26 -7.531 11.202 1.998 713 H TYR 27 H TYR 27 -5.563 14.020 1.623 714 HA TYR 27 HA TYR 27 -4.448 14.076 4.332 715 HB2 TYR 27 HB2 TYR 27 -3.406 12.924 2.166 716 HB3 TYR 27 HB3 TYR 27 -2.743 14.537 1.934 717 HD1 TYR 27 HD1 TYR 27 -2.226 15.348 4.731 718 HD2 TYR 27 HD2 TYR 27 -1.562 11.629 2.773 719 HE1 TYR 27 HE1 TYR 27 -0.422 14.838 6.324 720 HE2 TYR 27 HE2 TYR 27 0.243 11.109 4.361 721 HH TYR 27 HH TYR 27 1.312 11.744 6.207 722 H LYS 28 H LYS 28 -4.872 15.993 5.260 723 HA LYS 28 HA LYS 28 -5.018 18.455 3.851 724 HB2 LYS 28 HB2 LYS 28 -4.919 17.706 6.758 725 HB3 LYS 28 HB3 LYS 28 -4.834 19.392 6.266 726 HG2 LYS 28 HG2 LYS 28 -7.048 17.581 5.360 727 HG3 LYS 28 HG3 LYS 28 -7.118 18.467 6.886 728 HD2 LYS 28 HD2 LYS 28 -6.437 19.964 4.403 729 HD3 LYS 28 HD3 LYS 28 -8.114 19.477 4.658 730 HE2 LYS 28 HE2 LYS 28 -6.593 20.849 6.838 731 HE3 LYS 28 HE3 LYS 28 -7.298 21.788 5.523 732 HZ1 LYS 28 HZ1 LYS 28 -8.585 20.497 7.748 733 HZ2 LYS 28 HZ2 LYS 28 -9.127 21.772 6.776 734 HZ3 LYS 28 HZ3 LYS 28 -9.331 20.172 6.264 735 H LYS 29 H LYS 29 -3.638 20.354 5.006 736 HA LYS 29 HA LYS 29 -0.854 19.667 4.405 737 HB2 LYS 29 HB2 LYS 29 -0.585 22.200 4.377 738 HB3 LYS 29 HB3 LYS 29 -1.568 21.499 3.099 739 HG2 LYS 29 HG2 LYS 29 -3.484 22.440 3.863 740 HG3 LYS 29 HG3 LYS 29 -2.973 22.378 5.551 741 HD2 LYS 29 HD2 LYS 29 -1.342 24.208 5.032 742 HD3 LYS 29 HD3 LYS 29 -2.087 24.338 3.437 743 HE2 LYS 29 HE2 LYS 29 -4.219 24.889 4.445 744 HE3 LYS 29 HE3 LYS 29 -3.547 24.655 6.058 745 HZ1 LYS 29 HZ1 LYS 29 -3.727 27.024 5.152 746 HZ2 LYS 29 HZ2 LYS 29 -2.275 26.571 5.893 747 HZ3 LYS 29 HZ3 LYS 29 -2.381 26.634 4.205 748 H GLY 30 H GLY 30 0.072 18.893 6.231 749 HA2 GLY 30 HA2 GLY 30 0.492 20.770 8.396 750 HA3 GLY 30 HA3 GLY 30 -0.421 19.337 8.844 751 H GLU 31 H GLU 31 2.146 19.349 6.453 752 HA GLU 31 HA GLU 31 3.765 17.716 8.297 753 HB2 GLU 31 HB2 GLU 31 4.661 16.569 6.335 754 HB3 GLU 31 HB3 GLU 31 2.909 16.435 6.391 755 HG2 GLU 31 HG2 GLU 31 4.227 18.581 4.780 756 HG3 GLU 31 HG3 GLU 31 4.053 16.946 4.145 757 H1 TYR 1 H TYR 1 2.702 10.226 0.916 758 HA TYR 1 HA TYR 1 1.540 7.964 -0.505 759 HB2 TYR 1 HB2 TYR 1 1.646 8.482 2.473 760 HB3 TYR 1 HB3 TYR 1 1.246 6.961 1.682 761 HD1 TYR 1 HD1 TYR 1 3.974 9.341 2.400 762 HD2 TYR 1 HD2 TYR 1 2.955 5.492 0.899 763 HE1 TYR 1 HE1 TYR 1 6.347 8.696 2.459 764 HE2 TYR 1 HE2 TYR 1 5.325 4.837 0.955 765 HH TYR 1 HH TYR 1 7.510 5.832 0.968 766 H GLY 2 H GLY 2 0.307 10.488 -0.943 767 HA2 GLY 2 HA2 GLY 2 -2.026 10.744 0.699 768 HA3 GLY 2 HA3 GLY 2 -1.728 11.568 -0.825 769 H GLY 3 H GLY 3 -4.076 11.136 -1.084 770 HA2 GLY 3 HA2 GLY 3 -5.797 9.991 -2.084 771 HA3 GLY 3 HA3 GLY 3 -4.541 9.131 -2.962 772 H PHE 4 H PHE 4 -5.571 7.151 -2.919 773 HA PHE 4 HA PHE 4 -6.493 6.005 -0.447 774 HB2 PHE 4 HB2 PHE 4 -6.405 5.153 -3.302 775 HB3 PHE 4 HB3 PHE 4 -6.545 3.899 -2.073 776 HD1 PHE 4 HD1 PHE 4 -8.727 3.140 -2.460 777 HD2 PHE 4 HD2 PHE 4 -7.995 7.300 -1.935 778 HE1 PHE 4 HE1 PHE 4 -11.150 3.546 -2.323 779 HE2 PHE 4 HE2 PHE 4 -10.416 7.712 -1.797 780 HZ PHE 4 HZ PHE 4 -11.998 5.834 -1.989 781 H MET 5 H MET 5 -5.679 4.023 0.469 782 HA MET 5 HA MET 5 -2.809 3.595 -0.043 783 HB2 MET 5 HB2 MET 5 -3.003 4.761 2.050 784 HB3 MET 5 HB3 MET 5 -4.265 3.667 2.602 785 HG2 MET 5 HG2 MET 5 -2.120 3.206 3.668 786 HG3 MET 5 HG3 MET 5 -2.685 1.842 2.706 787 HE1 MET 5 HE1 MET 5 -0.062 1.612 3.670 788 HE2 MET 5 HE2 MET 5 -0.183 0.590 2.239 789 HE3 MET 5 HE3 MET 5 1.200 1.665 2.440 790 H THR 6 H THR 6 -2.610 1.674 -0.987 791 HA THR 6 HA THR 6 -4.413 -0.505 -0.214 792 HB THR 6 HB THR 6 -2.608 -0.137 -2.603 793 HG1 THR 6 HG1 THR 6 -4.767 -0.523 -3.609 794 HG21 THR 6 HG21 THR 6 -2.421 -2.458 -1.938 795 HG22 THR 6 HG22 THR 6 -4.174 -2.587 -1.786 796 HG23 THR 6 HG23 THR 6 -3.441 -2.341 -3.372 797 H SER 7 H SER 7 -3.631 -1.539 1.529 798 HA SER 7 HA SER 7 -0.769 -2.197 1.608 799 HB2 SER 7 HB2 SER 7 -2.185 -1.048 3.556 800 HB3 SER 7 HB3 SER 7 -2.544 -2.731 3.943 801 HG SER 7 HG SER 7 -0.553 -1.628 4.859 802 H GLU 8 H GLU 8 -0.712 -3.983 0.268 803 HA GLU 8 HA GLU 8 -2.285 -6.313 1.148 804 HB2 GLU 8 HB2 GLU 8 -2.061 -5.183 -1.396 805 HB3 GLU 8 HB3 GLU 8 -1.041 -6.614 -1.454 806 HG2 GLU 8 HG2 GLU 8 -3.057 -7.468 -2.115 807 HG3 GLU 8 HG3 GLU 8 -3.099 -7.790 -0.383 808 H LYS 9 H LYS 9 -1.197 -7.883 2.113 809 HA LYS 9 HA LYS 9 1.707 -8.071 1.651 810 HB2 LYS 9 HB2 LYS 9 0.837 -7.463 3.984 811 HB3 LYS 9 HB3 LYS 9 0.264 -9.123 4.077 812 HG2 LYS 9 HG2 LYS 9 3.115 -8.586 3.381 813 HG3 LYS 9 HG3 LYS 9 2.583 -8.480 5.061 814 HD2 LYS 9 HD2 LYS 9 1.494 -10.814 4.515 815 HD3 LYS 9 HD3 LYS 9 2.729 -10.847 3.255 816 HE2 LYS 9 HE2 LYS 9 3.772 -11.881 5.059 817 HE3 LYS 9 HE3 LYS 9 4.364 -10.222 5.143 818 HZ1 LYS 9 HZ1 LYS 9 2.992 -9.746 6.944 819 HZ2 LYS 9 HZ2 LYS 9 1.994 -11.086 6.681 820 HZ3 LYS 9 HZ3 LYS 9 3.559 -11.303 7.285 821 H SER 10 H SER 10 2.188 -9.709 0.351 822 HA SER 10 HA SER 10 1.281 -12.370 0.961 823 HB2 SER 10 HB2 SER 10 0.401 -12.768 -1.371 824 HB3 SER 10 HB3 SER 10 -0.613 -11.732 -0.367 825 HG SER 10 HG SER 10 0.405 -11.178 -2.729 826 H GLN 11 H GLN 11 2.692 -13.904 0.255 827 HA GLN 11 HA GLN 11 5.162 -12.939 -0.924 828 HB2 GLN 11 HB2 GLN 11 5.997 -15.226 -0.427 829 HB3 GLN 11 HB3 GLN 11 5.364 -14.395 0.987 830 HG2 GLN 11 HG2 GLN 11 3.550 -15.778 1.163 831 HG3 GLN 11 HG3 GLN 11 3.553 -16.182 -0.553 832 HE21 GLN 11 HE21 GLN 11 4.695 -17.911 -1.257 833 HE22 GLN 11 HE22 GLN 11 5.558 -18.989 -0.218 834 H THR 12 H THR 12 3.014 -12.850 -2.702 835 HA THR 12 HA THR 12 4.003 -14.646 -4.773 836 HB THR 12 HB THR 12 1.307 -14.743 -5.296 837 HG1 THR 12 HG1 THR 12 0.963 -13.948 -3.103 838 HG21 THR 12 HG21 THR 12 2.008 -16.840 -5.575 839 HG22 THR 12 HG22 THR 12 3.420 -16.543 -4.561 840 HG23 THR 12 HG23 THR 12 1.904 -17.069 -3.829 841 HA PRO 13 HA PRO 13 3.395 -11.244 -7.478 842 HB2 PRO 13 HB2 PRO 13 2.521 -12.427 -9.761 843 HB3 PRO 13 HB3 PRO 13 4.186 -12.565 -9.184 844 HG2 PRO 13 HG2 PRO 13 1.921 -14.503 -8.911 845 HG3 PRO 13 HG3 PRO 13 3.618 -14.815 -9.322 846 HD2 PRO 13 HD2 PRO 13 2.622 -15.218 -6.836 847 HD3 PRO 13 HD3 PRO 13 4.300 -14.712 -7.123 848 H LEU 14 H LEU 14 1.520 -10.626 -5.998 849 HA LEU 14 HA LEU 14 -1.137 -11.149 -6.965 850 HB2 LEU 14 HB2 LEU 14 -1.901 -9.873 -5.149 851 HB3 LEU 14 HB3 LEU 14 -0.487 -10.744 -4.559 852 HG LEU 14 HG LEU 14 -0.268 -7.909 -5.517 853 HD11 LEU 14 HD11 LEU 14 -0.383 -8.024 -2.678 854 HD12 LEU 14 HD12 LEU 14 -1.408 -7.119 -3.792 855 HD13 LEU 14 HD13 LEU 14 -1.845 -8.763 -3.329 856 HD21 LEU 14 HD21 LEU 14 1.837 -8.895 -5.227 857 HD22 LEU 14 HD22 LEU 14 1.561 -7.995 -3.735 858 HD23 LEU 14 HD23 LEU 14 1.337 -9.744 -3.764 859 H VAL 15 H VAL 15 -2.318 -8.619 -6.613 860 HA VAL 15 HA VAL 15 -1.071 -6.690 -8.326 861 HB VAL 15 HB VAL 15 -1.900 -8.342 -9.991 862 HG11 VAL 15 HG11 VAL 15 -4.069 -8.585 -8.368 863 HG12 VAL 15 HG12 VAL 15 -4.702 -7.550 -9.648 864 HG13 VAL 15 HG13 VAL 15 -4.005 -9.121 -10.047 865 HG21 VAL 15 HG21 VAL 15 -2.222 -5.549 -9.958 866 HG22 VAL 15 HG22 VAL 15 -2.080 -6.605 -11.364 867 HG23 VAL 15 HG23 VAL 15 -3.672 -6.210 -10.715 868 H THR 16 H THR 16 -2.040 -4.690 -8.201 869 HA THR 16 HA THR 16 -4.181 -4.467 -6.213 870 HB THR 16 HB THR 16 -2.296 -3.137 -5.625 871 HG1 THR 16 HG1 THR 16 -4.114 -1.328 -6.859 872 HG21 THR 16 HG21 THR 16 -1.972 -1.200 -7.586 873 HG22 THR 16 HG22 THR 16 -0.882 -2.546 -7.254 874 HG23 THR 16 HG23 THR 16 -2.128 -2.705 -8.491 875 H LEU 17 H LEU 17 -6.159 -4.442 -7.070 876 HA LEU 17 HA LEU 17 -6.638 -3.382 -9.718 877 HB2 LEU 17 HB2 LEU 17 -7.740 -5.434 -8.552 878 HB3 LEU 17 HB3 LEU 17 -8.798 -4.223 -7.831 879 HG LEU 17 HG LEU 17 -9.802 -5.284 -9.800 880 HD11 LEU 17 HD11 LEU 17 -9.993 -2.745 -9.123 881 HD12 LEU 17 HD12 LEU 17 -9.216 -2.508 -10.688 882 HD13 LEU 17 HD13 LEU 17 -10.754 -3.365 -10.587 883 HD21 LEU 17 HD21 LEU 17 -8.902 -5.116 -11.964 884 HD22 LEU 17 HD22 LEU 17 -7.694 -3.933 -11.461 885 HD23 LEU 17 HD23 LEU 17 -7.552 -5.613 -10.942 886 H PHE 18 H PHE 18 -6.294 -1.180 -9.595 887 HA PHE 18 HA PHE 18 -8.016 0.329 -7.750 888 HB2 PHE 18 HB2 PHE 18 -5.296 0.710 -8.731 889 HB3 PHE 18 HB3 PHE 18 -6.287 2.152 -8.925 890 HD1 PHE 18 HD1 PHE 18 -7.983 2.207 -6.626 891 HD2 PHE 18 HD2 PHE 18 -3.917 0.986 -6.919 892 HE1 PHE 18 HE1 PHE 18 -7.651 2.756 -4.250 893 HE2 PHE 18 HE2 PHE 18 -3.578 1.532 -4.544 894 HZ PHE 18 HZ PHE 18 -5.446 2.417 -3.206 895 H LYS 19 H LYS 19 -9.911 0.694 -8.738 896 HA LYS 19 HA LYS 19 -9.838 1.826 -11.459 897 HB2 LYS 19 HB2 LYS 19 -11.681 -0.151 -10.191 898 HB3 LYS 19 HB3 LYS 19 -12.338 0.954 -11.391 899 HG2 LYS 19 HG2 LYS 19 -10.558 0.183 -12.962 900 HG3 LYS 19 HG3 LYS 19 -10.119 -1.041 -11.768 901 HD2 LYS 19 HD2 LYS 19 -11.564 -2.178 -13.196 902 HD3 LYS 19 HD3 LYS 19 -12.611 -1.702 -11.858 903 HE2 LYS 19 HE2 LYS 19 -13.917 -1.037 -13.604 904 HE3 LYS 19 HE3 LYS 19 -12.969 0.433 -13.380 905 HZ1 LYS 19 HZ1 LYS 19 -11.650 -1.392 -15.117 906 HZ2 LYS 19 HZ2 LYS 19 -13.203 -1.036 -15.688 907 HZ3 LYS 19 HZ3 LYS 19 -12.102 0.215 -15.395 908 H ASN 20 H ASN 20 -11.496 3.401 -11.956 909 HA ASN 20 HA ASN 20 -12.512 5.397 -11.538 910 HB2 ASN 20 HB2 ASN 20 -13.642 4.241 -9.012 911 HB3 ASN 20 HB3 ASN 20 -14.416 5.285 -10.201 912 HD21 ASN 20 HD21 ASN 20 -14.207 4.111 -12.517 913 HD22 ASN 20 HD22 ASN 20 -14.887 2.523 -12.517 914 H ALA 21 H ALA 21 -9.867 5.151 -10.529 915 HA ALA 21 HA ALA 21 -9.672 6.155 -7.876 916 HB1 ALA 21 HB1 ALA 21 -7.665 6.200 -10.126 917 HB2 ALA 21 HB2 ALA 21 -7.315 6.580 -8.440 918 HB3 ALA 21 HB3 ALA 21 -7.828 4.953 -8.890 919 H ILE 22 H ILE 22 -10.575 8.055 -7.369 920 HA ILE 22 HA ILE 22 -10.142 10.332 -9.186 921 HB ILE 22 HB ILE 22 -12.284 9.977 -7.086 922 HG12 ILE 22 HG12 ILE 22 -12.550 10.081 -10.096 923 HG13 ILE 22 HG13 ILE 22 -12.523 8.589 -9.163 924 HG21 ILE 22 HG21 ILE 22 -12.103 12.242 -7.102 925 HG22 ILE 22 HG22 ILE 22 -11.409 12.287 -8.722 926 HG23 ILE 22 HG23 ILE 22 -13.144 12.052 -8.513 927 HD11 ILE 22 HD11 ILE 22 -14.472 10.229 -7.984 928 HD12 ILE 22 HD12 ILE 22 -14.711 10.327 -9.729 929 HD13 ILE 22 HD13 ILE 22 -14.711 8.757 -8.925 930 H ILE 23 H ILE 23 -8.501 11.556 -8.540 931 HA ILE 23 HA ILE 23 -8.001 11.872 -5.662 932 HB ILE 23 HB ILE 23 -6.246 12.132 -8.076 933 HG12 ILE 23 HG12 ILE 23 -6.445 9.992 -6.783 934 HG13 ILE 23 HG13 ILE 23 -4.809 10.637 -6.858 935 HG21 ILE 23 HG21 ILE 23 -5.584 14.114 -7.140 936 HG22 ILE 23 HG22 ILE 23 -6.000 13.606 -5.503 937 HG23 ILE 23 HG23 ILE 23 -4.536 12.992 -6.271 938 HD11 ILE 23 HD11 ILE 23 -6.253 11.587 -4.535 939 HD12 ILE 23 HD12 ILE 23 -6.152 9.827 -4.597 940 HD13 ILE 23 HD13 ILE 23 -4.680 10.797 -4.650 941 H LYS 24 H LYS 24 -9.055 13.576 -4.865 942 HA LYS 24 HA LYS 24 -8.841 16.129 -6.316 943 HB2 LYS 24 HB2 LYS 24 -11.224 14.787 -5.162 944 HB3 LYS 24 HB3 LYS 24 -11.108 16.527 -4.931 945 HG2 LYS 24 HG2 LYS 24 -10.584 16.445 -7.534 946 HG3 LYS 24 HG3 LYS 24 -11.530 14.961 -7.407 947 HD2 LYS 24 HD2 LYS 24 -13.147 16.533 -6.027 948 HD3 LYS 24 HD3 LYS 24 -12.353 17.790 -6.978 949 HE2 LYS 24 HE2 LYS 24 -12.877 16.251 -8.994 950 HE3 LYS 24 HE3 LYS 24 -14.038 15.493 -7.905 951 HZ1 LYS 24 HZ1 LYS 24 -14.910 17.821 -7.526 952 HZ2 LYS 24 HZ2 LYS 24 -13.996 18.289 -8.870 953 HZ3 LYS 24 HZ3 LYS 24 -15.225 17.139 -9.042 954 H ASN 25 H ASN 25 -7.427 17.305 -5.191 955 HA ASN 25 HA ASN 25 -6.374 18.358 -3.470 956 HB2 ASN 25 HB2 ASN 25 -9.158 18.090 -2.335 957 HB3 ASN 25 HB3 ASN 25 -7.873 18.957 -1.498 958 HD21 ASN 25 HD21 ASN 25 -7.469 21.003 -2.036 959 HD22 ASN 25 HD22 ASN 25 -8.199 21.843 -3.358 960 H ALA 26 H ALA 26 -6.050 15.544 -3.620 961 HA ALA 26 HA ALA 26 -6.365 14.218 -1.168 962 HB1 ALA 26 HB1 ALA 26 -5.712 13.305 -3.506 963 HB2 ALA 26 HB2 ALA 26 -4.060 13.629 -2.980 964 HB3 ALA 26 HB3 ALA 26 -5.076 12.518 -2.061 965 H TYR 27 H TYR 27 -3.295 15.446 -2.514 966 HA TYR 27 HA TYR 27 -2.278 15.708 0.221 967 HB2 TYR 27 HB2 TYR 27 -1.088 14.527 -1.852 968 HB3 TYR 27 HB3 TYR 27 -0.528 16.170 -2.146 969 HD1 TYR 27 HD1 TYR 27 -0.164 17.147 0.624 970 HD2 TYR 27 HD2 TYR 27 0.823 13.398 -1.129 971 HE1 TYR 27 HE1 TYR 27 1.616 16.842 2.294 972 HE2 TYR 27 HE2 TYR 27 2.605 13.082 0.537 973 HH TYR 27 HH TYR 27 3.564 13.878 2.381 974 H LYS 28 H LYS 28 -2.863 17.634 1.036 975 HA LYS 28 HA LYS 28 -3.127 20.009 -0.498 976 HB2 LYS 28 HB2 LYS 28 -3.069 19.414 2.446 977 HB3 LYS 28 HB3 LYS 28 -3.093 21.075 1.867 978 HG2 LYS 28 HG2 LYS 28 -5.138 19.061 0.995 979 HG3 LYS 28 HG3 LYS 28 -5.320 20.009 2.472 980 HD2 LYS 28 HD2 LYS 28 -4.676 21.433 -0.063 981 HD3 LYS 28 HD3 LYS 28 -6.321 20.836 0.174 982 HE2 LYS 28 HE2 LYS 28 -4.965 22.420 2.319 983 HE3 LYS 28 HE3 LYS 28 -5.698 23.241 0.942 984 HZ1 LYS 28 HZ1 LYS 28 -6.952 21.969 3.196 985 HZ2 LYS 28 HZ2 LYS 28 -7.557 23.150 2.146 986 HZ3 LYS 28 HZ3 LYS 28 -7.629 21.516 1.713 987 H LYS 29 H LYS 29 -1.918 22.052 0.612 988 HA LYS 29 HA LYS 29 0.924 21.532 0.125 989 HB2 LYS 29 HB2 LYS 29 1.023 24.073 -0.019 990 HB3 LYS 29 HB3 LYS 29 0.132 23.246 -1.290 991 HG2 LYS 29 HG2 LYS 29 -1.868 24.085 -0.629 992 HG3 LYS 29 HG3 LYS 29 -1.407 24.143 1.074 993 HD2 LYS 29 HD2 LYS 29 0.109 26.055 0.507 994 HD3 LYS 29 HD3 LYS 29 -0.592 26.052 -1.113 995 HE2 LYS 29 HE2 LYS 29 -2.788 26.502 -0.195 996 HE3 LYS 29 HE3 LYS 29 -2.152 26.398 1.446 997 HZ1 LYS 29 HZ1 LYS 29 -2.467 28.699 0.411 998 HZ2 LYS 29 HZ2 LYS 29 -1.011 28.388 1.214 999 HZ3 LYS 29 HZ3 LYS 29 -1.068 28.357 -0.477 1000 H GLY 30 H GLY 30 1.837 20.908 2.015 1001 HA2 GLY 30 HA2 GLY 30 2.058 22.910 4.096 1002 HA3 GLY 30 HA3 GLY 30 1.230 21.439 4.587 1003 H GLU 31 H GLU 31 3.871 21.524 2.278 1004 HA GLU 31 HA GLU 31 5.533 20.093 4.247 1005 HB2 GLU 31 HB2 GLU 31 6.573 18.924 2.368 1006 HB3 GLU 31 HB3 GLU 31 4.834 18.665 2.384 1007 HG2 GLU 31 HG2 GLU 31 6.047 20.821 0.704 1008 HG3 GLU 31 HG3 GLU 31 6.003 19.150 0.147 1009 H1 TYR 1 H TYR 1 5.207 12.219 -2.793 1010 HA TYR 1 HA TYR 1 4.270 9.801 -4.127 1011 HB2 TYR 1 HB2 TYR 1 4.236 10.477 -1.180 1012 HB3 TYR 1 HB3 TYR 1 3.965 8.894 -1.899 1013 HD1 TYR 1 HD1 TYR 1 6.504 11.487 -1.226 1014 HD2 TYR 1 HD2 TYR 1 5.794 7.505 -2.548 1015 HE1 TYR 1 HE1 TYR 1 8.910 11.009 -1.059 1016 HE2 TYR 1 HE2 TYR 1 8.199 7.016 -2.383 1017 HH TYR 1 HH TYR 1 10.312 8.162 -2.359 1018 H GLY 2 H GLY 2 2.887 12.218 -4.728 1019 HA2 GLY 2 HA2 GLY 2 0.484 12.387 -3.181 1020 HA3 GLY 2 HA3 GLY 2 0.780 13.156 -4.734 1021 H GLY 3 H GLY 3 -1.526 12.547 -5.039 1022 HA2 GLY 3 HA2 GLY 3 -3.126 11.241 -6.041 1023 HA3 GLY 3 HA3 GLY 3 -1.784 10.427 -6.831 1024 H PHE 4 H PHE 4 -2.680 8.385 -6.721 1025 HA PHE 4 HA PHE 4 -3.613 7.301 -4.224 1026 HB2 PHE 4 HB2 PHE 4 -3.369 6.321 -7.028 1027 HB3 PHE 4 HB3 PHE 4 -3.463 5.120 -5.744 1028 HD1 PHE 4 HD1 PHE 4 -5.574 4.192 -6.165 1029 HD2 PHE 4 HD2 PHE 4 -5.148 8.412 -5.812 1030 HE1 PHE 4 HE1 PHE 4 -8.022 4.432 -6.122 1031 HE2 PHE 4 HE2 PHE 4 -7.595 8.659 -5.767 1032 HZ PHE 4 HZ PHE 4 -9.036 6.667 -5.921 1033 H MET 5 H MET 5 -2.704 5.415 -3.192 1034 HA MET 5 HA MET 5 0.205 5.165 -3.583 1035 HB2 MET 5 HB2 MET 5 -0.147 6.411 -1.557 1036 HB3 MET 5 HB3 MET 5 -1.348 5.256 -0.995 1037 HG2 MET 5 HG2 MET 5 0.785 5.000 0.161 1038 HG3 MET 5 HG3 MET 5 0.349 3.556 -0.749 1039 HE1 MET 5 HE1 MET 5 2.955 3.574 0.313 1040 HE2 MET 5 HE2 MET 5 2.946 2.465 -1.058 1041 HE3 MET 5 HE3 MET 5 4.246 3.644 -0.885 1042 H THR 6 H THR 6 0.576 3.219 -4.417 1043 HA THR 6 HA THR 6 -1.109 0.960 -3.605 1044 HB THR 6 HB THR 6 0.760 1.340 -5.943 1045 HG1 THR 6 HG1 THR 6 -1.323 0.767 -7.009 1046 HG21 THR 6 HG21 THR 6 1.072 -0.930 -5.153 1047 HG22 THR 6 HG22 THR 6 -0.673 -1.172 -5.070 1048 HG23 THR 6 HG23 THR 6 0.112 -0.949 -6.633 1049 H SER 7 H SER 7 -0.327 0.067 -1.785 1050 HA SER 7 HA SER 7 2.568 -0.388 -1.572 1051 HB2 SER 7 HB2 SER 7 0.998 0.747 0.265 1052 HB3 SER 7 HB3 SER 7 0.744 -0.937 0.721 1053 HG SER 7 HG SER 7 2.616 0.348 1.651 1054 H GLU 8 H GLU 8 2.798 -2.226 -2.820 1055 HA GLU 8 HA GLU 8 1.352 -4.616 -1.884 1056 HB2 GLU 8 HB2 GLU 8 1.596 -3.593 -4.470 1057 HB3 GLU 8 HB3 GLU 8 2.714 -4.949 -4.423 1058 HG2 GLU 8 HG2 GLU 8 0.801 -5.989 -5.103 1059 HG3 GLU 8 HG3 GLU 8 0.692 -6.207 -3.357 1060 H LYS 9 H LYS 9 2.504 -6.071 -0.816 1061 HA LYS 9 HA LYS 9 5.431 -6.070 -1.155 1062 HB2 LYS 9 HB2 LYS 9 4.414 -5.437 1.115 1063 HB3 LYS 9 HB3 LYS 9 3.969 -7.133 1.255 1064 HG2 LYS 9 HG2 LYS 9 6.796 -6.390 0.653 1065 HG3 LYS 9 HG3 LYS 9 6.183 -6.275 2.305 1066 HD2 LYS 9 HD2 LYS 9 5.314 -8.705 1.807 1067 HD3 LYS 9 HD3 LYS 9 6.590 -8.680 0.587 1068 HE2 LYS 9 HE2 LYS 9 7.653 -9.564 2.455 1069 HE3 LYS 9 HE3 LYS 9 8.105 -7.861 2.501 1070 HZ1 LYS 9 HZ1 LYS 9 6.638 -7.444 4.242 1071 HZ2 LYS 9 HZ2 LYS 9 5.763 -8.870 3.994 1072 HZ3 LYS 9 HZ3 LYS 9 7.320 -8.936 4.654 1073 H SER 10 H SER 10 6.077 -7.717 -2.369 1074 HA SER 10 HA SER 10 5.343 -10.411 -1.681 1075 HB2 SER 10 HB2 SER 10 4.586 -10.956 -4.034 1076 HB3 SER 10 HB3 SER 10 3.455 -9.988 -3.089 1077 HG SER 10 HG SER 10 4.495 -9.406 -5.435 1078 H GLN 11 H GLN 11 6.910 -11.840 -2.232 1079 HA GLN 11 HA GLN 11 9.330 -10.746 -3.394 1080 HB2 GLN 11 HB2 GLN 11 10.322 -12.933 -2.760 1081 HB3 GLN 11 HB3 GLN 11 9.575 -12.093 -1.408 1082 HG2 GLN 11 HG2 GLN 11 7.875 -13.610 -1.221 1083 HG3 GLN 11 HG3 GLN 11 7.963 -14.083 -2.917 1084 HE21 GLN 11 HE21 GLN 11 9.256 -15.745 -3.514 1085 HE22 GLN 11 HE22 GLN 11 10.166 -16.707 -2.406 1086 H THR 12 H THR 12 7.268 -10.889 -5.250 1087 HA THR 12 HA THR 12 8.455 -12.704 -7.195 1088 HB THR 12 HB THR 12 5.798 -13.033 -7.805 1089 HG1 THR 12 HG1 THR 12 5.302 -12.160 -5.674 1090 HG21 THR 12 HG21 THR 12 6.659 -15.083 -7.946 1091 HG22 THR 12 HG22 THR 12 8.008 -14.628 -6.905 1092 HG23 THR 12 HG23 THR 12 6.510 -15.230 -6.195 1093 HA PRO 13 HA PRO 13 7.698 -9.483 -10.078 1094 HB2 PRO 13 HB2 PRO 13 7.004 -10.831 -12.330 1095 HB3 PRO 13 HB3 PRO 13 8.652 -10.814 -11.690 1096 HG2 PRO 13 HG2 PRO 13 6.531 -12.907 -11.404 1097 HG3 PRO 13 HG3 PRO 13 8.260 -13.106 -11.740 1098 HD2 PRO 13 HD2 PRO 13 7.204 -13.472 -9.274 1099 HD3 PRO 13 HD3 PRO 13 8.848 -12.852 -9.526 1100 H LEU 14 H LEU 14 5.735 -8.915 -8.717 1101 HA LEU 14 HA LEU 14 3.160 -9.693 -9.746 1102 HB2 LEU 14 HB2 LEU 14 2.232 -8.406 -8.019 1103 HB3 LEU 14 HB3 LEU 14 3.684 -9.136 -7.338 1104 HG LEU 14 HG LEU 14 3.712 -6.335 -8.415 1105 HD11 LEU 14 HD11 LEU 14 3.520 -6.348 -5.577 1106 HD12 LEU 14 HD12 LEU 14 2.464 -5.569 -6.755 1107 HD13 LEU 14 HD13 LEU 14 2.140 -7.224 -6.240 1108 HD21 LEU 14 HD21 LEU 14 5.882 -7.097 -8.027 1109 HD22 LEU 14 HD22 LEU 14 5.478 -6.216 -6.554 1110 HD23 LEU 14 HD23 LEU 14 5.414 -7.978 -6.573 1111 H VAL 15 H VAL 15 1.774 -7.258 -9.565 1112 HA VAL 15 HA VAL 15 2.948 -5.316 -11.321 1113 HB VAL 15 HB VAL 15 2.289 -7.099 -12.927 1114 HG11 VAL 15 HG11 VAL 15 0.088 -7.415 -11.361 1115 HG12 VAL 15 HG12 VAL 15 -0.570 -6.484 -12.707 1116 HG13 VAL 15 HG13 VAL 15 0.243 -8.020 -13.010 1117 HG21 VAL 15 HG21 VAL 15 1.779 -4.336 -13.039 1118 HG22 VAL 15 HG22 VAL 15 2.042 -5.443 -14.387 1119 HG23 VAL 15 HG23 VAL 15 0.405 -5.130 -13.809 1120 H THR 16 H THR 16 1.844 -3.385 -11.314 1121 HA THR 16 HA THR 16 -0.372 -3.223 -9.403 1122 HB THR 16 HB THR 16 1.395 -1.736 -8.828 1123 HG1 THR 16 HG1 THR 16 -0.503 -0.121 -10.203 1124 HG21 THR 16 HG21 THR 16 1.656 0.125 -10.865 1125 HG22 THR 16 HG22 THR 16 2.818 -1.134 -10.446 1126 HG23 THR 16 HG23 THR 16 1.620 -1.423 -11.709 1127 H LEU 17 H LEU 17 -2.316 -3.386 -10.321 1128 HA LEU 17 HA LEU 17 -2.785 -2.483 -13.028 1129 HB2 LEU 17 HB2 LEU 17 -3.775 -4.554 -11.796 1130 HB3 LEU 17 HB3 LEU 17 -4.941 -3.391 -11.167 1131 HG LEU 17 HG LEU 17 -5.801 -4.613 -13.110 1132 HD11 LEU 17 HD11 LEU 17 -6.192 -2.064 -12.566 1133 HD12 LEU 17 HD12 LEU 17 -5.381 -1.847 -14.117 1134 HD13 LEU 17 HD13 LEU 17 -6.858 -2.806 -14.021 1135 HD21 LEU 17 HD21 LEU 17 -4.843 -4.482 -15.252 1136 HD22 LEU 17 HD22 LEU 17 -3.737 -3.195 -14.772 1137 HD23 LEU 17 HD23 LEU 17 -3.498 -4.834 -14.167 1138 H PHE 18 H PHE 18 -2.607 -0.259 -13.005 1139 HA PHE 18 HA PHE 18 -4.491 1.203 -11.284 1140 HB2 PHE 18 HB2 PHE 18 -1.774 1.737 -12.203 1141 HB3 PHE 18 HB3 PHE 18 -2.859 3.093 -12.488 1142 HD1 PHE 18 HD1 PHE 18 -4.624 3.127 -10.243 1143 HD2 PHE 18 HD2 PHE 18 -0.476 2.182 -10.365 1144 HE1 PHE 18 HE1 PHE 18 -4.406 3.798 -7.886 1145 HE2 PHE 18 HE2 PHE 18 -0.251 2.850 -8.008 1146 HZ PHE 18 HZ PHE 18 -2.217 3.659 -6.765 1147 H LYS 19 H LYS 19 -6.372 1.382 -12.346 1148 HA LYS 19 HA LYS 19 -6.288 2.390 -15.115 1149 HB2 LYS 19 HB2 LYS 19 -8.028 0.347 -13.807 1150 HB3 LYS 19 HB3 LYS 19 -8.724 1.347 -15.076 1151 HG2 LYS 19 HG2 LYS 19 -6.846 0.634 -16.559 1152 HG3 LYS 19 HG3 LYS 19 -6.360 -0.500 -15.297 1153 HD2 LYS 19 HD2 LYS 19 -7.677 -1.801 -16.708 1154 HD3 LYS 19 HD3 LYS 19 -8.795 -1.341 -15.423 1155 HE2 LYS 19 HE2 LYS 19 -10.090 -0.850 -17.233 1156 HE3 LYS 19 HE3 LYS 19 -9.255 0.692 -17.055 1157 HZ1 LYS 19 HZ1 LYS 19 -7.760 -1.113 -18.666 1158 HZ2 LYS 19 HZ2 LYS 19 -9.315 -0.894 -19.295 1159 HZ3 LYS 19 HZ3 LYS 19 -8.313 0.444 -19.033 1160 H ASN 20 H ASN 20 -8.032 3.820 -15.739 1161 HA ASN 20 HA ASN 20 -9.198 5.756 -15.450 1162 HB2 ASN 20 HB2 ASN 20 -10.327 4.640 -12.905 1163 HB3 ASN 20 HB3 ASN 20 -11.132 5.574 -14.163 1164 HD21 ASN 20 HD21 ASN 20 -10.772 4.316 -16.414 1165 HD22 ASN 20 HD22 ASN 20 -11.341 2.686 -16.359 1166 H ALA 21 H ALA 21 -6.577 5.745 -14.352 1167 HA ALA 21 HA ALA 21 -6.537 6.882 -11.747 1168 HB1 ALA 21 HB1 ALA 21 -4.468 6.972 -13.940 1169 HB2 ALA 21 HB2 ALA 21 -4.200 7.449 -12.263 1170 HB3 ALA 21 HB3 ALA 21 -4.582 5.772 -12.652 1171 H ILE 22 H ILE 22 -7.582 8.734 -11.354 1172 HA ILE 22 HA ILE 22 -7.258 10.952 -13.266 1173 HB ILE 22 HB ILE 22 -9.432 10.539 -11.210 1174 HG12 ILE 22 HG12 ILE 22 -9.609 10.485 -14.228 1175 HG13 ILE 22 HG13 ILE 22 -9.512 9.043 -13.222 1176 HG21 ILE 22 HG21 ILE 22 -9.414 12.808 -11.328 1177 HG22 ILE 22 HG22 ILE 22 -8.672 12.829 -12.928 1178 HG23 ILE 22 HG23 ILE 22 -10.392 12.479 -12.759 1179 HD11 ILE 22 HD11 ILE 22 -11.605 10.597 -12.183 1180 HD12 ILE 22 HD12 ILE 22 -11.793 10.599 -13.936 1181 HD13 ILE 22 HD13 ILE 22 -11.713 9.071 -13.060 1182 H ILE 23 H ILE 23 -5.719 12.309 -12.632 1183 HA ILE 23 HA ILE 23 -5.335 12.795 -9.761 1184 HB ILE 23 HB ILE 23 -3.528 13.066 -12.134 1185 HG12 ILE 23 HG12 ILE 23 -3.615 10.979 -10.748 1186 HG13 ILE 23 HG13 ILE 23 -2.028 11.738 -10.799 1187 HG21 ILE 23 HG21 ILE 23 -3.031 15.129 -11.278 1188 HG22 ILE 23 HG22 ILE 23 -3.467 14.674 -9.631 1189 HG23 ILE 23 HG23 ILE 23 -1.939 14.127 -10.323 1190 HD11 ILE 23 HD11 ILE 23 -3.620 12.681 -8.572 1191 HD12 ILE 23 HD12 ILE 23 -3.390 10.932 -8.548 1192 HD13 ILE 23 HD13 ILE 23 -1.991 12.005 -8.598 1193 H LYS 24 H LYS 24 -6.536 14.452 -9.079 1194 HA LYS 24 HA LYS 24 -6.451 16.946 -10.644 1195 HB2 LYS 24 HB2 LYS 24 -8.769 15.492 -9.496 1196 HB3 LYS 24 HB3 LYS 24 -8.782 17.243 -9.341 1197 HG2 LYS 24 HG2 LYS 24 -8.172 17.087 -11.922 1198 HG3 LYS 24 HG3 LYS 24 -9.019 15.547 -11.754 1199 HD2 LYS 24 HD2 LYS 24 -10.781 17.062 -10.492 1200 HD3 LYS 24 HD3 LYS 24 -10.046 18.327 -11.479 1201 HE2 LYS 24 HE2 LYS 24 -10.403 16.667 -13.433 1202 HE3 LYS 24 HE3 LYS 24 -11.542 15.880 -12.342 1203 HZ1 LYS 24 HZ1 LYS 24 -12.581 18.157 -12.096 1204 HZ2 LYS 24 HZ2 LYS 24 -11.661 18.625 -13.437 1205 HZ3 LYS 24 HZ3 LYS 24 -12.803 17.386 -13.586 1206 H ASN 25 H ASN 25 -5.163 18.275 -9.540 1207 HA ASN 25 HA ASN 25 -4.237 19.475 -7.843 1208 HB2 ASN 25 HB2 ASN 25 -7.031 19.067 -6.777 1209 HB3 ASN 25 HB3 ASN 25 -5.836 20.059 -5.945 1210 HD21 ASN 25 HD21 ASN 25 -5.556 22.101 -6.571 1211 HD22 ASN 25 HD22 ASN 25 -6.299 22.827 -7.952 1212 H ALA 26 H ALA 26 -3.719 16.686 -7.845 1213 HA ALA 26 HA ALA 26 -4.019 15.458 -5.341 1214 HB1 ALA 26 HB1 ALA 26 -3.230 14.485 -7.612 1215 HB2 ALA 26 HB2 ALA 26 -1.622 14.949 -7.055 1216 HB3 ALA 26 HB3 ALA 26 -2.589 13.813 -6.113 1217 H TYR 27 H TYR 27 -0.998 16.830 -6.657 1218 HA TYR 27 HA TYR 27 -0.092 17.296 -3.909 1219 HB2 TYR 27 HB2 TYR 27 1.243 16.098 -5.882 1220 HB3 TYR 27 HB3 TYR 27 1.702 17.758 -6.243 1221 HD1 TYR 27 HD1 TYR 27 1.902 18.890 -3.512 1222 HD2 TYR 27 HD2 TYR 27 3.204 15.142 -5.048 1223 HE1 TYR 27 HE1 TYR 27 3.641 18.790 -1.776 1224 HE2 TYR 27 HE2 TYR 27 4.946 15.030 -3.315 1225 HH TYR 27 HH TYR 27 5.786 15.978 -1.485 1226 H LYS 28 H LYS 28 -0.834 19.215 -3.213 1227 HA LYS 28 HA LYS 28 -1.204 21.487 -4.876 1228 HB2 LYS 28 HB2 LYS 28 -1.204 21.046 -1.903 1229 HB3 LYS 28 HB3 LYS 28 -1.323 22.669 -2.570 1230 HG2 LYS 28 HG2 LYS 28 -3.194 20.476 -3.400 1231 HG3 LYS 28 HG3 LYS 28 -3.491 21.477 -1.976 1232 HD2 LYS 28 HD2 LYS 28 -2.863 22.825 -4.556 1233 HD3 LYS 28 HD3 LYS 28 -4.468 22.123 -4.343 1234 HE2 LYS 28 HE2 LYS 28 -3.302 23.898 -2.235 1235 HE3 LYS 28 HE3 LYS 28 -4.044 24.599 -3.672 1236 HZ1 LYS 28 HZ1 LYS 28 -5.279 23.345 -1.397 1237 HZ2 LYS 28 HZ2 LYS 28 -5.931 24.428 -2.522 1238 HZ3 LYS 28 HZ3 LYS 28 -5.872 22.775 -2.876 1239 H LYS 29 H LYS 29 -0.172 23.659 -3.822 1240 HA LYS 29 HA LYS 29 2.713 23.313 -4.200 1241 HB2 LYS 29 HB2 LYS 29 2.645 25.846 -4.466 1242 HB3 LYS 29 HB3 LYS 29 1.857 24.900 -5.723 1243 HG2 LYS 29 HG2 LYS 29 -0.217 25.629 -5.168 1244 HG3 LYS 29 HG3 LYS 29 0.179 25.799 -3.456 1245 HD2 LYS 29 HD2 LYS 29 1.583 27.782 -4.070 1246 HD3 LYS 29 HD3 LYS 29 0.937 27.655 -5.709 1247 HE2 LYS 29 HE2 LYS 29 -1.313 27.993 -4.879 1248 HE3 LYS 29 HE3 LYS 29 -0.726 28.013 -3.217 1249 HZ1 LYS 29 HZ1 LYS 29 -1.163 30.234 -4.374 1250 HZ2 LYS 29 HZ2 LYS 29 0.284 30.063 -3.515 1251 HZ3 LYS 29 HZ3 LYS 29 0.284 29.948 -5.203 1252 H GLY 30 H GLY 30 3.599 22.842 -2.253 1253 HA2 GLY 30 HA2 GLY 30 3.615 24.952 -0.269 1254 HA3 GLY 30 HA3 GLY 30 2.872 23.453 0.268 1255 H GLU 31 H GLU 31 5.578 23.610 -1.960 1256 HA GLU 31 HA GLU 31 7.265 22.390 0.126 1257 HB2 GLU 31 HB2 GLU 31 8.445 21.210 -1.661 1258 HB3 GLU 31 HB3 GLU 31 6.728 20.833 -1.687 1259 HG2 GLU 31 HG2 GLU 31 7.850 22.989 -3.429 1260 HG3 GLU 31 HG3 GLU 31 7.937 21.294 -3.907 1261 H1 TYR 1 H TYR 1 7.725 14.212 -6.528 1262 HA TYR 1 HA TYR 1 7.004 11.656 -7.736 1263 HB2 TYR 1 HB2 TYR 1 6.826 12.502 -4.839 1264 HB3 TYR 1 HB3 TYR 1 6.681 10.865 -5.467 1265 HD1 TYR 1 HD1 TYR 1 9.025 13.650 -4.870 1266 HD2 TYR 1 HD2 TYR 1 8.615 9.564 -5.983 1267 HE1 TYR 1 HE1 TYR 1 11.450 13.340 -4.601 1268 HE2 TYR 1 HE2 TYR 1 11.039 9.243 -5.716 1269 HH TYR 1 HH TYR 1 13.073 10.519 -5.689 1270 H GLY 2 H GLY 2 5.492 13.946 -8.517 1271 HA2 GLY 2 HA2 GLY 2 3.030 14.040 -7.061 1272 HA3 GLY 2 HA3 GLY 2 3.330 14.740 -8.644 1273 H GLY 3 H GLY 3 1.086 13.968 -9.000 1274 HA2 GLY 3 HA2 GLY 3 -0.393 12.505 -9.969 1275 HA3 GLY 3 HA3 GLY 3 1.025 11.741 -10.671 1276 H PHE 4 H PHE 4 0.267 9.652 -10.475 1277 HA PHE 4 HA PHE 4 -0.682 8.642 -7.954 1278 HB2 PHE 4 HB2 PHE 4 -0.271 7.532 -10.688 1279 HB3 PHE 4 HB3 PHE 4 -0.331 6.398 -9.343 1280 HD1 PHE 4 HD1 PHE 4 -2.358 5.305 -9.790 1281 HD2 PHE 4 HD2 PHE 4 -2.230 9.557 -9.640 1282 HE1 PHE 4 HE1 PHE 4 -4.817 5.378 -9.841 1283 HE2 PHE 4 HE2 PHE 4 -4.688 9.637 -9.689 1284 HZ PHE 4 HZ PHE 4 -5.985 7.545 -9.789 1285 H MET 5 H MET 5 0.308 6.815 -6.840 1286 HA MET 5 HA MET 5 3.242 6.773 -7.099 1287 HB2 MET 5 HB2 MET 5 2.715 8.085 -5.149 1288 HB3 MET 5 HB3 MET 5 1.594 6.861 -4.569 1289 HG2 MET 5 HG2 MET 5 3.703 6.835 -3.340 1290 HG3 MET 5 HG3 MET 5 3.414 5.320 -4.193 1291 HE1 MET 5 HE1 MET 5 5.964 5.572 -3.067 1292 HE2 MET 5 HE2 MET 5 6.100 4.425 -4.400 1293 HE3 MET 5 HE3 MET 5 7.290 5.713 -4.221 1294 H THR 6 H THR 6 3.823 4.820 -7.768 1295 HA THR 6 HA THR 6 2.246 2.489 -6.935 1296 HB THR 6 HB THR 6 4.215 2.863 -9.192 1297 HG1 THR 6 HG1 THR 6 2.213 2.148 -10.338 1298 HG21 THR 6 HG21 THR 6 4.558 0.645 -8.264 1299 HG22 THR 6 HG22 THR 6 2.822 0.338 -8.294 1300 HG23 THR 6 HG23 THR 6 3.711 0.524 -9.806 1301 H SER 7 H SER 7 3.000 1.750 -5.034 1302 HA SER 7 HA SER 7 5.904 1.513 -4.668 1303 HB2 SER 7 HB2 SER 7 4.157 2.609 -2.965 1304 HB3 SER 7 HB3 SER 7 4.023 0.933 -2.433 1305 HG SER 7 HG SER 7 5.735 2.411 -1.488 1306 H GLU 8 H GLU 8 6.295 -0.357 -5.842 1307 HA GLU 8 HA GLU 8 4.987 -2.801 -4.846 1308 HB2 GLU 8 HB2 GLU 8 5.295 -1.879 -7.466 1309 HB3 GLU 8 HB3 GLU 8 6.494 -3.155 -7.297 1310 HG2 GLU 8 HG2 GLU 8 4.700 -4.364 -8.006 1311 HG3 GLU 8 HG3 GLU 8 4.487 -4.478 -6.260 1312 H LYS 9 H LYS 9 6.180 -4.147 -3.683 1313 HA LYS 9 HA LYS 9 9.114 -3.927 -3.856 1314 HB2 LYS 9 HB2 LYS 9 7.894 -3.331 -1.666 1315 HB3 LYS 9 HB3 LYS 9 7.616 -5.060 -1.504 1316 HG2 LYS 9 HG2 LYS 9 10.381 -4.030 -1.962 1317 HG3 LYS 9 HG3 LYS 9 9.663 -3.969 -0.351 1318 HD2 LYS 9 HD2 LYS 9 9.095 -6.481 -0.850 1319 HD3 LYS 9 HD3 LYS 9 10.415 -6.332 -2.013 1320 HE2 LYS 9 HE2 LYS 9 11.488 -7.073 -0.092 1321 HE3 LYS 9 HE3 LYS 9 11.738 -5.329 -0.038 1322 HZ1 LYS 9 HZ1 LYS 9 10.148 -5.079 1.626 1323 HZ2 LYS 9 HZ2 LYS 9 9.462 -6.601 1.352 1324 HZ3 LYS 9 HZ3 LYS 9 10.982 -6.478 2.084 1325 H SER 10 H SER 10 9.931 -5.540 -5.015 1326 HA SER 10 HA SER 10 9.390 -8.269 -4.281 1327 HB2 SER 10 HB2 SER 10 8.774 -8.940 -6.634 1328 HB3 SER 10 HB3 SER 10 7.536 -8.016 -5.784 1329 HG SER 10 HG SER 10 8.650 -7.455 -8.101 1330 H GLN 11 H GLN 11 11.058 -9.616 -4.796 1331 HA GLN 11 HA GLN 11 13.437 -8.342 -5.885 1332 HB2 GLN 11 HB2 GLN 11 14.585 -10.414 -5.120 1333 HB3 GLN 11 HB3 GLN 11 13.738 -9.564 -3.834 1334 HG2 GLN 11 HG2 GLN 11 12.154 -11.197 -3.602 1335 HG3 GLN 11 HG3 GLN 11 12.325 -11.751 -5.267 1336 HE21 GLN 11 HE21 GLN 11 13.777 -13.323 -5.747 1337 HE22 GLN 11 HE22 GLN 11 14.720 -14.156 -4.563 1338 H THR 12 H THR 12 11.470 -8.746 -7.800 1339 HA THR 12 HA THR 12 12.874 -10.549 -9.608 1340 HB THR 12 HB THR 12 10.287 -11.120 -10.308 1341 HG1 THR 12 HG1 THR 12 9.615 -10.164 -8.263 1342 HG21 THR 12 HG21 THR 12 11.306 -13.101 -10.281 1343 HG22 THR 12 HG22 THR 12 12.557 -12.485 -9.201 1344 HG23 THR 12 HG23 THR 12 11.070 -13.159 -8.534 1345 HA PRO 13 HA PRO 13 11.983 -7.556 -12.691 1346 HB2 PRO 13 HB2 PRO 13 11.422 -9.061 -14.880 1347 HB3 PRO 13 HB3 PRO 13 13.050 -8.911 -14.209 1348 HG2 PRO 13 HG2 PRO 13 11.049 -11.109 -13.851 1349 HG3 PRO 13 HG3 PRO 13 12.795 -11.222 -14.142 1350 HD2 PRO 13 HD2 PRO 13 11.705 -11.518 -11.681 1351 HD3 PRO 13 HD3 PRO 13 13.316 -10.815 -11.933 1352 H LEU 14 H LEU 14 9.954 -7.057 -11.385 1353 HA LEU 14 HA LEU 14 7.458 -8.030 -12.444 1354 HB2 LEU 14 HB2 LEU 14 6.411 -6.767 -10.779 1355 HB3 LEU 14 HB3 LEU 14 7.907 -7.339 -10.044 1356 HG LEU 14 HG LEU 14 7.718 -4.597 -11.248 1357 HD11 LEU 14 HD11 LEU 14 7.448 -4.624 -8.377 1358 HD12 LEU 14 HD12 LEU 14 6.473 -3.797 -9.593 1359 HD13 LEU 14 HD13 LEU 14 6.105 -5.465 -9.152 1360 HD21 LEU 14 HD21 LEU 14 9.937 -5.168 -10.787 1361 HD22 LEU 14 HD22 LEU 14 9.432 -4.237 -9.377 1362 HD23 LEU 14 HD23 LEU 14 9.510 -5.997 -9.290 1363 H VAL 15 H VAL 15 5.870 -5.775 -12.471 1364 HA VAL 15 HA VAL 15 6.980 -3.786 -14.233 1365 HB VAL 15 HB VAL 15 6.508 -5.681 -15.783 1366 HG11 VAL 15 HG11 VAL 15 4.264 -6.066 -14.292 1367 HG12 VAL 15 HG12 VAL 15 3.611 -5.243 -15.708 1368 HG13 VAL 15 HG13 VAL 15 4.530 -6.735 -15.902 1369 HG21 VAL 15 HG21 VAL 15 5.811 -2.959 -16.029 1370 HG22 VAL 15 HG22 VAL 15 6.237 -4.092 -17.311 1371 HG23 VAL 15 HG23 VAL 15 4.550 -3.888 -16.840 1372 H THR 16 H THR 16 5.714 -1.952 -14.380 1373 HA THR 16 HA THR 16 3.432 -1.881 -12.540 1374 HB THR 16 HB THR 16 5.069 -0.243 -11.975 1375 HG1 THR 16 HG1 THR 16 3.086 1.164 -13.455 1376 HG21 THR 16 HG21 THR 16 5.205 1.547 -14.110 1377 HG22 THR 16 HG22 THR 16 6.479 0.461 -13.557 1378 HG23 THR 16 HG23 THR 16 5.385 -0.047 -14.843 1379 H LEU 17 H LEU 17 1.524 -2.181 -13.489 1380 HA LEU 17 HA LEU 17 1.094 -1.446 -16.257 1381 HB2 LEU 17 HB2 LEU 17 0.208 -3.527 -14.964 1382 HB3 LEU 17 HB3 LEU 17 -1.058 -2.424 -14.427 1383 HG LEU 17 HG LEU 17 -1.759 -3.788 -16.340 1384 HD11 LEU 17 HD11 LEU 17 -2.352 -1.255 -15.922 1385 HD12 LEU 17 HD12 LEU 17 -1.504 -1.044 -17.454 1386 HD13 LEU 17 HD13 LEU 17 -2.911 -2.104 -17.363 1387 HD21 LEU 17 HD21 LEU 17 -0.738 -3.676 -18.455 1388 HD22 LEU 17 HD22 LEU 17 0.255 -2.293 -17.995 1389 HD23 LEU 17 HD23 LEU 17 0.589 -3.885 -17.313 1390 H PHE 18 H PHE 18 1.114 0.783 -16.331 1391 HA PHE 18 HA PHE 18 -0.922 2.182 -14.735 1392 HB2 PHE 18 HB2 PHE 18 1.778 2.867 -15.602 1393 HB3 PHE 18 HB3 PHE 18 0.609 4.128 -15.980 1394 HD1 PHE 18 HD1 PHE 18 -1.217 4.169 -13.800 1395 HD2 PHE 18 HD2 PHE 18 2.978 3.452 -13.740 1396 HE1 PHE 18 HE1 PHE 18 -1.119 4.958 -11.472 1397 HE2 PHE 18 HE2 PHE 18 3.083 4.238 -11.411 1398 HZ PHE 18 HZ PHE 18 1.033 4.992 -10.274 1399 H LYS 19 H LYS 19 -2.776 2.137 -15.869 1400 HA LYS 19 HA LYS 19 -2.678 3.035 -18.674 1401 HB2 LYS 19 HB2 LYS 19 -4.311 0.938 -17.317 1402 HB3 LYS 19 HB3 LYS 19 -5.033 1.823 -18.654 1403 HG2 LYS 19 HG2 LYS 19 -3.055 1.176 -20.040 1404 HG3 LYS 19 HG3 LYS 19 -2.543 0.136 -18.709 1405 HD2 LYS 19 HD2 LYS 19 -3.719 -1.314 -20.099 1406 HD3 LYS 19 HD3 LYS 19 -4.914 -0.869 -18.878 1407 HE2 LYS 19 HE2 LYS 19 -6.166 -0.552 -20.757 1408 HE3 LYS 19 HE3 LYS 19 -5.441 1.050 -20.623 1409 HZ1 LYS 19 HZ1 LYS 19 -3.765 -0.717 -22.089 1410 HZ2 LYS 19 HZ2 LYS 19 -5.306 -0.642 -22.783 1411 HZ3 LYS 19 HZ3 LYS 19 -4.412 0.776 -22.553 1412 H ASN 20 H ASN 20 -4.478 4.321 -19.415 1413 HA ASN 20 HA ASN 20 -5.790 6.176 -19.254 1414 HB2 ASN 20 HB2 ASN 20 -6.922 5.100 -16.693 1415 HB3 ASN 20 HB3 ASN 20 -7.748 5.917 -18.016 1416 HD21 ASN 20 HD21 ASN 20 -7.237 4.590 -20.194 1417 HD22 ASN 20 HD22 ASN 20 -7.691 2.927 -20.079 1418 H ALA 21 H ALA 21 -3.213 6.406 -18.087 1419 HA ALA 21 HA ALA 21 -3.338 7.661 -15.537 1420 HB1 ALA 21 HB1 ALA 21 -1.207 7.797 -17.667 1421 HB2 ALA 21 HB2 ALA 21 -1.029 8.362 -16.006 1422 HB3 ALA 21 HB3 ALA 21 -1.283 6.647 -16.332 1423 H ILE 22 H ILE 22 -4.522 9.451 -15.269 1424 HA ILE 22 HA ILE 22 -4.286 11.594 -17.276 1425 HB ILE 22 HB ILE 22 -6.494 11.128 -15.268 1426 HG12 ILE 22 HG12 ILE 22 -6.567 10.917 -18.284 1427 HG13 ILE 22 HG13 ILE 22 -6.404 9.536 -17.205 1428 HG21 ILE 22 HG21 ILE 22 -6.629 13.383 -15.500 1429 HG22 ILE 22 HG22 ILE 22 -5.835 13.381 -17.075 1430 HG23 ILE 22 HG23 ILE 22 -7.532 12.919 -16.942 1431 HD11 ILE 22 HD11 ILE 22 -8.632 10.985 -16.306 1432 HD12 ILE 22 HD12 ILE 22 -8.762 10.890 -18.062 1433 HD13 ILE 22 HD13 ILE 22 -8.605 9.415 -17.109 1434 H ILE 23 H ILE 23 -2.878 13.095 -16.667 1435 HA ILE 23 HA ILE 23 -2.619 13.736 -13.811 1436 HB ILE 23 HB ILE 23 -0.760 14.062 -16.143 1437 HG12 ILE 23 HG12 ILE 23 -0.749 11.989 -14.742 1438 HG13 ILE 23 HG13 ILE 23 0.783 12.856 -14.738 1439 HG21 ILE 23 HG21 ILE 23 -0.414 16.160 -15.304 1440 HG22 ILE 23 HG22 ILE 23 -0.889 15.705 -13.668 1441 HG23 ILE 23 HG23 ILE 23 0.696 15.241 -14.287 1442 HD11 ILE 23 HD11 ILE 23 -0.964 13.695 -12.583 1443 HD12 ILE 23 HD12 ILE 23 -0.601 11.969 -12.534 1444 HD13 ILE 23 HD13 ILE 23 0.712 13.146 -12.540 1445 H LYS 24 H LYS 24 -3.948 15.336 -13.243 1446 HA LYS 24 HA LYS 24 -3.991 17.752 -14.927 1447 HB2 LYS 24 HB2 LYS 24 -6.237 16.193 -13.769 1448 HB3 LYS 24 HB3 LYS 24 -6.377 17.945 -13.706 1449 HG2 LYS 24 HG2 LYS 24 -5.677 17.702 -16.258 1450 HG3 LYS 24 HG3 LYS 24 -6.422 16.118 -16.033 1451 HD2 LYS 24 HD2 LYS 24 -8.322 17.565 -14.901 1452 HD3 LYS 24 HD3 LYS 24 -7.643 18.831 -15.928 1453 HE2 LYS 24 HE2 LYS 24 -7.822 17.058 -17.807 1454 HE3 LYS 24 HE3 LYS 24 -8.941 16.247 -16.712 1455 HZ1 LYS 24 HZ1 LYS 24 -10.140 18.455 -16.611 1456 HZ2 LYS 24 HZ2 LYS 24 -9.210 18.924 -17.944 1457 HZ3 LYS 24 HZ3 LYS 24 -10.259 17.602 -18.067 1458 H ASN 25 H ASN 25 -2.816 19.206 -13.850 1459 HA ASN 25 HA ASN 25 -2.033 20.551 -12.191 1460 HB2 ASN 25 HB2 ASN 25 -4.824 20.002 -11.183 1461 HB3 ASN 25 HB3 ASN 25 -3.726 21.114 -10.370 1462 HD21 ASN 25 HD21 ASN 25 -3.567 23.138 -11.090 1463 HD22 ASN 25 HD22 ASN 25 -4.314 23.742 -12.526 1464 H ALA 26 H ALA 26 -1.332 17.804 -12.040 1465 HA ALA 26 HA ALA 26 -1.626 16.680 -9.489 1466 HB1 ALA 26 HB1 ALA 26 -0.707 15.650 -11.680 1467 HB2 ALA 26 HB2 ALA 26 0.849 16.259 -11.116 1468 HB3 ALA 26 HB3 ALA 26 -0.055 15.105 -10.135 1469 H TYR 27 H TYR 27 1.336 18.194 -10.784 1470 HA TYR 27 HA TYR 27 2.118 18.853 -8.038 1471 HB2 TYR 27 HB2 TYR 27 3.594 17.648 -9.901 1472 HB3 TYR 27 HB3 TYR 27 3.955 19.314 -10.339 1473 HD1 TYR 27 HD1 TYR 27 3.977 20.590 -7.658 1474 HD2 TYR 27 HD2 TYR 27 5.598 16.881 -8.970 1475 HE1 TYR 27 HE1 TYR 27 5.660 20.699 -5.868 1476 HE2 TYR 27 HE2 TYR 27 7.285 16.980 -7.184 1477 HH TYR 27 HH TYR 27 7.992 18.070 -5.377 1478 H LYS 28 H LYS 28 1.218 20.749 -7.472 1479 HA LYS 28 HA LYS 28 0.763 22.905 -9.260 1480 HB2 LYS 28 HB2 LYS 28 0.693 22.622 -6.268 1481 HB3 LYS 28 HB3 LYS 28 0.478 24.192 -7.031 1482 HG2 LYS 28 HG2 LYS 28 -1.199 21.829 -7.800 1483 HG3 LYS 28 HG3 LYS 28 -1.612 22.861 -6.429 1484 HD2 LYS 28 HD2 LYS 28 -1.013 24.143 -9.050 1485 HD3 LYS 28 HD3 LYS 28 -2.569 23.336 -8.841 1486 HE2 LYS 28 HE2 LYS 28 -1.585 25.282 -6.792 1487 HE3 LYS 28 HE3 LYS 28 -2.344 25.862 -8.274 1488 HZ1 LYS 28 HZ1 LYS 28 -3.535 24.621 -5.969 1489 HZ2 LYS 28 HZ2 LYS 28 -4.239 25.603 -7.153 1490 HZ3 LYS 28 HZ3 LYS 28 -4.051 23.945 -7.432 1491 H LYS 29 H LYS 29 1.611 25.192 -8.263 1492 HA LYS 29 HA LYS 29 4.525 25.023 -8.543 1493 HB2 LYS 29 HB2 LYS 29 4.300 27.530 -8.935 1494 HB3 LYS 29 HB3 LYS 29 3.619 26.476 -10.167 1495 HG2 LYS 29 HG2 LYS 29 1.484 27.090 -9.714 1496 HG3 LYS 29 HG3 LYS 29 1.808 27.364 -8.001 1497 HD2 LYS 29 HD2 LYS 29 3.103 29.406 -8.667 1498 HD3 LYS 29 HD3 LYS 29 2.517 29.162 -10.315 1499 HE2 LYS 29 HE2 LYS 29 0.224 29.386 -9.563 1500 HE3 LYS 29 HE3 LYS 29 0.760 29.523 -7.889 1501 HZ1 LYS 29 HZ1 LYS 29 0.213 31.653 -9.166 1502 HZ2 LYS 29 HZ2 LYS 29 1.642 31.620 -8.260 1503 HZ3 LYS 29 HZ3 LYS 29 1.700 31.426 -9.940 1504 H GLY 30 H GLY 30 5.368 24.700 -6.547 1505 HA2 GLY 30 HA2 GLY 30 5.171 26.898 -4.667 1506 HA3 GLY 30 HA3 GLY 30 4.524 25.372 -4.082 1507 H GLU 31 H GLU 31 7.279 25.625 -6.239 1508 HA GLU 31 HA GLU 31 8.985 24.635 -4.049 1509 HB2 GLU 31 HB2 GLU 31 10.306 23.468 -5.745 1510 HB3 GLU 31 HB3 GLU 31 8.624 22.959 -5.795 1511 HG2 GLU 31 HG2 GLU 31 9.623 25.111 -7.613 1512 HG3 GLU 31 HG3 GLU 31 9.861 23.409 -8.004 Start of MODEL 7 1 H1 TYR 1 H TYR 1 -6.171 2.700 13.969 2 HA TYR 1 HA TYR 1 -8.772 1.424 13.728 3 HB2 TYR 1 HB2 TYR 1 -8.348 3.815 15.457 4 HB3 TYR 1 HB3 TYR 1 -9.299 2.365 15.759 5 HD1 TYR 1 HD1 TYR 1 -6.718 4.070 17.064 6 HD2 TYR 1 HD2 TYR 1 -7.514 0.170 15.562 7 HE1 TYR 1 HE1 TYR 1 -4.895 3.171 18.449 8 HE2 TYR 1 HE2 TYR 1 -5.694 -0.740 16.943 9 HH TYR 1 HH TYR 1 -3.360 0.611 18.031 10 H GLY 2 H GLY 2 -7.831 4.860 13.920 11 HA2 GLY 2 HA2 GLY 2 -8.792 6.714 12.948 12 HA3 GLY 2 HA3 GLY 2 -8.662 5.760 11.478 13 H GLY 3 H GLY 3 -10.500 5.679 10.384 14 HA2 GLY 3 HA2 GLY 3 -13.003 6.392 11.535 15 HA3 GLY 3 HA3 GLY 3 -12.750 5.762 9.914 16 H PHE 4 H PHE 4 -13.441 3.765 9.480 17 HA PHE 4 HA PHE 4 -14.716 2.254 11.582 18 HB2 PHE 4 HB2 PHE 4 -14.536 1.991 8.597 19 HB3 PHE 4 HB3 PHE 4 -15.135 0.651 9.569 20 HD1 PHE 4 HD1 PHE 4 -17.337 0.622 10.355 21 HD2 PHE 4 HD2 PHE 4 -15.712 4.215 8.752 22 HE1 PHE 4 HE1 PHE 4 -19.574 1.647 10.391 23 HE2 PHE 4 HE2 PHE 4 -17.946 5.245 8.787 24 HZ PHE 4 HZ PHE 4 -19.880 3.961 9.608 25 H MET 5 H MET 5 -14.160 0.215 12.308 26 HA MET 5 HA MET 5 -11.405 -0.616 11.689 27 HB2 MET 5 HB2 MET 5 -12.459 -0.001 14.125 28 HB3 MET 5 HB3 MET 5 -12.701 -1.743 14.083 29 HG2 MET 5 HG2 MET 5 -10.052 -0.448 13.516 30 HG3 MET 5 HG3 MET 5 -10.561 -0.937 15.130 31 HE1 MET 5 HE1 MET 5 -10.548 -3.463 15.990 32 HE2 MET 5 HE2 MET 5 -9.140 -4.302 15.339 33 HE3 MET 5 HE3 MET 5 -9.005 -2.620 15.851 34 H THR 6 H THR 6 -11.585 -2.090 10.090 35 HA THR 6 HA THR 6 -13.615 -4.189 10.305 36 HB THR 6 HB THR 6 -11.748 -4.029 7.981 37 HG1 THR 6 HG1 THR 6 -13.896 -2.234 8.506 38 HG21 THR 6 HG21 THR 6 -14.143 -5.395 8.651 39 HG22 THR 6 HG22 THR 6 -14.505 -4.300 7.315 40 HG23 THR 6 HG23 THR 6 -13.212 -5.489 7.156 41 H SER 7 H SER 7 -12.653 -5.399 11.984 42 HA SER 7 HA SER 7 -10.069 -6.647 11.367 43 HB2 SER 7 HB2 SER 7 -10.816 -5.508 13.676 44 HB3 SER 7 HB3 SER 7 -11.412 -7.140 13.975 45 HG SER 7 HG SER 7 -9.236 -6.847 14.662 46 H GLU 8 H GLU 8 -10.441 -8.352 10.061 47 HA GLU 8 HA GLU 8 -12.419 -10.340 10.969 48 HB2 GLU 8 HB2 GLU 8 -11.751 -9.319 8.254 49 HB3 GLU 8 HB3 GLU 8 -12.166 -11.020 8.404 50 HG2 GLU 8 HG2 GLU 8 -14.232 -10.184 8.022 51 HG3 GLU 8 HG3 GLU 8 -14.197 -10.027 9.777 52 H LYS 9 H LYS 9 -11.403 -11.991 11.887 53 HA LYS 9 HA LYS 9 -8.791 -12.824 10.827 54 HB2 LYS 9 HB2 LYS 9 -8.832 -12.227 13.211 55 HB3 LYS 9 HB3 LYS 9 -10.079 -13.435 13.495 56 HG2 LYS 9 HG2 LYS 9 -8.222 -14.999 12.381 57 HG3 LYS 9 HG3 LYS 9 -7.174 -13.764 13.082 58 HD2 LYS 9 HD2 LYS 9 -7.758 -14.296 15.235 59 HD3 LYS 9 HD3 LYS 9 -9.349 -14.901 14.768 60 HE2 LYS 9 HE2 LYS 9 -6.925 -16.360 13.835 61 HE3 LYS 9 HE3 LYS 9 -7.427 -16.539 15.515 62 HZ1 LYS 9 HZ1 LYS 9 -8.706 -17.495 13.086 63 HZ2 LYS 9 HZ2 LYS 9 -8.674 -18.176 14.634 64 HZ3 LYS 9 HZ3 LYS 9 -9.745 -16.913 14.287 65 H SER 10 H SER 10 -8.974 -14.399 9.372 66 HA SER 10 HA SER 10 -10.249 -16.875 10.091 67 HB2 SER 10 HB2 SER 10 -11.703 -16.936 8.051 68 HB3 SER 10 HB3 SER 10 -12.209 -15.743 9.247 69 HG SER 10 HG SER 10 -11.198 -14.144 7.986 70 H GLN 11 H GLN 11 -9.431 -18.603 8.970 71 HA GLN 11 HA GLN 11 -7.087 -18.057 7.351 72 HB2 GLN 11 HB2 GLN 11 -6.716 -20.501 7.496 73 HB3 GLN 11 HB3 GLN 11 -6.884 -19.743 9.074 74 HG2 GLN 11 HG2 GLN 11 -9.130 -20.555 9.289 75 HG3 GLN 11 HG3 GLN 11 -9.104 -21.181 7.641 76 HE21 GLN 11 HE21 GLN 11 -7.026 -22.625 7.311 77 HE22 GLN 11 HE22 GLN 11 -6.838 -23.861 8.503 78 H THR 12 H THR 12 -9.414 -17.275 6.067 79 HA THR 12 HA THR 12 -9.324 -19.009 3.725 80 HB THR 12 HB THR 12 -12.001 -18.395 3.767 81 HG1 THR 12 HG1 THR 12 -11.379 -19.348 6.370 82 HG21 THR 12 HG21 THR 12 -10.324 -20.751 4.066 83 HG22 THR 12 HG22 THR 12 -11.880 -20.930 4.876 84 HG23 THR 12 HG23 THR 12 -11.821 -20.541 3.157 85 HA PRO 13 HA PRO 13 -9.477 -15.259 1.451 86 HB2 PRO 13 HB2 PRO 13 -10.934 -15.957 -0.731 87 HB3 PRO 13 HB3 PRO 13 -9.280 -16.520 -0.460 88 HG2 PRO 13 HG2 PRO 13 -11.870 -17.933 0.049 89 HG3 PRO 13 HG3 PRO 13 -10.374 -18.561 -0.668 90 HD2 PRO 13 HD2 PRO 13 -11.054 -19.014 1.914 91 HD3 PRO 13 HD3 PRO 13 -9.367 -18.858 1.384 92 H LEU 14 H LEU 14 -10.723 -13.991 2.909 93 HA LEU 14 HA LEU 14 -13.616 -13.961 2.559 94 HB2 LEU 14 HB2 LEU 14 -13.718 -12.610 4.481 95 HB3 LEU 14 HB3 LEU 14 -12.492 -13.832 4.811 96 HG LEU 14 HG LEU 14 -11.683 -11.130 3.810 97 HD11 LEU 14 HD11 LEU 14 -11.356 -10.951 6.512 98 HD12 LEU 14 HD12 LEU 14 -12.654 -10.189 5.592 99 HD13 LEU 14 HD13 LEU 14 -12.927 -11.741 6.384 100 HD21 LEU 14 HD21 LEU 14 -9.832 -12.481 3.865 101 HD22 LEU 14 HD22 LEU 14 -9.789 -11.811 5.496 102 HD23 LEU 14 HD23 LEU 14 -10.429 -13.432 5.226 103 H VAL 15 H VAL 15 -14.098 -11.255 3.104 104 HA VAL 15 HA VAL 15 -12.726 -9.530 1.309 105 HB VAL 15 HB VAL 15 -13.859 -10.805 -0.410 106 HG11 VAL 15 HG11 VAL 15 -16.011 -10.800 1.487 107 HG12 VAL 15 HG12 VAL 15 -16.573 -10.179 -0.066 108 HG13 VAL 15 HG13 VAL 15 -15.813 -11.768 0.026 109 HG21 VAL 15 HG21 VAL 15 -15.623 -8.499 -0.552 110 HG22 VAL 15 HG22 VAL 15 -13.972 -8.064 -0.110 111 HG23 VAL 15 HG23 VAL 15 -14.279 -8.961 -1.597 112 H THR 16 H THR 16 -13.180 -7.436 1.751 113 HA THR 16 HA THR 16 -15.102 -6.926 3.879 114 HB THR 16 HB THR 16 -12.931 -5.958 4.226 115 HG1 THR 16 HG1 THR 16 -13.818 -4.171 4.935 116 HG21 THR 16 HG21 THR 16 -11.674 -5.313 2.504 117 HG22 THR 16 HG22 THR 16 -13.050 -5.466 1.412 118 HG23 THR 16 HG23 THR 16 -12.754 -3.943 2.250 119 H LEU 17 H LEU 17 -17.132 -6.590 3.225 120 HA LEU 17 HA LEU 17 -17.748 -5.419 0.672 121 HB2 LEU 17 HB2 LEU 17 -19.057 -7.198 2.073 122 HB3 LEU 17 HB3 LEU 17 -19.766 -5.779 2.842 123 HG LEU 17 HG LEU 17 -19.875 -6.357 -0.117 124 HD11 LEU 17 HD11 LEU 17 -22.284 -6.485 1.599 125 HD12 LEU 17 HD12 LEU 17 -21.880 -7.384 0.136 126 HD13 LEU 17 HD13 LEU 17 -21.159 -7.841 1.679 127 HD21 LEU 17 HD21 LEU 17 -20.218 -4.109 -0.044 128 HD22 LEU 17 HD22 LEU 17 -21.860 -4.646 0.311 129 HD23 LEU 17 HD23 LEU 17 -20.795 -4.136 1.622 130 H PHE 18 H PHE 18 -17.080 -3.319 0.585 131 HA PHE 18 HA PHE 18 -18.191 -1.482 2.601 132 HB2 PHE 18 HB2 PHE 18 -15.620 -1.538 1.118 133 HB3 PHE 18 HB3 PHE 18 -16.342 0.045 1.389 134 HD1 PHE 18 HD1 PHE 18 -17.380 0.128 3.961 135 HD2 PHE 18 HD2 PHE 18 -13.973 -2.042 2.617 136 HE1 PHE 18 HE1 PHE 18 -16.465 0.155 6.245 137 HE2 PHE 18 HE2 PHE 18 -13.054 -2.019 4.899 138 HZ PHE 18 HZ PHE 18 -14.300 -0.921 6.717 139 H LYS 19 H LYS 19 -20.151 -0.991 1.718 140 HA LYS 19 HA LYS 19 -20.433 -0.340 -1.074 141 HB2 LYS 19 HB2 LYS 19 -22.273 -1.438 0.042 142 HB3 LYS 19 HB3 LYS 19 -22.354 -0.164 1.252 143 HG2 LYS 19 HG2 LYS 19 -23.285 1.362 -0.236 144 HG3 LYS 19 HG3 LYS 19 -22.762 0.445 -1.650 145 HD2 LYS 19 HD2 LYS 19 -24.764 -0.621 0.327 146 HD3 LYS 19 HD3 LYS 19 -25.233 0.338 -1.079 147 HE2 LYS 19 HE2 LYS 19 -24.183 -1.300 -2.553 148 HE3 LYS 19 HE3 LYS 19 -23.679 -2.248 -1.154 149 HZ1 LYS 19 HZ1 LYS 19 -25.724 -3.065 -2.270 150 HZ2 LYS 19 HZ2 LYS 19 -25.935 -2.720 -0.627 151 HZ3 LYS 19 HZ3 LYS 19 -26.511 -1.644 -1.798 152 H ASN 20 H ASN 20 -21.575 1.578 1.687 153 HA ASN 20 HA ASN 20 -20.684 3.992 0.277 154 HB2 ASN 20 HB2 ASN 20 -23.129 3.540 1.157 155 HB3 ASN 20 HB3 ASN 20 -22.452 4.083 2.689 156 HD21 ASN 20 HD21 ASN 20 -24.491 5.331 1.072 157 HD22 ASN 20 HD22 ASN 20 -23.902 6.903 0.663 158 H ALA 21 H ALA 21 -18.565 4.207 0.866 159 HA ALA 21 HA ALA 21 -17.968 4.321 3.746 160 HB1 ALA 21 HB1 ALA 21 -16.403 2.852 3.030 161 HB2 ALA 21 HB2 ALA 21 -16.414 3.474 1.380 162 HB3 ALA 21 HB3 ALA 21 -15.528 4.332 2.640 163 H ILE 22 H ILE 22 -18.057 6.326 4.517 164 HA ILE 22 HA ILE 22 -16.873 8.491 2.905 165 HB ILE 22 HB ILE 22 -19.214 8.764 4.793 166 HG12 ILE 22 HG12 ILE 22 -19.137 8.888 1.770 167 HG13 ILE 22 HG13 ILE 22 -19.798 7.559 2.716 168 HG21 ILE 22 HG21 ILE 22 -17.363 10.662 3.805 169 HG22 ILE 22 HG22 ILE 22 -18.906 10.953 3.002 170 HG23 ILE 22 HG23 ILE 22 -18.817 10.945 4.763 171 HD11 ILE 22 HD11 ILE 22 -21.013 9.984 3.573 172 HD12 ILE 22 HD12 ILE 22 -21.104 9.882 1.814 173 HD13 ILE 22 HD13 ILE 22 -21.752 8.578 2.808 174 H ILE 23 H ILE 23 -15.112 9.292 3.820 175 HA ILE 23 HA ILE 23 -14.767 9.024 6.723 176 HB ILE 23 HB ILE 23 -12.774 9.446 4.502 177 HG12 ILE 23 HG12 ILE 23 -13.585 7.137 4.915 178 HG13 ILE 23 HG13 ILE 23 -11.867 7.320 5.254 179 HG21 ILE 23 HG21 ILE 23 -11.870 10.808 6.144 180 HG22 ILE 23 HG22 ILE 23 -12.468 9.794 7.457 181 HG23 ILE 23 HG23 ILE 23 -11.108 9.251 6.473 182 HD11 ILE 23 HD11 ILE 23 -12.472 7.575 7.669 183 HD12 ILE 23 HD12 ILE 23 -14.120 7.126 7.230 184 HD13 ILE 23 HD13 ILE 23 -12.798 5.987 6.973 185 H LYS 24 H LYS 24 -15.215 10.753 7.902 186 HA LYS 24 HA LYS 24 -14.583 13.411 6.802 187 HB2 LYS 24 HB2 LYS 24 -17.104 12.642 7.086 188 HB3 LYS 24 HB3 LYS 24 -16.814 13.097 8.760 189 HG2 LYS 24 HG2 LYS 24 -15.934 15.311 7.752 190 HG3 LYS 24 HG3 LYS 24 -16.824 14.809 6.312 191 HD2 LYS 24 HD2 LYS 24 -18.008 15.062 9.076 192 HD3 LYS 24 HD3 LYS 24 -18.144 16.278 7.803 193 HE2 LYS 24 HE2 LYS 24 -19.103 14.321 6.394 194 HE3 LYS 24 HE3 LYS 24 -19.362 13.547 7.957 195 HZ1 LYS 24 HZ1 LYS 24 -21.110 15.198 6.783 196 HZ2 LYS 24 HZ2 LYS 24 -21.039 14.926 8.451 197 HZ3 LYS 24 HZ3 LYS 24 -20.283 16.284 7.783 198 H ASN 25 H ASN 25 -12.707 13.795 7.875 199 HA ASN 25 HA ASN 25 -11.312 14.353 9.583 200 HB2 ASN 25 HB2 ASN 25 -13.645 14.503 11.464 201 HB3 ASN 25 HB3 ASN 25 -12.207 15.517 11.395 202 HD21 ASN 25 HD21 ASN 25 -15.378 15.617 10.980 203 HD22 ASN 25 HD22 ASN 25 -15.512 16.819 9.747 204 H ALA 26 H ALA 26 -11.760 11.611 9.094 205 HA ALA 26 HA ALA 26 -12.312 10.055 11.339 206 HB1 ALA 26 HB1 ALA 26 -12.186 8.912 9.306 207 HB2 ALA 26 HB2 ALA 26 -10.603 9.585 8.919 208 HB3 ALA 26 HB3 ALA 26 -10.758 8.371 10.189 209 H TYR 27 H TYR 27 -9.035 10.677 10.071 210 HA TYR 27 HA TYR 27 -7.967 10.266 12.758 211 HB2 TYR 27 HB2 TYR 27 -6.999 9.110 10.721 212 HB3 TYR 27 HB3 TYR 27 -6.403 10.685 10.210 213 HD1 TYR 27 HD1 TYR 27 -4.407 11.571 11.100 214 HD2 TYR 27 HD2 TYR 27 -6.184 8.157 12.913 215 HE1 TYR 27 HE1 TYR 27 -2.392 11.260 12.475 216 HE2 TYR 27 HE2 TYR 27 -4.174 7.837 14.293 217 HH TYR 27 HH TYR 27 -2.270 9.411 15.167 218 H LYS 28 H LYS 28 -6.877 11.798 13.910 219 HA LYS 28 HA LYS 28 -6.643 14.480 12.724 220 HB2 LYS 28 HB2 LYS 28 -7.549 13.947 15.557 221 HB3 LYS 28 HB3 LYS 28 -7.454 15.506 14.749 222 HG2 LYS 28 HG2 LYS 28 -9.283 13.269 13.908 223 HG3 LYS 28 HG3 LYS 28 -9.755 14.611 14.952 224 HD2 LYS 28 HD2 LYS 28 -8.473 15.274 12.358 225 HD3 LYS 28 HD3 LYS 28 -10.126 14.657 12.317 226 HE2 LYS 28 HE2 LYS 28 -9.254 16.950 14.063 227 HE3 LYS 28 HE3 LYS 28 -9.897 17.163 12.435 228 HZ1 LYS 28 HZ1 LYS 28 -11.866 17.237 13.449 229 HZ2 LYS 28 HZ2 LYS 28 -11.730 15.558 13.605 230 HZ3 LYS 28 HZ3 LYS 28 -11.277 16.566 14.886 231 H LYS 29 H LYS 29 -5.120 15.892 13.887 232 HA LYS 29 HA LYS 29 -2.994 14.348 15.222 233 HB2 LYS 29 HB2 LYS 29 -2.662 15.317 12.780 234 HB3 LYS 29 HB3 LYS 29 -2.337 16.805 13.659 235 HG2 LYS 29 HG2 LYS 29 -0.926 14.301 14.449 236 HG3 LYS 29 HG3 LYS 29 -0.392 15.196 13.025 237 HD2 LYS 29 HD2 LYS 29 0.335 16.980 14.251 238 HD3 LYS 29 HD3 LYS 29 -0.863 16.732 15.523 239 HE2 LYS 29 HE2 LYS 29 0.547 14.529 15.917 240 HE3 LYS 29 HE3 LYS 29 1.813 15.487 15.152 241 HZ1 LYS 29 HZ1 LYS 29 0.967 15.588 17.797 242 HZ2 LYS 29 HZ2 LYS 29 2.120 16.570 17.042 243 HZ3 LYS 29 HZ3 LYS 29 0.498 17.051 17.088 244 H GLY 30 H GLY 30 -4.715 17.405 14.973 245 HA2 GLY 30 HA2 GLY 30 -3.864 18.016 17.719 246 HA3 GLY 30 HA3 GLY 30 -3.659 19.239 16.474 247 H GLU 31 H GLU 31 -6.057 18.759 15.046 248 HA GLU 31 HA GLU 31 -8.217 19.473 14.997 249 HB2 GLU 31 HB2 GLU 31 -8.216 17.432 16.699 250 HB3 GLU 31 HB3 GLU 31 -8.643 18.696 17.843 251 HG2 GLU 31 HG2 GLU 31 -10.159 18.541 15.297 252 HG3 GLU 31 HG3 GLU 31 -10.473 17.328 16.537 253 H1 TYR 1 H TYR 1 -3.435 4.426 10.189 254 HA TYR 1 HA TYR 1 -5.957 2.997 9.965 255 HB2 TYR 1 HB2 TYR 1 -5.696 5.474 11.602 256 HB3 TYR 1 HB3 TYR 1 -6.567 3.985 11.950 257 HD1 TYR 1 HD1 TYR 1 -4.153 5.874 13.269 258 HD2 TYR 1 HD2 TYR 1 -4.614 1.902 11.817 259 HE1 TYR 1 HE1 TYR 1 -2.304 5.137 14.714 260 HE2 TYR 1 HE2 TYR 1 -2.768 1.154 13.259 261 HH TYR 1 HH TYR 1 -0.570 2.700 14.383 262 H GLY 2 H GLY 2 -5.225 6.487 10.049 263 HA2 GLY 2 HA2 GLY 2 -6.286 8.243 8.998 264 HA3 GLY 2 HA3 GLY 2 -6.037 7.261 7.562 265 H GLY 3 H GLY 3 -7.824 7.011 6.410 266 HA2 GLY 3 HA2 GLY 3 -10.410 7.595 7.434 267 HA3 GLY 3 HA3 GLY 3 -10.054 6.903 5.859 268 H PHE 4 H PHE 4 -10.722 4.894 5.509 269 HA PHE 4 HA PHE 4 -11.915 3.393 7.654 270 HB2 PHE 4 HB2 PHE 4 -11.670 3.021 4.688 271 HB3 PHE 4 HB3 PHE 4 -12.193 1.680 5.701 272 HD1 PHE 4 HD1 PHE 4 -14.398 1.538 6.471 273 HD2 PHE 4 HD2 PHE 4 -12.994 5.161 4.733 274 HE1 PHE 4 HE1 PHE 4 -16.699 2.411 6.441 275 HE2 PHE 4 HE2 PHE 4 -15.292 6.040 4.701 276 HZ PHE 4 HZ PHE 4 -17.148 4.665 5.557 277 H MET 5 H MET 5 -11.273 1.401 8.457 278 HA MET 5 HA MET 5 -8.461 0.709 7.933 279 HB2 MET 5 HB2 MET 5 -9.589 1.366 10.320 280 HB3 MET 5 HB3 MET 5 -9.749 -0.385 10.349 281 HG2 MET 5 HG2 MET 5 -7.152 1.008 9.775 282 HG3 MET 5 HG3 MET 5 -7.671 0.567 11.400 283 HE1 MET 5 HE1 MET 5 -7.523 -1.915 12.379 284 HE2 MET 5 HE2 MET 5 -6.061 -2.696 11.778 285 HE3 MET 5 HE3 MET 5 -6.033 -0.987 12.210 286 H THR 6 H THR 6 -8.525 -0.837 6.394 287 HA THR 6 HA THR 6 -10.447 -3.030 6.648 288 HB THR 6 HB THR 6 -8.514 -2.880 4.379 289 HG1 THR 6 HG1 THR 6 -10.763 -1.172 4.751 290 HG21 THR 6 HG21 THR 6 -10.864 -4.329 5.035 291 HG22 THR 6 HG22 THR 6 -11.231 -3.314 3.639 292 HG23 THR 6 HG23 THR 6 -9.879 -4.445 3.576 293 H SER 7 H SER 7 -9.517 -4.164 8.376 294 HA SER 7 HA SER 7 -6.837 -5.275 7.924 295 HB2 SER 7 HB2 SER 7 -7.749 -4.116 10.159 296 HB3 SER 7 HB3 SER 7 -8.284 -5.765 10.479 297 HG SER 7 HG SER 7 -6.162 -5.350 11.263 298 H GLU 8 H GLU 8 -7.065 -7.024 6.640 299 HA GLU 8 HA GLU 8 -8.967 -9.098 7.517 300 HB2 GLU 8 HB2 GLU 8 -8.236 -8.105 4.810 301 HB3 GLU 8 HB3 GLU 8 -8.547 -9.827 4.983 302 HG2 GLU 8 HG2 GLU 8 -10.644 -9.146 4.494 303 HG3 GLU 8 HG3 GLU 8 -10.698 -8.927 6.242 304 H LYS 9 H LYS 9 -7.940 -10.710 8.482 305 HA LYS 9 HA LYS 9 -5.221 -11.400 7.597 306 HB2 LYS 9 HB2 LYS 9 -5.522 -10.764 9.987 307 HB3 LYS 9 HB3 LYS 9 -6.602 -12.138 10.184 308 HG2 LYS 9 HG2 LYS 9 -4.508 -13.441 9.211 309 HG3 LYS 9 HG3 LYS 9 -3.654 -12.061 9.906 310 HD2 LYS 9 HD2 LYS 9 -4.246 -12.606 12.056 311 HD3 LYS 9 HD3 LYS 9 -5.716 -13.444 11.554 312 HE2 LYS 9 HE2 LYS 9 -3.076 -14.566 10.749 313 HE3 LYS 9 HE3 LYS 9 -3.610 -14.771 12.416 314 HZ1 LYS 9 HZ1 LYS 9 -4.647 -15.963 9.976 315 HZ2 LYS 9 HZ2 LYS 9 -4.580 -16.591 11.546 316 HZ3 LYS 9 HZ3 LYS 9 -5.804 -15.502 11.122 317 H SER 10 H SER 10 -5.217 -13.008 6.170 318 HA SER 10 HA SER 10 -6.410 -15.537 6.845 319 HB2 SER 10 HB2 SER 10 -7.720 -15.706 4.719 320 HB3 SER 10 HB3 SER 10 -8.361 -14.512 5.848 321 HG SER 10 HG SER 10 -7.344 -12.895 4.619 322 H GLN 11 H GLN 11 -5.393 -17.227 5.856 323 HA GLN 11 HA GLN 11 -2.998 -16.576 4.356 324 HB2 GLN 11 HB2 GLN 11 -2.479 -18.985 4.610 325 HB3 GLN 11 HB3 GLN 11 -2.788 -18.188 6.146 326 HG2 GLN 11 HG2 GLN 11 -4.984 -19.141 6.266 327 HG3 GLN 11 HG3 GLN 11 -4.824 -19.814 4.644 328 HE21 GLN 11 HE21 GLN 11 -2.652 -21.134 4.474 329 HE22 GLN 11 HE22 GLN 11 -2.450 -22.316 5.718 330 H THR 12 H THR 12 -5.335 -16.020 2.936 331 HA THR 12 HA THR 12 -4.962 -17.788 0.648 332 HB THR 12 HB THR 12 -7.687 -17.411 0.544 333 HG1 THR 12 HG1 THR 12 -7.114 -18.288 3.185 334 HG21 THR 12 HG21 THR 12 -5.821 -19.600 0.935 335 HG22 THR 12 HG22 THR 12 -7.377 -19.914 1.704 336 HG23 THR 12 HG23 THR 12 -7.304 -19.541 -0.018 337 HA PRO 13 HA PRO 13 -5.363 -14.138 -1.755 338 HB2 PRO 13 HB2 PRO 13 -6.723 -14.996 -3.942 339 HB3 PRO 13 HB3 PRO 13 -5.040 -15.434 -3.625 340 HG2 PRO 13 HG2 PRO 13 -7.534 -17.012 -3.123 341 HG3 PRO 13 HG3 PRO 13 -5.984 -17.552 -3.794 342 HD2 PRO 13 HD2 PRO 13 -6.682 -17.981 -1.213 343 HD3 PRO 13 HD3 PRO 13 -5.000 -17.721 -1.717 344 H LEU 14 H LEU 14 -6.714 -12.897 -0.385 345 HA LEU 14 HA LEU 14 -9.598 -13.088 -0.776 346 HB2 LEU 14 HB2 LEU 14 -9.831 -11.684 1.098 347 HB3 LEU 14 HB3 LEU 14 -8.538 -12.816 1.490 348 HG LEU 14 HG LEU 14 -7.877 -10.100 0.421 349 HD11 LEU 14 HD11 LEU 14 -7.624 -9.815 3.121 350 HD12 LEU 14 HD12 LEU 14 -8.947 -9.168 2.150 351 HD13 LEU 14 HD13 LEU 14 -9.139 -10.709 2.988 352 HD21 LEU 14 HD21 LEU 14 -5.956 -11.356 0.556 353 HD22 LEU 14 HD22 LEU 14 -5.975 -10.593 2.146 354 HD23 LEU 14 HD23 LEU 14 -6.515 -12.261 1.963 355 H VAL 15 H VAL 15 -10.251 -10.390 -0.306 356 HA VAL 15 HA VAL 15 -8.974 -8.637 -2.138 357 HB VAL 15 HB VAL 15 -9.993 -10.042 -3.831 358 HG11 VAL 15 HG11 VAL 15 -12.182 -10.093 -1.974 359 HG12 VAL 15 HG12 VAL 15 -12.743 -9.572 -3.563 360 HG13 VAL 15 HG13 VAL 15 -11.892 -11.107 -3.388 361 HG21 VAL 15 HG21 VAL 15 -11.886 -7.851 -4.084 362 HG22 VAL 15 HG22 VAL 15 -10.272 -7.304 -3.627 363 HG23 VAL 15 HG23 VAL 15 -10.497 -8.267 -5.088 364 H THR 16 H THR 16 -9.610 -6.558 -1.819 365 HA THR 16 HA THR 16 -11.590 -6.117 0.278 366 HB THR 16 HB THR 16 -9.499 -4.996 0.641 367 HG1 THR 16 HG1 THR 16 -10.514 -3.246 1.266 368 HG21 THR 16 HG21 THR 16 -8.243 -4.336 -1.075 369 HG22 THR 16 HG22 THR 16 -9.582 -4.600 -2.191 370 HG23 THR 16 HG23 THR 16 -9.394 -3.039 -1.393 371 H LEU 17 H LEU 17 -13.624 -5.913 -0.411 372 HA LEU 17 HA LEU 17 -14.262 -4.876 -3.017 373 HB2 LEU 17 HB2 LEU 17 -15.486 -6.681 -1.570 374 HB3 LEU 17 HB3 LEU 17 -16.297 -5.281 -0.871 375 HG LEU 17 HG LEU 17 -16.308 -5.978 -3.807 376 HD11 LEU 17 HD11 LEU 17 -18.750 -6.183 -2.152 377 HD12 LEU 17 HD12 LEU 17 -18.238 -7.131 -3.548 378 HD13 LEU 17 HD13 LEU 17 -17.544 -7.455 -1.959 379 HD21 LEU 17 HD21 LEU 17 -16.789 -3.755 -3.832 380 HD22 LEU 17 HD22 LEU 17 -18.402 -4.376 -3.483 381 HD23 LEU 17 HD23 LEU 17 -17.397 -3.752 -2.176 382 H PHE 18 H PHE 18 -13.714 -2.742 -3.162 383 HA PHE 18 HA PHE 18 -14.976 -0.909 -1.234 384 HB2 PHE 18 HB2 PHE 18 -12.376 -0.861 -2.664 385 HB3 PHE 18 HB3 PHE 18 -13.196 0.684 -2.469 386 HD1 PHE 18 HD1 PHE 18 -14.289 0.807 0.075 387 HD2 PHE 18 HD2 PHE 18 -10.738 -1.217 -1.114 388 HE1 PHE 18 HE1 PHE 18 -13.428 0.974 2.374 389 HE2 PHE 18 HE2 PHE 18 -9.872 -1.053 1.183 390 HZ PHE 18 HZ PHE 18 -11.218 0.043 2.931 391 H LYS 19 H LYS 19 -16.943 -0.567 -2.169 392 HA LYS 19 HA LYS 19 -17.211 -0.035 -4.987 393 HB2 LYS 19 HB2 LYS 19 -19.004 -1.194 -3.852 394 HB3 LYS 19 HB3 LYS 19 -19.182 0.124 -2.701 395 HG2 LYS 19 HG2 LYS 19 -20.181 1.522 -4.262 396 HG3 LYS 19 HG3 LYS 19 -19.561 0.596 -5.631 397 HD2 LYS 19 HD2 LYS 19 -21.543 -0.532 -3.667 398 HD3 LYS 19 HD3 LYS 19 -22.032 0.340 -5.122 399 HE2 LYS 19 HE2 LYS 19 -20.833 -1.278 -6.501 400 HE3 LYS 19 HE3 LYS 19 -20.309 -2.136 -5.053 401 HZ1 LYS 19 HZ1 LYS 19 -22.263 -3.128 -6.193 402 HZ2 LYS 19 HZ2 LYS 19 -22.540 -2.743 -4.569 403 HZ3 LYS 19 HZ3 LYS 19 -23.156 -1.748 -5.791 404 H ASN 20 H ASN 20 -18.531 1.919 -2.336 405 HA ASN 20 HA ASN 20 -17.741 4.324 -3.817 406 HB2 ASN 20 HB2 ASN 20 -20.175 3.765 -2.971 407 HB3 ASN 20 HB3 ASN 20 -19.566 4.406 -1.448 408 HD21 ASN 20 HD21 ASN 20 -21.635 5.470 -3.157 409 HD22 ASN 20 HD22 ASN 20 -21.127 7.057 -3.616 410 H ALA 21 H ALA 21 -15.656 4.697 -3.194 411 HA ALA 21 HA ALA 21 -15.130 4.948 -0.309 412 HB1 ALA 21 HB1 ALA 21 -13.463 3.554 -0.935 413 HB2 ALA 21 HB2 ALA 21 -13.478 4.108 -2.609 414 HB3 ALA 21 HB3 ALA 21 -12.671 5.069 -1.370 415 H ILE 22 H ILE 22 -15.357 6.970 0.383 416 HA ILE 22 HA ILE 22 -14.268 9.143 -1.283 417 HB ILE 22 HB ILE 22 -16.663 9.345 0.546 418 HG12 ILE 22 HG12 ILE 22 -16.529 9.353 -2.477 419 HG13 ILE 22 HG13 ILE 22 -17.131 8.026 -1.490 420 HG21 ILE 22 HG21 ILE 22 -14.909 11.311 -0.489 421 HG22 ILE 22 HG22 ILE 22 -16.454 11.477 -1.323 422 HG23 ILE 22 HG23 ILE 22 -16.392 11.543 0.438 423 HD11 ILE 22 HD11 ILE 22 -18.502 10.411 -0.761 424 HD12 ILE 22 HD12 ILE 22 -18.551 10.227 -2.514 425 HD13 ILE 22 HD13 ILE 22 -19.143 8.931 -1.475 426 H ILE 23 H ILE 23 -12.579 10.079 -0.363 427 HA ILE 23 HA ILE 23 -12.284 9.939 2.555 428 HB ILE 23 HB ILE 23 -10.272 10.400 0.360 429 HG12 ILE 23 HG12 ILE 23 -10.942 8.064 0.837 430 HG13 ILE 23 HG13 ILE 23 -9.251 8.365 1.223 431 HG21 ILE 23 HG21 ILE 23 -9.488 11.875 1.967 432 HG22 ILE 23 HG22 ILE 23 -10.052 10.875 3.306 433 HG23 ILE 23 HG23 ILE 23 -8.641 10.382 2.370 434 HD11 ILE 23 HD11 ILE 23 -9.965 8.676 3.608 435 HD12 ILE 23 HD12 ILE 23 -11.555 8.086 3.127 436 HD13 ILE 23 HD13 ILE 23 -10.142 7.043 2.965 437 H LYS 24 H LYS 24 -12.872 11.677 3.655 438 HA LYS 24 HA LYS 24 -12.376 14.329 2.471 439 HB2 LYS 24 HB2 LYS 24 -14.851 13.413 2.741 440 HB3 LYS 24 HB3 LYS 24 -14.622 13.950 4.400 441 HG2 LYS 24 HG2 LYS 24 -13.863 16.175 3.323 442 HG3 LYS 24 HG3 LYS 24 -14.685 15.563 1.886 443 HD2 LYS 24 HD2 LYS 24 -15.947 15.846 4.612 444 HD3 LYS 24 HD3 LYS 24 -16.130 17.000 3.289 445 HE2 LYS 24 HE2 LYS 24 -16.930 14.933 1.939 446 HE3 LYS 24 HE3 LYS 24 -17.177 14.205 3.526 447 HZ1 LYS 24 HZ1 LYS 24 -18.998 15.695 2.252 448 HZ2 LYS 24 HZ2 LYS 24 -18.948 15.494 3.931 449 HZ3 LYS 24 HZ3 LYS 24 -18.263 16.869 3.223 450 H ASN 25 H ASN 25 -10.549 14.868 3.561 451 HA ASN 25 HA ASN 25 -9.226 15.573 5.271 452 HB2 ASN 25 HB2 ASN 25 -11.601 15.646 7.104 453 HB3 ASN 25 HB3 ASN 25 -10.227 16.744 7.024 454 HD21 ASN 25 HD21 ASN 25 -13.389 16.631 6.548 455 HD22 ASN 25 HD22 ASN 25 -13.571 17.777 5.268 456 H ALA 26 H ALA 26 -9.499 12.791 4.877 457 HA ALA 26 HA ALA 26 -9.999 11.284 7.165 458 HB1 ALA 26 HB1 ALA 26 -9.753 10.081 5.179 459 HB2 ALA 26 HB2 ALA 26 -8.207 10.840 4.801 460 HB3 ALA 26 HB3 ALA 26 -8.314 9.664 6.111 461 H TYR 27 H TYR 27 -6.738 12.068 5.946 462 HA TYR 27 HA TYR 27 -5.712 11.823 8.670 463 HB2 TYR 27 HB2 TYR 27 -4.625 10.657 6.698 464 HB3 TYR 27 HB3 TYR 27 -4.115 12.247 6.142 465 HD1 TYR 27 HD1 TYR 27 -2.194 13.279 7.035 466 HD2 TYR 27 HD2 TYR 27 -3.813 9.842 8.950 467 HE1 TYR 27 HE1 TYR 27 -0.198 13.143 8.465 468 HE2 TYR 27 HE2 TYR 27 -1.822 9.698 10.387 469 HH TYR 27 HH TYR 27 -0.035 11.415 11.234 470 H LYS 28 H LYS 28 -4.741 13.461 9.784 471 HA LYS 28 HA LYS 28 -4.650 16.108 8.503 472 HB2 LYS 28 HB2 LYS 28 -5.581 15.624 11.335 473 HB3 LYS 28 HB3 LYS 28 -5.568 17.155 10.470 474 HG2 LYS 28 HG2 LYS 28 -7.234 14.774 9.683 475 HG3 LYS 28 HG3 LYS 28 -7.812 16.124 10.663 476 HD2 LYS 28 HD2 LYS 28 -6.518 16.761 8.067 477 HD3 LYS 28 HD3 LYS 28 -8.131 16.045 8.023 478 HE2 LYS 28 HE2 LYS 28 -7.427 18.457 9.684 479 HE3 LYS 28 HE3 LYS 28 -8.056 18.562 8.041 480 HZ1 LYS 28 HZ1 LYS 28 -10.042 18.560 9.027 481 HZ2 LYS 28 HZ2 LYS 28 -9.808 16.899 9.254 482 HZ3 LYS 28 HZ3 LYS 28 -9.435 17.984 10.498 483 H LYS 29 H LYS 29 -3.242 17.654 9.637 484 HA LYS 29 HA LYS 29 -1.057 16.299 11.079 485 HB2 LYS 29 HB2 LYS 29 -0.730 17.185 8.603 486 HB3 LYS 29 HB3 LYS 29 -0.509 18.723 9.426 487 HG2 LYS 29 HG2 LYS 29 1.024 16.338 10.349 488 HG3 LYS 29 HG3 LYS 29 1.537 17.200 8.896 489 HD2 LYS 29 HD2 LYS 29 2.140 19.072 10.055 490 HD3 LYS 29 HD3 LYS 29 0.929 18.815 11.313 491 HE2 LYS 29 HE2 LYS 29 2.447 16.712 11.834 492 HE3 LYS 29 HE3 LYS 29 3.677 17.705 11.053 493 HZ1 LYS 29 HZ1 LYS 29 2.766 17.874 13.673 494 HZ2 LYS 29 HZ2 LYS 29 3.879 18.886 12.898 495 HZ3 LYS 29 HZ3 LYS 29 2.232 19.276 12.891 496 H GLY 30 H GLY 30 -2.962 19.225 10.667 497 HA2 GLY 30 HA2 GLY 30 -2.205 20.007 13.397 498 HA3 GLY 30 HA3 GLY 30 -2.053 21.186 12.103 499 H GLU 31 H GLU 31 -4.386 20.496 10.656 500 HA GLU 31 HA GLU 31 -6.585 21.067 10.540 501 HB2 GLU 31 HB2 GLU 31 -6.488 19.103 12.328 502 HB3 GLU 31 HB3 GLU 31 -7.021 20.383 13.408 503 HG2 GLU 31 HG2 GLU 31 -8.468 20.022 10.842 504 HG3 GLU 31 HG3 GLU 31 -8.729 18.844 12.127 505 H1 TYR 1 H TYR 1 -0.751 6.176 6.413 506 HA TYR 1 HA TYR 1 -3.155 4.563 6.155 507 HB2 TYR 1 HB2 TYR 1 -3.128 7.101 7.717 508 HB3 TYR 1 HB3 TYR 1 -3.900 5.564 8.087 509 HD1 TYR 1 HD1 TYR 1 -1.683 7.662 9.427 510 HD2 TYR 1 HD2 TYR 1 -1.788 3.630 8.071 511 HE1 TYR 1 HE1 TYR 1 0.166 7.107 10.951 512 HE2 TYR 1 HE2 TYR 1 0.059 3.064 9.592 513 HH TYR 1 HH TYR 1 2.092 4.801 10.742 514 H GLY 2 H GLY 2 -2.677 8.098 6.143 515 HA2 GLY 2 HA2 GLY 2 -3.815 9.741 4.996 516 HA3 GLY 2 HA3 GLY 2 -3.473 8.723 3.605 517 H GLY 3 H GLY 3 -5.215 8.320 2.429 518 HA2 GLY 3 HA2 GLY 3 -7.854 8.776 3.376 519 HA3 GLY 3 HA3 GLY 3 -7.420 8.044 1.838 520 H PHE 4 H PHE 4 -7.977 5.992 1.561 521 HA PHE 4 HA PHE 4 -9.113 4.505 3.743 522 HB2 PHE 4 HB2 PHE 4 -8.778 4.024 0.800 523 HB3 PHE 4 HB3 PHE 4 -9.250 2.701 1.862 524 HD1 PHE 4 HD1 PHE 4 -11.464 2.464 2.578 525 HD2 PHE 4 HD2 PHE 4 -10.218 6.091 0.731 526 HE1 PHE 4 HE1 PHE 4 -13.807 3.204 2.459 527 HE2 PHE 4 HE2 PHE 4 -12.559 6.837 0.610 528 HZ PHE 4 HZ PHE 4 -14.358 5.394 1.476 529 H MET 5 H MET 5 -8.370 2.584 4.633 530 HA MET 5 HA MET 5 -5.510 2.046 4.190 531 HB2 MET 5 HB2 MET 5 -6.708 2.741 6.526 532 HB3 MET 5 HB3 MET 5 -6.786 0.988 6.631 533 HG2 MET 5 HG2 MET 5 -4.246 2.473 6.034 534 HG3 MET 5 HG3 MET 5 -4.774 2.089 7.671 535 HE1 MET 5 HE1 MET 5 -4.560 -0.353 8.764 536 HE2 MET 5 HE2 MET 5 -3.041 -1.080 8.241 537 HE3 MET 5 HE3 MET 5 -3.115 0.644 8.601 538 H THR 6 H THR 6 -5.469 0.441 2.707 539 HA THR 6 HA THR 6 -7.261 -1.848 3.022 540 HB THR 6 HB THR 6 -5.279 -1.703 0.798 541 HG1 THR 6 HG1 THR 6 -7.605 -0.076 1.035 542 HG21 THR 6 HG21 THR 6 -7.594 -3.213 1.458 543 HG22 THR 6 HG22 THR 6 -7.948 -2.285 0.000 544 HG23 THR 6 HG23 THR 6 -6.553 -3.365 0.041 545 H SER 7 H SER 7 -6.334 -2.879 4.804 546 HA SER 7 HA SER 7 -3.577 -3.838 4.488 547 HB2 SER 7 HB2 SER 7 -4.640 -2.664 6.647 548 HB3 SER 7 HB3 SER 7 -5.086 -4.332 7.005 549 HG SER 7 HG SER 7 -3.023 -3.763 7.848 550 H GLU 8 H GLU 8 -3.657 -5.638 3.254 551 HA GLU 8 HA GLU 8 -5.459 -7.795 4.140 552 HB2 GLU 8 HB2 GLU 8 -4.703 -6.842 1.426 553 HB3 GLU 8 HB3 GLU 8 -4.909 -8.574 1.644 554 HG2 GLU 8 HG2 GLU 8 -7.028 -8.045 1.068 555 HG3 GLU 8 HG3 GLU 8 -7.154 -7.780 2.806 556 H LYS 9 H LYS 9 -4.371 -9.312 5.187 557 HA LYS 9 HA LYS 9 -1.586 -9.857 4.417 558 HB2 LYS 9 HB2 LYS 9 -2.036 -9.178 6.781 559 HB3 LYS 9 HB3 LYS 9 -3.006 -10.632 6.971 560 HG2 LYS 9 HG2 LYS 9 -0.784 -11.785 6.114 561 HG3 LYS 9 HG3 LYS 9 -0.064 -10.319 6.784 562 HD2 LYS 9 HD2 LYS 9 -0.676 -10.840 8.935 563 HD3 LYS 9 HD3 LYS 9 -2.059 -11.809 8.421 564 HE2 LYS 9 HE2 LYS 9 0.685 -12.740 7.730 565 HE3 LYS 9 HE3 LYS 9 0.119 -12.933 9.388 566 HZ1 LYS 9 HZ1 LYS 9 -0.751 -14.281 6.962 567 HZ2 LYS 9 HZ2 LYS 9 -0.672 -14.854 8.552 568 HZ3 LYS 9 HZ3 LYS 9 -1.970 -13.883 8.066 569 H SER 10 H SER 10 -1.407 -11.510 3.057 570 HA SER 10 HA SER 10 -2.471 -14.085 3.753 571 HB2 SER 10 HB2 SER 10 -3.696 -14.397 1.598 572 HB3 SER 10 HB3 SER 10 -4.445 -13.205 2.660 573 HG SER 10 HG SER 10 -3.475 -11.574 1.408 574 H GLN 11 H GLN 11 -1.306 -15.728 2.858 575 HA GLN 11 HA GLN 11 1.087 -14.962 1.409 576 HB2 GLN 11 HB2 GLN 11 1.770 -17.313 1.771 577 HB3 GLN 11 HB3 GLN 11 1.344 -16.493 3.267 578 HG2 GLN 11 HG2 GLN 11 -0.773 -17.607 3.349 579 HG3 GLN 11 HG3 GLN 11 -0.515 -18.306 1.751 580 HE21 GLN 11 HE21 GLN 11 1.752 -19.468 1.681 581 HE22 GLN 11 HE22 GLN 11 1.999 -20.600 2.962 582 H THR 12 H THR 12 -1.223 -14.614 -0.107 583 HA THR 12 HA THR 12 -0.657 -16.430 -2.314 584 HB THR 12 HB THR 12 -3.398 -16.259 -2.509 585 HG1 THR 12 HG1 THR 12 -2.838 -17.003 0.176 586 HG21 THR 12 HG21 THR 12 -1.389 -18.289 -1.995 587 HG22 THR 12 HG22 THR 12 -2.938 -18.696 -1.257 588 HG23 THR 12 HG23 THR 12 -2.844 -18.372 -2.988 589 HA PRO 13 HA PRO 13 -1.259 -12.907 -4.860 590 HB2 PRO 13 HB2 PRO 13 -2.507 -13.932 -7.042 591 HB3 PRO 13 HB3 PRO 13 -0.806 -14.241 -6.675 592 HG2 PRO 13 HG2 PRO 13 -3.197 -15.969 -6.167 593 HG3 PRO 13 HG3 PRO 13 -1.599 -16.424 -6.787 594 HD2 PRO 13 HD2 PRO 13 -2.325 -16.810 -4.207 595 HD3 PRO 13 HD3 PRO 13 -0.653 -16.453 -4.686 596 H LEU 14 H LEU 14 -2.718 -11.697 -3.586 597 HA LEU 14 HA LEU 14 -5.574 -12.106 -4.023 598 HB2 LEU 14 HB2 LEU 14 -5.946 -10.655 -2.206 599 HB3 LEU 14 HB3 LEU 14 -4.593 -11.686 -1.745 600 HG LEU 14 HG LEU 14 -4.082 -8.971 -2.895 601 HD11 LEU 14 HD11 LEU 14 -3.918 -8.577 -0.202 602 HD12 LEU 14 HD12 LEU 14 -5.254 -8.052 -1.226 603 HD13 LEU 14 HD13 LEU 14 -5.367 -9.572 -0.338 604 HD21 LEU 14 HD21 LEU 14 -2.087 -10.092 -2.670 605 HD22 LEU 14 HD22 LEU 14 -2.197 -9.279 -1.109 606 HD23 LEU 14 HD23 LEU 14 -2.624 -10.985 -1.246 607 H VAL 15 H VAL 15 -6.407 -9.436 -3.656 608 HA VAL 15 HA VAL 15 -5.210 -7.671 -5.529 609 HB VAL 15 HB VAL 15 -6.110 -9.203 -7.183 610 HG11 VAL 15 HG11 VAL 15 -8.331 -9.306 -5.366 611 HG12 VAL 15 HG12 VAL 15 -8.888 -8.878 -6.984 612 HG13 VAL 15 HG13 VAL 15 -7.956 -10.355 -6.733 613 HG21 VAL 15 HG21 VAL 15 -8.116 -7.132 -7.556 614 HG22 VAL 15 HG22 VAL 15 -6.544 -6.479 -7.094 615 HG23 VAL 15 HG23 VAL 15 -6.688 -7.509 -8.519 616 H THR 16 H THR 16 -5.996 -5.625 -5.317 617 HA THR 16 HA THR 16 -8.037 -5.238 -3.265 618 HB THR 16 HB THR 16 -6.028 -3.978 -2.901 619 HG1 THR 16 HG1 THR 16 -7.165 -2.278 -2.355 620 HG21 THR 16 HG21 THR 16 -4.777 -3.296 -4.613 621 HG22 THR 16 HG22 THR 16 -6.071 -3.685 -5.746 622 HG23 THR 16 HG23 THR 16 -6.002 -2.088 -5.002 623 H LEU 17 H LEU 17 -10.064 -5.185 -4.000 624 HA LEU 17 HA LEU 17 -10.708 -4.279 -6.654 625 HB2 LEU 17 HB2 LEU 17 -11.850 -6.105 -5.166 626 HB3 LEU 17 HB3 LEU 17 -12.761 -4.735 -4.535 627 HG LEU 17 HG LEU 17 -12.664 -5.535 -7.443 628 HD11 LEU 17 HD11 LEU 17 -15.124 -5.830 -5.828 629 HD12 LEU 17 HD12 LEU 17 -14.528 -6.792 -7.180 630 HD13 LEU 17 HD13 LEU 17 -13.848 -7.020 -5.569 631 HD21 LEU 17 HD21 LEU 17 -13.278 -3.347 -7.559 632 HD22 LEU 17 HD22 LEU 17 -14.858 -4.055 -7.222 633 HD23 LEU 17 HD23 LEU 17 -13.922 -3.323 -5.918 634 H PHE 18 H PHE 18 -10.288 -2.122 -6.864 635 HA PHE 18 HA PHE 18 -11.703 -0.305 -5.028 636 HB2 PHE 18 HB2 PHE 18 -9.078 -0.147 -6.403 637 HB3 PHE 18 HB3 PHE 18 -9.995 1.351 -6.283 638 HD1 PHE 18 HD1 PHE 18 -11.152 1.504 -3.772 639 HD2 PHE 18 HD2 PHE 18 -7.463 -0.351 -4.802 640 HE1 PHE 18 HE1 PHE 18 -10.359 1.806 -1.462 641 HE2 PHE 18 HE2 PHE 18 -6.664 -0.053 -2.495 642 HZ PHE 18 HZ PHE 18 -8.113 1.026 -0.821 643 H LYS 19 H LYS 19 -13.666 -0.126 -6.020 644 HA LYS 19 HA LYS 19 -13.902 0.292 -8.858 645 HB2 LYS 19 HB2 LYS 19 -15.647 -0.930 -7.713 646 HB3 LYS 19 HB3 LYS 19 -15.930 0.420 -6.621 647 HG2 LYS 19 HG2 LYS 19 -16.981 1.687 -8.253 648 HG3 LYS 19 HG3 LYS 19 -16.265 0.760 -9.574 649 HD2 LYS 19 HD2 LYS 19 -18.224 -0.427 -7.621 650 HD3 LYS 19 HD3 LYS 19 -18.726 0.356 -9.121 651 HE2 LYS 19 HE2 LYS 19 -17.388 -1.229 -10.404 652 HE3 LYS 19 HE3 LYS 19 -16.845 -1.995 -8.912 653 HZ1 LYS 19 HZ1 LYS 19 -18.701 -3.156 -10.063 654 HZ2 LYS 19 HZ2 LYS 19 -19.040 -2.738 -8.459 655 HZ3 LYS 19 HZ3 LYS 19 -19.693 -1.827 -9.727 656 H ASN 20 H ASN 20 -15.400 2.259 -6.314 657 HA ASN 20 HA ASN 20 -14.719 4.651 -7.868 658 HB2 ASN 20 HB2 ASN 20 -17.134 3.974 -7.042 659 HB3 ASN 20 HB3 ASN 20 -16.595 4.718 -5.540 660 HD21 ASN 20 HD21 ASN 20 -18.691 5.576 -7.328 661 HD22 ASN 20 HD22 ASN 20 -18.273 7.169 -7.851 662 H ALA 21 H ALA 21 -12.677 5.180 -7.220 663 HA ALA 21 HA ALA 21 -12.229 5.564 -4.336 664 HB1 ALA 21 HB1 ALA 21 -10.468 4.252 -4.878 665 HB2 ALA 21 HB2 ALA 21 -10.479 4.746 -6.571 666 HB3 ALA 21 HB3 ALA 21 -9.759 5.797 -5.351 667 H ILE 22 H ILE 22 -12.600 7.593 -3.728 668 HA ILE 22 HA ILE 22 -11.606 9.767 -5.452 669 HB ILE 22 HB ILE 22 -14.050 9.885 -3.682 670 HG12 ILE 22 HG12 ILE 22 -13.846 9.799 -6.700 671 HG13 ILE 22 HG13 ILE 22 -14.387 8.471 -5.680 672 HG21 ILE 22 HG21 ILE 22 -12.395 11.919 -4.747 673 HG22 ILE 22 HG22 ILE 22 -13.927 11.961 -5.621 674 HG23 ILE 22 HG23 ILE 22 -13.911 12.090 -3.862 675 HD11 ILE 22 HD11 ILE 22 -15.920 10.788 -5.063 676 HD12 ILE 22 HD12 ILE 22 -15.918 10.542 -6.809 677 HD13 ILE 22 HD13 ILE 22 -16.452 9.247 -5.737 678 H ILE 23 H ILE 23 -9.995 10.834 -4.533 679 HA ILE 23 HA ILE 23 -9.759 10.819 -1.607 680 HB ILE 23 HB ILE 23 -7.731 11.323 -3.777 681 HG12 ILE 23 HG12 ILE 23 -8.262 8.970 -3.226 682 HG13 ILE 23 HG13 ILE 23 -6.604 9.391 -2.809 683 HG21 ILE 23 HG21 ILE 23 -7.074 12.905 -2.216 684 HG22 ILE 23 HG22 ILE 23 -7.606 11.925 -0.850 685 HG23 ILE 23 HG23 ILE 23 -6.147 11.483 -1.736 686 HD11 ILE 23 HD11 ILE 23 -7.407 9.749 -0.456 687 HD12 ILE 23 HD12 ILE 23 -8.938 9.031 -0.957 688 HD13 ILE 23 HD13 ILE 23 -7.452 8.085 -1.038 689 H LYS 24 H LYS 24 -10.480 12.556 -0.586 690 HA LYS 24 HA LYS 24 -10.119 15.189 -1.856 691 HB2 LYS 24 HB2 LYS 24 -12.539 14.131 -1.605 692 HB3 LYS 24 HB3 LYS 24 -12.383 14.743 0.036 693 HG2 LYS 24 HG2 LYS 24 -11.735 16.968 -1.112 694 HG3 LYS 24 HG3 LYS 24 -12.487 16.253 -2.539 695 HD2 LYS 24 HD2 LYS 24 -13.824 16.558 0.149 696 HD3 LYS 24 HD3 LYS 24 -14.045 17.652 -1.218 697 HE2 LYS 24 HE2 LYS 24 -14.691 15.495 -2.508 698 HE3 LYS 24 HE3 LYS 24 -14.929 14.810 -0.902 699 HZ1 LYS 24 HZ1 LYS 24 -16.806 16.142 -2.266 700 HZ2 LYS 24 HZ2 LYS 24 -16.783 16.002 -0.580 701 HZ3 LYS 24 HZ3 LYS 24 -16.165 17.391 -1.322 702 H ASN 25 H ASN 25 -8.357 15.882 -0.747 703 HA ASN 25 HA ASN 25 -7.121 16.728 0.964 704 HB2 ASN 25 HB2 ASN 25 -9.535 16.715 2.745 705 HB3 ASN 25 HB3 ASN 25 -8.234 17.897 2.647 706 HD21 ASN 25 HD21 ASN 25 -11.372 17.560 2.118 707 HD22 ASN 25 HD22 ASN 25 -11.600 18.644 0.792 708 H ALA 26 H ALA 26 -7.206 13.925 0.666 709 HA ALA 26 HA ALA 26 -7.665 12.470 2.997 710 HB1 ALA 26 HB1 ALA 26 -7.301 11.214 1.063 711 HB2 ALA 26 HB2 ALA 26 -5.798 12.056 0.686 712 HB3 ALA 26 HB3 ALA 26 -5.859 10.924 2.036 713 H TYR 27 H TYR 27 -4.433 13.413 1.816 714 HA TYR 27 HA TYR 27 -3.455 13.331 4.567 715 HB2 TYR 27 HB2 TYR 27 -2.255 12.163 2.662 716 HB3 TYR 27 HB3 TYR 27 -1.829 13.761 2.060 717 HD1 TYR 27 HD1 TYR 27 0.002 14.942 2.957 718 HD2 TYR 27 HD2 TYR 27 -1.447 11.477 4.956 719 HE1 TYR 27 HE1 TYR 27 1.969 14.979 4.434 720 HE2 TYR 27 HE2 TYR 27 0.516 11.504 6.439 721 HH TYR 27 HH TYR 27 2.174 13.357 7.264 722 H LYS 28 H LYS 28 -2.616 15.066 5.639 723 HA LYS 28 HA LYS 28 -2.657 17.664 4.260 724 HB2 LYS 28 HB2 LYS 28 -3.619 17.227 7.090 725 HB3 LYS 28 HB3 LYS 28 -3.681 18.723 6.167 726 HG2 LYS 28 HG2 LYS 28 -5.180 16.216 5.439 727 HG3 LYS 28 HG3 LYS 28 -5.861 17.563 6.355 728 HD2 LYS 28 HD2 LYS 28 -4.551 18.185 3.765 729 HD3 LYS 28 HD3 LYS 28 -6.113 17.365 3.713 730 HE2 LYS 28 HE2 LYS 28 -5.604 19.877 5.295 731 HE3 LYS 28 HE3 LYS 28 -6.204 19.879 3.637 732 HZ1 LYS 28 HZ1 LYS 28 -8.206 19.783 4.585 733 HZ2 LYS 28 HZ2 LYS 28 -7.869 18.151 4.880 734 HZ3 LYS 28 HZ3 LYS 28 -7.594 19.304 6.088 735 H LYS 29 H LYS 29 -1.372 19.335 5.363 736 HA LYS 29 HA LYS 29 0.860 18.172 6.897 737 HB2 LYS 29 HB2 LYS 29 1.187 18.987 4.397 738 HB3 LYS 29 HB3 LYS 29 1.292 20.565 5.166 739 HG2 LYS 29 HG2 LYS 29 2.951 18.319 6.208 740 HG3 LYS 29 HG3 LYS 29 3.441 19.158 4.735 741 HD2 LYS 29 HD2 LYS 29 3.902 21.104 5.833 742 HD3 LYS 29 HD3 LYS 29 2.678 20.821 7.072 743 HE2 LYS 29 HE2 LYS 29 4.308 18.837 7.710 744 HE3 LYS 29 HE3 LYS 29 5.494 19.875 6.920 745 HZ1 LYS 29 HZ1 LYS 29 4.508 20.084 9.510 746 HZ2 LYS 29 HZ2 LYS 29 5.575 21.135 8.721 747 HZ3 LYS 29 HZ3 LYS 29 3.908 21.419 8.661 748 H GLY 30 H GLY 30 -1.216 20.954 6.342 749 HA2 GLY 30 HA2 GLY 30 -0.567 21.880 9.055 750 HA3 GLY 30 HA3 GLY 30 -0.460 23.020 7.722 751 H GLU 31 H GLU 31 -2.713 22.141 6.254 752 HA GLU 31 HA GLU 31 -4.939 22.570 6.073 753 HB2 GLU 31 HB2 GLU 31 -4.763 20.675 7.929 754 HB3 GLU 31 HB3 GLU 31 -5.396 21.955 8.954 755 HG2 GLU 31 HG2 GLU 31 -6.760 21.417 6.372 756 HG3 GLU 31 HG3 GLU 31 -6.980 20.274 7.695 757 H1 TYR 1 H TYR 1 1.897 7.946 2.598 758 HA TYR 1 HA TYR 1 -0.395 6.178 2.347 759 HB2 TYR 1 HB2 TYR 1 -0.561 8.768 3.812 760 HB3 TYR 1 HB3 TYR 1 -1.250 7.201 4.221 761 HD1 TYR 1 HD1 TYR 1 0.782 9.468 5.556 762 HD2 TYR 1 HD2 TYR 1 0.995 5.407 4.304 763 HE1 TYR 1 HE1 TYR 1 2.621 9.081 7.143 764 HE2 TYR 1 HE2 TYR 1 2.834 5.009 5.888 765 HH TYR 1 HH TYR 1 4.708 6.910 7.045 766 H GLY 2 H GLY 2 -0.126 9.732 2.203 767 HA2 GLY 2 HA2 GLY 2 -1.333 11.259 0.969 768 HA3 GLY 2 HA3 GLY 2 -0.904 10.208 -0.373 769 H GLY 3 H GLY 3 -2.592 9.640 -1.560 770 HA2 GLY 3 HA2 GLY 3 -5.273 9.986 -0.683 771 HA3 GLY 3 HA3 GLY 3 -4.765 9.217 -2.180 772 H PHE 4 H PHE 4 -5.201 7.127 -2.379 773 HA PHE 4 HA PHE 4 -6.294 5.668 -0.157 774 HB2 PHE 4 HB2 PHE 4 -5.867 5.085 -3.069 775 HB3 PHE 4 HB3 PHE 4 -6.283 3.782 -1.962 776 HD1 PHE 4 HD1 PHE 4 -8.495 3.435 -1.291 777 HD2 PHE 4 HD2 PHE 4 -7.425 7.064 -3.240 778 HE1 PHE 4 HE1 PHE 4 -10.875 4.027 -1.487 779 HE2 PHE 4 HE2 PHE 4 -9.803 7.663 -3.438 780 HZ PHE 4 HZ PHE 4 -11.532 6.144 -2.560 781 H MET 5 H MET 5 -5.464 3.827 0.824 782 HA MET 5 HA MET 5 -2.567 3.443 0.464 783 HB2 MET 5 HB2 MET 5 -3.854 4.164 2.744 784 HB3 MET 5 HB3 MET 5 -3.838 2.415 2.923 785 HG2 MET 5 HG2 MET 5 -1.372 4.019 2.319 786 HG3 MET 5 HG3 MET 5 -1.914 3.662 3.957 787 HE1 MET 5 HE1 MET 5 -1.581 1.279 5.144 788 HE2 MET 5 HE2 MET 5 -0.013 0.622 4.677 789 HE3 MET 5 HE3 MET 5 -0.192 2.352 4.971 790 H THR 6 H THR 6 -2.411 1.787 -0.957 791 HA THR 6 HA THR 6 -4.073 -0.588 -0.583 792 HB THR 6 HB THR 6 -2.041 -0.431 -2.759 793 HG1 THR 6 HG1 THR 6 -4.447 1.089 -2.650 794 HG21 THR 6 HG21 THR 6 -4.296 -2.025 -2.095 795 HG22 THR 6 HG22 THR 6 -4.657 -1.176 -3.598 796 HG23 THR 6 HG23 THR 6 -3.213 -2.182 -3.479 797 H SER 7 H SER 7 -3.148 -1.509 1.254 798 HA SER 7 HA SER 7 -0.328 -2.306 1.062 799 HB2 SER 7 HB2 SER 7 -1.537 -1.133 3.144 800 HB3 SER 7 HB3 SER 7 -1.893 -2.813 3.543 801 HG SER 7 HG SER 7 0.100 -2.090 4.435 802 H GLU 8 H GLU 8 -0.250 -4.147 -0.107 803 HA GLU 8 HA GLU 8 -1.946 -6.383 0.792 804 HB2 GLU 8 HB2 GLU 8 -1.169 -5.468 -1.929 805 HB3 GLU 8 HB3 GLU 8 -1.272 -7.203 -1.661 806 HG2 GLU 8 HG2 GLU 8 -3.403 -6.833 -2.309 807 HG3 GLU 8 HG3 GLU 8 -3.596 -6.512 -0.587 808 H LYS 9 H LYS 9 -0.795 -7.789 1.925 809 HA LYS 9 HA LYS 9 2.040 -8.181 1.252 810 HB2 LYS 9 HB2 LYS 9 1.458 -7.462 3.581 811 HB3 LYS 9 HB3 LYS 9 0.599 -8.983 3.785 812 HG2 LYS 9 HG2 LYS 9 2.930 -9.981 3.027 813 HG3 LYS 9 HG3 LYS 9 3.512 -8.446 3.676 814 HD2 LYS 9 HD2 LYS 9 2.871 -8.954 5.822 815 HD3 LYS 9 HD3 LYS 9 1.588 -10.046 5.294 816 HE2 LYS 9 HE2 LYS 9 4.419 -10.770 4.714 817 HE3 LYS 9 HE3 LYS 9 3.817 -10.962 6.360 818 HZ1 LYS 9 HZ1 LYS 9 3.136 -12.442 3.950 819 HZ2 LYS 9 HZ2 LYS 9 3.211 -12.964 5.558 820 HZ3 LYS 9 HZ3 LYS 9 1.855 -12.115 5.007 821 H SER 10 H SER 10 2.372 -9.862 -0.043 822 HA SER 10 HA SER 10 1.449 -12.477 0.700 823 HB2 SER 10 HB2 SER 10 0.321 -12.928 -1.488 824 HB3 SER 10 HB3 SER 10 -0.542 -11.770 -0.476 825 HG SER 10 HG SER 10 0.347 -10.102 -1.737 826 H GLN 11 H GLN 11 2.732 -14.074 -0.121 827 HA GLN 11 HA GLN 11 5.119 -13.197 -1.522 828 HB2 GLN 11 HB2 GLN 11 5.949 -15.476 -1.053 829 HB3 GLN 11 HB3 GLN 11 5.411 -14.645 0.400 830 HG2 GLN 11 HG2 GLN 11 3.375 -15.904 0.441 831 HG3 GLN 11 HG3 GLN 11 3.746 -16.635 -1.120 832 HE21 GLN 11 HE21 GLN 11 6.088 -17.633 -1.067 833 HE22 GLN 11 HE22 GLN 11 6.366 -18.701 0.262 834 H THR 12 H THR 12 2.850 -13.045 -3.119 835 HA THR 12 HA THR 12 3.594 -14.894 -5.242 836 HB THR 12 HB THR 12 0.854 -14.919 -5.513 837 HG1 THR 12 HG1 THR 12 1.389 -15.540 -2.793 838 HG21 THR 12 HG21 THR 12 2.982 -16.788 -4.885 839 HG22 THR 12 HG22 THR 12 1.446 -17.278 -4.172 840 HG23 THR 12 HG23 THR 12 1.563 -17.002 -5.909 841 HA PRO 13 HA PRO 13 2.824 -11.508 -7.924 842 HB2 PRO 13 HB2 PRO 13 1.707 -12.687 -10.099 843 HB3 PRO 13 HB3 PRO 13 3.415 -12.867 -9.680 844 HG2 PRO 13 HG2 PRO 13 1.133 -14.736 -9.171 845 HG3 PRO 13 HG3 PRO 13 2.773 -15.101 -9.735 846 HD2 PRO 13 HD2 PRO 13 2.006 -15.451 -7.162 847 HD3 PRO 13 HD3 PRO 13 3.662 -14.996 -7.611 848 H LEU 14 H LEU 14 1.254 -10.356 -6.733 849 HA LEU 14 HA LEU 14 -1.556 -10.973 -7.226 850 HB2 LEU 14 HB2 LEU 14 -2.073 -9.494 -5.469 851 HB3 LEU 14 HB3 LEU 14 -0.665 -10.412 -4.940 852 HG LEU 14 HG LEU 14 -0.313 -7.707 -6.170 853 HD11 LEU 14 HD11 LEU 14 -0.244 -7.214 -3.490 854 HD12 LEU 14 HD12 LEU 14 -1.590 -6.821 -4.560 855 HD13 LEU 14 HD13 LEU 14 -1.615 -8.314 -3.622 856 HD21 LEU 14 HD21 LEU 14 1.749 -8.671 -5.861 857 HD22 LEU 14 HD22 LEU 14 1.541 -7.829 -4.326 858 HD23 LEU 14 HD23 LEU 14 1.240 -9.563 -4.427 859 H VAL 15 H VAL 15 -2.571 -8.351 -6.968 860 HA VAL 15 HA VAL 15 -1.444 -6.576 -8.876 861 HB VAL 15 HB VAL 15 -2.208 -8.223 -10.491 862 HG11 VAL 15 HG11 VAL 15 -4.463 -8.392 -8.723 863 HG12 VAL 15 HG12 VAL 15 -5.005 -8.054 -10.367 864 HG13 VAL 15 HG13 VAL 15 -3.996 -9.464 -10.043 865 HG21 VAL 15 HG21 VAL 15 -4.321 -6.288 -10.987 866 HG22 VAL 15 HG22 VAL 15 -2.800 -5.529 -10.516 867 HG23 VAL 15 HG23 VAL 15 -2.850 -6.617 -11.903 868 H THR 16 H THR 16 -2.370 -4.579 -8.761 869 HA THR 16 HA THR 16 -4.479 -4.257 -6.767 870 HB THR 16 HB THR 16 -2.563 -2.859 -6.399 871 HG1 THR 16 HG1 THR 16 -3.818 -1.217 -5.939 872 HG21 THR 16 HG21 THR 16 -1.316 -2.147 -8.102 873 HG22 THR 16 HG22 THR 16 -2.549 -2.668 -9.251 874 HG23 THR 16 HG23 THR 16 -2.611 -1.043 -8.568 875 H LEU 17 H LEU 17 -6.488 -4.349 -7.544 876 HA LEU 17 HA LEU 17 -7.121 -3.579 -10.243 877 HB2 LEU 17 HB2 LEU 17 -8.184 -5.423 -8.722 878 HB3 LEU 17 HB3 LEU 17 -9.191 -4.093 -8.154 879 HG LEU 17 HG LEU 17 -8.980 -4.975 -11.032 880 HD11 LEU 17 HD11 LEU 17 -11.454 -5.373 -9.461 881 HD12 LEU 17 HD12 LEU 17 -10.766 -6.340 -10.766 882 HD13 LEU 17 HD13 LEU 17 -10.113 -6.471 -9.133 883 HD21 LEU 17 HD21 LEU 17 -9.726 -2.835 -11.232 884 HD22 LEU 17 HD22 LEU 17 -11.266 -3.629 -10.902 885 HD23 LEU 17 HD23 LEU 17 -10.406 -2.800 -9.605 886 H PHE 18 H PHE 18 -6.837 -1.409 -10.525 887 HA PHE 18 HA PHE 18 -8.403 0.377 -8.784 888 HB2 PHE 18 HB2 PHE 18 -5.762 0.654 -10.109 889 HB3 PHE 18 HB3 PHE 18 -6.774 2.093 -10.063 890 HD1 PHE 18 HD1 PHE 18 -7.993 2.270 -7.586 891 HD2 PHE 18 HD2 PHE 18 -4.178 0.599 -8.466 892 HE1 PHE 18 HE1 PHE 18 -7.273 2.704 -5.274 893 HE2 PHE 18 HE2 PHE 18 -3.453 1.029 -6.155 894 HZ PHE 18 HZ PHE 18 -5.001 2.082 -4.555 895 H LYS 19 H LYS 19 -10.351 0.402 -9.819 896 HA LYS 19 HA LYS 19 -10.550 0.700 -12.675 897 HB2 LYS 19 HB2 LYS 19 -12.243 -0.582 -11.511 898 HB3 LYS 19 HB3 LYS 19 -12.632 0.793 -10.486 899 HG2 LYS 19 HG2 LYS 19 -13.723 1.921 -12.190 900 HG3 LYS 19 HG3 LYS 19 -12.916 0.991 -13.455 901 HD2 LYS 19 HD2 LYS 19 -14.838 -0.251 -11.501 902 HD3 LYS 19 HD3 LYS 19 -15.360 0.451 -13.034 903 HE2 LYS 19 HE2 LYS 19 -13.902 -1.083 -14.244 904 HE3 LYS 19 HE3 LYS 19 -13.334 -1.764 -12.720 905 HZ1 LYS 19 HZ1 LYS 19 -15.089 -3.083 -13.856 906 HZ2 LYS 19 HZ2 LYS 19 -15.483 -2.635 -12.273 907 HZ3 LYS 19 HZ3 LYS 19 -16.173 -1.813 -13.581 908 H ASN 20 H ASN 20 -12.211 2.667 -10.233 909 HA ASN 20 HA ASN 20 -11.643 5.037 -11.866 910 HB2 ASN 20 HB2 ASN 20 -14.030 4.244 -11.055 911 HB3 ASN 20 HB3 ASN 20 -13.566 5.082 -9.577 912 HD21 ASN 20 HD21 ASN 20 -15.675 5.735 -11.436 913 HD22 ASN 20 HD22 ASN 20 -15.343 7.327 -12.020 914 H ALA 21 H ALA 21 -9.655 5.720 -11.202 915 HA ALA 21 HA ALA 21 -9.287 6.232 -8.327 916 HB1 ALA 21 HB1 ALA 21 -7.436 5.018 -8.783 917 HB2 ALA 21 HB2 ALA 21 -7.449 5.437 -10.496 918 HB3 ALA 21 HB3 ALA 21 -6.817 6.582 -9.314 919 H ILE 22 H ILE 22 -9.807 8.255 -7.807 920 HA ILE 22 HA ILE 22 -8.906 10.423 -9.589 921 HB ILE 22 HB ILE 22 -11.394 10.451 -7.877 922 HG12 ILE 22 HG12 ILE 22 -11.115 10.269 -10.885 923 HG13 ILE 22 HG13 ILE 22 -11.594 8.947 -9.827 924 HG21 ILE 22 HG21 ILE 22 -9.843 12.545 -8.985 925 HG22 ILE 22 HG22 ILE 22 -11.354 12.459 -9.890 926 HG23 ILE 22 HG23 ILE 22 -11.386 12.653 -8.137 927 HD11 ILE 22 HD11 ILE 22 -13.284 11.182 -9.329 928 HD12 ILE 22 HD12 ILE 22 -13.227 10.873 -11.064 929 HD13 ILE 22 HD13 ILE 22 -13.702 9.587 -9.955 930 H ILE 23 H ILE 23 -7.383 11.616 -8.676 931 HA ILE 23 HA ILE 23 -7.216 11.724 -5.747 932 HB ILE 23 HB ILE 23 -5.171 12.278 -7.890 933 HG12 ILE 23 HG12 ILE 23 -5.572 9.915 -7.272 934 HG13 ILE 23 HG13 ILE 23 -3.954 10.451 -6.834 935 HG21 ILE 23 HG21 ILE 23 -4.653 13.947 -6.367 936 HG22 ILE 23 HG22 ILE 23 -5.152 12.976 -4.981 937 HG23 ILE 23 HG23 ILE 23 -3.649 12.603 -5.824 938 HD11 ILE 23 HD11 ILE 23 -4.834 10.836 -4.513 939 HD12 ILE 23 HD12 ILE 23 -6.304 10.005 -5.022 940 HD13 ILE 23 HD13 ILE 23 -4.760 9.154 -5.039 941 H LYS 24 H LYS 24 -8.065 13.449 -4.807 942 HA LYS 24 HA LYS 24 -7.836 16.051 -6.168 943 HB2 LYS 24 HB2 LYS 24 -10.192 14.855 -5.927 944 HB3 LYS 24 HB3 LYS 24 -10.111 15.536 -4.307 945 HG2 LYS 24 HG2 LYS 24 -9.574 17.753 -5.528 946 HG3 LYS 24 HG3 LYS 24 -10.248 16.939 -6.941 947 HD2 LYS 24 HD2 LYS 24 -11.662 17.264 -4.295 948 HD3 LYS 24 HD3 LYS 24 -11.920 18.286 -5.711 949 HE2 LYS 24 HE2 LYS 24 -12.403 16.045 -6.924 950 HE3 LYS 24 HE3 LYS 24 -12.632 15.408 -5.296 951 HZ1 LYS 24 HZ1 LYS 24 -14.559 16.564 -6.747 952 HZ2 LYS 24 HZ2 LYS 24 -14.563 16.492 -5.057 953 HZ3 LYS 24 HZ3 LYS 24 -14.018 17.888 -5.842 954 H ASN 25 H ASN 25 -6.147 16.894 -5.050 955 HA ASN 25 HA ASN 25 -5.005 17.877 -3.347 956 HB2 ASN 25 HB2 ASN 25 -7.455 17.776 -1.618 957 HB3 ASN 25 HB3 ASN 25 -6.226 19.032 -1.730 958 HD21 ASN 25 HD21 ASN 25 -9.324 18.485 -2.312 959 HD22 ASN 25 HD22 ASN 25 -9.587 19.505 -3.682 960 H ALA 26 H ALA 26 -4.916 15.062 -3.542 961 HA ALA 26 HA ALA 26 -5.334 13.666 -1.168 962 HB1 ALA 26 HB1 ALA 26 -4.850 12.367 -3.046 963 HB2 ALA 26 HB2 ALA 26 -3.394 13.288 -3.424 964 HB3 ALA 26 HB3 ALA 26 -3.415 12.203 -2.034 965 H TYR 27 H TYR 27 -2.140 14.765 -2.317 966 HA TYR 27 HA TYR 27 -1.223 14.845 0.455 967 HB2 TYR 27 HB2 TYR 27 0.090 13.683 -1.378 968 HB3 TYR 27 HB3 TYR 27 0.431 15.281 -2.033 969 HD1 TYR 27 HD1 TYR 27 2.165 16.607 -1.144 970 HD2 TYR 27 HD2 TYR 27 0.887 13.135 0.956 971 HE1 TYR 27 HE1 TYR 27 4.092 16.821 0.369 972 HE2 TYR 27 HE2 TYR 27 2.810 13.339 2.476 973 HH TYR 27 HH TYR 27 4.331 15.320 3.264 974 H LYS 28 H LYS 28 -0.515 16.667 1.476 975 HA LYS 28 HA LYS 28 -0.683 19.205 -0.001 976 HB2 LYS 28 HB2 LYS 28 -1.680 18.815 2.823 977 HB3 LYS 28 HB3 LYS 28 -1.814 20.268 1.841 978 HG2 LYS 28 HG2 LYS 28 -3.138 17.647 1.182 979 HG3 LYS 28 HG3 LYS 28 -3.921 18.980 2.032 980 HD2 LYS 28 HD2 LYS 28 -2.596 19.584 -0.556 981 HD3 LYS 28 HD3 LYS 28 -4.106 18.671 -0.603 982 HE2 LYS 28 HE2 LYS 28 -3.777 21.267 0.888 983 HE3 LYS 28 HE3 LYS 28 -4.342 21.171 -0.779 984 HZ1 LYS 28 HZ1 LYS 28 -6.353 20.993 0.135 985 HZ2 LYS 28 HZ2 LYS 28 -5.928 19.396 0.500 986 HZ3 LYS 28 HZ3 LYS 28 -5.746 20.608 1.667 987 H LYS 29 H LYS 29 0.470 20.993 1.068 988 HA LYS 29 HA LYS 29 2.734 20.026 2.688 989 HB2 LYS 29 HB2 LYS 29 3.066 20.771 0.166 990 HB3 LYS 29 HB3 LYS 29 3.060 22.378 0.880 991 HG2 LYS 29 HG2 LYS 29 4.826 20.274 2.035 992 HG3 LYS 29 HG3 LYS 29 5.298 21.089 0.542 993 HD2 LYS 29 HD2 LYS 29 5.613 23.098 1.578 994 HD3 LYS 29 HD3 LYS 29 4.386 22.781 2.807 995 HE2 LYS 29 HE2 LYS 29 6.124 20.926 3.540 996 HE3 LYS 29 HE3 LYS 29 7.258 22.007 2.732 997 HZ1 LYS 29 HZ1 LYS 29 6.217 22.245 5.297 998 HZ2 LYS 29 HZ2 LYS 29 7.230 23.333 4.487 999 HZ3 LYS 29 HZ3 LYS 29 5.550 23.510 4.392 1000 H GLY 30 H GLY 30 0.504 22.651 1.988 1001 HA2 GLY 30 HA2 GLY 30 1.033 23.712 4.677 1002 HA3 GLY 30 HA3 GLY 30 1.101 24.808 3.305 1003 H GLU 31 H GLU 31 -1.059 23.736 1.825 1004 HA GLU 31 HA GLU 31 -3.304 24.016 1.582 1005 HB2 GLU 31 HB2 GLU 31 -3.053 22.212 3.519 1006 HB3 GLU 31 HB3 GLU 31 -3.788 23.491 4.475 1007 HG2 GLU 31 HG2 GLU 31 -5.057 22.769 1.891 1008 HG3 GLU 31 HG3 GLU 31 -5.233 21.662 3.252 1009 H1 TYR 1 H TYR 1 4.528 9.746 -1.200 1010 HA TYR 1 HA TYR 1 2.369 7.823 -1.462 1011 HB2 TYR 1 HB2 TYR 1 1.987 10.446 -0.097 1012 HB3 TYR 1 HB3 TYR 1 1.388 8.852 0.348 1013 HD1 TYR 1 HD1 TYR 1 3.225 11.288 1.663 1014 HD2 TYR 1 HD2 TYR 1 3.744 7.214 0.553 1015 HE1 TYR 1 HE1 TYR 1 5.036 11.076 3.313 1016 HE2 TYR 1 HE2 TYR 1 5.555 6.990 2.201 1017 HH TYR 1 HH TYR 1 7.263 9.048 3.348 1018 H GLY 2 H GLY 2 2.393 11.381 -1.730 1019 HA2 GLY 2 HA2 GLY 2 1.127 12.776 -3.056 1020 HA3 GLY 2 HA3 GLY 2 1.650 11.700 -4.343 1021 H GLY 3 H GLY 3 0.026 10.986 -5.540 1022 HA2 GLY 3 HA2 GLY 3 -2.689 11.194 -4.731 1023 HA3 GLY 3 HA3 GLY 3 -2.101 10.395 -6.182 1024 H PHE 4 H PHE 4 -2.420 8.279 -6.298 1025 HA PHE 4 HA PHE 4 -3.460 6.850 -4.034 1026 HB2 PHE 4 HB2 PHE 4 -2.943 6.170 -6.911 1027 HB3 PHE 4 HB3 PHE 4 -3.307 4.894 -5.753 1028 HD1 PHE 4 HD1 PHE 4 -5.509 4.447 -5.114 1029 HD2 PHE 4 HD2 PHE 4 -4.607 8.050 -7.192 1030 HE1 PHE 4 HE1 PHE 4 -7.914 4.892 -5.378 1031 HE2 PHE 4 HE2 PHE 4 -7.011 8.502 -7.458 1032 HZ PHE 4 HZ PHE 4 -8.668 6.923 -6.550 1033 H MET 5 H MET 5 -2.537 5.115 -2.954 1034 HA MET 5 HA MET 5 0.383 4.887 -3.256 1035 HB2 MET 5 HB2 MET 5 -0.977 5.634 -1.031 1036 HB3 MET 5 HB3 MET 5 -0.873 3.897 -0.773 1037 HG2 MET 5 HG2 MET 5 1.520 5.591 -1.417 1038 HG3 MET 5 HG3 MET 5 0.964 5.300 0.230 1039 HE1 MET 5 HE1 MET 5 1.370 2.991 1.548 1040 HE2 MET 5 HE2 MET 5 2.983 2.396 1.155 1041 HE3 MET 5 HE3 MET 5 2.706 4.126 1.355 1042 H THR 6 H THR 6 0.663 3.183 -4.597 1043 HA THR 6 HA THR 6 -0.868 0.735 -4.156 1044 HB THR 6 HB THR 6 1.220 0.898 -6.276 1045 HG1 THR 6 HG1 THR 6 -1.251 2.313 -6.307 1046 HG21 THR 6 HG21 THR 6 -0.972 -0.774 -5.608 1047 HG22 THR 6 HG22 THR 6 -1.341 0.001 -7.149 1048 HG23 THR 6 HG23 THR 6 0.147 -0.928 -6.963 1049 H SER 7 H SER 7 0.036 -0.083 -2.270 1050 HA SER 7 HA SER 7 2.905 -0.707 -2.327 1051 HB2 SER 7 HB2 SER 7 1.548 0.458 -0.335 1052 HB3 SER 7 HB3 SER 7 1.277 -1.226 0.110 1053 HG SER 7 HG SER 7 3.187 -0.355 1.050 1054 H GLU 8 H GLU 8 3.134 -2.576 -3.432 1055 HA GLU 8 HA GLU 8 1.554 -4.885 -2.504 1056 HB2 GLU 8 HB2 GLU 8 2.345 -4.014 -5.237 1057 HB3 GLU 8 HB3 GLU 8 2.329 -5.741 -4.910 1058 HG2 GLU 8 HG2 GLU 8 0.198 -5.521 -5.613 1059 HG3 GLU 8 HG3 GLU 8 -0.056 -5.131 -3.913 1060 H LYS 9 H LYS 9 2.772 -6.153 -1.279 1061 HA LYS 9 HA LYS 9 5.639 -6.392 -1.880 1062 HB2 LYS 9 HB2 LYS 9 4.951 -5.642 0.409 1063 HB3 LYS 9 HB3 LYS 9 4.186 -7.208 0.641 1064 HG2 LYS 9 HG2 LYS 9 6.589 -8.082 -0.020 1065 HG3 LYS 9 HG3 LYS 9 7.063 -6.489 0.574 1066 HD2 LYS 9 HD2 LYS 9 6.417 -6.949 2.727 1067 HD3 LYS 9 HD3 LYS 9 5.204 -8.129 2.224 1068 HE2 LYS 9 HE2 LYS 9 8.079 -8.722 1.721 1069 HE3 LYS 9 HE3 LYS 9 7.457 -8.881 3.363 1070 HZ1 LYS 9 HZ1 LYS 9 6.903 -10.491 1.006 1071 HZ2 LYS 9 HZ2 LYS 9 6.972 -10.943 2.635 1072 HZ3 LYS 9 HZ3 LYS 9 5.586 -10.190 2.024 1073 H SER 10 H SER 10 6.121 -8.089 -3.103 1074 HA SER 10 HA SER 10 5.346 -10.733 -2.302 1075 HB2 SER 10 HB2 SER 10 4.313 -11.321 -4.509 1076 HB3 SER 10 HB3 SER 10 3.345 -10.204 -3.547 1077 HG SER 10 HG SER 10 4.146 -8.507 -4.829 1078 H GLN 11 H GLN 11 6.767 -12.256 -3.016 1079 HA GLN 11 HA GLN 11 9.121 -11.271 -4.396 1080 HB2 GLN 11 HB2 GLN 11 10.089 -13.471 -3.826 1081 HB3 GLN 11 HB3 GLN 11 9.457 -12.631 -2.417 1082 HG2 GLN 11 HG2 GLN 11 7.510 -14.024 -2.382 1083 HG3 GLN 11 HG3 GLN 11 7.971 -14.778 -3.908 1084 HE21 GLN 11 HE21 GLN 11 10.377 -15.608 -3.759 1085 HE22 GLN 11 HE22 GLN 11 10.688 -16.612 -2.389 1086 H THR 12 H THR 12 6.906 -11.316 -6.060 1087 HA THR 12 HA THR 12 7.825 -13.183 -8.095 1088 HB THR 12 HB THR 12 5.099 -13.401 -8.433 1089 HG1 THR 12 HG1 THR 12 5.610 -13.892 -5.681 1090 HG21 THR 12 HG21 THR 12 7.331 -15.102 -7.693 1091 HG22 THR 12 HG22 THR 12 5.812 -15.673 -7.004 1092 HG23 THR 12 HG23 THR 12 5.958 -15.441 -8.746 1093 HA PRO 13 HA PRO 13 6.910 -9.940 -10.907 1094 HB2 PRO 13 HB2 PRO 13 5.956 -11.264 -13.076 1095 HB3 PRO 13 HB3 PRO 13 7.657 -11.306 -12.597 1096 HG2 PRO 13 HG2 PRO 13 5.500 -13.321 -12.100 1097 HG3 PRO 13 HG3 PRO 13 7.181 -13.582 -12.599 1098 HD2 PRO 13 HD2 PRO 13 6.353 -13.908 -10.041 1099 HD3 PRO 13 HD3 PRO 13 7.987 -13.347 -10.452 1100 H LEU 14 H LEU 14 5.222 -8.868 -9.808 1101 HA LEU 14 HA LEU 14 2.482 -9.705 -10.371 1102 HB2 LEU 14 HB2 LEU 14 1.798 -8.213 -8.681 1103 HB3 LEU 14 HB3 LEU 14 3.243 -9.020 -8.075 1104 HG LEU 14 HG LEU 14 3.452 -6.327 -9.367 1105 HD11 LEU 14 HD11 LEU 14 3.412 -5.767 -6.702 1106 HD12 LEU 14 HD12 LEU 14 2.069 -5.500 -7.814 1107 HD13 LEU 14 HD13 LEU 14 2.128 -6.967 -6.838 1108 HD21 LEU 14 HD21 LEU 14 5.565 -7.147 -8.982 1109 HD22 LEU 14 HD22 LEU 14 5.260 -6.276 -7.479 1110 HD23 LEU 14 HD23 LEU 14 5.078 -8.029 -7.534 1111 H VAL 15 H VAL 15 1.270 -7.161 -10.230 1112 HA VAL 15 HA VAL 15 2.337 -5.372 -12.165 1113 HB VAL 15 HB VAL 15 1.711 -7.119 -13.737 1114 HG11 VAL 15 HG11 VAL 15 -0.572 -7.359 -12.013 1115 HG12 VAL 15 HG12 VAL 15 -1.092 -7.112 -13.680 1116 HG13 VAL 15 HG13 VAL 15 -0.011 -8.447 -13.282 1117 HG21 VAL 15 HG21 VAL 15 -0.499 -5.325 -14.341 1118 HG22 VAL 15 HG22 VAL 15 0.970 -4.467 -13.873 1119 HG23 VAL 15 HG23 VAL 15 1.004 -5.605 -15.220 1120 H THR 16 H THR 16 1.274 -3.436 -12.157 1121 HA THR 16 HA THR 16 -0.889 -3.179 -10.210 1122 HB THR 16 HB THR 16 0.926 -1.648 -9.858 1123 HG1 THR 16 HG1 THR 16 -0.440 -0.075 -9.483 1124 HG21 THR 16 HG21 THR 16 2.163 -0.926 -11.563 1125 HG22 THR 16 HG22 THR 16 0.986 -1.556 -12.715 1126 HG23 THR 16 HG23 THR 16 0.816 0.084 -12.089 1127 H LEU 17 H LEU 17 -2.875 -3.412 -11.013 1128 HA LEU 17 HA LEU 17 -3.498 -2.787 -13.753 1129 HB2 LEU 17 HB2 LEU 17 -4.476 -4.633 -12.172 1130 HB3 LEU 17 HB3 LEU 17 -5.581 -3.347 -11.692 1131 HG LEU 17 HG LEU 17 -5.234 -4.340 -14.519 1132 HD11 LEU 17 HD11 LEU 17 -7.717 -4.828 -12.988 1133 HD12 LEU 17 HD12 LEU 17 -6.941 -5.801 -14.238 1134 HD13 LEU 17 HD13 LEU 17 -6.318 -5.825 -12.588 1135 HD21 LEU 17 HD21 LEU 17 -6.107 -2.263 -14.834 1136 HD22 LEU 17 HD22 LEU 17 -7.602 -3.141 -14.511 1137 HD23 LEU 17 HD23 LEU 17 -6.836 -2.202 -13.230 1138 H PHE 18 H PHE 18 -3.358 -0.620 -14.124 1139 HA PHE 18 HA PHE 18 -5.064 1.128 -12.479 1140 HB2 PHE 18 HB2 PHE 18 -2.414 1.523 -13.754 1141 HB3 PHE 18 HB3 PHE 18 -3.515 2.897 -13.784 1142 HD1 PHE 18 HD1 PHE 18 -4.802 3.080 -11.341 1143 HD2 PHE 18 HD2 PHE 18 -0.869 1.630 -12.077 1144 HE1 PHE 18 HE1 PHE 18 -4.168 3.639 -9.031 1145 HE2 PHE 18 HE2 PHE 18 -0.228 2.186 -9.768 1146 HZ PHE 18 HZ PHE 18 -1.878 3.191 -8.241 1147 H LYS 19 H LYS 19 -6.984 0.994 -13.557 1148 HA LYS 19 HA LYS 19 -7.133 1.173 -16.425 1149 HB2 LYS 19 HB2 LYS 19 -8.775 -0.162 -15.250 1150 HB3 LYS 19 HB3 LYS 19 -9.267 1.223 -14.285 1151 HG2 LYS 19 HG2 LYS 19 -10.388 2.219 -16.047 1152 HG3 LYS 19 HG3 LYS 19 -9.494 1.305 -17.264 1153 HD2 LYS 19 HD2 LYS 19 -11.383 0.005 -15.314 1154 HD3 LYS 19 HD3 LYS 19 -11.907 0.620 -16.884 1155 HE2 LYS 19 HE2 LYS 19 -10.325 -0.858 -18.002 1156 HE3 LYS 19 HE3 LYS 19 -9.752 -1.446 -16.442 1157 HZ1 LYS 19 HZ1 LYS 19 -11.390 -2.916 -17.569 1158 HZ2 LYS 19 HZ2 LYS 19 -11.850 -2.441 -16.012 1159 HZ3 LYS 19 HZ3 LYS 19 -12.560 -1.711 -17.363 1160 H ASN 20 H ASN 20 -8.952 3.132 -14.090 1161 HA ASN 20 HA ASN 20 -8.490 5.466 -15.807 1162 HB2 ASN 20 HB2 ASN 20 -10.845 4.563 -15.014 1163 HB3 ASN 20 HB3 ASN 20 -10.466 5.488 -13.563 1164 HD21 ASN 20 HD21 ASN 20 -12.565 5.936 -15.493 1165 HD22 ASN 20 HD22 ASN 20 -12.314 7.520 -16.135 1166 H ALA 21 H ALA 21 -6.567 6.300 -15.130 1167 HA ALA 21 HA ALA 21 -6.292 6.935 -12.269 1168 HB1 ALA 21 HB1 ALA 21 -4.349 5.850 -12.622 1169 HB2 ALA 21 HB2 ALA 21 -4.374 6.148 -14.360 1170 HB3 ALA 21 HB3 ALA 21 -3.828 7.411 -13.257 1171 H ILE 22 H ILE 22 -6.943 8.937 -11.830 1172 HA ILE 22 HA ILE 22 -6.143 11.094 -13.672 1173 HB ILE 22 HB ILE 22 -8.663 11.028 -12.010 1174 HG12 ILE 22 HG12 ILE 22 -8.307 10.750 -15.002 1175 HG13 ILE 22 HG13 ILE 22 -8.734 9.444 -13.902 1176 HG21 ILE 22 HG21 ILE 22 -7.222 13.173 -13.168 1177 HG22 ILE 22 HG22 ILE 22 -8.706 12.959 -14.096 1178 HG23 ILE 22 HG23 ILE 22 -8.786 13.215 -12.353 1179 HD11 ILE 22 HD11 ILE 22 -10.561 11.594 -13.531 1180 HD12 ILE 22 HD12 ILE 22 -10.446 11.220 -15.251 1181 HD13 ILE 22 HD13 ILE 22 -10.872 9.954 -14.099 1182 H ILE 23 H ILE 23 -4.714 12.410 -12.773 1183 HA ILE 23 HA ILE 23 -4.621 12.631 -9.848 1184 HB ILE 23 HB ILE 23 -2.565 13.234 -11.967 1185 HG12 ILE 23 HG12 ILE 23 -2.828 10.875 -11.281 1186 HG13 ILE 23 HG13 ILE 23 -1.262 11.525 -10.811 1187 HG21 ILE 23 HG21 ILE 23 -2.189 14.984 -10.492 1188 HG22 ILE 23 HG22 ILE 23 -2.649 14.028 -9.083 1189 HG23 ILE 23 HG23 ILE 23 -1.110 13.726 -9.889 1190 HD11 ILE 23 HD11 ILE 23 -2.244 11.927 -8.532 1191 HD12 ILE 23 HD12 ILE 23 -3.637 10.984 -9.060 1192 HD13 ILE 23 HD13 ILE 23 -2.040 10.238 -8.998 1193 H LYS 24 H LYS 24 -5.605 14.330 -8.996 1194 HA LYS 24 HA LYS 24 -5.500 16.892 -10.445 1195 HB2 LYS 24 HB2 LYS 24 -7.783 15.559 -10.204 1196 HB3 LYS 24 HB3 LYS 24 -7.781 16.309 -8.613 1197 HG2 LYS 24 HG2 LYS 24 -7.351 18.503 -9.917 1198 HG3 LYS 24 HG3 LYS 24 -7.947 17.591 -11.306 1199 HD2 LYS 24 HD2 LYS 24 -9.431 17.936 -8.701 1200 HD3 LYS 24 HD3 LYS 24 -9.718 18.887 -10.160 1201 HE2 LYS 24 HE2 LYS 24 -10.045 16.577 -11.293 1202 HE3 LYS 24 HE3 LYS 24 -10.269 15.989 -9.646 1203 HZ1 LYS 24 HZ1 LYS 24 -12.232 16.973 -11.175 1204 HZ2 LYS 24 HZ2 LYS 24 -12.264 16.966 -9.483 1205 HZ3 LYS 24 HZ3 LYS 24 -11.787 18.360 -10.315 1206 H ASN 25 H ASN 25 -3.897 17.884 -9.325 1207 HA ASN 25 HA ASN 25 -2.855 18.995 -7.637 1208 HB2 ASN 25 HB2 ASN 25 -5.333 18.802 -5.955 1209 HB3 ASN 25 HB3 ASN 25 -4.182 20.128 -6.089 1210 HD21 ASN 25 HD21 ASN 25 -7.226 19.371 -6.710 1211 HD22 ASN 25 HD22 ASN 25 -7.521 20.320 -8.123 1212 H ALA 26 H ALA 26 -2.593 16.183 -7.725 1213 HA ALA 26 HA ALA 26 -2.976 14.851 -5.312 1214 HB1 ALA 26 HB1 ALA 26 -2.367 13.518 -7.128 1215 HB2 ALA 26 HB2 ALA 26 -0.964 14.516 -7.510 1216 HB3 ALA 26 HB3 ALA 26 -0.948 13.483 -6.081 1217 H TYR 27 H TYR 27 0.168 16.111 -6.431 1218 HA TYR 27 HA TYR 27 1.012 16.347 -3.644 1219 HB2 TYR 27 HB2 TYR 27 2.437 15.202 -5.401 1220 HB3 TYR 27 HB3 TYR 27 2.697 16.793 -6.110 1221 HD1 TYR 27 HD1 TYR 27 4.322 18.258 -5.233 1222 HD2 TYR 27 HD2 TYR 27 3.211 14.790 -3.032 1223 HE1 TYR 27 HE1 TYR 27 6.194 18.647 -3.687 1224 HE2 TYR 27 HE2 TYR 27 5.080 15.171 -1.479 1225 HH TYR 27 HH TYR 27 6.456 17.271 -0.733 1226 H LYS 28 H LYS 28 1.582 18.247 -2.679 1227 HA LYS 28 HA LYS 28 1.295 20.713 -4.257 1228 HB2 LYS 28 HB2 LYS 28 0.256 20.368 -1.441 1229 HB3 LYS 28 HB3 LYS 28 0.056 21.771 -2.483 1230 HG2 LYS 28 HG2 LYS 28 -1.086 19.049 -3.069 1231 HG3 LYS 28 HG3 LYS 28 -1.971 20.360 -2.285 1232 HD2 LYS 28 HD2 LYS 28 -0.627 20.952 -4.867 1233 HD3 LYS 28 HD3 LYS 28 -2.077 19.945 -4.910 1234 HE2 LYS 28 HE2 LYS 28 -1.942 22.610 -3.512 1235 HE3 LYS 28 HE3 LYS 28 -2.463 22.417 -5.185 1236 HZ1 LYS 28 HZ1 LYS 28 -4.479 22.146 -4.306 1237 HZ2 LYS 28 HZ2 LYS 28 -3.964 20.594 -3.870 1238 HZ3 LYS 28 HZ3 LYS 28 -3.883 21.859 -2.748 1239 H LYS 29 H LYS 29 2.310 22.607 -3.233 1240 HA LYS 29 HA LYS 29 4.591 21.844 -1.529 1241 HB2 LYS 29 HB2 LYS 29 4.934 22.517 -4.070 1242 HB3 LYS 29 HB3 LYS 29 4.813 24.145 -3.417 1243 HG2 LYS 29 HG2 LYS 29 6.678 22.197 -2.147 1244 HG3 LYS 29 HG3 LYS 29 7.133 22.986 -3.659 1245 HD2 LYS 29 HD2 LYS 29 7.298 25.047 -2.693 1246 HD3 LYS 29 HD3 LYS 29 6.067 24.696 -1.477 1247 HE2 LYS 29 HE2 LYS 29 7.901 22.982 -0.643 1248 HE3 LYS 29 HE3 LYS 29 8.983 24.103 -1.468 1249 HZ1 LYS 29 HZ1 LYS 29 7.875 24.366 1.066 1250 HZ2 LYS 29 HZ2 LYS 29 8.834 25.486 0.236 1251 HZ3 LYS 29 HZ3 LYS 29 7.149 25.553 0.103 1252 H GLY 30 H GLY 30 2.219 24.297 -2.374 1253 HA2 GLY 30 HA2 GLY 30 2.618 25.485 0.284 1254 HA3 GLY 30 HA3 GLY 30 2.650 26.533 -1.127 1255 H GLU 31 H GLU 31 0.595 25.272 -2.609 1256 HA GLU 31 HA GLU 31 -1.657 25.398 -2.909 1257 HB2 GLU 31 HB2 GLU 31 -1.338 23.694 -0.893 1258 HB3 GLU 31 HB3 GLU 31 -2.175 24.960 -0.007 1259 HG2 GLU 31 HG2 GLU 31 -3.333 24.053 -2.585 1260 HG3 GLU 31 HG3 GLU 31 -3.474 22.995 -1.182 1261 H1 TYR 1 H TYR 1 7.156 11.589 -5.038 1262 HA TYR 1 HA TYR 1 5.175 9.484 -5.314 1263 HB2 TYR 1 HB2 TYR 1 4.529 12.106 -4.049 1264 HB3 TYR 1 HB3 TYR 1 4.038 10.482 -3.579 1265 HD1 TYR 1 HD1 TYR 1 5.636 13.098 -2.283 1266 HD2 TYR 1 HD2 TYR 1 6.489 9.036 -3.215 1267 HE1 TYR 1 HE1 TYR 1 7.387 13.075 -0.555 1268 HE2 TYR 1 HE2 TYR 1 8.241 9.001 -1.490 1269 HH TYR 1 HH TYR 1 9.749 11.214 -0.356 1270 H GLY 2 H GLY 2 4.938 13.022 -5.708 1271 HA2 GLY 2 HA2 GLY 2 3.649 14.278 -7.143 1272 HA3 GLY 2 HA3 GLY 2 4.253 13.166 -8.363 1273 H GLY 3 H GLY 3 2.687 12.317 -9.550 1274 HA2 GLY 3 HA2 GLY 3 -0.048 12.416 -8.795 1275 HA3 GLY 3 HA3 GLY 3 0.608 11.579 -10.195 1276 H PHE 4 H PHE 4 0.398 9.447 -10.211 1277 HA PHE 4 HA PHE 4 -0.610 8.076 -7.898 1278 HB2 PHE 4 HB2 PHE 4 0.011 7.285 -10.725 1279 HB3 PHE 4 HB3 PHE 4 -0.307 6.048 -9.513 1280 HD1 PHE 4 HD1 PHE 4 -2.492 5.499 -8.907 1281 HD2 PHE 4 HD2 PHE 4 -1.751 9.058 -11.122 1282 HE1 PHE 4 HE1 PHE 4 -4.912 5.792 -9.241 1283 HE2 PHE 4 HE2 PHE 4 -4.169 9.357 -11.458 1284 HZ PHE 4 HZ PHE 4 -5.754 7.723 -10.517 1285 H MET 5 H MET 5 0.371 6.386 -6.762 1286 HA MET 5 HA MET 5 3.309 6.336 -6.964 1287 HB2 MET 5 HB2 MET 5 1.834 7.076 -4.804 1288 HB3 MET 5 HB3 MET 5 2.058 5.363 -4.477 1289 HG2 MET 5 HG2 MET 5 4.334 7.210 -5.127 1290 HG3 MET 5 HG3 MET 5 3.762 6.927 -3.484 1291 HE1 MET 5 HE1 MET 5 4.315 4.699 -2.082 1292 HE2 MET 5 HE2 MET 5 5.977 4.219 -2.424 1293 HE3 MET 5 HE3 MET 5 5.563 5.928 -2.287 1294 H THR 6 H THR 6 3.736 4.600 -8.219 1295 HA THR 6 HA THR 6 2.328 2.087 -7.732 1296 HB THR 6 HB THR 6 4.478 2.281 -9.785 1297 HG1 THR 6 HG1 THR 6 1.944 3.568 -9.959 1298 HG21 THR 6 HG21 THR 6 2.351 0.526 -9.128 1299 HG22 THR 6 HG22 THR 6 1.992 1.227 -10.706 1300 HG23 THR 6 HG23 THR 6 3.518 0.382 -10.442 1301 H SER 7 H SER 7 3.208 1.395 -5.786 1302 HA SER 7 HA SER 7 6.107 0.937 -5.719 1303 HB2 SER 7 HB2 SER 7 4.612 2.088 -3.821 1304 HB3 SER 7 HB3 SER 7 4.420 0.407 -3.325 1305 HG SER 7 HG SER 7 6.240 1.421 -2.349 1306 H GLU 8 H GLU 8 6.495 -0.953 -6.737 1307 HA GLU 8 HA GLU 8 5.022 -3.319 -5.779 1308 HB2 GLU 8 HB2 GLU 8 5.849 -2.503 -8.521 1309 HB3 GLU 8 HB3 GLU 8 5.903 -4.216 -8.126 1310 HG2 GLU 8 HG2 GLU 8 3.786 -4.136 -8.886 1311 HG3 GLU 8 HG3 GLU 8 3.460 -3.665 -7.219 1312 H LYS 9 H LYS 9 6.295 -4.412 -4.439 1313 HA LYS 9 HA LYS 9 9.183 -4.494 -4.947 1314 HB2 LYS 9 HB2 LYS 9 8.312 -3.771 -2.697 1315 HB3 LYS 9 HB3 LYS 9 7.709 -5.408 -2.474 1316 HG2 LYS 9 HG2 LYS 9 10.219 -6.021 -3.037 1317 HG3 LYS 9 HG3 LYS 9 10.492 -4.385 -2.434 1318 HD2 LYS 9 HD2 LYS 9 9.812 -4.911 -0.306 1319 HD3 LYS 9 HD3 LYS 9 8.754 -6.214 -0.851 1320 HE2 LYS 9 HE2 LYS 9 11.695 -6.495 -1.232 1321 HE3 LYS 9 HE3 LYS 9 11.026 -6.719 0.383 1322 HZ1 LYS 9 HZ1 LYS 9 10.747 -8.380 -1.989 1323 HZ2 LYS 9 HZ2 LYS 9 10.798 -8.822 -0.356 1324 HZ3 LYS 9 HZ3 LYS 9 9.364 -8.223 -1.026 1325 H SER 10 H SER 10 9.836 -6.168 -6.121 1326 HA SER 10 HA SER 10 9.229 -8.851 -5.308 1327 HB2 SER 10 HB2 SER 10 8.325 -9.538 -7.551 1328 HB3 SER 10 HB3 SER 10 7.237 -8.509 -6.619 1329 HG SER 10 HG SER 10 7.926 -6.747 -7.880 1330 H GLN 11 H GLN 11 10.755 -10.296 -5.999 1331 HA GLN 11 HA GLN 11 13.073 -9.147 -7.328 1332 HB2 GLN 11 HB2 GLN 11 14.199 -11.249 -6.665 1333 HB3 GLN 11 HB3 GLN 11 13.484 -10.402 -5.300 1334 HG2 GLN 11 HG2 GLN 11 11.643 -11.934 -5.238 1335 HG3 GLN 11 HG3 GLN 11 12.190 -12.717 -6.719 1336 HE21 GLN 11 HE21 GLN 11 14.656 -13.341 -6.487 1337 HE22 GLN 11 HE22 GLN 11 15.011 -14.263 -5.070 1338 H THR 12 H THR 12 10.937 -9.411 -9.051 1339 HA THR 12 HA THR 12 12.044 -11.278 -10.988 1340 HB THR 12 HB THR 12 9.363 -11.722 -11.401 1341 HG1 THR 12 HG1 THR 12 9.794 -12.033 -8.608 1342 HG21 THR 12 HG21 THR 12 11.681 -13.211 -10.484 1343 HG22 THR 12 HG22 THR 12 10.177 -13.862 -9.832 1344 HG23 THR 12 HG23 THR 12 10.386 -13.703 -11.576 1345 HA PRO 13 HA PRO 13 10.971 -8.218 -13.945 1346 HB2 PRO 13 HB2 PRO 13 10.160 -9.685 -16.081 1347 HB3 PRO 13 HB3 PRO 13 11.848 -9.591 -15.566 1348 HG2 PRO 13 HG2 PRO 13 9.822 -11.730 -15.036 1349 HG3 PRO 13 HG3 PRO 13 11.528 -11.893 -15.490 1350 HD2 PRO 13 HD2 PRO 13 10.665 -12.180 -12.939 1351 HD3 PRO 13 HD3 PRO 13 12.266 -11.523 -13.337 1352 H LEU 14 H LEU 14 9.186 -7.238 -12.906 1353 HA LEU 14 HA LEU 14 6.525 -8.275 -13.512 1354 HB2 LEU 14 HB2 LEU 14 5.697 -6.804 -11.873 1355 HB3 LEU 14 HB3 LEU 14 7.186 -7.480 -11.216 1356 HG LEU 14 HG LEU 14 7.202 -4.810 -12.574 1357 HD11 LEU 14 HD11 LEU 14 7.089 -4.211 -9.913 1358 HD12 LEU 14 HD12 LEU 14 5.752 -4.051 -11.051 1359 HD13 LEU 14 HD13 LEU 14 5.893 -5.499 -10.054 1360 HD21 LEU 14 HD21 LEU 14 9.370 -5.449 -12.149 1361 HD22 LEU 14 HD22 LEU 14 8.979 -4.573 -10.670 1362 HD23 LEU 14 HD23 LEU 14 8.939 -6.336 -10.687 1363 H VAL 15 H VAL 15 5.115 -5.850 -13.488 1364 HA VAL 15 HA VAL 15 6.114 -4.024 -15.431 1365 HB VAL 15 HB VAL 15 5.654 -5.863 -16.965 1366 HG11 VAL 15 HG11 VAL 15 3.330 -6.186 -15.311 1367 HG12 VAL 15 HG12 VAL 15 2.855 -6.019 -17.002 1368 HG13 VAL 15 HG13 VAL 15 3.997 -7.276 -16.526 1369 HG21 VAL 15 HG21 VAL 15 3.366 -4.210 -17.686 1370 HG22 VAL 15 HG22 VAL 15 4.780 -3.266 -17.216 1371 HG23 VAL 15 HG23 VAL 15 4.902 -4.445 -18.521 1372 H THR 16 H THR 16 4.892 -2.179 -15.536 1373 HA THR 16 HA THR 16 2.671 -2.028 -13.641 1374 HB THR 16 HB THR 16 4.343 -0.354 -13.277 1375 HG1 THR 16 HG1 THR 16 2.854 1.127 -13.013 1376 HG21 THR 16 HG21 THR 16 5.602 0.381 -14.962 1377 HG22 THR 16 HG22 THR 16 4.506 -0.345 -16.137 1378 HG23 THR 16 HG23 THR 16 4.219 1.297 -15.562 1379 H LEU 17 H LEU 17 0.712 -2.374 -14.459 1380 HA LEU 17 HA LEU 17 0.124 -1.903 -17.241 1381 HB2 LEU 17 HB2 LEU 17 -0.774 -3.752 -15.617 1382 HB3 LEU 17 HB3 LEU 17 -1.968 -2.523 -15.205 1383 HG LEU 17 HG LEU 17 -1.496 -3.594 -17.986 1384 HD11 LEU 17 HD11 LEU 17 -3.983 -4.168 -16.490 1385 HD12 LEU 17 HD12 LEU 17 -3.124 -5.139 -17.686 1386 HD13 LEU 17 HD13 LEU 17 -2.539 -5.066 -16.024 1387 HD21 LEU 17 HD21 LEU 17 -2.480 -1.586 -18.403 1388 HD22 LEU 17 HD22 LEU 17 -3.930 -2.535 -18.075 1389 HD23 LEU 17 HD23 LEU 17 -3.248 -1.505 -16.817 1390 H PHE 18 H PHE 18 0.148 0.259 -17.678 1391 HA PHE 18 HA PHE 18 -1.708 1.951 -16.140 1392 HB2 PHE 18 HB2 PHE 18 0.938 2.469 -17.382 1393 HB3 PHE 18 HB3 PHE 18 -0.246 3.768 -17.475 1394 HD1 PHE 18 HD1 PHE 18 -1.585 3.956 -15.064 1395 HD2 PHE 18 HD2 PHE 18 2.440 2.720 -15.682 1396 HE1 PHE 18 HE1 PHE 18 -1.030 4.629 -12.764 1397 HE2 PHE 18 HE2 PHE 18 3.002 3.390 -13.382 1398 HZ PHE 18 HZ PHE 18 1.266 4.345 -11.920 1399 H LYS 19 H LYS 19 -3.591 1.651 -17.251 1400 HA LYS 19 HA LYS 19 -3.690 1.712 -20.124 1401 HB2 LYS 19 HB2 LYS 19 -5.274 0.332 -18.915 1402 HB3 LYS 19 HB3 LYS 19 -5.873 1.730 -18.033 1403 HG2 LYS 19 HG2 LYS 19 -7.009 2.565 -19.867 1404 HG3 LYS 19 HG3 LYS 19 -6.026 1.654 -21.017 1405 HD2 LYS 19 HD2 LYS 19 -7.874 0.322 -19.051 1406 HD3 LYS 19 HD3 LYS 19 -8.405 0.839 -20.653 1407 HE2 LYS 19 HE2 LYS 19 -6.712 -0.579 -21.683 1408 HE3 LYS 19 HE3 LYS 19 -6.133 -1.066 -20.091 1409 HZ1 LYS 19 HZ1 LYS 19 -7.650 -2.684 -21.180 1410 HZ2 LYS 19 HZ2 LYS 19 -8.174 -2.172 -19.654 1411 HZ3 LYS 19 HZ3 LYS 19 -8.898 -1.548 -21.051 1412 H ASN 20 H ASN 20 -5.649 3.658 -17.890 1413 HA ASN 20 HA ASN 20 -5.291 5.944 -19.697 1414 HB2 ASN 20 HB2 ASN 20 -7.609 4.936 -18.918 1415 HB3 ASN 20 HB3 ASN 20 -7.318 5.939 -17.500 1416 HD21 ASN 20 HD21 ASN 20 -9.392 6.183 -19.495 1417 HD22 ASN 20 HD22 ASN 20 -9.218 7.752 -20.196 1418 H ALA 21 H ALA 21 -3.437 6.915 -19.014 1419 HA ALA 21 HA ALA 21 -3.264 7.671 -16.175 1420 HB1 ALA 21 HB1 ALA 21 -1.247 6.708 -16.442 1421 HB2 ALA 21 HB2 ALA 21 -1.261 6.917 -18.193 1422 HB3 ALA 21 HB3 ALA 21 -0.814 8.265 -17.148 1423 H ILE 22 H ILE 22 -4.060 9.641 -15.831 1424 HA ILE 22 HA ILE 22 -3.348 11.777 -17.733 1425 HB ILE 22 HB ILE 22 -5.895 11.617 -16.119 1426 HG12 ILE 22 HG12 ILE 22 -5.459 11.243 -19.090 1427 HG13 ILE 22 HG13 ILE 22 -5.829 9.958 -17.946 1428 HG21 ILE 22 HG21 ILE 22 -4.565 13.800 -17.331 1429 HG22 ILE 22 HG22 ILE 22 -6.008 13.457 -18.285 1430 HG23 ILE 22 HG23 ILE 22 -6.149 13.776 -16.556 1431 HD11 ILE 22 HD11 ILE 22 -7.792 12.001 -17.695 1432 HD12 ILE 22 HD12 ILE 22 -7.617 11.573 -19.397 1433 HD13 ILE 22 HD13 ILE 22 -7.988 10.325 -18.207 1434 H ILE 23 H ILE 23 -2.028 13.215 -16.857 1435 HA ILE 23 HA ILE 23 -2.014 13.548 -13.940 1436 HB ILE 23 HB ILE 23 0.051 14.216 -16.033 1437 HG12 ILE 23 HG12 ILE 23 -0.083 11.859 -15.316 1438 HG13 ILE 23 HG13 ILE 23 1.426 12.609 -14.810 1439 HG21 ILE 23 HG21 ILE 23 0.300 16.008 -14.585 1440 HG22 ILE 23 HG22 ILE 23 -0.154 15.059 -13.170 1441 HG23 ILE 23 HG23 ILE 23 1.423 14.822 -13.922 1442 HD11 ILE 23 HD11 ILE 23 0.385 12.968 -12.565 1443 HD12 ILE 23 HD12 ILE 23 -0.971 11.982 -13.113 1444 HD13 ILE 23 HD13 ILE 23 0.645 11.282 -13.012 1445 H LYS 24 H LYS 24 -3.113 15.216 -13.173 1446 HA LYS 24 HA LYS 24 -3.130 17.724 -14.718 1447 HB2 LYS 24 HB2 LYS 24 -5.334 16.264 -14.476 1448 HB3 LYS 24 HB3 LYS 24 -5.415 17.071 -12.916 1449 HG2 LYS 24 HG2 LYS 24 -5.087 19.238 -14.291 1450 HG3 LYS 24 HG3 LYS 24 -5.590 18.242 -15.659 1451 HD2 LYS 24 HD2 LYS 24 -7.159 18.594 -13.105 1452 HD3 LYS 24 HD3 LYS 24 -7.469 19.463 -14.609 1453 HE2 LYS 24 HE2 LYS 24 -7.623 17.093 -15.650 1454 HE3 LYS 24 HE3 LYS 24 -7.848 16.559 -13.985 1455 HZ1 LYS 24 HZ1 LYS 24 -9.832 17.355 -15.596 1456 HZ2 LYS 24 HZ2 LYS 24 -9.905 17.409 -13.906 1457 HZ3 LYS 24 HZ3 LYS 24 -9.497 18.799 -14.780 1458 H ASN 25 H ASN 25 -1.609 18.843 -13.601 1459 HA ASN 25 HA ASN 25 -0.680 20.082 -11.934 1460 HB2 ASN 25 HB2 ASN 25 -3.176 19.795 -10.295 1461 HB3 ASN 25 HB3 ASN 25 -2.109 21.186 -10.460 1462 HD21 ASN 25 HD21 ASN 25 -5.086 20.214 -11.105 1463 HD22 ASN 25 HD22 ASN 25 -5.411 21.088 -12.560 1464 H ALA 26 H ALA 26 -0.248 17.287 -11.914 1465 HA ALA 26 HA ALA 26 -0.602 16.021 -9.462 1466 HB1 ALA 26 HB1 ALA 26 0.130 14.670 -11.222 1467 HB2 ALA 26 HB2 ALA 26 1.483 15.736 -11.600 1468 HB3 ALA 26 HB3 ALA 26 1.518 14.751 -10.137 1469 H TYR 27 H TYR 27 2.481 17.440 -10.563 1470 HA TYR 27 HA TYR 27 3.245 17.825 -7.769 1471 HB2 TYR 27 HB2 TYR 27 4.779 16.709 -9.452 1472 HB3 TYR 27 HB3 TYR 27 4.956 18.286 -10.214 1473 HD1 TYR 27 HD1 TYR 27 6.469 19.879 -9.361 1474 HD2 TYR 27 HD2 TYR 27 5.520 16.434 -7.051 1475 HE1 TYR 27 HE1 TYR 27 8.278 20.440 -7.792 1476 HE2 TYR 27 HE2 TYR 27 7.325 16.986 -5.475 1477 HH TYR 27 HH TYR 27 8.554 19.195 -4.783 1478 H LYS 28 H LYS 28 3.673 19.789 -6.862 1479 HA LYS 28 HA LYS 28 3.272 22.175 -8.536 1480 HB2 LYS 28 HB2 LYS 28 2.192 21.869 -5.732 1481 HB3 LYS 28 HB3 LYS 28 1.928 23.216 -6.830 1482 HG2 LYS 28 HG2 LYS 28 0.974 20.407 -7.338 1483 HG3 LYS 28 HG3 LYS 28 -0.010 21.683 -6.617 1484 HD2 LYS 28 HD2 LYS 28 1.346 22.277 -9.191 1485 HD3 LYS 28 HD3 LYS 28 -0.033 21.175 -9.228 1486 HE2 LYS 28 HE2 LYS 28 -0.102 23.888 -7.921 1487 HE3 LYS 28 HE3 LYS 28 -0.576 23.604 -9.595 1488 HZ1 LYS 28 HZ1 LYS 28 -2.587 23.228 -8.742 1489 HZ2 LYS 28 HZ2 LYS 28 -1.979 21.731 -8.242 1490 HZ3 LYS 28 HZ3 LYS 28 -2.005 23.036 -7.165 1491 H LYS 29 H LYS 29 4.144 24.164 -7.562 1492 HA LYS 29 HA LYS 29 6.427 23.606 -5.783 1493 HB2 LYS 29 HB2 LYS 29 6.787 24.208 -8.339 1494 HB3 LYS 29 HB3 LYS 29 6.550 25.848 -7.749 1495 HG2 LYS 29 HG2 LYS 29 8.502 24.066 -6.371 1496 HG3 LYS 29 HG3 LYS 29 8.943 24.830 -7.900 1497 HD2 LYS 29 HD2 LYS 29 8.962 26.928 -7.002 1498 HD3 LYS 29 HD3 LYS 29 7.721 26.546 -5.807 1499 HE2 LYS 29 HE2 LYS 29 9.629 24.976 -4.864 1500 HE3 LYS 29 HE3 LYS 29 10.665 26.130 -5.702 1501 HZ1 LYS 29 HZ1 LYS 29 9.476 26.415 -3.208 1502 HZ2 LYS 29 HZ2 LYS 29 10.387 27.562 -4.055 1503 HZ3 LYS 29 HZ3 LYS 29 8.705 27.520 -4.231 1504 H GLY 30 H GLY 30 3.929 25.875 -6.768 1505 HA2 GLY 30 HA2 GLY 30 4.194 27.181 -4.149 1506 HA3 GLY 30 HA3 GLY 30 4.190 28.177 -5.597 1507 H GLU 31 H GLU 31 2.252 26.734 -7.071 1508 HA GLU 31 HA GLU 31 0.004 26.711 -7.420 1509 HB2 GLU 31 HB2 GLU 31 0.383 25.091 -5.350 1510 HB3 GLU 31 HB3 GLU 31 -0.544 26.330 -4.515 1511 HG2 GLU 31 HG2 GLU 31 -1.595 25.272 -7.083 1512 HG3 GLU 31 HG3 GLU 31 -1.705 24.259 -5.645 Start of MODEL 8 1 H1 TYR 1 H TYR 1 -4.485 3.371 13.660 2 HA TYR 1 HA TYR 1 -6.092 2.630 11.341 3 HB2 TYR 1 HB2 TYR 1 -6.850 2.310 14.243 4 HB3 TYR 1 HB3 TYR 1 -7.501 1.449 12.853 5 HD1 TYR 1 HD1 TYR 1 -5.058 1.423 15.457 6 HD2 TYR 1 HD2 TYR 1 -5.917 -0.115 11.584 7 HE1 TYR 1 HE1 TYR 1 -3.419 -0.376 15.814 8 HE2 TYR 1 HE2 TYR 1 -4.281 -1.918 11.930 9 HH TYR 1 HH TYR 1 -2.361 -2.110 14.911 10 H GLY 2 H GLY 2 -8.597 3.056 11.866 11 HA2 GLY 2 HA2 GLY 2 -9.463 5.326 13.181 12 HA3 GLY 2 HA3 GLY 2 -8.920 5.876 11.603 13 H GLY 3 H GLY 3 -11.418 6.416 11.951 14 HA2 GLY 3 HA2 GLY 3 -13.562 6.076 11.202 15 HA3 GLY 3 HA3 GLY 3 -12.814 5.099 9.948 16 H PHE 4 H PHE 4 -14.216 3.425 9.831 17 HA PHE 4 HA PHE 4 -15.265 2.159 12.193 18 HB2 PHE 4 HB2 PHE 4 -15.513 1.646 9.242 19 HB3 PHE 4 HB3 PHE 4 -16.108 0.473 10.412 20 HD1 PHE 4 HD1 PHE 4 -18.278 0.647 11.151 21 HD2 PHE 4 HD2 PHE 4 -16.331 4.107 9.617 22 HE1 PHE 4 HE1 PHE 4 -20.378 1.914 11.355 23 HE2 PHE 4 HE2 PHE 4 -18.427 5.380 9.819 24 HZ PHE 4 HZ PHE 4 -20.454 4.284 10.689 25 H MET 5 H MET 5 -14.790 0.112 12.975 26 HA MET 5 HA MET 5 -12.137 -0.882 12.234 27 HB2 MET 5 HB2 MET 5 -12.992 -0.315 14.667 28 HB3 MET 5 HB3 MET 5 -13.666 -1.936 14.575 29 HG2 MET 5 HG2 MET 5 -11.222 -2.532 13.788 30 HG3 MET 5 HG3 MET 5 -10.834 -1.057 14.671 31 HE1 MET 5 HE1 MET 5 -9.976 -4.527 16.102 32 HE2 MET 5 HE2 MET 5 -11.610 -5.149 15.870 33 HE3 MET 5 HE3 MET 5 -10.771 -4.353 14.538 34 H THR 6 H THR 6 -12.381 -2.226 10.524 35 HA THR 6 HA THR 6 -14.482 -4.263 10.601 36 HB THR 6 HB THR 6 -12.603 -4.046 8.296 37 HG1 THR 6 HG1 THR 6 -14.313 -2.383 7.573 38 HG21 THR 6 HG21 THR 6 -15.119 -5.262 8.883 39 HG22 THR 6 HG22 THR 6 -15.338 -4.110 7.566 40 HG23 THR 6 HG23 THR 6 -14.142 -5.398 7.421 41 H SER 7 H SER 7 -13.583 -5.623 12.193 42 HA SER 7 HA SER 7 -10.990 -6.840 11.628 43 HB2 SER 7 HB2 SER 7 -11.997 -6.062 13.978 44 HB3 SER 7 HB3 SER 7 -12.632 -7.707 13.958 45 HG SER 7 HG SER 7 -10.584 -7.654 14.925 46 H GLU 8 H GLU 8 -11.113 -8.381 10.112 47 HA GLU 8 HA GLU 8 -13.203 -10.437 10.416 48 HB2 GLU 8 HB2 GLU 8 -12.141 -9.049 8.016 49 HB3 GLU 8 HB3 GLU 8 -12.491 -10.764 7.849 50 HG2 GLU 8 HG2 GLU 8 -14.723 -10.467 7.992 51 HG3 GLU 8 HG3 GLU 8 -14.584 -9.121 9.121 52 H LYS 9 H LYS 9 -12.336 -12.202 11.272 53 HA LYS 9 HA LYS 9 -9.617 -12.981 10.449 54 HB2 LYS 9 HB2 LYS 9 -9.931 -12.506 12.872 55 HB3 LYS 9 HB3 LYS 9 -11.120 -13.800 12.942 56 HG2 LYS 9 HG2 LYS 9 -8.393 -14.405 11.913 57 HG3 LYS 9 HG3 LYS 9 -8.637 -14.213 13.650 58 HD2 LYS 9 HD2 LYS 9 -10.573 -15.873 13.361 59 HD3 LYS 9 HD3 LYS 9 -9.852 -16.234 11.790 60 HE2 LYS 9 HE2 LYS 9 -8.829 -17.816 13.098 61 HE3 LYS 9 HE3 LYS 9 -7.662 -16.499 13.211 62 HZ1 LYS 9 HZ1 LYS 9 -8.037 -17.344 15.386 63 HZ2 LYS 9 HZ2 LYS 9 -8.794 -15.833 15.304 64 HZ3 LYS 9 HZ3 LYS 9 -9.718 -17.248 15.215 65 H SER 10 H SER 10 -9.724 -14.442 8.870 66 HA SER 10 HA SER 10 -11.092 -16.935 9.332 67 HB2 SER 10 HB2 SER 10 -12.329 -16.825 7.135 68 HB3 SER 10 HB3 SER 10 -12.956 -15.754 8.388 69 HG SER 10 HG SER 10 -12.270 -14.046 7.301 70 H GLN 11 H GLN 11 -10.118 -18.603 8.294 71 HA GLN 11 HA GLN 11 -7.679 -18.000 6.851 72 HB2 GLN 11 HB2 GLN 11 -7.307 -20.454 6.960 73 HB3 GLN 11 HB3 GLN 11 -7.564 -19.720 8.538 74 HG2 GLN 11 HG2 GLN 11 -9.676 -20.654 8.770 75 HG3 GLN 11 HG3 GLN 11 -9.837 -20.958 7.041 76 HE21 GLN 11 HE21 GLN 11 -9.280 -22.891 6.267 77 HE22 GLN 11 HE22 GLN 11 -8.512 -24.143 7.177 78 H THR 12 H THR 12 -9.802 -17.162 5.367 79 HA THR 12 HA THR 12 -9.546 -18.841 3.013 80 HB THR 12 HB THR 12 -12.221 -18.338 2.833 81 HG1 THR 12 HG1 THR 12 -12.099 -17.708 5.139 82 HG21 THR 12 HG21 THR 12 -10.649 -20.723 3.727 83 HG22 THR 12 HG22 THR 12 -12.410 -20.799 3.669 84 HG23 THR 12 HG23 THR 12 -11.494 -20.448 2.203 85 HA PRO 13 HA PRO 13 -9.644 -15.024 0.850 86 HB2 PRO 13 HB2 PRO 13 -10.923 -15.685 -1.452 87 HB3 PRO 13 HB3 PRO 13 -9.278 -16.215 -1.080 88 HG2 PRO 13 HG2 PRO 13 -11.857 -17.709 -0.803 89 HG3 PRO 13 HG3 PRO 13 -10.299 -18.275 -1.431 90 HD2 PRO 13 HD2 PRO 13 -11.147 -18.830 1.080 91 HD3 PRO 13 HD3 PRO 13 -9.431 -18.615 0.678 92 H LEU 14 H LEU 14 -11.068 -13.939 2.351 93 HA LEU 14 HA LEU 14 -13.910 -13.927 1.739 94 HB2 LEU 14 HB2 LEU 14 -14.215 -12.726 3.725 95 HB3 LEU 14 HB3 LEU 14 -12.947 -13.897 4.080 96 HG LEU 14 HG LEU 14 -12.308 -11.057 3.338 97 HD11 LEU 14 HD11 LEU 14 -12.280 -11.820 6.186 98 HD12 LEU 14 HD12 LEU 14 -12.670 -10.279 5.423 99 HD13 LEU 14 HD13 LEU 14 -13.870 -11.571 5.464 100 HD21 LEU 14 HD21 LEU 14 -10.378 -12.339 3.222 101 HD22 LEU 14 HD22 LEU 14 -10.326 -11.704 4.866 102 HD23 LEU 14 HD23 LEU 14 -10.853 -13.362 4.578 103 H VAL 15 H VAL 15 -14.543 -11.289 2.366 104 HA VAL 15 HA VAL 15 -13.068 -9.507 0.643 105 HB VAL 15 HB VAL 15 -14.510 -10.783 -0.951 106 HG11 VAL 15 HG11 VAL 15 -16.739 -10.981 -0.734 107 HG12 VAL 15 HG12 VAL 15 -16.425 -10.621 0.964 108 HG13 VAL 15 HG13 VAL 15 -16.929 -9.334 -0.131 109 HG21 VAL 15 HG21 VAL 15 -15.732 -8.196 -1.264 110 HG22 VAL 15 HG22 VAL 15 -14.048 -8.030 -0.768 111 HG23 VAL 15 HG23 VAL 15 -14.454 -8.954 -2.215 112 H THR 16 H THR 16 -13.370 -7.408 1.189 113 HA THR 16 HA THR 16 -15.177 -6.885 3.428 114 HB THR 16 HB THR 16 -12.943 -6.156 3.850 115 HG1 THR 16 HG1 THR 16 -13.963 -3.667 3.166 116 HG21 THR 16 HG21 THR 16 -13.011 -5.419 1.049 117 HG22 THR 16 HG22 THR 16 -12.391 -4.106 2.050 118 HG23 THR 16 HG23 THR 16 -11.626 -5.694 2.105 119 H LEU 17 H LEU 17 -17.176 -6.388 2.739 120 HA LEU 17 HA LEU 17 -17.685 -4.966 0.311 121 HB2 LEU 17 HB2 LEU 17 -19.157 -6.666 1.688 122 HB3 LEU 17 HB3 LEU 17 -19.728 -5.191 2.466 123 HG LEU 17 HG LEU 17 -19.887 -5.781 -0.489 124 HD11 LEU 17 HD11 LEU 17 -22.133 -6.308 -0.210 125 HD12 LEU 17 HD12 LEU 17 -21.353 -7.119 1.148 126 HD13 LEU 17 HD13 LEU 17 -22.203 -5.594 1.401 127 HD21 LEU 17 HD21 LEU 17 -20.776 -3.455 1.197 128 HD22 LEU 17 HD22 LEU 17 -19.747 -3.443 -0.236 129 HD23 LEU 17 HD23 LEU 17 -21.468 -3.798 -0.389 130 H PHE 18 H PHE 18 -16.705 -2.969 0.394 131 HA PHE 18 HA PHE 18 -17.558 -1.145 2.534 132 HB2 PHE 18 HB2 PHE 18 -15.118 -1.375 0.872 133 HB3 PHE 18 HB3 PHE 18 -15.661 0.262 1.223 134 HD1 PHE 18 HD1 PHE 18 -16.302 -2.423 3.598 135 HD2 PHE 18 HD2 PHE 18 -13.650 0.722 2.508 136 HE1 PHE 18 HE1 PHE 18 -15.244 -2.551 5.816 137 HE2 PHE 18 HE2 PHE 18 -12.587 0.599 4.723 138 HZ PHE 18 HZ PHE 18 -13.383 -1.040 6.381 139 H LYS 19 H LYS 19 -19.430 -0.222 1.937 140 HA LYS 19 HA LYS 19 -19.444 1.277 -0.584 141 HB2 LYS 19 HB2 LYS 19 -20.745 -0.978 -0.634 142 HB3 LYS 19 HB3 LYS 19 -21.931 -0.124 0.345 143 HG2 LYS 19 HG2 LYS 19 -22.194 1.547 -1.406 144 HG3 LYS 19 HG3 LYS 19 -20.980 0.721 -2.386 145 HD2 LYS 19 HD2 LYS 19 -23.410 -0.737 -1.411 146 HD3 LYS 19 HD3 LYS 19 -23.487 0.278 -2.853 147 HE2 LYS 19 HE2 LYS 19 -21.900 -1.042 -3.989 148 HE3 LYS 19 HE3 LYS 19 -21.400 -1.857 -2.508 149 HZ1 LYS 19 HZ1 LYS 19 -23.492 -2.990 -2.414 150 HZ2 LYS 19 HZ2 LYS 19 -24.088 -2.125 -3.741 151 HZ3 LYS 19 HZ3 LYS 19 -22.825 -3.232 -3.950 152 H ASN 20 H ASN 20 -20.805 3.124 -0.595 153 HA ASN 20 HA ASN 20 -21.556 5.062 0.344 154 HB2 ASN 20 HB2 ASN 20 -23.038 2.926 1.849 155 HB3 ASN 20 HB3 ASN 20 -23.286 4.625 2.238 156 HD21 ASN 20 HD21 ASN 20 -24.951 5.495 1.264 157 HD22 ASN 20 HD22 ASN 20 -25.573 5.059 -0.288 158 H ALA 21 H ALA 21 -19.027 4.280 1.269 159 HA ALA 21 HA ALA 21 -19.016 4.740 4.146 160 HB1 ALA 21 HB1 ALA 21 -16.398 4.640 3.461 161 HB2 ALA 21 HB2 ALA 21 -17.376 3.229 3.863 162 HB3 ALA 21 HB3 ALA 21 -17.118 3.671 2.176 163 H ILE 22 H ILE 22 -18.841 6.702 4.989 164 HA ILE 22 HA ILE 22 -17.596 8.826 3.367 165 HB ILE 22 HB ILE 22 -19.802 9.207 5.393 166 HG12 ILE 22 HG12 ILE 22 -19.972 9.320 2.375 167 HG13 ILE 22 HG13 ILE 22 -20.539 7.972 3.355 168 HG21 ILE 22 HG21 ILE 22 -17.963 11.002 4.168 169 HG22 ILE 22 HG22 ILE 22 -19.583 11.352 3.565 170 HG23 ILE 22 HG23 ILE 22 -19.268 11.357 5.300 171 HD11 ILE 22 HD11 ILE 22 -21.707 10.318 4.397 172 HD12 ILE 22 HD12 ILE 22 -21.897 10.359 2.644 173 HD13 ILE 22 HD13 ILE 22 -22.491 8.976 3.564 174 H ILE 23 H ILE 23 -15.691 9.356 4.195 175 HA ILE 23 HA ILE 23 -15.237 9.086 7.074 176 HB ILE 23 HB ILE 23 -13.380 9.372 4.727 177 HG12 ILE 23 HG12 ILE 23 -14.186 7.120 5.314 178 HG13 ILE 23 HG13 ILE 23 -12.455 7.277 5.594 179 HG21 ILE 23 HG21 ILE 23 -12.270 10.784 6.167 180 HG22 ILE 23 HG22 ILE 23 -12.851 9.947 7.607 181 HG23 ILE 23 HG23 ILE 23 -11.585 9.222 6.616 182 HD11 ILE 23 HD11 ILE 23 -13.066 7.764 8.016 183 HD12 ILE 23 HD12 ILE 23 -14.671 7.161 7.603 184 HD13 ILE 23 HD13 ILE 23 -13.266 6.108 7.441 185 H LYS 24 H LYS 24 -15.764 10.833 8.215 186 HA LYS 24 HA LYS 24 -15.081 13.482 7.120 187 HB2 LYS 24 HB2 LYS 24 -17.541 12.753 7.763 188 HB3 LYS 24 HB3 LYS 24 -17.001 13.159 9.386 189 HG2 LYS 24 HG2 LYS 24 -16.846 15.388 8.931 190 HG3 LYS 24 HG3 LYS 24 -16.517 15.128 7.216 191 HD2 LYS 24 HD2 LYS 24 -18.716 16.090 7.473 192 HD3 LYS 24 HD3 LYS 24 -18.870 14.424 6.911 193 HE2 LYS 24 HE2 LYS 24 -19.728 13.688 8.905 194 HE3 LYS 24 HE3 LYS 24 -18.921 14.945 9.841 195 HZ1 LYS 24 HZ1 LYS 24 -21.547 14.922 8.833 196 HZ2 LYS 24 HZ2 LYS 24 -20.803 16.082 9.813 197 HZ3 LYS 24 HZ3 LYS 24 -20.709 16.211 8.128 198 H ASN 25 H ASN 25 -13.097 13.923 7.911 199 HA ASN 25 HA ASN 25 -11.398 14.288 9.385 200 HB2 ASN 25 HB2 ASN 25 -13.711 14.915 11.234 201 HB3 ASN 25 HB3 ASN 25 -12.039 15.406 11.482 202 HD21 ASN 25 HD21 ASN 25 -13.634 17.413 11.552 203 HD22 ASN 25 HD22 ASN 25 -13.659 18.323 10.083 204 H ALA 26 H ALA 26 -12.041 11.604 9.149 205 HA ALA 26 HA ALA 26 -12.535 10.224 11.523 206 HB1 ALA 26 HB1 ALA 26 -10.976 9.454 9.068 207 HB2 ALA 26 HB2 ALA 26 -11.287 8.339 10.398 208 HB3 ALA 26 HB3 ALA 26 -12.634 9.022 9.488 209 H TYR 27 H TYR 27 -9.557 11.580 10.236 210 HA TYR 27 HA TYR 27 -8.226 10.879 12.769 211 HB2 TYR 27 HB2 TYR 27 -7.475 9.737 10.504 212 HB3 TYR 27 HB3 TYR 27 -6.623 11.259 10.276 213 HD1 TYR 27 HD1 TYR 27 -4.798 11.902 11.782 214 HD2 TYR 27 HD2 TYR 27 -6.773 8.154 12.180 215 HE1 TYR 27 HE1 TYR 27 -2.960 11.091 13.201 216 HE2 TYR 27 HE2 TYR 27 -4.941 7.333 13.601 217 HH TYR 27 HH TYR 27 -3.143 8.021 14.868 218 H LYS 28 H LYS 28 -8.399 12.780 13.835 219 HA LYS 28 HA LYS 28 -7.747 15.273 12.467 220 HB2 LYS 28 HB2 LYS 28 -8.568 14.933 15.350 221 HB3 LYS 28 HB3 LYS 28 -8.634 16.397 14.378 222 HG2 LYS 28 HG2 LYS 28 -10.344 15.300 12.948 223 HG3 LYS 28 HG3 LYS 28 -10.341 13.937 14.071 224 HD2 LYS 28 HD2 LYS 28 -12.110 15.194 14.860 225 HD3 LYS 28 HD3 LYS 28 -10.782 15.775 15.867 226 HE2 LYS 28 HE2 LYS 28 -10.523 17.520 13.904 227 HE3 LYS 28 HE3 LYS 28 -12.221 17.128 13.639 228 HZ1 LYS 28 HZ1 LYS 28 -11.389 19.004 15.329 229 HZ2 LYS 28 HZ2 LYS 28 -12.844 18.161 15.520 230 HZ3 LYS 28 HZ3 LYS 28 -11.471 17.686 16.386 231 H LYS 29 H LYS 29 -6.534 16.865 14.106 232 HA LYS 29 HA LYS 29 -3.865 16.029 14.174 233 HB2 LYS 29 HB2 LYS 29 -3.481 18.074 15.548 234 HB3 LYS 29 HB3 LYS 29 -4.396 18.373 14.076 235 HG2 LYS 29 HG2 LYS 29 -6.481 18.205 15.509 236 HG3 LYS 29 HG3 LYS 29 -5.401 18.282 16.903 237 HD2 LYS 29 HD2 LYS 29 -5.396 20.339 14.703 238 HD3 LYS 29 HD3 LYS 29 -6.394 20.481 16.152 239 HE2 LYS 29 HE2 LYS 29 -4.316 20.286 17.515 240 HE3 LYS 29 HE3 LYS 29 -3.385 20.335 16.019 241 HZ1 LYS 29 HZ1 LYS 29 -3.519 22.531 16.012 242 HZ2 LYS 29 HZ2 LYS 29 -5.209 22.486 16.076 243 HZ3 LYS 29 HZ3 LYS 29 -4.307 22.486 17.508 244 H GLY 30 H GLY 30 -2.574 16.372 16.371 245 HA2 GLY 30 HA2 GLY 30 -3.284 15.867 18.868 246 HA3 GLY 30 HA3 GLY 30 -3.600 14.295 18.150 247 H GLU 31 H GLU 31 -1.473 14.092 16.383 248 HA GLU 31 HA GLU 31 0.570 13.156 18.067 249 HB2 GLU 31 HB2 GLU 31 0.910 13.855 15.152 250 HB3 GLU 31 HB3 GLU 31 1.790 12.649 16.079 251 HG2 GLU 31 HG2 GLU 31 -0.486 11.511 16.387 252 HG3 GLU 31 HG3 GLU 31 -1.024 12.551 15.069 253 H1 TYR 1 H TYR 1 -1.943 5.442 9.919 254 HA TYR 1 HA TYR 1 -3.406 4.477 7.589 255 HB2 TYR 1 HB2 TYR 1 -4.247 4.247 10.477 256 HB3 TYR 1 HB3 TYR 1 -4.781 3.271 9.113 257 HD1 TYR 1 HD1 TYR 1 -2.431 3.566 11.789 258 HD2 TYR 1 HD2 TYR 1 -3.052 1.760 7.987 259 HE1 TYR 1 HE1 TYR 1 -0.680 1.915 12.294 260 HE2 TYR 1 HE2 TYR 1 -1.303 0.103 8.482 261 HH TYR 1 HH TYR 1 0.526 0.215 11.523 262 H GLY 2 H GLY 2 -5.958 4.735 8.024 263 HA2 GLY 2 HA2 GLY 2 -7.032 7.001 9.180 264 HA3 GLY 2 HA3 GLY 2 -6.479 7.505 7.590 265 H GLY 3 H GLY 3 -9.023 7.869 7.842 266 HA2 GLY 3 HA2 GLY 3 -11.110 7.328 7.052 267 HA3 GLY 3 HA3 GLY 3 -10.250 6.349 5.872 268 H PHE 4 H PHE 4 -11.538 4.579 5.807 269 HA PHE 4 HA PHE 4 -12.561 3.355 8.198 270 HB2 PHE 4 HB2 PHE 4 -12.666 2.682 5.272 271 HB3 PHE 4 HB3 PHE 4 -13.196 1.513 6.477 272 HD1 PHE 4 HD1 PHE 4 -15.385 1.547 7.194 273 HD2 PHE 4 HD2 PHE 4 -13.715 5.059 5.463 274 HE1 PHE 4 HE1 PHE 4 -17.590 2.634 7.280 275 HE2 PHE 4 HE2 PHE 4 -15.917 6.152 5.547 276 HZ PHE 4 HZ PHE 4 -17.859 4.940 6.457 277 H MET 5 H MET 5 -11.987 1.357 9.071 278 HA MET 5 HA MET 5 -9.233 0.542 8.479 279 HB2 MET 5 HB2 MET 5 -10.205 1.180 10.852 280 HB3 MET 5 HB3 MET 5 -10.749 -0.492 10.836 281 HG2 MET 5 HG2 MET 5 -8.246 -0.940 10.153 282 HG3 MET 5 HG3 MET 5 -7.997 0.611 10.951 283 HE1 MET 5 HE1 MET 5 -6.908 -2.676 12.613 284 HE2 MET 5 HE2 MET 5 -8.480 -3.447 12.396 285 HE3 MET 5 HE3 MET 5 -7.680 -2.673 11.027 286 H THR 6 H THR 6 -9.356 -0.893 6.823 287 HA THR 6 HA THR 6 -11.297 -3.075 6.967 288 HB THR 6 HB THR 6 -9.368 -2.886 4.708 289 HG1 THR 6 HG1 THR 6 -11.139 -1.339 3.852 290 HG21 THR 6 HG21 THR 6 -11.835 -4.183 5.296 291 HG22 THR 6 HG22 THR 6 -12.090 -3.099 3.928 292 HG23 THR 6 HG23 THR 6 -10.831 -4.331 3.853 293 H SER 7 H SER 7 -10.375 -4.296 8.646 294 HA SER 7 HA SER 7 -7.679 -5.343 8.247 295 HB2 SER 7 HB2 SER 7 -8.843 -4.532 10.513 296 HB3 SER 7 HB3 SER 7 -9.349 -6.221 10.551 297 HG SER 7 HG SER 7 -7.353 -5.957 11.594 298 H GLU 8 H GLU 8 -7.615 -6.967 6.818 299 HA GLU 8 HA GLU 8 -9.576 -9.145 7.129 300 HB2 GLU 8 HB2 GLU 8 -8.491 -7.801 4.720 301 HB3 GLU 8 HB3 GLU 8 -8.682 -9.546 4.622 302 HG2 GLU 8 HG2 GLU 8 -10.931 -9.440 4.611 303 HG3 GLU 8 HG3 GLU 8 -10.982 -8.054 5.699 304 H LYS 9 H LYS 9 -8.662 -10.830 8.086 305 HA LYS 9 HA LYS 9 -5.844 -11.441 7.483 306 HB2 LYS 9 HB2 LYS 9 -6.432 -10.897 9.870 307 HB3 LYS 9 HB3 LYS 9 -7.430 -12.345 9.891 308 HG2 LYS 9 HG2 LYS 9 -4.575 -12.579 9.083 309 HG3 LYS 9 HG3 LYS 9 -4.973 -12.383 10.791 310 HD2 LYS 9 HD2 LYS 9 -6.641 -14.306 10.404 311 HD3 LYS 9 HD3 LYS 9 -5.733 -14.603 8.920 312 HE2 LYS 9 HE2 LYS 9 -4.610 -15.980 10.360 313 HE3 LYS 9 HE3 LYS 9 -3.674 -14.499 10.558 314 HZ1 LYS 9 HZ1 LYS 9 -4.142 -15.362 12.704 315 HZ2 LYS 9 HZ2 LYS 9 -5.115 -13.993 12.503 316 HZ3 LYS 9 HZ3 LYS 9 -5.789 -15.538 12.360 317 H SER 10 H SER 10 -5.758 -12.950 5.946 318 HA SER 10 HA SER 10 -6.978 -15.520 6.419 319 HB2 SER 10 HB2 SER 10 -8.097 -15.592 4.183 320 HB3 SER 10 HB3 SER 10 -8.838 -14.449 5.304 321 HG SER 10 HG SER 10 -8.146 -12.809 4.121 322 H GLN 11 H GLN 11 -5.813 -17.147 5.531 323 HA GLN 11 HA GLN 11 -3.337 -16.421 4.210 324 HB2 GLN 11 HB2 GLN 11 -2.784 -18.828 4.474 325 HB3 GLN 11 HB3 GLN 11 -3.197 -18.041 5.991 326 HG2 GLN 11 HG2 GLN 11 -5.246 -19.125 6.143 327 HG3 GLN 11 HG3 GLN 11 -5.262 -19.536 4.428 328 HE21 GLN 11 HE21 GLN 11 -4.508 -21.458 3.811 329 HE22 GLN 11 HE22 GLN 11 -3.708 -22.590 4.842 330 H THR 12 H THR 12 -5.479 -15.858 2.585 331 HA THR 12 HA THR 12 -4.922 -17.604 0.331 332 HB THR 12 HB THR 12 -7.616 -17.362 -0.019 333 HG1 THR 12 HG1 THR 12 -7.705 -16.615 2.245 334 HG21 THR 12 HG21 THR 12 -5.884 -19.544 1.071 335 HG22 THR 12 HG22 THR 12 -7.625 -19.790 0.942 336 HG23 THR 12 HG23 THR 12 -6.677 -19.423 -0.499 337 HA PRO 13 HA PRO 13 -5.262 -13.929 -2.044 338 HB2 PRO 13 HB2 PRO 13 -6.409 -14.800 -4.345 339 HB3 PRO 13 HB3 PRO 13 -4.741 -15.181 -3.899 340 HG2 PRO 13 HG2 PRO 13 -7.206 -16.857 -3.622 341 HG3 PRO 13 HG3 PRO 13 -5.588 -17.329 -4.173 342 HD2 PRO 13 HD2 PRO 13 -6.474 -17.826 -1.663 343 HD3 PRO 13 HD3 PRO 13 -4.768 -17.496 -2.025 344 H LEU 14 H LEU 14 -6.815 -12.885 -0.645 345 HA LEU 14 HA LEU 14 -9.628 -13.130 -1.336 346 HB2 LEU 14 HB2 LEU 14 -10.087 -11.849 0.571 347 HB3 LEU 14 HB3 LEU 14 -8.747 -12.901 1.026 348 HG LEU 14 HG LEU 14 -8.288 -10.067 0.142 349 HD11 LEU 14 HD11 LEU 14 -8.349 -10.691 3.031 350 HD12 LEU 14 HD12 LEU 14 -8.750 -9.199 2.180 351 HD13 LEU 14 HD13 LEU 14 -9.905 -10.532 2.216 352 HD21 LEU 14 HD21 LEU 14 -6.267 -11.201 0.175 353 HD22 LEU 14 HD22 LEU 14 -6.332 -10.483 1.785 354 HD23 LEU 14 HD23 LEU 14 -6.726 -12.188 1.564 355 H VAL 15 H VAL 15 -10.474 -10.513 -0.863 356 HA VAL 15 HA VAL 15 -9.091 -8.714 -2.641 357 HB VAL 15 HB VAL 15 -10.362 -10.177 -4.212 358 HG11 VAL 15 HG11 VAL 15 -12.569 -10.570 -4.049 359 HG12 VAL 15 HG12 VAL 15 -12.350 -10.094 -2.365 360 HG13 VAL 15 HG13 VAL 15 -12.929 -8.918 -3.546 361 HG21 VAL 15 HG21 VAL 15 -11.796 -7.723 -4.683 362 HG22 VAL 15 HG22 VAL 15 -10.146 -7.392 -4.156 363 HG23 VAL 15 HG23 VAL 15 -10.432 -8.412 -5.565 364 H THR 16 H THR 16 -9.588 -6.619 -2.230 365 HA THR 16 HA THR 16 -11.505 -6.130 -0.077 366 HB THR 16 HB THR 16 -9.358 -5.195 0.376 367 HG1 THR 16 HG1 THR 16 -10.545 -2.840 -0.493 368 HG21 THR 16 HG21 THR 16 -9.378 -4.625 -2.466 369 HG22 THR 16 HG22 THR 16 -8.896 -3.215 -1.522 370 HG23 THR 16 HG23 THR 16 -8.016 -4.733 -1.350 371 H LEU 17 H LEU 17 -13.514 -5.794 -0.814 372 HA LEU 17 HA LEU 17 -14.054 -4.565 -3.345 373 HB2 LEU 17 HB2 LEU 17 -15.431 -6.304 -1.926 374 HB3 LEU 17 HB3 LEU 17 -16.138 -4.845 -1.234 375 HG LEU 17 HG LEU 17 -16.163 -5.573 -4.163 376 HD11 LEU 17 HD11 LEU 17 -18.368 -6.271 -3.919 377 HD12 LEU 17 HD12 LEU 17 -17.558 -6.967 -2.515 378 HD13 LEU 17 HD13 LEU 17 -18.537 -5.511 -2.336 379 HD21 LEU 17 HD21 LEU 17 -17.292 -3.265 -2.602 380 HD22 LEU 17 HD22 LEU 17 -16.228 -3.224 -4.007 381 HD23 LEU 17 HD23 LEU 17 -17.908 -3.730 -4.188 382 H PHE 18 H PHE 18 -13.216 -2.496 -3.327 383 HA PHE 18 HA PHE 18 -14.286 -0.636 -1.321 384 HB2 PHE 18 HB2 PHE 18 -11.783 -0.754 -2.902 385 HB3 PHE 18 HB3 PHE 18 -12.463 0.849 -2.644 386 HD1 PHE 18 HD1 PHE 18 -12.966 -1.768 -0.162 387 HD2 PHE 18 HD2 PHE 18 -10.533 1.524 -1.329 388 HE1 PHE 18 HE1 PHE 18 -11.970 -1.712 2.087 389 HE2 PHE 18 HE2 PHE 18 -9.532 1.584 0.918 390 HZ PHE 18 HZ PHE 18 -10.250 -0.035 2.629 391 H LYS 19 H LYS 19 -16.200 0.112 -2.019 392 HA LYS 19 HA LYS 19 -16.248 1.462 -4.623 393 HB2 LYS 19 HB2 LYS 19 -17.381 -0.879 -4.576 394 HB3 LYS 19 HB3 LYS 19 -18.651 -0.066 -3.670 395 HG2 LYS 19 HG2 LYS 19 -19.000 1.481 -5.514 396 HG3 LYS 19 HG3 LYS 19 -17.697 0.708 -6.420 397 HD2 LYS 19 HD2 LYS 19 -20.027 -0.893 -5.428 398 HD3 LYS 19 HD3 LYS 19 -20.147 0.039 -6.922 399 HE2 LYS 19 HE2 LYS 19 -18.427 -1.200 -7.951 400 HE3 LYS 19 HE3 LYS 19 -17.906 -1.899 -6.419 401 HZ1 LYS 19 HZ1 LYS 19 -19.904 -3.191 -6.320 402 HZ2 LYS 19 HZ2 LYS 19 -20.527 -2.442 -7.704 403 HZ3 LYS 19 HZ3 LYS 19 -19.175 -3.453 -7.824 404 H ASN 20 H ASN 20 -17.750 3.195 -4.778 405 HA ASN 20 HA ASN 20 -18.647 5.131 -3.970 406 HB2 ASN 20 HB2 ASN 20 -20.042 2.982 -2.398 407 HB3 ASN 20 HB3 ASN 20 -20.421 4.680 -2.124 408 HD21 ASN 20 HD21 ASN 20 -22.102 5.368 -3.211 409 HD22 ASN 20 HD22 ASN 20 -22.627 4.799 -4.755 410 H ALA 21 H ALA 21 -16.112 4.602 -2.927 411 HA ALA 21 HA ALA 21 -16.238 5.186 -0.074 412 HB1 ALA 21 HB1 ALA 21 -13.596 5.264 -0.676 413 HB2 ALA 21 HB2 ALA 21 -14.475 3.801 -0.231 414 HB3 ALA 21 HB3 ALA 21 -14.197 4.180 -1.931 415 H ILE 22 H ILE 22 -16.239 7.190 0.684 416 HA ILE 22 HA ILE 22 -15.117 9.333 -1.002 417 HB ILE 22 HB ILE 22 -17.396 9.627 0.956 418 HG12 ILE 22 HG12 ILE 22 -17.497 9.589 -2.068 419 HG13 ILE 22 HG13 ILE 22 -17.985 8.248 -1.037 420 HG21 ILE 22 HG21 ILE 22 -15.673 11.505 -0.312 421 HG22 ILE 22 HG22 ILE 22 -17.299 11.699 -0.966 422 HG23 ILE 22 HG23 ILE 22 -17.029 11.807 0.774 423 HD11 ILE 22 HD11 ILE 22 -19.354 10.546 -0.137 424 HD12 ILE 22 HD12 ILE 22 -19.504 10.485 -1.893 425 HD13 ILE 22 HD13 ILE 22 -20.013 9.107 -0.916 426 H ILE 23 H ILE 23 -13.292 10.072 -0.156 427 HA ILE 23 HA ILE 23 -12.894 9.961 2.744 428 HB ILE 23 HB ILE 23 -10.998 10.268 0.433 429 HG12 ILE 23 HG12 ILE 23 -11.649 7.994 1.114 430 HG13 ILE 23 HG13 ILE 23 -9.944 8.296 1.433 431 HG21 ILE 23 HG21 ILE 23 -10.037 11.831 1.823 432 HG22 ILE 23 HG22 ILE 23 -10.594 11.025 3.290 433 HG23 ILE 23 HG23 ILE 23 -9.250 10.350 2.369 434 HD11 ILE 23 HD11 ILE 23 -10.667 8.856 3.809 435 HD12 ILE 23 HD12 ILE 23 -12.207 8.110 3.383 436 HD13 ILE 23 HD13 ILE 23 -10.721 7.164 3.316 437 H LYS 24 H LYS 24 -13.595 11.717 3.775 438 HA LYS 24 HA LYS 24 -13.077 14.353 2.566 439 HB2 LYS 24 HB2 LYS 24 -15.490 13.461 3.205 440 HB3 LYS 24 HB3 LYS 24 -15.017 14.009 4.809 441 HG2 LYS 24 HG2 LYS 24 -15.038 16.209 4.218 442 HG3 LYS 24 HG3 LYS 24 -14.636 15.876 2.532 443 HD2 LYS 24 HD2 LYS 24 -16.911 16.667 2.669 444 HD3 LYS 24 HD3 LYS 24 -16.915 14.962 2.212 445 HE2 LYS 24 HE2 LYS 24 -17.772 14.285 4.229 446 HE3 LYS 24 HE3 LYS 24 -17.098 15.661 5.100 447 HZ1 LYS 24 HZ1 LYS 24 -19.682 15.357 4.030 448 HZ2 LYS 24 HZ2 LYS 24 -19.063 16.637 4.947 449 HZ3 LYS 24 HZ3 LYS 24 -18.929 16.662 3.260 450 H ASN 25 H ASN 25 -11.164 15.005 3.376 451 HA ASN 25 HA ASN 25 -9.529 15.565 4.863 452 HB2 ASN 25 HB2 ASN 25 -11.933 16.102 6.623 453 HB3 ASN 25 HB3 ASN 25 -10.308 16.727 6.891 454 HD21 ASN 25 HD21 ASN 25 -12.041 18.614 6.823 455 HD22 ASN 25 HD22 ASN 25 -12.091 19.448 5.311 456 H ALA 26 H ALA 26 -9.963 12.830 4.752 457 HA ALA 26 HA ALA 26 -10.410 11.531 7.177 458 HB1 ALA 26 HB1 ALA 26 -8.711 10.770 4.812 459 HB2 ALA 26 HB2 ALA 26 -8.993 9.698 6.184 460 HB3 ALA 26 HB3 ALA 26 -10.348 10.236 5.193 461 H TYR 27 H TYR 27 -7.517 13.070 5.907 462 HA TYR 27 HA TYR 27 -6.213 12.607 8.507 463 HB2 TYR 27 HB2 TYR 27 -5.307 11.405 6.329 464 HB3 TYR 27 HB3 TYR 27 -4.559 12.972 6.047 465 HD1 TYR 27 HD1 TYR 27 -2.843 13.826 7.579 466 HD2 TYR 27 HD2 TYR 27 -4.548 9.963 8.104 467 HE1 TYR 27 HE1 TYR 27 -1.003 13.226 9.096 468 HE2 TYR 27 HE2 TYR 27 -2.713 9.353 9.623 469 HH TYR 27 HH TYR 27 -1.018 10.236 10.911 470 H LYS 28 H LYS 28 -6.556 14.546 9.458 471 HA LYS 28 HA LYS 28 -6.052 17.001 7.963 472 HB2 LYS 28 HB2 LYS 28 -6.934 16.769 10.838 473 HB3 LYS 28 HB3 LYS 28 -7.089 18.159 9.772 474 HG2 LYS 28 HG2 LYS 28 -8.665 16.846 8.377 475 HG3 LYS 28 HG3 LYS 28 -8.580 15.552 9.575 476 HD2 LYS 28 HD2 LYS 28 -10.468 16.696 10.251 477 HD3 LYS 28 HD3 LYS 28 -9.220 17.442 11.253 478 HE2 LYS 28 HE2 LYS 28 -9.053 19.092 9.200 479 HE3 LYS 28 HE3 LYS 28 -10.706 18.545 8.921 480 HZ1 LYS 28 HZ1 LYS 28 -10.075 20.574 10.520 481 HZ2 LYS 28 HZ2 LYS 28 -11.460 19.625 10.726 482 HZ3 LYS 28 HZ3 LYS 28 -10.077 19.313 11.648 483 H LYS 29 H LYS 29 -5.005 18.772 9.513 484 HA LYS 29 HA LYS 29 -2.289 18.154 9.710 485 HB2 LYS 29 HB2 LYS 29 -2.111 20.291 10.989 486 HB3 LYS 29 HB3 LYS 29 -2.989 20.440 9.473 487 HG2 LYS 29 HG2 LYS 29 -5.108 20.190 10.836 488 HG3 LYS 29 HG3 LYS 29 -4.095 20.411 12.264 489 HD2 LYS 29 HD2 LYS 29 -4.144 22.360 9.969 490 HD3 LYS 29 HD3 LYS 29 -5.215 22.492 11.365 491 HE2 LYS 29 HE2 LYS 29 -3.194 22.518 12.823 492 HE3 LYS 29 HE3 LYS 29 -2.201 22.566 11.367 493 HZ1 LYS 29 HZ1 LYS 29 -2.492 24.744 11.247 494 HZ2 LYS 29 HZ2 LYS 29 -4.176 24.575 11.239 495 HZ3 LYS 29 HZ3 LYS 29 -3.346 24.708 12.707 496 H GLY 30 H GLY 30 -1.106 18.733 11.930 497 HA2 GLY 30 HA2 GLY 30 -1.849 18.295 14.426 498 HA3 GLY 30 HA3 GLY 30 -2.015 16.667 13.786 499 H GLU 31 H GLU 31 0.169 16.514 12.107 500 HA GLU 31 HA GLU 31 2.229 15.863 13.899 501 HB2 GLU 31 HB2 GLU 31 2.607 16.387 10.953 502 HB3 GLU 31 HB3 GLU 31 3.538 15.310 11.985 503 HG2 GLU 31 HG2 GLU 31 1.343 14.032 12.303 504 HG3 GLU 31 HG3 GLU 31 0.769 14.946 10.909 505 H1 TYR 1 H TYR 1 0.528 7.530 6.156 506 HA TYR 1 HA TYR 1 -0.755 6.323 3.830 507 HB2 TYR 1 HB2 TYR 1 -1.691 6.171 6.693 508 HB3 TYR 1 HB3 TYR 1 -2.094 5.091 5.364 509 HD1 TYR 1 HD1 TYR 1 0.120 5.704 8.102 510 HD2 TYR 1 HD2 TYR 1 -0.215 3.661 4.385 511 HE1 TYR 1 HE1 TYR 1 1.970 4.222 8.757 512 HE2 TYR 1 HE2 TYR 1 1.633 2.172 5.030 513 HH TYR 1 HH TYR 1 3.330 2.583 8.122 514 H GLY 2 H GLY 2 -3.337 6.403 4.171 515 HA2 GLY 2 HA2 GLY 2 -4.617 8.640 5.162 516 HA3 GLY 2 HA3 GLY 2 -4.050 9.095 3.562 517 H GLY 3 H GLY 3 -6.626 9.272 3.731 518 HA2 GLY 3 HA2 GLY 3 -8.638 8.528 2.914 519 HA3 GLY 3 HA3 GLY 3 -7.669 7.561 1.812 520 H PHE 4 H PHE 4 -8.823 5.697 1.809 521 HA PHE 4 HA PHE 4 -9.819 4.519 4.232 522 HB2 PHE 4 HB2 PHE 4 -9.774 3.685 1.346 523 HB3 PHE 4 HB3 PHE 4 -10.257 2.547 2.600 524 HD1 PHE 4 HD1 PHE 4 -12.467 2.452 3.241 525 HD2 PHE 4 HD2 PHE 4 -11.000 5.984 1.374 526 HE1 PHE 4 HE1 PHE 4 -14.749 3.372 3.196 527 HE2 PHE 4 HE2 PHE 4 -13.279 6.910 1.328 528 HZ PHE 4 HZ PHE 4 -15.157 5.604 2.240 529 H MET 5 H MET 5 -9.124 2.614 5.223 530 HA MET 5 HA MET 5 -6.297 1.990 4.752 531 HB2 MET 5 HB2 MET 5 -7.376 2.684 7.059 532 HB3 MET 5 HB3 MET 5 -7.802 0.979 7.127 533 HG2 MET 5 HG2 MET 5 -5.254 0.673 6.532 534 HG3 MET 5 HG3 MET 5 -5.137 2.278 7.248 535 HE1 MET 5 HE1 MET 5 -3.875 -0.834 9.113 536 HE2 MET 5 HE2 MET 5 -5.385 -1.721 8.905 537 HE3 MET 5 HE3 MET 5 -4.605 -0.971 7.513 538 H THR 6 H THR 6 -6.272 0.464 3.172 539 HA THR 6 HA THR 6 -8.047 -1.848 3.389 540 HB THR 6 HB THR 6 -6.054 -1.643 1.187 541 HG1 THR 6 HG1 THR 6 -7.906 -0.288 0.185 542 HG21 THR 6 HG21 THR 6 -8.435 -3.091 1.769 543 HG22 THR 6 HG22 THR 6 -8.722 -2.108 0.333 544 HG23 THR 6 HG23 THR 6 -7.371 -3.241 0.370 545 H SER 7 H SER 7 -7.111 -2.914 5.158 546 HA SER 7 HA SER 7 -4.330 -3.773 4.919 547 HB2 SER 7 HB2 SER 7 -5.645 -2.935 7.092 548 HB3 SER 7 HB3 SER 7 -6.025 -4.654 7.203 549 HG SER 7 HG SER 7 -4.099 -4.188 8.304 550 H GLU 8 H GLU 8 -4.104 -5.450 3.566 551 HA GLU 8 HA GLU 8 -5.908 -7.753 3.928 552 HB2 GLU 8 HB2 GLU 8 -4.822 -6.458 1.493 553 HB3 GLU 8 HB3 GLU 8 -4.885 -8.215 1.482 554 HG2 GLU 8 HG2 GLU 8 -7.136 -8.275 1.389 555 HG3 GLU 8 HG3 GLU 8 -7.327 -6.834 2.385 556 H LYS 9 H LYS 9 -4.912 -9.306 5.018 557 HA LYS 9 HA LYS 9 -2.035 -9.736 4.558 558 HB2 LYS 9 HB2 LYS 9 -2.785 -9.127 6.888 559 HB3 LYS 9 HB3 LYS 9 -3.651 -10.656 6.938 560 HG2 LYS 9 HG2 LYS 9 -0.749 -10.661 6.269 561 HG3 LYS 9 HG3 LYS 9 -1.250 -10.440 7.947 562 HD2 LYS 9 HD2 LYS 9 -2.717 -12.521 7.560 563 HD3 LYS 9 HD3 LYS 9 -1.707 -12.789 6.136 564 HE2 LYS 9 HE2 LYS 9 -0.536 -13.998 7.681 565 HE3 LYS 9 HE3 LYS 9 0.241 -12.427 7.876 566 HZ1 LYS 9 HZ1 LYS 9 -0.263 -13.260 10.024 567 HZ2 LYS 9 HZ2 LYS 9 -1.359 -12.007 9.719 568 HZ3 LYS 9 HZ3 LYS 9 -1.861 -13.618 9.598 569 H SER 10 H SER 10 -1.756 -11.312 3.115 570 HA SER 10 HA SER 10 -2.797 -13.940 3.663 571 HB2 SER 10 HB2 SER 10 -3.838 -14.214 1.414 572 HB3 SER 10 HB3 SER 10 -4.689 -13.051 2.430 573 HG SER 10 HG SER 10 -4.052 -11.448 1.165 574 H GLN 11 H GLN 11 -1.469 -15.505 2.905 575 HA GLN 11 HA GLN 11 0.984 -14.643 1.622 576 HB2 GLN 11 HB2 GLN 11 1.732 -16.969 2.044 577 HB3 GLN 11 HB3 GLN 11 1.185 -16.149 3.500 578 HG2 GLN 11 HG2 GLN 11 -0.764 -17.407 3.628 579 HG3 GLN 11 HG3 GLN 11 -0.668 -17.901 1.939 580 HE21 GLN 11 HE21 GLN 11 0.287 -19.772 1.453 581 HE22 GLN 11 HE22 GLN 11 1.136 -20.775 2.574 582 H THR 12 H THR 12 -1.110 -14.336 -0.109 583 HA THR 12 HA THR 12 -0.342 -16.154 -2.237 584 HB THR 12 HB THR 12 -3.030 -16.159 -2.689 585 HG1 THR 12 HG1 THR 12 -3.267 -15.291 -0.479 586 HG21 THR 12 HG21 THR 12 -1.167 -18.121 -1.416 587 HG22 THR 12 HG22 THR 12 -2.877 -18.519 -1.574 588 HG23 THR 12 HG23 THR 12 -1.919 -18.162 -3.010 589 HA PRO 13 HA PRO 13 -0.893 -12.657 -4.829 590 HB2 PRO 13 HB2 PRO 13 -1.892 -13.741 -7.108 591 HB3 PRO 13 HB3 PRO 13 -0.216 -13.962 -6.594 592 HG2 PRO 13 HG2 PRO 13 -2.550 -15.813 -6.291 593 HG3 PRO 13 HG3 PRO 13 -0.882 -16.183 -6.768 594 HD2 PRO 13 HD2 PRO 13 -1.809 -16.611 -4.260 595 HD3 PRO 13 HD3 PRO 13 -0.123 -16.167 -4.592 596 H LEU 14 H LEU 14 -2.564 -11.653 -3.548 597 HA LEU 14 HA LEU 14 -5.326 -12.162 -4.302 598 HB2 LEU 14 HB2 LEU 14 -5.947 -10.822 -2.484 599 HB3 LEU 14 HB3 LEU 14 -4.548 -11.740 -1.932 600 HG LEU 14 HG LEU 14 -4.276 -8.930 -2.957 601 HD11 LEU 14 HD11 LEU 14 -4.393 -9.400 -0.041 602 HD12 LEU 14 HD12 LEU 14 -4.877 -7.993 -0.988 603 HD13 LEU 14 HD13 LEU 14 -5.926 -9.409 -0.912 604 HD21 LEU 14 HD21 LEU 14 -2.177 -9.901 -2.796 605 HD22 LEU 14 HD22 LEU 14 -2.354 -9.103 -1.233 606 HD23 LEU 14 HD23 LEU 14 -2.609 -10.842 -1.369 607 H VAL 15 H VAL 15 -6.384 -9.595 -3.997 608 HA VAL 15 HA VAL 15 -5.085 -7.791 -5.831 609 HB VAL 15 HB VAL 15 -6.191 -9.432 -7.354 610 HG11 VAL 15 HG11 VAL 15 -8.369 -9.977 -7.236 611 HG12 VAL 15 HG12 VAL 15 -8.240 -9.401 -5.575 612 HG13 VAL 15 HG13 VAL 15 -8.863 -8.333 -6.833 613 HG21 VAL 15 HG21 VAL 15 -7.783 -7.125 -8.010 614 HG22 VAL 15 HG22 VAL 15 -6.184 -6.638 -7.447 615 HG23 VAL 15 HG23 VAL 15 -6.339 -7.753 -8.805 616 H THR 16 H THR 16 -5.752 -5.723 -5.549 617 HA THR 16 HA THR 16 -7.771 -5.271 -3.483 618 HB THR 16 HB THR 16 -5.719 -4.148 -3.020 619 HG1 THR 16 HG1 THR 16 -7.045 -1.941 -4.055 620 HG21 THR 16 HG21 THR 16 -5.687 -3.731 -5.890 621 HG22 THR 16 HG22 THR 16 -5.338 -2.244 -5.009 622 HG23 THR 16 HG23 THR 16 -4.358 -3.685 -4.731 623 H LEU 17 H LEU 17 -9.774 -5.139 -4.300 624 HA LEU 17 HA LEU 17 -10.322 -4.087 -6.907 625 HB2 LEU 17 HB2 LEU 17 -11.607 -5.856 -5.443 626 HB3 LEU 17 HB3 LEU 17 -12.446 -4.426 -4.845 627 HG LEU 17 HG LEU 17 -12.322 -5.294 -7.733 628 HD11 LEU 17 HD11 LEU 17 -14.472 -6.152 -7.515 629 HD12 LEU 17 HD12 LEU 17 -13.657 -6.711 -6.054 630 HD13 LEU 17 HD13 LEU 17 -14.751 -5.329 -5.980 631 HD21 LEU 17 HD21 LEU 17 -13.674 -3.009 -6.323 632 HD22 LEU 17 HD22 LEU 17 -12.572 -2.952 -7.699 633 HD23 LEU 17 HD23 LEU 17 -14.202 -3.597 -7.900 634 H PHE 18 H PHE 18 -9.650 -1.960 -6.978 635 HA PHE 18 HA PHE 18 -10.929 -0.090 -5.108 636 HB2 PHE 18 HB2 PHE 18 -8.373 -0.090 -6.606 637 HB3 PHE 18 HB3 PHE 18 -9.183 1.466 -6.456 638 HD1 PHE 18 HD1 PHE 18 -9.568 -1.049 -3.850 639 HD2 PHE 18 HD2 PHE 18 -7.353 2.355 -5.124 640 HE1 PHE 18 HE1 PHE 18 -8.654 -0.798 -1.579 641 HE2 PHE 18 HE2 PHE 18 -6.436 2.612 -2.856 642 HZ PHE 18 HZ PHE 18 -7.085 1.034 -1.080 643 H LYS 19 H LYS 19 -12.866 0.478 -5.896 644 HA LYS 19 HA LYS 19 -12.935 1.679 -8.571 645 HB2 LYS 19 HB2 LYS 19 -13.886 -0.739 -8.427 646 HB3 LYS 19 HB3 LYS 19 -15.244 0.021 -7.608 647 HG2 LYS 19 HG2 LYS 19 -15.643 1.435 -9.547 648 HG3 LYS 19 HG3 LYS 19 -14.255 0.715 -10.367 649 HD2 LYS 19 HD2 LYS 19 -16.487 -1.007 -9.356 650 HD3 LYS 19 HD3 LYS 19 -16.634 -0.164 -10.900 651 HE2 LYS 19 HE2 LYS 19 -14.793 -1.315 -11.816 652 HE3 LYS 19 HE3 LYS 19 -14.267 -1.893 -10.236 653 HZ1 LYS 19 HZ1 LYS 19 -16.166 -3.328 -10.122 654 HZ2 LYS 19 HZ2 LYS 19 -16.796 -2.705 -11.563 655 HZ3 LYS 19 HZ3 LYS 19 -15.368 -3.612 -11.587 656 H ASN 20 H ASN 20 -14.551 3.283 -8.863 657 HA ASN 20 HA ASN 20 -15.622 5.180 -8.187 658 HB2 ASN 20 HB2 ASN 20 -16.901 3.014 -6.542 659 HB3 ASN 20 HB3 ASN 20 -17.418 4.689 -6.374 660 HD21 ASN 20 HD21 ASN 20 -19.108 5.186 -7.547 661 HD22 ASN 20 HD22 ASN 20 -19.535 4.497 -9.073 662 H ALA 21 H ALA 21 -13.091 4.907 -7.043 663 HA ALA 21 HA ALA 21 -13.355 5.620 -4.230 664 HB1 ALA 21 HB1 ALA 21 -10.709 5.883 -4.763 665 HB2 ALA 21 HB2 ALA 21 -11.483 4.379 -4.264 666 HB3 ALA 21 HB3 ALA 21 -11.183 4.691 -5.974 667 H ILE 22 H ILE 22 -13.533 7.653 -3.573 668 HA ILE 22 HA ILE 22 -12.534 9.794 -5.336 669 HB ILE 22 HB ILE 22 -14.890 9.995 -3.459 670 HG12 ILE 22 HG12 ILE 22 -14.891 9.818 -6.479 671 HG13 ILE 22 HG13 ILE 22 -15.300 8.486 -5.404 672 HG21 ILE 22 HG21 ILE 22 -13.280 11.947 -4.762 673 HG22 ILE 22 HG22 ILE 22 -14.894 11.981 -5.471 674 HG23 ILE 22 HG23 ILE 22 -14.691 12.186 -3.732 675 HD11 ILE 22 HD11 ILE 22 -16.880 10.699 -4.645 676 HD12 ILE 22 HD12 ILE 22 -16.969 10.550 -6.400 677 HD13 ILE 22 HD13 ILE 22 -17.394 9.178 -5.376 678 H ILE 23 H ILE 23 -10.799 10.717 -4.482 679 HA ILE 23 HA ILE 23 -10.485 10.783 -1.570 680 HB ILE 23 HB ILE 23 -8.545 11.119 -3.841 681 HG12 ILE 23 HG12 ILE 23 -9.043 8.839 -3.059 682 HG13 ILE 23 HG13 ILE 23 -7.377 9.287 -2.710 683 HG21 ILE 23 HG21 ILE 23 -7.756 12.822 -2.505 684 HG22 ILE 23 HG22 ILE 23 -8.288 12.044 -1.015 685 HG23 ILE 23 HG23 ILE 23 -6.869 11.437 -1.869 686 HD11 ILE 23 HD11 ILE 23 -8.213 9.909 -0.388 687 HD12 ILE 23 HD12 ILE 23 -9.679 9.027 -0.815 688 HD13 ILE 23 HD13 ILE 23 -8.125 8.194 -0.792 689 H LYS 24 H LYS 24 -11.353 12.529 -0.655 690 HA LYS 24 HA LYS 24 -11.004 15.132 -1.990 691 HB2 LYS 24 HB2 LYS 24 -13.356 14.085 -1.354 692 HB3 LYS 24 HB3 LYS 24 -12.969 14.757 0.225 693 HG2 LYS 24 HG2 LYS 24 -13.154 16.910 -0.489 694 HG3 LYS 24 HG3 LYS 24 -12.672 16.521 -2.142 695 HD2 LYS 24 HD2 LYS 24 -15.006 17.129 -2.118 696 HD3 LYS 24 HD3 LYS 24 -14.860 15.405 -2.470 697 HE2 LYS 24 HE2 LYS 24 -15.725 14.779 -0.442 698 HE3 LYS 24 HE3 LYS 24 -15.190 16.253 0.364 699 HZ1 LYS 24 HZ1 LYS 24 -17.707 15.681 -0.754 700 HZ2 LYS 24 HZ2 LYS 24 -17.219 17.059 0.097 701 HZ3 LYS 24 HZ3 LYS 24 -17.035 16.994 -1.583 702 H ASN 25 H ASN 25 -9.171 15.976 -1.175 703 HA ASN 25 HA ASN 25 -7.622 16.736 0.316 704 HB2 ASN 25 HB2 ASN 25 -10.108 17.183 1.983 705 HB3 ASN 25 HB3 ASN 25 -8.543 17.941 2.260 706 HD21 ASN 25 HD21 ASN 25 -10.406 19.687 2.042 707 HD22 ASN 25 HD22 ASN 25 -10.471 20.435 0.486 708 H ALA 26 H ALA 26 -7.842 13.975 0.349 709 HA ALA 26 HA ALA 26 -8.259 12.776 2.830 710 HB1 ALA 26 HB1 ALA 26 -6.438 12.027 0.555 711 HB2 ALA 26 HB2 ALA 26 -6.673 11.011 1.977 712 HB3 ALA 26 HB3 ALA 26 -8.038 11.385 0.925 713 H TYR 27 H TYR 27 -5.458 14.470 1.552 714 HA TYR 27 HA TYR 27 -4.203 14.255 4.209 715 HB2 TYR 27 HB2 TYR 27 -3.142 13.003 2.130 716 HB3 TYR 27 HB3 TYR 27 -2.502 14.605 1.779 717 HD1 TYR 27 HD1 TYR 27 -0.908 15.670 3.311 718 HD2 TYR 27 HD2 TYR 27 -2.335 11.721 4.000 719 HE1 TYR 27 HE1 TYR 27 0.921 15.295 4.913 720 HE2 TYR 27 HE2 TYR 27 -0.511 11.336 5.604 721 HH TYR 27 HH TYR 27 1.070 12.413 6.889 722 H LYS 28 H LYS 28 -4.719 16.213 5.032 723 HA LYS 28 HA LYS 28 -4.354 18.609 3.408 724 HB2 LYS 28 HB2 LYS 28 -5.304 18.481 6.267 725 HB3 LYS 28 HB3 LYS 28 -5.534 19.787 5.111 726 HG2 LYS 28 HG2 LYS 28 -6.963 18.274 3.764 727 HG3 LYS 28 HG3 LYS 28 -6.810 17.061 5.037 728 HD2 LYS 28 HD2 LYS 28 -8.801 18.086 5.601 729 HD3 LYS 28 HD3 LYS 28 -7.645 18.985 6.586 730 HE2 LYS 28 HE2 LYS 28 -7.552 20.524 4.444 731 HE3 LYS 28 HE3 LYS 28 -9.147 19.831 4.159 732 HZ1 LYS 28 HZ1 LYS 28 -8.724 21.992 5.650 733 HZ2 LYS 28 HZ2 LYS 28 -10.034 20.947 5.880 734 HZ3 LYS 28 HZ3 LYS 28 -8.656 20.801 6.850 735 H LYS 29 H LYS 29 -3.490 20.542 4.874 736 HA LYS 29 HA LYS 29 -0.744 20.150 5.180 737 HB2 LYS 29 HB2 LYS 29 -0.770 22.360 6.343 738 HB3 LYS 29 HB3 LYS 29 -1.610 22.358 4.798 739 HG2 LYS 29 HG2 LYS 29 -3.745 22.020 6.112 740 HG3 LYS 29 HG3 LYS 29 -2.798 22.385 7.556 741 HD2 LYS 29 HD2 LYS 29 -2.918 24.212 5.164 742 HD3 LYS 29 HD3 LYS 29 -4.039 24.331 6.523 743 HE2 LYS 29 HE2 LYS 29 -2.069 24.578 8.031 744 HE3 LYS 29 HE3 LYS 29 -1.039 24.631 6.601 745 HZ1 LYS 29 HZ1 LYS 29 -1.486 26.772 6.365 746 HZ2 LYS 29 HZ2 LYS 29 -3.151 26.478 6.319 747 HZ3 LYS 29 HZ3 LYS 29 -2.379 26.743 7.801 748 H GLY 30 H GLY 30 0.314 20.952 7.399 749 HA2 GLY 30 HA2 GLY 30 -0.465 20.585 9.894 750 HA3 GLY 30 HA3 GLY 30 -0.483 18.917 9.341 751 H GLU 31 H GLU 31 1.753 18.825 7.743 752 HA GLU 31 HA GLU 31 3.802 18.455 9.625 753 HB2 GLU 31 HB2 GLU 31 4.229 18.817 6.662 754 HB3 GLU 31 HB3 GLU 31 5.206 17.883 7.786 755 HG2 GLU 31 HG2 GLU 31 3.101 16.463 8.131 756 HG3 GLU 31 HG3 GLU 31 2.507 17.239 6.664 757 H1 TYR 1 H TYR 1 2.956 9.601 2.337 758 HA TYR 1 HA TYR 1 1.841 8.162 0.055 759 HB2 TYR 1 HB2 TYR 1 0.834 8.106 2.898 760 HB3 TYR 1 HB3 TYR 1 0.549 6.923 1.626 761 HD1 TYR 1 HD1 TYR 1 2.629 7.851 4.379 762 HD2 TYR 1 HD2 TYR 1 2.561 5.589 0.776 763 HE1 TYR 1 HE1 TYR 1 4.563 6.551 5.166 764 HE2 TYR 1 HE2 TYR 1 4.494 4.282 1.553 765 HH TYR 1 HH TYR 1 6.061 4.989 4.659 766 H GLY 2 H GLY 2 -0.749 8.062 0.323 767 HA2 GLY 2 HA2 GLY 2 -2.226 10.245 1.145 768 HA3 GLY 2 HA3 GLY 2 -1.642 10.655 -0.461 769 H GLY 3 H GLY 3 -4.225 10.644 -0.386 770 HA2 GLY 3 HA2 GLY 3 -6.149 9.701 -1.213 771 HA3 GLY 3 HA3 GLY 3 -5.073 8.756 -2.232 772 H PHE 4 H PHE 4 -6.082 6.811 -2.167 773 HA PHE 4 HA PHE 4 -7.063 5.687 0.288 774 HB2 PHE 4 HB2 PHE 4 -6.859 4.709 -2.546 775 HB3 PHE 4 HB3 PHE 4 -7.293 3.604 -1.246 776 HD1 PHE 4 HD1 PHE 4 -9.509 3.368 -0.663 777 HD2 PHE 4 HD2 PHE 4 -8.260 6.902 -2.679 778 HE1 PHE 4 HE1 PHE 4 -11.853 4.101 -0.822 779 HE2 PHE 4 HE2 PHE 4 -10.601 7.642 -2.841 780 HZ PHE 4 HZ PHE 4 -12.401 6.241 -1.911 781 H MET 5 H MET 5 -6.260 3.892 1.397 782 HA MET 5 HA MET 5 -3.379 3.466 1.042 783 HB2 MET 5 HB2 MET 5 -4.577 4.201 3.276 784 HB3 MET 5 HB3 MET 5 -4.877 2.475 3.430 785 HG2 MET 5 HG2 MET 5 -2.298 2.327 2.925 786 HG3 MET 5 HG3 MET 5 -2.320 3.978 3.542 787 HE1 MET 5 HE1 MET 5 -0.897 1.079 5.631 788 HE2 MET 5 HE2 MET 5 -2.335 0.076 5.435 789 HE3 MET 5 HE3 MET 5 -1.564 0.798 4.022 790 H THR 6 H THR 6 -3.190 1.862 -0.447 791 HA THR 6 HA THR 6 -4.795 -0.561 -0.151 792 HB THR 6 HB THR 6 -2.742 -0.335 -2.294 793 HG1 THR 6 HG1 THR 6 -4.648 0.827 -3.432 794 HG21 THR 6 HG21 THR 6 -5.035 -1.915 -1.708 795 HG22 THR 6 HG22 THR 6 -5.341 -1.033 -3.204 796 HG23 THR 6 HG23 THR 6 -3.916 -2.063 -3.064 797 H SER 7 H SER 7 -3.856 -1.468 1.699 798 HA SER 7 HA SER 7 -1.011 -2.121 1.609 799 HB2 SER 7 HB2 SER 7 -2.473 -1.277 3.685 800 HB3 SER 7 HB3 SER 7 -2.724 -3.012 3.875 801 HG SER 7 HG SER 7 -0.885 -2.335 5.017 802 H GLU 8 H GLU 8 -0.612 -3.841 0.351 803 HA GLU 8 HA GLU 8 -2.250 -6.254 0.775 804 HB2 GLU 8 HB2 GLU 8 -1.168 -5.006 -1.688 805 HB3 GLU 8 HB3 GLU 8 -1.103 -6.761 -1.606 806 HG2 GLU 8 HG2 GLU 8 -3.338 -6.994 -1.773 807 HG3 GLU 8 HG3 GLU 8 -3.671 -5.520 -0.864 808 H LYS 9 H LYS 9 -1.180 -7.657 1.993 809 HA LYS 9 HA LYS 9 1.735 -7.890 1.655 810 HB2 LYS 9 HB2 LYS 9 0.836 -7.228 3.922 811 HB3 LYS 9 HB3 LYS 9 0.106 -8.826 4.019 812 HG2 LYS 9 HG2 LYS 9 3.024 -8.593 3.462 813 HG3 LYS 9 HG3 LYS 9 2.430 -8.354 5.107 814 HD2 LYS 9 HD2 LYS 9 1.179 -10.577 4.748 815 HD3 LYS 9 HD3 LYS 9 2.272 -10.804 3.381 816 HE2 LYS 9 HE2 LYS 9 3.482 -11.835 5.021 817 HE3 LYS 9 HE3 LYS 9 4.094 -10.190 5.190 818 HZ1 LYS 9 HZ1 LYS 9 3.569 -10.995 7.343 819 HZ2 LYS 9 HZ2 LYS 9 2.375 -9.865 6.942 820 HZ3 LYS 9 HZ3 LYS 9 2.035 -11.521 6.859 821 H SER 10 H SER 10 2.191 -9.509 0.306 822 HA SER 10 HA SER 10 1.333 -12.180 0.953 823 HB2 SER 10 HB2 SER 10 0.405 -12.645 -1.314 824 HB3 SER 10 HB3 SER 10 -0.572 -11.504 -0.389 825 HG SER 10 HG SER 10 -0.008 -9.918 -1.711 826 H GLN 11 H GLN 11 2.800 -13.675 0.316 827 HA GLN 11 HA GLN 11 5.229 -12.685 -0.924 828 HB2 GLN 11 HB2 GLN 11 6.141 -14.918 -0.350 829 HB3 GLN 11 HB3 GLN 11 5.473 -14.073 1.040 830 HG2 GLN 11 HG2 GLN 11 3.625 -15.476 1.165 831 HG3 GLN 11 HG3 GLN 11 3.830 -16.048 -0.490 832 HE21 GLN 11 HE21 GLN 11 4.955 -17.854 -0.839 833 HE22 GLN 11 HE22 GLN 11 5.833 -18.725 0.367 834 H THR 12 H THR 12 3.201 -12.625 -2.745 835 HA THR 12 HA THR 12 4.182 -14.487 -4.742 836 HB THR 12 HB THR 12 1.524 -14.735 -5.285 837 HG1 THR 12 HG1 THR 12 1.137 -13.772 -3.133 838 HG21 THR 12 HG21 THR 12 3.487 -16.467 -3.841 839 HG22 THR 12 HG22 THR 12 1.820 -17.011 -4.030 840 HG23 THR 12 HG23 THR 12 2.799 -16.656 -5.453 841 HA PRO 13 HA PRO 13 3.452 -11.182 -7.536 842 HB2 PRO 13 HB2 PRO 13 2.627 -12.459 -9.785 843 HB3 PRO 13 HB3 PRO 13 4.296 -12.517 -9.204 844 HG2 PRO 13 HG2 PRO 13 2.106 -14.532 -8.880 845 HG3 PRO 13 HG3 PRO 13 3.813 -14.791 -9.281 846 HD2 PRO 13 HD2 PRO 13 2.831 -15.163 -6.786 847 HD3 PRO 13 HD3 PRO 13 4.488 -14.602 -7.085 848 H LEU 14 H LEU 14 1.664 -10.247 -6.373 849 HA LEU 14 HA LEU 14 -1.021 -11.017 -7.187 850 HB2 LEU 14 HB2 LEU 14 -1.813 -9.642 -5.464 851 HB3 LEU 14 HB3 LEU 14 -0.365 -10.412 -4.818 852 HG LEU 14 HG LEU 14 -0.284 -7.646 -5.984 853 HD11 LEU 14 HD11 LEU 14 -0.464 -7.965 -3.053 854 HD12 LEU 14 HD12 LEU 14 -1.039 -6.663 -4.094 855 HD13 LEU 14 HD13 LEU 14 -1.960 -8.161 -3.965 856 HD21 LEU 14 HD21 LEU 14 1.879 -8.436 -5.703 857 HD22 LEU 14 HD22 LEU 14 1.583 -7.567 -4.197 858 HD23 LEU 14 HD23 LEU 14 1.472 -9.327 -4.236 859 H VAL 15 H VAL 15 -2.288 -8.531 -7.055 860 HA VAL 15 HA VAL 15 -1.067 -6.726 -8.941 861 HB VAL 15 HB VAL 15 -1.989 -8.527 -10.405 862 HG11 VAL 15 HG11 VAL 15 -4.123 -9.230 -10.328 863 HG12 VAL 15 HG12 VAL 15 -4.099 -8.558 -8.698 864 HG13 VAL 15 HG13 VAL 15 -4.753 -7.610 -10.033 865 HG21 VAL 15 HG21 VAL 15 -3.724 -6.375 -11.226 866 HG22 VAL 15 HG22 VAL 15 -2.173 -5.755 -10.660 867 HG23 VAL 15 HG23 VAL 15 -2.225 -6.949 -11.956 868 H THR 16 H THR 16 -1.903 -4.704 -8.794 869 HA THR 16 HA THR 16 -4.021 -4.308 -6.818 870 HB THR 16 HB THR 16 -2.086 -2.999 -6.353 871 HG1 THR 16 HG1 THR 16 -3.537 -0.966 -7.563 872 HG21 THR 16 HG21 THR 16 -1.972 -2.746 -9.239 873 HG22 THR 16 HG22 THR 16 -1.775 -1.187 -8.438 874 HG23 THR 16 HG23 THR 16 -0.698 -2.525 -8.039 875 H LEU 17 H LEU 17 -6.001 -4.369 -7.693 876 HA LEU 17 HA LEU 17 -6.540 -3.506 -10.372 877 HB2 LEU 17 HB2 LEU 17 -7.732 -5.293 -8.853 878 HB3 LEU 17 HB3 LEU 17 -8.700 -3.906 -8.358 879 HG LEU 17 HG LEU 17 -8.411 -4.909 -11.191 880 HD11 LEU 17 HD11 LEU 17 -10.495 -5.922 -10.990 881 HD12 LEU 17 HD12 LEU 17 -9.686 -6.341 -9.480 882 HD13 LEU 17 HD13 LEU 17 -10.886 -5.049 -9.508 883 HD21 LEU 17 HD21 LEU 17 -9.984 -2.669 -9.945 884 HD22 LEU 17 HD22 LEU 17 -8.846 -2.596 -11.290 885 HD23 LEU 17 HD23 LEU 17 -10.412 -3.378 -11.503 886 H PHE 18 H PHE 18 -6.031 -1.338 -10.535 887 HA PHE 18 HA PHE 18 -7.514 0.518 -8.808 888 HB2 PHE 18 HB2 PHE 18 -4.919 0.645 -10.233 889 HB3 PHE 18 HB3 PHE 18 -5.854 2.137 -10.187 890 HD1 PHE 18 HD1 PHE 18 -6.127 -0.263 -7.463 891 HD2 PHE 18 HD2 PHE 18 -4.138 3.233 -8.855 892 HE1 PHE 18 HE1 PHE 18 -5.308 0.175 -5.184 893 HE2 PHE 18 HE2 PHE 18 -3.315 3.676 -6.579 894 HZ PHE 18 HZ PHE 18 -3.899 2.146 -4.740 895 H LYS 19 H LYS 19 -9.463 0.894 -9.680 896 HA LYS 19 HA LYS 19 -9.538 1.940 -12.419 897 HB2 LYS 19 HB2 LYS 19 -10.306 -0.533 -12.165 898 HB3 LYS 19 HB3 LYS 19 -11.743 0.161 -11.427 899 HG2 LYS 19 HG2 LYS 19 -12.190 1.433 -13.451 900 HG3 LYS 19 HG3 LYS 19 -10.725 0.785 -14.193 901 HD2 LYS 19 HD2 LYS 19 -12.848 -1.054 -13.150 902 HD3 LYS 19 HD3 LYS 19 -13.009 -0.309 -14.742 903 HE2 LYS 19 HE2 LYS 19 -11.052 -1.356 -15.539 904 HE3 LYS 19 HE3 LYS 19 -10.538 -1.808 -13.914 905 HZ1 LYS 19 HZ1 LYS 19 -12.320 -3.383 -13.780 906 HZ2 LYS 19 HZ2 LYS 19 -12.952 -2.883 -15.268 907 HZ3 LYS 19 HZ3 LYS 19 -11.458 -3.675 -15.206 908 H ASN 20 H ASN 20 -11.256 3.400 -12.843 909 HA ASN 20 HA ASN 20 -12.488 5.242 -12.303 910 HB2 ASN 20 HB2 ASN 20 -13.656 3.074 -10.580 911 HB3 ASN 20 HB3 ASN 20 -14.302 4.711 -10.521 912 HD21 ASN 20 HD21 ASN 20 -15.986 5.011 -11.767 913 HD22 ASN 20 HD22 ASN 20 -16.308 4.213 -13.265 914 H ALA 21 H ALA 21 -9.985 5.229 -11.076 915 HA ALA 21 HA ALA 21 -10.388 6.055 -8.311 916 HB1 ALA 21 HB1 ALA 21 -7.759 6.515 -8.796 917 HB2 ALA 21 HB2 ALA 21 -8.418 4.979 -8.235 918 HB3 ALA 21 HB3 ALA 21 -8.099 5.227 -9.951 919 H ILE 22 H ILE 22 -10.755 8.094 -7.761 920 HA ILE 22 HA ILE 22 -9.888 10.226 -9.604 921 HB ILE 22 HB ILE 22 -12.302 10.317 -7.794 922 HG12 ILE 22 HG12 ILE 22 -12.201 9.989 -10.800 923 HG13 ILE 22 HG13 ILE 22 -12.542 8.688 -9.664 924 HG21 ILE 22 HG21 ILE 22 -10.825 12.334 -9.154 925 HG22 ILE 22 HG22 ILE 22 -12.416 12.197 -9.903 926 HG23 ILE 22 HG23 ILE 22 -12.279 12.502 -8.171 927 HD11 ILE 22 HD11 ILE 22 -14.307 10.810 -9.073 928 HD12 ILE 22 HD12 ILE 22 -14.329 10.562 -10.819 929 HD13 ILE 22 HD13 ILE 22 -14.681 9.218 -9.733 930 H ILE 23 H ILE 23 -8.253 11.322 -8.755 931 HA ILE 23 HA ILE 23 -8.033 11.560 -5.843 932 HB ILE 23 HB ILE 23 -6.057 11.932 -8.077 933 HG12 ILE 23 HG12 ILE 23 -6.402 9.663 -7.187 934 HG13 ILE 23 HG13 ILE 23 -4.786 10.256 -6.823 935 HG21 ILE 23 HG21 ILE 23 -5.441 13.757 -6.813 936 HG22 ILE 23 HG22 ILE 23 -5.958 13.016 -5.298 937 HG23 ILE 23 HG23 ILE 23 -4.471 12.479 -6.081 938 HD11 ILE 23 HD11 ILE 23 -5.729 10.929 -4.558 939 HD12 ILE 23 HD12 ILE 23 -7.114 9.917 -4.972 940 HD13 ILE 23 HD13 ILE 23 -5.502 9.207 -4.869 941 H LYS 24 H LYS 24 -9.060 13.277 -5.046 942 HA LYS 24 HA LYS 24 -8.876 15.827 -6.510 943 HB2 LYS 24 HB2 LYS 24 -11.156 14.632 -5.873 944 HB3 LYS 24 HB3 LYS 24 -10.866 15.414 -4.325 945 HG2 LYS 24 HG2 LYS 24 -11.202 17.505 -5.157 946 HG3 LYS 24 HG3 LYS 24 -10.639 17.073 -6.773 947 HD2 LYS 24 HD2 LYS 24 -13.012 17.490 -6.847 948 HD3 LYS 24 HD3 LYS 24 -12.721 15.767 -7.100 949 HE2 LYS 24 HE2 LYS 24 -13.598 15.181 -5.065 950 HE3 LYS 24 HE3 LYS 24 -13.206 16.734 -4.327 951 HZ1 LYS 24 HZ1 LYS 24 -15.633 15.905 -5.479 952 HZ2 LYS 24 HZ2 LYS 24 -15.282 17.361 -4.693 953 HZ3 LYS 24 HZ3 LYS 24 -15.041 17.221 -6.361 954 H ASN 25 H ASN 25 -7.136 16.854 -5.699 955 HA ASN 25 HA ASN 25 -5.692 17.810 -4.214 956 HB2 ASN 25 HB2 ASN 25 -8.249 18.148 -2.630 957 HB3 ASN 25 HB3 ASN 25 -6.756 19.043 -2.366 958 HD21 ASN 25 HD21 ASN 25 -8.742 20.621 -2.720 959 HD22 ASN 25 HD22 ASN 25 -8.827 21.274 -4.318 960 H ALA 26 H ALA 26 -5.701 15.046 -4.036 961 HA ALA 26 HA ALA 26 -6.095 13.950 -1.504 962 HB1 ALA 26 HB1 ALA 26 -4.154 13.227 -3.687 963 HB2 ALA 26 HB2 ALA 26 -4.356 12.272 -2.219 964 HB3 ALA 26 HB3 ALA 26 -5.712 12.484 -3.326 965 H TYR 27 H TYR 27 -3.399 15.793 -2.801 966 HA TYR 27 HA TYR 27 -2.211 15.821 -0.106 967 HB2 TYR 27 HB2 TYR 27 -0.996 14.536 -2.077 968 HB3 TYR 27 HB3 TYR 27 -0.468 16.159 -2.507 969 HD1 TYR 27 HD1 TYR 27 0.989 17.433 -0.995 970 HD2 TYR 27 HD2 TYR 27 -0.147 13.429 -0.117 971 HE1 TYR 27 HE1 TYR 27 2.791 17.294 0.673 972 HE2 TYR 27 HE2 TYR 27 1.651 13.279 1.555 973 HH TYR 27 HH TYR 27 3.103 14.547 2.816 974 H LYS 28 H LYS 28 -2.899 17.777 0.585 975 HA LYS 28 HA LYS 28 -2.661 20.098 -1.168 976 HB2 LYS 28 HB2 LYS 28 -3.689 20.069 1.666 977 HB3 LYS 28 HB3 LYS 28 -3.985 21.275 0.421 978 HG2 LYS 28 HG2 LYS 28 -5.253 19.576 -0.859 979 HG3 LYS 28 HG3 LYS 28 -5.037 18.455 0.487 980 HD2 LYS 28 HD2 LYS 28 -7.120 19.345 0.941 981 HD3 LYS 28 HD3 LYS 28 -6.068 20.388 1.901 982 HE2 LYS 28 HE2 LYS 28 -6.036 21.808 -0.324 983 HE3 LYS 28 HE3 LYS 28 -7.563 20.974 -0.606 984 HZ1 LYS 28 HZ1 LYS 28 -7.354 23.241 0.767 985 HZ2 LYS 28 HZ2 LYS 28 -8.584 22.109 1.027 986 HZ3 LYS 28 HZ3 LYS 28 -7.225 22.129 2.036 987 H LYS 29 H LYS 29 -1.985 22.172 0.192 988 HA LYS 29 HA LYS 29 0.767 22.011 0.601 989 HB2 LYS 29 HB2 LYS 29 0.537 24.271 1.639 990 HB3 LYS 29 HB3 LYS 29 -0.249 24.121 0.073 991 HG2 LYS 29 HG2 LYS 29 -2.395 23.691 1.341 992 HG3 LYS 29 HG3 LYS 29 -1.527 24.203 2.789 993 HD2 LYS 29 HD2 LYS 29 -1.698 25.888 0.300 994 HD3 LYS 29 HD3 LYS 29 -2.878 25.989 1.609 995 HE2 LYS 29 HE2 LYS 29 -0.996 26.468 3.171 996 HE3 LYS 29 HE3 LYS 29 0.085 26.526 1.779 997 HZ1 LYS 29 HZ1 LYS 29 -0.514 28.610 1.406 998 HZ2 LYS 29 HZ2 LYS 29 -2.149 28.185 1.320 999 HZ3 LYS 29 HZ3 LYS 29 -1.457 28.588 2.810 1000 H GLY 30 H GLY 30 1.688 23.017 2.802 1001 HA2 GLY 30 HA2 GLY 30 0.865 22.725 5.291 1002 HA3 GLY 30 HA3 GLY 30 0.989 21.033 4.833 1003 H GLU 31 H GLU 31 3.272 21.015 3.310 1004 HA GLU 31 HA GLU 31 5.285 20.911 5.261 1005 HB2 GLU 31 HB2 GLU 31 5.775 21.141 2.294 1006 HB3 GLU 31 HB3 GLU 31 6.784 20.348 3.495 1007 HG2 GLU 31 HG2 GLU 31 4.782 18.793 3.866 1008 HG3 GLU 31 HG3 GLU 31 4.177 19.438 2.341 1009 H1 TYR 1 H TYR 1 5.343 11.612 -1.489 1010 HA TYR 1 HA TYR 1 4.405 9.992 -3.725 1011 HB2 TYR 1 HB2 TYR 1 3.313 10.003 -0.913 1012 HB3 TYR 1 HB3 TYR 1 3.162 8.738 -2.128 1013 HD1 TYR 1 HD1 TYR 1 5.083 9.978 0.622 1014 HD2 TYR 1 HD2 TYR 1 5.287 7.513 -2.840 1015 HE1 TYR 1 HE1 TYR 1 7.084 8.876 1.532 1016 HE2 TYR 1 HE2 TYR 1 7.288 6.403 -1.939 1017 HH TYR 1 HH TYR 1 8.709 7.406 1.156 1018 H GLY 2 H GLY 2 1.826 9.704 -3.537 1019 HA2 GLY 2 HA2 GLY 2 0.158 11.804 -2.873 1020 HA3 GLY 2 HA3 GLY 2 0.762 12.174 -4.481 1021 H GLY 3 H GLY 3 -1.814 11.965 -4.480 1022 HA2 GLY 3 HA2 GLY 3 -3.631 10.832 -5.309 1023 HA3 GLY 3 HA3 GLY 3 -2.454 9.923 -6.244 1024 H PHE 4 H PHE 4 -3.315 7.911 -6.101 1025 HA PHE 4 HA PHE 4 -4.287 6.844 -3.617 1026 HB2 PHE 4 HB2 PHE 4 -3.917 5.740 -6.387 1027 HB3 PHE 4 HB3 PHE 4 -4.305 4.672 -5.042 1028 HD1 PHE 4 HD1 PHE 4 -6.513 4.292 -4.507 1029 HD2 PHE 4 HD2 PHE 4 -5.479 7.805 -6.677 1030 HE1 PHE 4 HE1 PHE 4 -8.900 4.828 -4.770 1031 HE2 PHE 4 HE2 PHE 4 -7.864 8.347 -6.942 1032 HZ PHE 4 HZ PHE 4 -9.579 6.858 -5.988 1033 H MET 5 H MET 5 -3.383 5.186 -2.383 1034 HA MET 5 HA MET 5 -0.468 4.962 -2.639 1035 HB2 MET 5 HB2 MET 5 -1.778 5.733 -0.485 1036 HB3 MET 5 HB3 MET 5 -1.966 4.002 -0.236 1037 HG2 MET 5 HG2 MET 5 0.630 3.999 -0.661 1038 HG3 MET 5 HG3 MET 5 0.482 5.679 -0.149 1039 HE1 MET 5 HE1 MET 5 2.029 3.019 2.154 1040 HE2 MET 5 HE2 MET 5 0.669 1.910 1.985 1041 HE3 MET 5 HE3 MET 5 1.432 2.594 0.550 1042 H THR 6 H THR 6 -0.111 3.293 -4.020 1043 HA THR 6 HA THR 6 -1.543 0.776 -3.629 1044 HB THR 6 HB THR 6 0.562 1.043 -5.719 1045 HG1 THR 6 HG1 THR 6 -1.385 1.974 -6.985 1046 HG21 THR 6 HG21 THR 6 -1.607 -0.692 -5.106 1047 HG22 THR 6 HG22 THR 6 -1.940 0.075 -6.658 1048 HG23 THR 6 HG23 THR 6 -0.438 -0.818 -6.420 1049 H SER 7 H SER 7 -0.608 0.043 -1.704 1050 HA SER 7 HA SER 7 2.280 -0.394 -1.664 1051 HB2 SER 7 HB2 SER 7 0.684 0.446 0.312 1052 HB3 SER 7 HB3 SER 7 0.553 -1.291 0.591 1053 HG SER 7 HG SER 7 2.294 -0.418 1.754 1054 H GLU 8 H GLU 8 2.856 -2.143 -2.806 1055 HA GLU 8 HA GLU 8 1.389 -4.650 -2.303 1056 HB2 GLU 8 HB2 GLU 8 2.469 -3.458 -4.795 1057 HB3 GLU 8 HB3 GLU 8 2.652 -5.196 -4.612 1058 HG2 GLU 8 HG2 GLU 8 0.444 -5.595 -4.837 1059 HG3 GLU 8 HG3 GLU 8 -0.022 -4.099 -4.029 1060 H LYS 9 H LYS 9 2.515 -5.906 -0.981 1061 HA LYS 9 HA LYS 9 5.451 -5.926 -1.206 1062 HB2 LYS 9 HB2 LYS 9 4.416 -5.223 0.991 1063 HB3 LYS 9 HB3 LYS 9 3.811 -6.866 1.148 1064 HG2 LYS 9 HG2 LYS 9 6.720 -6.427 0.679 1065 HG3 LYS 9 HG3 LYS 9 6.047 -6.156 2.288 1066 HD2 LYS 9 HD2 LYS 9 4.989 -8.489 1.999 1067 HD3 LYS 9 HD3 LYS 9 6.154 -8.693 0.688 1068 HE2 LYS 9 HE2 LYS 9 7.376 -9.537 2.420 1069 HE3 LYS 9 HE3 LYS 9 7.840 -7.841 2.535 1070 HZ1 LYS 9 HZ1 LYS 9 7.291 -8.590 4.702 1071 HZ2 LYS 9 HZ2 LYS 9 6.024 -7.587 4.199 1072 HZ3 LYS 9 HZ3 LYS 9 5.830 -9.268 4.183 1073 H SER 10 H SER 10 6.076 -7.570 -2.453 1074 HA SER 10 HA SER 10 5.409 -10.264 -1.691 1075 HB2 SER 10 HB2 SER 10 4.591 -10.916 -3.955 1076 HB3 SER 10 HB3 SER 10 3.498 -9.815 -3.117 1077 HG SER 10 HG SER 10 3.972 -8.255 -4.503 1078 H GLN 11 H GLN 11 7.029 -11.645 -2.170 1079 HA GLN 11 HA GLN 11 9.400 -10.535 -3.411 1080 HB2 GLN 11 HB2 GLN 11 10.473 -12.645 -2.685 1081 HB3 GLN 11 HB3 GLN 11 9.687 -11.792 -1.364 1082 HG2 GLN 11 HG2 GLN 11 7.964 -13.343 -1.219 1083 HG3 GLN 11 HG3 GLN 11 8.269 -13.974 -2.837 1084 HE21 GLN 11 HE21 GLN 11 9.552 -15.693 -3.061 1085 HE22 GLN 11 HE22 GLN 11 10.461 -16.427 -1.789 1086 H THR 12 H THR 12 7.466 -10.717 -5.302 1087 HA THR 12 HA THR 12 8.646 -12.606 -7.156 1088 HB THR 12 HB THR 12 6.033 -13.088 -7.764 1089 HG1 THR 12 HG1 THR 12 5.501 -12.055 -5.679 1090 HG21 THR 12 HG21 THR 12 8.076 -14.588 -6.177 1091 HG22 THR 12 HG22 THR 12 6.464 -15.270 -6.389 1092 HG23 THR 12 HG23 THR 12 7.460 -14.908 -7.798 1093 HA PRO 13 HA PRO 13 7.765 -9.518 -10.147 1094 HB2 PRO 13 HB2 PRO 13 7.133 -10.973 -12.350 1095 HB3 PRO 13 HB3 PRO 13 8.777 -10.864 -11.711 1096 HG2 PRO 13 HG2 PRO 13 6.745 -13.032 -11.351 1097 HG3 PRO 13 HG3 PRO 13 8.482 -13.170 -11.679 1098 HD2 PRO 13 HD2 PRO 13 7.437 -13.493 -9.202 1099 HD3 PRO 13 HD3 PRO 13 9.054 -12.813 -9.475 1100 H LEU 14 H LEU 14 5.865 -8.667 -9.108 1101 HA LEU 14 HA LEU 14 3.284 -9.698 -9.969 1102 HB2 LEU 14 HB2 LEU 14 2.317 -8.306 -8.352 1103 HB3 LEU 14 HB3 LEU 14 3.793 -8.924 -7.615 1104 HG LEU 14 HG LEU 14 3.702 -6.221 -8.920 1105 HD11 LEU 14 HD11 LEU 14 3.447 -6.401 -5.985 1106 HD12 LEU 14 HD12 LEU 14 2.794 -5.214 -7.114 1107 HD13 LEU 14 HD13 LEU 14 2.003 -6.779 -6.925 1108 HD21 LEU 14 HD21 LEU 14 5.909 -6.827 -8.529 1109 HD22 LEU 14 HD22 LEU 14 5.492 -5.902 -7.086 1110 HD23 LEU 14 HD23 LEU 14 5.518 -7.665 -7.027 1111 H VAL 15 H VAL 15 1.815 -7.326 -10.019 1112 HA VAL 15 HA VAL 15 2.963 -5.528 -11.960 1113 HB VAL 15 HB VAL 15 2.226 -7.471 -13.347 1114 HG11 VAL 15 HG11 VAL 15 0.147 -8.325 -13.294 1115 HG12 VAL 15 HG12 VAL 15 0.069 -7.568 -11.704 1116 HG13 VAL 15 HG13 VAL 15 -0.609 -6.743 -13.107 1117 HG21 VAL 15 HG21 VAL 15 0.368 -5.505 -14.342 1118 HG22 VAL 15 HG22 VAL 15 1.845 -4.737 -13.761 1119 HG23 VAL 15 HG23 VAL 15 1.933 -5.999 -14.989 1120 H THR 16 H THR 16 1.963 -3.574 -11.968 1121 HA THR 16 HA THR 16 -0.236 -3.233 -10.069 1122 HB THR 16 HB THR 16 1.577 -1.751 -9.632 1123 HG1 THR 16 HG1 THR 16 0.015 0.091 -10.999 1124 HG21 THR 16 HG21 THR 16 1.763 -1.658 -12.523 1125 HG22 THR 16 HG22 THR 16 1.812 -0.043 -11.815 1126 HG23 THR 16 HG23 THR 16 2.977 -1.266 -11.306 1127 H LEU 17 H LEU 17 -2.179 -3.493 -10.986 1128 HA LEU 17 HA LEU 17 -2.701 -2.826 -13.726 1129 HB2 LEU 17 HB2 LEU 17 -3.792 -4.622 -12.145 1130 HB3 LEU 17 HB3 LEU 17 -4.881 -3.295 -11.750 1131 HG LEU 17 HG LEU 17 -4.432 -4.419 -14.514 1132 HD11 LEU 17 HD11 LEU 17 -6.436 -5.579 -14.311 1133 HD12 LEU 17 HD12 LEU 17 -5.647 -5.849 -12.757 1134 HD13 LEU 17 HD13 LEU 17 -6.940 -4.658 -12.894 1135 HD21 LEU 17 HD21 LEU 17 -6.205 -2.243 -13.439 1136 HD22 LEU 17 HD22 LEU 17 -5.036 -2.156 -14.756 1137 HD23 LEU 17 HD23 LEU 17 -6.532 -3.066 -14.964 1138 H PHE 18 H PHE 18 -2.365 -0.636 -13.998 1139 HA PHE 18 HA PHE 18 -4.046 1.181 -12.417 1140 HB2 PHE 18 HB2 PHE 18 -1.425 1.448 -13.776 1141 HB3 PHE 18 HB3 PHE 18 -2.477 2.859 -13.828 1142 HD1 PHE 18 HD1 PHE 18 -2.645 0.581 -10.995 1143 HD2 PHE 18 HD2 PHE 18 -0.886 4.148 -12.510 1144 HE1 PHE 18 HE1 PHE 18 -1.932 1.191 -8.720 1145 HE2 PHE 18 HE2 PHE 18 -0.169 4.763 -10.238 1146 HZ PHE 18 HZ PHE 18 -0.691 3.284 -8.340 1147 H LYS 19 H LYS 19 -5.985 1.369 -13.360 1148 HA LYS 19 HA LYS 19 -6.052 2.252 -16.156 1149 HB2 LYS 19 HB2 LYS 19 -6.635 -0.256 -15.788 1150 HB3 LYS 19 HB3 LYS 19 -8.144 0.360 -15.127 1151 HG2 LYS 19 HG2 LYS 19 -8.626 1.484 -17.229 1152 HG3 LYS 19 HG3 LYS 19 -7.093 0.915 -17.895 1153 HD2 LYS 19 HD2 LYS 19 -9.100 -1.026 -16.810 1154 HD3 LYS 19 HD3 LYS 19 -9.265 -0.384 -18.445 1155 HE2 LYS 19 HE2 LYS 19 -7.207 -1.315 -19.124 1156 HE3 LYS 19 HE3 LYS 19 -6.717 -1.639 -17.462 1157 HZ1 LYS 19 HZ1 LYS 19 -8.375 -3.339 -17.295 1158 HZ2 LYS 19 HZ2 LYS 19 -8.997 -2.967 -18.824 1159 HZ3 LYS 19 HZ3 LYS 19 -7.449 -3.636 -18.680 1160 H ASN 20 H ASN 20 -7.857 3.552 -16.708 1161 HA ASN 20 HA ASN 20 -9.246 5.318 -16.307 1162 HB2 ASN 20 HB2 ASN 20 -10.301 3.156 -14.506 1163 HB3 ASN 20 HB3 ASN 20 -11.071 4.740 -14.549 1164 HD21 ASN 20 HD21 ASN 20 -12.734 4.844 -15.854 1165 HD22 ASN 20 HD22 ASN 20 -12.946 3.951 -17.318 1166 H ALA 21 H ALA 21 -6.794 5.577 -15.016 1167 HA ALA 21 HA ALA 21 -7.345 6.503 -12.310 1168 HB1 ALA 21 HB1 ALA 21 -4.740 7.165 -12.808 1169 HB2 ALA 21 HB2 ALA 21 -5.288 5.648 -12.096 1170 HB3 ALA 21 HB3 ALA 21 -4.966 5.743 -13.827 1171 H ILE 22 H ILE 22 -7.875 8.532 -11.863 1172 HA ILE 22 HA ILE 22 -7.145 10.634 -13.797 1173 HB ILE 22 HB ILE 22 -9.608 10.609 -12.050 1174 HG12 ILE 22 HG12 ILE 22 -9.385 10.138 -15.031 1175 HG13 ILE 22 HG13 ILE 22 -9.673 8.880 -13.835 1176 HG21 ILE 22 HG21 ILE 22 -8.265 12.677 -13.473 1177 HG22 ILE 22 HG22 ILE 22 -9.818 12.372 -14.251 1178 HG23 ILE 22 HG23 ILE 22 -9.755 12.768 -12.534 1179 HD11 ILE 22 HD11 ILE 22 -11.606 10.893 -13.419 1180 HD12 ILE 22 HD12 ILE 22 -11.547 10.554 -15.149 1181 HD13 ILE 22 HD13 ILE 22 -11.841 9.246 -14.004 1182 H ILE 23 H ILE 23 -5.618 11.888 -12.963 1183 HA ILE 23 HA ILE 23 -5.505 12.295 -10.064 1184 HB ILE 23 HB ILE 23 -3.500 12.711 -12.264 1185 HG12 ILE 23 HG12 ILE 23 -3.697 10.467 -11.265 1186 HG13 ILE 23 HG13 ILE 23 -2.140 11.202 -10.899 1187 HG21 ILE 23 HG21 ILE 23 -3.084 14.644 -11.071 1188 HG22 ILE 23 HG22 ILE 23 -3.555 13.920 -9.533 1189 HG23 ILE 23 HG23 ILE 23 -2.015 13.487 -10.276 1190 HD11 ILE 23 HD11 ILE 23 -3.173 11.907 -8.690 1191 HD12 ILE 23 HD12 ILE 23 -4.484 10.793 -9.079 1192 HD13 ILE 23 HD13 ILE 23 -2.835 10.190 -8.911 1193 H LYS 24 H LYS 24 -6.703 13.958 -9.396 1194 HA LYS 24 HA LYS 24 -6.674 16.436 -10.986 1195 HB2 LYS 24 HB2 LYS 24 -8.869 15.099 -10.341 1196 HB3 LYS 24 HB3 LYS 24 -8.683 15.974 -8.826 1197 HG2 LYS 24 HG2 LYS 24 -9.172 17.985 -9.763 1198 HG3 LYS 24 HG3 LYS 24 -8.515 17.537 -11.338 1199 HD2 LYS 24 HD2 LYS 24 -10.906 17.743 -11.521 1200 HD3 LYS 24 HD3 LYS 24 -10.467 16.039 -11.670 1201 HE2 LYS 24 HE2 LYS 24 -11.374 15.488 -9.638 1202 HE3 LYS 24 HE3 LYS 24 -11.139 17.104 -8.973 1203 HZ1 LYS 24 HZ1 LYS 24 -13.442 16.016 -10.168 1204 HZ2 LYS 24 HZ2 LYS 24 -13.244 17.532 -9.444 1205 HZ3 LYS 24 HZ3 LYS 24 -12.924 17.334 -11.093 1206 H ASN 25 H ASN 25 -5.039 17.636 -10.193 1207 HA ASN 25 HA ASN 25 -3.714 18.780 -8.731 1208 HB2 ASN 25 HB2 ASN 25 -6.336 19.005 -7.235 1209 HB3 ASN 25 HB3 ASN 25 -4.922 20.023 -6.978 1210 HD21 ASN 25 HD21 ASN 25 -7.012 21.422 -7.472 1211 HD22 ASN 25 HD22 ASN 25 -7.094 21.984 -9.104 1212 H ALA 26 H ALA 26 -3.516 16.038 -8.397 1213 HA ALA 26 HA ALA 26 -3.897 15.053 -5.818 1214 HB1 ALA 26 HB1 ALA 26 -1.844 14.368 -7.909 1215 HB2 ALA 26 HB2 ALA 26 -2.014 13.481 -6.395 1216 HB3 ALA 26 HB3 ALA 26 -3.350 13.526 -7.545 1217 H TYR 27 H TYR 27 -1.307 17.020 -7.153 1218 HA TYR 27 HA TYR 27 -0.209 17.293 -4.433 1219 HB2 TYR 27 HB2 TYR 27 1.159 15.994 -6.292 1220 HB3 TYR 27 HB3 TYR 27 1.578 17.625 -6.804 1221 HD1 TYR 27 HD1 TYR 27 2.889 19.091 -5.333 1222 HD2 TYR 27 HD2 TYR 27 2.026 15.069 -4.247 1223 HE1 TYR 27 HE1 TYR 27 4.645 19.185 -3.613 1224 HE2 TYR 27 HE2 TYR 27 3.778 15.152 -2.523 1225 HH TYR 27 HH TYR 27 5.093 16.597 -1.302 1226 H LYS 28 H LYS 28 -1.070 19.227 -3.881 1227 HA LYS 28 HA LYS 28 -0.946 21.455 -5.761 1228 HB2 LYS 28 HB2 LYS 28 -2.059 21.517 -2.960 1229 HB3 LYS 28 HB3 LYS 28 -2.410 22.615 -4.288 1230 HG2 LYS 28 HG2 LYS 28 -3.505 20.748 -5.486 1231 HG3 LYS 28 HG3 LYS 28 -3.237 19.728 -4.070 1232 HD2 LYS 28 HD2 LYS 28 -5.397 20.470 -3.722 1233 HD3 LYS 28 HD3 LYS 28 -4.457 21.642 -2.795 1234 HE2 LYS 28 HE2 LYS 28 -4.472 22.942 -5.093 1235 HE3 LYS 28 HE3 LYS 28 -5.921 21.975 -5.367 1236 HZ1 LYS 28 HZ1 LYS 28 -5.928 24.321 -4.113 1237 HZ2 LYS 28 HZ2 LYS 28 -7.075 23.110 -3.827 1238 HZ3 LYS 28 HZ3 LYS 28 -5.754 23.288 -2.784 1239 H LYS 29 H LYS 29 -0.467 23.649 -4.517 1240 HA LYS 29 HA LYS 29 2.272 23.726 -4.022 1241 HB2 LYS 29 HB2 LYS 29 1.840 26.014 -3.121 1242 HB3 LYS 29 HB3 LYS 29 1.112 25.718 -4.695 1243 HG2 LYS 29 HG2 LYS 29 -1.030 25.193 -3.459 1244 HG3 LYS 29 HG3 LYS 29 -0.245 25.847 -2.019 1245 HD2 LYS 29 HD2 LYS 29 -0.466 27.382 -4.599 1246 HD3 LYS 29 HD3 LYS 29 -1.693 27.457 -3.333 1247 HE2 LYS 29 HE2 LYS 29 0.092 28.162 -1.743 1248 HE3 LYS 29 HE3 LYS 29 1.212 28.232 -3.103 1249 HZ1 LYS 29 HZ1 LYS 29 0.468 30.240 -3.609 1250 HZ2 LYS 29 HZ2 LYS 29 -1.127 29.686 -3.716 1251 HZ3 LYS 29 HZ3 LYS 29 -0.515 30.219 -2.232 1252 H GLY 30 H GLY 30 3.041 24.926 -1.857 1253 HA2 GLY 30 HA2 GLY 30 2.169 24.703 0.621 1254 HA3 GLY 30 HA3 GLY 30 2.439 23.004 0.264 1255 H GLU 31 H GLU 31 4.762 23.073 -1.188 1256 HA GLU 31 HA GLU 31 6.714 23.246 0.818 1257 HB2 GLU 31 HB2 GLU 31 7.276 23.329 -2.143 1258 HB3 GLU 31 HB3 GLU 31 8.307 22.695 -0.868 1259 HG2 GLU 31 HG2 GLU 31 6.423 21.011 -0.448 1260 HG3 GLU 31 HG3 GLU 31 5.813 21.511 -2.025 1261 H1 TYR 1 H TYR 1 7.720 13.630 -5.407 1262 HA TYR 1 HA TYR 1 6.973 11.789 -7.544 1263 HB2 TYR 1 HB2 TYR 1 5.798 11.914 -4.768 1264 HB3 TYR 1 HB3 TYR 1 5.767 10.563 -5.896 1265 HD1 TYR 1 HD1 TYR 1 7.495 12.083 -3.170 1266 HD2 TYR 1 HD2 TYR 1 8.012 9.470 -6.488 1267 HE1 TYR 1 HE1 TYR 1 9.537 11.184 -2.136 1268 HE2 TYR 1 HE2 TYR 1 10.055 8.562 -5.462 1269 HH TYR 1 HH TYR 1 11.279 9.824 -2.378 1270 H GLY 2 H GLY 2 4.417 11.338 -7.412 1271 HA2 GLY 2 HA2 GLY 2 2.587 13.349 -6.933 1272 HA3 GLY 2 HA3 GLY 2 3.219 13.666 -8.542 1273 H GLY 3 H GLY 3 0.670 13.277 -8.617 1274 HA2 GLY 3 HA2 GLY 3 -1.038 11.969 -9.422 1275 HA3 GLY 3 HA3 GLY 3 0.231 11.098 -10.271 1276 H PHE 4 H PHE 4 -0.454 9.034 -10.036 1277 HA PHE 4 HA PHE 4 -1.445 8.036 -7.530 1278 HB2 PHE 4 HB2 PHE 4 -0.890 6.817 -10.218 1279 HB3 PHE 4 HB3 PHE 4 -1.234 5.792 -8.829 1280 HD1 PHE 4 HD1 PHE 4 -3.422 5.275 -8.312 1281 HD2 PHE 4 HD2 PHE 4 -2.604 8.708 -10.691 1282 HE1 PHE 4 HE1 PHE 4 -5.835 5.595 -8.673 1283 HE2 PHE 4 HE2 PHE 4 -5.016 9.034 -11.055 1284 HZ PHE 4 HZ PHE 4 -6.634 7.477 -10.045 1285 H MET 5 H MET 5 -0.475 6.456 -6.212 1286 HA MET 5 HA MET 5 2.460 6.468 -6.341 1287 HB2 MET 5 HB2 MET 5 1.017 7.256 -4.279 1288 HB3 MET 5 HB3 MET 5 0.953 5.533 -3.935 1289 HG2 MET 5 HG2 MET 5 3.557 5.714 -4.281 1290 HG3 MET 5 HG3 MET 5 3.259 7.400 -3.866 1291 HE1 MET 5 HE1 MET 5 4.932 5.004 -1.373 1292 HE2 MET 5 HE2 MET 5 3.675 3.776 -1.523 1293 HE3 MET 5 HE3 MET 5 4.430 4.447 -2.969 1294 H THR 6 H THR 6 3.001 4.754 -7.599 1295 HA THR 6 HA THR 6 1.735 2.166 -7.120 1296 HB THR 6 HB THR 6 3.909 2.453 -9.130 1297 HG1 THR 6 HG1 THR 6 1.977 3.201 -10.531 1298 HG21 THR 6 HG21 THR 6 1.814 0.631 -8.515 1299 HG22 THR 6 HG22 THR 6 1.508 1.295 -10.120 1300 HG23 THR 6 HG23 THR 6 3.045 0.504 -9.772 1301 H SER 7 H SER 7 2.634 1.628 -5.110 1302 HA SER 7 HA SER 7 5.538 1.406 -4.924 1303 HB2 SER 7 HB2 SER 7 3.793 2.221 -3.069 1304 HB3 SER 7 HB3 SER 7 3.775 0.497 -2.703 1305 HG SER 7 HG SER 7 5.389 1.551 -1.511 1306 H GLU 8 H GLU 8 6.294 -0.350 -5.946 1307 HA GLU 8 HA GLU 8 4.997 -2.933 -5.368 1308 HB2 GLU 8 HB2 GLU 8 6.107 -1.795 -7.874 1309 HB3 GLU 8 HB3 GLU 8 6.397 -3.505 -7.586 1310 HG2 GLU 8 HG2 GLU 8 4.238 -4.068 -7.893 1311 HG3 GLU 8 HG3 GLU 8 3.632 -2.575 -7.178 1312 H LYS 9 H LYS 9 6.151 -4.031 -3.934 1313 HA LYS 9 HA LYS 9 9.086 -3.819 -4.014 1314 HB2 LYS 9 HB2 LYS 9 7.841 -3.150 -1.902 1315 HB3 LYS 9 HB3 LYS 9 7.425 -4.849 -1.715 1316 HG2 LYS 9 HG2 LYS 9 10.282 -4.058 -2.045 1317 HG3 LYS 9 HG3 LYS 9 9.488 -3.862 -0.481 1318 HD2 LYS 9 HD2 LYS 9 8.759 -6.311 -0.778 1319 HD3 LYS 9 HD3 LYS 9 9.999 -6.380 -2.033 1320 HE2 LYS 9 HE2 LYS 9 11.232 -7.049 -0.230 1321 HE3 LYS 9 HE3 LYS 9 11.485 -5.307 -0.136 1322 HZ1 LYS 9 HZ1 LYS 9 10.935 -6.076 2.023 1323 HZ2 LYS 9 HZ2 LYS 9 9.580 -5.243 1.445 1324 HZ3 LYS 9 HZ3 LYS 9 9.590 -6.935 1.461 1325 H SER 10 H SER 10 9.910 -5.437 -5.178 1326 HA SER 10 HA SER 10 9.440 -8.155 -4.354 1327 HB2 SER 10 HB2 SER 10 8.823 -8.931 -6.657 1328 HB3 SER 10 HB3 SER 10 7.578 -7.956 -5.876 1329 HG SER 10 HG SER 10 7.927 -6.364 -7.260 1330 H GLN 11 H GLN 11 11.154 -9.461 -4.800 1331 HA GLN 11 HA GLN 11 13.493 -8.166 -5.949 1332 HB2 GLN 11 HB2 GLN 11 14.717 -10.131 -5.074 1333 HB3 GLN 11 HB3 GLN 11 13.797 -9.296 -3.830 1334 HG2 GLN 11 HG2 GLN 11 12.219 -10.993 -3.680 1335 HG3 GLN 11 HG3 GLN 11 12.652 -11.664 -5.252 1336 HE21 GLN 11 HE21 GLN 11 14.080 -13.275 -5.336 1337 HE22 GLN 11 HE22 GLN 11 15.001 -13.860 -3.996 1338 H THR 12 H THR 12 11.642 -8.631 -7.892 1339 HA THR 12 HA THR 12 13.071 -10.490 -9.602 1340 HB THR 12 HB THR 12 10.540 -11.223 -10.292 1341 HG1 THR 12 HG1 THR 12 9.827 -10.131 -8.291 1342 HG21 THR 12 HG21 THR 12 12.624 -12.459 -8.541 1343 HG22 THR 12 HG22 THR 12 11.083 -13.285 -8.772 1344 HG23 THR 12 HG23 THR 12 12.103 -12.919 -10.163 1345 HA PRO 13 HA PRO 13 12.067 -7.652 -12.794 1346 HB2 PRO 13 HB2 PRO 13 11.612 -9.265 -14.930 1347 HB3 PRO 13 HB3 PRO 13 13.222 -9.003 -14.250 1348 HG2 PRO 13 HG2 PRO 13 11.337 -11.290 -13.830 1349 HG3 PRO 13 HG3 PRO 13 13.089 -11.320 -14.098 1350 HD2 PRO 13 HD2 PRO 13 11.987 -11.584 -11.639 1351 HD3 PRO 13 HD3 PRO 13 13.561 -10.805 -11.902 1352 H LEU 14 H LEU 14 10.068 -6.926 -11.810 1353 HA LEU 14 HA LEU 14 7.601 -8.170 -12.716 1354 HB2 LEU 14 HB2 LEU 14 6.485 -6.814 -11.178 1355 HB3 LEU 14 HB3 LEU 14 7.996 -7.248 -10.381 1356 HG LEU 14 HG LEU 14 7.665 -4.633 -11.824 1357 HD11 LEU 14 HD11 LEU 14 7.383 -4.704 -8.885 1358 HD12 LEU 14 HD12 LEU 14 6.640 -3.635 -10.075 1359 HD13 LEU 14 HD13 LEU 14 5.997 -5.258 -9.826 1360 HD21 LEU 14 HD21 LEU 14 9.914 -4.990 -11.382 1361 HD22 LEU 14 HD22 LEU 14 9.386 -4.053 -9.984 1362 HD23 LEU 14 HD23 LEU 14 9.589 -5.799 -9.849 1363 H VAL 15 H VAL 15 5.921 -6.019 -12.988 1364 HA VAL 15 HA VAL 15 7.014 -4.190 -14.952 1365 HB VAL 15 HB VAL 15 6.466 -6.235 -16.267 1366 HG11 VAL 15 HG11 VAL 15 4.467 -7.262 -16.214 1367 HG12 VAL 15 HG12 VAL 15 4.287 -6.444 -14.662 1368 HG13 VAL 15 HG13 VAL 15 3.576 -5.743 -16.116 1369 HG21 VAL 15 HG21 VAL 15 4.472 -4.482 -17.387 1370 HG22 VAL 15 HG22 VAL 15 5.862 -3.563 -16.809 1371 HG23 VAL 15 HG23 VAL 15 6.089 -4.864 -17.978 1372 H THR 16 H THR 16 5.825 -2.336 -15.162 1373 HA THR 16 HA THR 16 3.573 -2.057 -13.309 1374 HB THR 16 HB THR 16 5.241 -0.413 -12.905 1375 HG1 THR 16 HG1 THR 16 3.604 1.213 -14.452 1376 HG21 THR 16 HG21 THR 16 5.524 -0.466 -15.797 1377 HG22 THR 16 HG22 THR 16 5.466 1.178 -15.162 1378 HG23 THR 16 HG23 THR 16 6.674 0.043 -14.561 1379 H LEU 17 H LEU 17 1.675 -2.497 -14.246 1380 HA LEU 17 HA LEU 17 1.183 -2.027 -17.035 1381 HB2 LEU 17 HB2 LEU 17 0.191 -3.818 -15.383 1382 HB3 LEU 17 HB3 LEU 17 -1.010 -2.561 -15.090 1383 HG LEU 17 HG LEU 17 -0.393 -3.795 -17.774 1384 HD11 LEU 17 HD11 LEU 17 -2.308 -5.096 -17.556 1385 HD12 LEU 17 HD12 LEU 17 -1.551 -5.215 -15.968 1386 HD13 LEU 17 HD13 LEU 17 -2.925 -4.137 -16.211 1387 HD21 LEU 17 HD21 LEU 17 -2.360 -1.709 -16.871 1388 HD22 LEU 17 HD22 LEU 17 -1.159 -1.601 -18.158 1389 HD23 LEU 17 HD23 LEU 17 -2.573 -2.635 -18.356 1390 H PHE 18 H PHE 18 1.359 0.167 -17.414 1391 HA PHE 18 HA PHE 18 -0.508 1.923 -15.977 1392 HB2 PHE 18 HB2 PHE 18 2.133 2.323 -17.258 1393 HB3 PHE 18 HB3 PHE 18 0.980 3.641 -17.437 1394 HD1 PHE 18 HD1 PHE 18 0.959 1.488 -14.484 1395 HD2 PHE 18 HD2 PHE 18 2.317 5.169 -16.134 1396 HE1 PHE 18 HE1 PHE 18 1.526 2.286 -12.227 1397 HE2 PHE 18 HE2 PHE 18 2.887 5.973 -13.880 1398 HZ PHE 18 HZ PHE 18 2.493 4.531 -11.923 1399 H LYS 19 H LYS 19 -2.422 1.919 -16.986 1400 HA LYS 19 HA LYS 19 -2.462 2.651 -19.825 1401 HB2 LYS 19 HB2 LYS 19 -2.865 0.126 -19.342 1402 HB3 LYS 19 HB3 LYS 19 -4.439 0.656 -18.763 1403 HG2 LYS 19 HG2 LYS 19 -4.926 1.634 -20.937 1404 HG3 LYS 19 HG3 LYS 19 -3.333 1.146 -21.522 1405 HD2 LYS 19 HD2 LYS 19 -5.242 -0.874 -20.400 1406 HD3 LYS 19 HD3 LYS 19 -5.378 -0.337 -22.076 1407 HE2 LYS 19 HE2 LYS 19 -3.234 -1.157 -22.616 1408 HE3 LYS 19 HE3 LYS 19 -2.795 -1.350 -20.919 1409 HZ1 LYS 19 HZ1 LYS 19 -4.342 -3.150 -20.716 1410 HZ2 LYS 19 HZ2 LYS 19 -4.912 -2.915 -22.291 1411 HZ3 LYS 19 HZ3 LYS 19 -3.332 -3.462 -22.037 1412 H ASN 20 H ASN 20 -4.331 3.789 -20.496 1413 HA ASN 20 HA ASN 20 -5.865 5.455 -20.230 1414 HB2 ASN 20 HB2 ASN 20 -6.817 3.317 -18.343 1415 HB3 ASN 20 HB3 ASN 20 -7.704 4.829 -18.509 1416 HD21 ASN 20 HD21 ASN 20 -9.315 4.730 -19.878 1417 HD22 ASN 20 HD22 ASN 20 -9.402 3.738 -21.289 1418 H ALA 21 H ALA 21 -3.487 5.969 -18.883 1419 HA ALA 21 HA ALA 21 -4.193 6.978 -16.244 1420 HB1 ALA 21 HB1 ALA 21 -1.648 7.821 -16.641 1421 HB2 ALA 21 HB2 ALA 21 -2.084 6.249 -15.970 1422 HB3 ALA 21 HB3 ALA 21 -1.699 6.400 -17.685 1423 H ILE 22 H ILE 22 -4.930 8.966 -15.934 1424 HA ILE 22 HA ILE 22 -4.300 11.029 -17.943 1425 HB ILE 22 HB ILE 22 -6.807 10.875 -16.267 1426 HG12 ILE 22 HG12 ILE 22 -6.450 10.311 -19.218 1427 HG13 ILE 22 HG13 ILE 22 -6.669 9.079 -17.980 1428 HG21 ILE 22 HG21 ILE 22 -5.594 12.991 -17.735 1429 HG22 ILE 22 HG22 ILE 22 -7.091 12.528 -18.544 1430 HG23 ILE 22 HG23 ILE 22 -7.115 12.994 -16.843 1431 HD11 ILE 22 HD11 ILE 22 -8.776 10.936 -17.703 1432 HD12 ILE 22 HD12 ILE 22 -8.634 10.536 -19.415 1433 HD13 ILE 22 HD13 ILE 22 -8.854 9.253 -18.225 1434 H ILE 23 H ILE 23 -2.914 12.451 -17.137 1435 HA ILE 23 HA ILE 23 -2.930 13.010 -14.260 1436 HB ILE 23 HB ILE 23 -0.881 13.493 -16.410 1437 HG12 ILE 23 HG12 ILE 23 -0.961 11.262 -15.358 1438 HG13 ILE 23 HG13 ILE 23 0.532 12.112 -14.973 1439 HG21 ILE 23 HG21 ILE 23 -0.623 15.470 -15.259 1440 HG22 ILE 23 HG22 ILE 23 -1.141 14.770 -13.726 1441 HG23 ILE 23 HG23 ILE 23 0.462 14.406 -14.365 1442 HD11 ILE 23 HD11 ILE 23 -0.562 12.786 -12.806 1443 HD12 ILE 23 HD12 ILE 23 -1.838 11.633 -13.198 1444 HD13 ILE 23 HD13 ILE 23 -0.179 11.074 -12.987 1445 H LYS 24 H LYS 24 -4.266 14.612 -13.721 1446 HA LYS 24 HA LYS 24 -4.370 16.995 -15.449 1447 HB2 LYS 24 HB2 LYS 24 -6.478 15.531 -14.784 1448 HB3 LYS 24 HB3 LYS 24 -6.405 16.504 -13.321 1449 HG2 LYS 24 HG2 LYS 24 -7.017 18.412 -14.390 1450 HG3 LYS 24 HG3 LYS 24 -6.274 17.929 -15.916 1451 HD2 LYS 24 HD2 LYS 24 -8.669 17.939 -16.177 1452 HD3 LYS 24 HD3 LYS 24 -8.094 16.270 -16.220 1453 HE2 LYS 24 HE2 LYS 24 -9.021 15.756 -14.186 1454 HE3 LYS 24 HE3 LYS 24 -8.936 17.418 -13.606 1455 HZ1 LYS 24 HZ1 LYS 24 -11.105 16.087 -14.806 1456 HZ2 LYS 24 HZ2 LYS 24 -11.052 17.650 -14.161 1457 HZ3 LYS 24 HZ3 LYS 24 -10.661 17.392 -15.787 1458 H ASN 25 H ASN 25 -2.830 18.335 -14.677 1459 HA ASN 25 HA ASN 25 -1.651 19.665 -13.251 1460 HB2 ASN 25 HB2 ASN 25 -4.322 19.766 -11.830 1461 HB3 ASN 25 HB3 ASN 25 -2.997 20.905 -11.602 1462 HD21 ASN 25 HD21 ASN 25 -5.176 22.106 -12.221 1463 HD22 ASN 25 HD22 ASN 25 -5.258 22.568 -13.883 1464 H ALA 26 H ALA 26 -1.244 16.974 -12.762 1465 HA ALA 26 HA ALA 26 -1.627 16.097 -10.144 1466 HB1 ALA 26 HB1 ALA 26 0.521 15.466 -12.153 1467 HB2 ALA 26 HB2 ALA 26 0.401 14.658 -10.589 1468 HB3 ALA 26 HB3 ALA 26 -0.915 14.521 -11.756 1469 H TYR 27 H TYR 27 0.854 18.176 -11.521 1470 HA TYR 27 HA TYR 27 1.839 18.686 -8.793 1471 HB2 TYR 27 HB2 TYR 27 3.357 17.388 -10.531 1472 HB3 TYR 27 HB3 TYR 27 3.673 19.014 -11.129 1473 HD1 TYR 27 HD1 TYR 27 4.821 20.658 -9.709 1474 HD2 TYR 27 HD2 TYR 27 4.228 16.649 -8.415 1475 HE1 TYR 27 HE1 TYR 27 6.509 20.983 -7.950 1476 HE2 TYR 27 HE2 TYR 27 5.914 16.963 -6.651 1477 HH TYR 27 HH TYR 27 7.076 18.572 -5.480 1478 H LYS 28 H LYS 28 0.794 20.573 -8.397 1479 HA LYS 28 HA LYS 28 0.826 22.694 -10.396 1480 HB2 LYS 28 HB2 LYS 28 -0.380 22.838 -7.638 1481 HB3 LYS 28 HB3 LYS 28 -0.771 23.820 -9.043 1482 HG2 LYS 28 HG2 LYS 28 -1.689 21.811 -10.147 1483 HG3 LYS 28 HG3 LYS 28 -1.375 20.893 -8.672 1484 HD2 LYS 28 HD2 LYS 28 -3.598 21.477 -8.415 1485 HD3 LYS 28 HD3 LYS 28 -2.776 22.762 -7.527 1486 HE2 LYS 28 HE2 LYS 28 -2.831 23.944 -9.887 1487 HE3 LYS 28 HE3 LYS 28 -4.192 22.855 -10.145 1488 HZ1 LYS 28 HZ1 LYS 28 -4.413 25.251 -9.009 1489 HZ2 LYS 28 HZ2 LYS 28 -5.471 23.970 -8.692 1490 HZ3 LYS 28 HZ3 LYS 28 -4.198 24.298 -7.628 1491 H LYS 29 H LYS 29 1.099 24.986 -9.273 1492 HA LYS 29 HA LYS 29 3.805 25.307 -8.712 1493 HB2 LYS 29 HB2 LYS 29 3.173 27.596 -7.948 1494 HB3 LYS 29 HB3 LYS 29 2.504 27.162 -9.516 1495 HG2 LYS 29 HG2 LYS 29 0.383 26.537 -8.294 1496 HG3 LYS 29 HG3 LYS 29 1.083 27.318 -6.874 1497 HD2 LYS 29 HD2 LYS 29 0.803 28.705 -9.531 1498 HD3 LYS 29 HD3 LYS 29 -0.454 28.746 -8.292 1499 HE2 LYS 29 HE2 LYS 29 1.238 29.663 -6.709 1500 HE3 LYS 29 HE3 LYS 29 2.378 29.753 -8.050 1501 HZ1 LYS 29 HZ1 LYS 29 1.496 31.671 -8.668 1502 HZ2 LYS 29 HZ2 LYS 29 -0.050 30.991 -8.778 1503 HZ3 LYS 29 HZ3 LYS 29 0.487 31.641 -7.310 1504 H GLY 30 H GLY 30 4.420 26.670 -6.596 1505 HA2 GLY 30 HA2 GLY 30 3.499 26.503 -4.130 1506 HA3 GLY 30 HA3 GLY 30 3.915 24.816 -4.392 1507 H GLU 31 H GLU 31 6.263 24.969 -5.765 1508 HA GLU 31 HA GLU 31 8.135 25.426 -3.729 1509 HB2 GLU 31 HB2 GLU 31 8.774 25.361 -6.675 1510 HB3 GLU 31 HB3 GLU 31 9.816 24.899 -5.337 1511 HG2 GLU 31 HG2 GLU 31 8.062 23.100 -4.845 1512 HG3 GLU 31 HG3 GLU 31 7.458 23.442 -6.465 Start of MODEL 9 1 H1 TYR 1 H TYR 1 -7.274 3.849 10.085 2 HA TYR 1 HA TYR 1 -8.979 3.102 12.314 3 HB2 TYR 1 HB2 TYR 1 -6.822 5.199 12.637 4 HB3 TYR 1 HB3 TYR 1 -8.042 4.774 13.833 5 HD1 TYR 1 HD1 TYR 1 -4.774 4.593 13.544 6 HD2 TYR 1 HD2 TYR 1 -8.023 1.856 13.771 7 HE1 TYR 1 HE1 TYR 1 -3.263 2.886 14.467 8 HE2 TYR 1 HE2 TYR 1 -6.522 0.142 14.696 9 HH TYR 1 HH TYR 1 -3.289 0.875 15.697 10 H GLY 2 H GLY 2 -10.050 5.249 13.186 11 HA2 GLY 2 HA2 GLY 2 -11.068 7.311 12.712 12 HA3 GLY 2 HA3 GLY 2 -10.439 7.220 11.074 13 H GLY 3 H GLY 3 -11.452 5.552 9.650 14 HA2 GLY 3 HA2 GLY 3 -14.272 5.893 9.656 15 HA3 GLY 3 HA3 GLY 3 -13.358 4.866 8.561 16 H PHE 4 H PHE 4 -14.619 3.069 8.594 17 HA PHE 4 HA PHE 4 -15.614 1.967 11.059 18 HB2 PHE 4 HB2 PHE 4 -15.818 1.284 8.168 19 HB3 PHE 4 HB3 PHE 4 -16.095 -0.008 9.331 20 HD1 PHE 4 HD1 PHE 4 -18.370 -0.415 9.278 21 HD2 PHE 4 HD2 PHE 4 -16.977 3.599 9.518 22 HE1 PHE 4 HE1 PHE 4 -20.683 0.364 9.593 23 HE2 PHE 4 HE2 PHE 4 -19.287 4.385 9.834 24 HZ PHE 4 HZ PHE 4 -21.143 2.767 9.873 25 H MET 5 H MET 5 -15.141 -0.214 11.792 26 HA MET 5 HA MET 5 -12.323 -0.924 11.317 27 HB2 MET 5 HB2 MET 5 -13.296 -0.219 13.670 28 HB3 MET 5 HB3 MET 5 -13.826 -1.896 13.710 29 HG2 MET 5 HG2 MET 5 -11.433 -2.527 13.207 30 HG3 MET 5 HG3 MET 5 -11.022 -0.844 13.528 31 HE1 MET 5 HE1 MET 5 -10.939 -4.056 14.566 32 HE2 MET 5 HE2 MET 5 -9.729 -3.387 15.660 33 HE3 MET 5 HE3 MET 5 -11.161 -4.183 16.310 34 H THR 6 H THR 6 -12.198 -2.556 9.917 35 HA THR 6 HA THR 6 -14.189 -4.716 10.074 36 HB THR 6 HB THR 6 -12.275 -4.565 7.797 37 HG1 THR 6 HG1 THR 6 -14.357 -2.716 8.311 38 HG21 THR 6 HG21 THR 6 -13.681 -6.130 7.063 39 HG22 THR 6 HG22 THR 6 -14.738 -5.878 8.452 40 HG23 THR 6 HG23 THR 6 -14.955 -4.912 6.992 41 H SER 7 H SER 7 -13.241 -5.860 11.784 42 HA SER 7 HA SER 7 -10.551 -6.938 11.310 43 HB2 SER 7 HB2 SER 7 -11.409 -5.802 13.551 44 HB3 SER 7 HB3 SER 7 -12.021 -7.426 13.864 45 HG SER 7 HG SER 7 -9.375 -6.537 13.591 46 H GLU 8 H GLU 8 -10.774 -8.673 10.002 47 HA GLU 8 HA GLU 8 -12.640 -10.781 10.875 48 HB2 GLU 8 HB2 GLU 8 -11.874 -9.839 8.135 49 HB3 GLU 8 HB3 GLU 8 -12.379 -11.506 8.376 50 HG2 GLU 8 HG2 GLU 8 -14.285 -10.277 7.699 51 HG3 GLU 8 HG3 GLU 8 -14.476 -10.639 9.414 52 H LYS 9 H LYS 9 -11.614 -12.446 11.742 53 HA LYS 9 HA LYS 9 -8.889 -13.071 10.821 54 HB2 LYS 9 HB2 LYS 9 -9.034 -12.503 13.195 55 HB3 LYS 9 HB3 LYS 9 -10.253 -13.748 13.434 56 HG2 LYS 9 HG2 LYS 9 -8.453 -15.370 12.559 57 HG3 LYS 9 HG3 LYS 9 -7.326 -14.056 12.903 58 HD2 LYS 9 HD2 LYS 9 -9.286 -15.025 14.961 59 HD3 LYS 9 HD3 LYS 9 -7.723 -15.813 14.732 60 HE2 LYS 9 HE2 LYS 9 -7.872 -12.849 15.098 61 HE3 LYS 9 HE3 LYS 9 -7.974 -13.916 16.497 62 HZ1 LYS 9 HZ1 LYS 9 -5.720 -13.470 14.665 63 HZ2 LYS 9 HZ2 LYS 9 -5.732 -13.529 16.356 64 HZ3 LYS 9 HZ3 LYS 9 -5.856 -14.958 15.458 65 H SER 10 H SER 10 -8.894 -14.653 9.366 66 HA SER 10 HA SER 10 -10.040 -17.207 10.015 67 HB2 SER 10 HB2 SER 10 -11.424 -17.364 7.954 68 HB3 SER 10 HB3 SER 10 -12.025 -16.153 9.086 69 HG SER 10 HG SER 10 -10.689 -15.789 6.634 70 H GLN 11 H GLN 11 -9.095 -18.878 8.890 71 HA GLN 11 HA GLN 11 -6.709 -18.174 7.395 72 HB2 GLN 11 HB2 GLN 11 -6.228 -20.612 7.512 73 HB3 GLN 11 HB3 GLN 11 -6.463 -19.869 9.088 74 HG2 GLN 11 HG2 GLN 11 -8.659 -20.791 9.271 75 HG3 GLN 11 HG3 GLN 11 -8.604 -21.375 7.608 76 HE21 GLN 11 HE21 GLN 11 -6.461 -22.724 7.257 77 HE22 GLN 11 HE22 GLN 11 -6.235 -23.984 8.417 78 H THR 12 H THR 12 -9.051 -17.523 6.034 79 HA THR 12 HA THR 12 -8.742 -19.201 3.667 80 HB THR 12 HB THR 12 -11.453 -18.750 3.602 81 HG1 THR 12 HG1 THR 12 -11.304 -18.172 5.882 82 HG21 THR 12 HG21 THR 12 -9.646 -20.997 3.896 83 HG22 THR 12 HG22 THR 12 -11.193 -21.297 4.689 84 HG23 THR 12 HG23 THR 12 -11.147 -20.873 2.978 85 HA PRO 13 HA PRO 13 -9.024 -15.427 1.446 86 HB2 PRO 13 HB2 PRO 13 -10.331 -16.176 -0.813 87 HB3 PRO 13 HB3 PRO 13 -8.659 -16.638 -0.472 88 HG2 PRO 13 HG2 PRO 13 -11.174 -18.221 -0.108 89 HG3 PRO 13 HG3 PRO 13 -9.610 -18.740 -0.762 90 HD2 PRO 13 HD2 PRO 13 -10.379 -19.281 1.777 91 HD3 PRO 13 HD3 PRO 13 -8.682 -19.010 1.330 92 H LEU 14 H LEU 14 -10.488 -14.454 3.035 93 HA LEU 14 HA LEU 14 -13.328 -14.558 2.534 94 HB2 LEU 14 HB2 LEU 14 -13.577 -13.210 4.439 95 HB3 LEU 14 HB3 LEU 14 -12.244 -14.304 4.802 96 HG LEU 14 HG LEU 14 -11.680 -11.553 3.770 97 HD11 LEU 14 HD11 LEU 14 -11.441 -11.419 6.533 98 HD12 LEU 14 HD12 LEU 14 -12.651 -10.614 5.534 99 HD13 LEU 14 HD13 LEU 14 -13.007 -12.182 6.258 100 HD21 LEU 14 HD21 LEU 14 -9.749 -12.850 3.872 101 HD22 LEU 14 HD22 LEU 14 -9.723 -11.956 5.391 102 HD23 LEU 14 HD23 LEU 14 -10.241 -13.641 5.369 103 H VAL 15 H VAL 15 -14.056 -11.905 3.018 104 HA VAL 15 HA VAL 15 -12.791 -10.088 1.236 105 HB VAL 15 HB VAL 15 -13.763 -11.484 -0.492 106 HG11 VAL 15 HG11 VAL 15 -16.427 -10.955 0.821 107 HG12 VAL 15 HG12 VAL 15 -16.154 -11.860 -0.668 108 HG13 VAL 15 HG13 VAL 15 -15.551 -12.485 0.868 109 HG21 VAL 15 HG21 VAL 15 -15.702 -9.323 -0.707 110 HG22 VAL 15 HG22 VAL 15 -14.095 -8.760 -0.251 111 HG23 VAL 15 HG23 VAL 15 -14.314 -9.703 -1.725 112 H THR 16 H THR 16 -13.315 -8.078 1.827 113 HA THR 16 HA THR 16 -15.400 -7.712 3.810 114 HB THR 16 HB THR 16 -13.320 -6.610 4.277 115 HG1 THR 16 HG1 THR 16 -14.430 -4.967 4.996 116 HG21 THR 16 HG21 THR 16 -13.327 -6.090 1.465 117 HG22 THR 16 HG22 THR 16 -13.167 -4.564 2.333 118 HG23 THR 16 HG23 THR 16 -12.019 -5.870 2.628 119 H LEU 17 H LEU 17 -17.416 -7.467 3.085 120 HA LEU 17 HA LEU 17 -17.966 -6.269 0.516 121 HB2 LEU 17 HB2 LEU 17 -19.199 -8.220 1.744 122 HB3 LEU 17 HB3 LEU 17 -20.077 -6.908 2.528 123 HG LEU 17 HG LEU 17 -19.961 -7.394 -0.448 124 HD11 LEU 17 HD11 LEU 17 -22.447 -7.667 1.152 125 HD12 LEU 17 HD12 LEU 17 -21.960 -8.481 -0.335 126 HD13 LEU 17 HD13 LEU 17 -21.272 -8.981 1.210 127 HD21 LEU 17 HD21 LEU 17 -22.075 -5.783 -0.043 128 HD22 LEU 17 HD22 LEU 17 -21.007 -5.213 1.239 129 HD23 LEU 17 HD23 LEU 17 -20.461 -5.193 -0.438 130 H PHE 18 H PHE 18 -17.488 -4.117 0.562 131 HA PHE 18 HA PHE 18 -18.918 -2.485 2.556 132 HB2 PHE 18 HB2 PHE 18 -16.204 -2.283 1.383 133 HB3 PHE 18 HB3 PHE 18 -17.071 -0.766 1.602 134 HD1 PHE 18 HD1 PHE 18 -18.390 -0.803 4.026 135 HD2 PHE 18 HD2 PHE 18 -14.731 -2.752 3.062 136 HE1 PHE 18 HE1 PHE 18 -17.757 -0.783 6.404 137 HE2 PHE 18 HE2 PHE 18 -14.092 -2.736 5.438 138 HZ PHE 18 HZ PHE 18 -15.606 -1.752 7.113 139 H LYS 19 H LYS 19 -20.775 -1.913 1.580 140 HA LYS 19 HA LYS 19 -20.853 -1.219 -1.226 141 HB2 LYS 19 HB2 LYS 19 -22.848 -1.613 0.943 142 HB3 LYS 19 HB3 LYS 19 -23.307 -0.559 -0.388 143 HG2 LYS 19 HG2 LYS 19 -22.415 -2.592 -1.826 144 HG3 LYS 19 HG3 LYS 19 -22.823 -3.484 -0.358 145 HD2 LYS 19 HD2 LYS 19 -25.070 -3.046 -0.555 146 HD3 LYS 19 HD3 LYS 19 -24.808 -1.554 -1.461 147 HE2 LYS 19 HE2 LYS 19 -23.947 -3.049 -3.340 148 HE3 LYS 19 HE3 LYS 19 -24.648 -4.392 -2.439 149 HZ1 LYS 19 HZ1 LYS 19 -26.791 -3.547 -2.712 150 HZ2 LYS 19 HZ2 LYS 19 -26.244 -2.011 -3.164 151 HZ3 LYS 19 HZ3 LYS 19 -26.070 -3.318 -4.225 152 H ASN 20 H ASN 20 -22.267 0.543 1.518 153 HA ASN 20 HA ASN 20 -21.415 3.047 0.246 154 HB2 ASN 20 HB2 ASN 20 -23.877 2.457 0.973 155 HB3 ASN 20 HB3 ASN 20 -23.309 2.957 2.563 156 HD21 ASN 20 HD21 ASN 20 -24.276 4.858 2.849 157 HD22 ASN 20 HD22 ASN 20 -24.140 6.213 1.785 158 H ALA 21 H ALA 21 -19.697 4.047 1.036 159 HA ALA 21 HA ALA 21 -19.118 3.810 3.914 160 HB1 ALA 21 HB1 ALA 21 -17.172 3.628 1.624 161 HB2 ALA 21 HB2 ALA 21 -16.685 3.892 3.298 162 HB3 ALA 21 HB3 ALA 21 -17.523 2.407 2.847 163 H ILE 22 H ILE 22 -19.540 5.762 4.729 164 HA ILE 22 HA ILE 22 -18.653 8.132 3.221 165 HB ILE 22 HB ILE 22 -20.719 8.045 5.420 166 HG12 ILE 22 HG12 ILE 22 -21.105 8.172 2.421 167 HG13 ILE 22 HG13 ILE 22 -21.484 6.793 3.447 168 HG21 ILE 22 HG21 ILE 22 -20.729 10.254 3.506 169 HG22 ILE 22 HG22 ILE 22 -20.860 10.274 5.264 170 HG23 ILE 22 HG23 ILE 22 -19.275 10.172 4.500 171 HD11 ILE 22 HD11 ILE 22 -22.996 9.237 2.945 172 HD12 ILE 22 HD12 ILE 22 -23.544 7.643 3.461 173 HD13 ILE 22 HD13 ILE 22 -22.902 8.780 4.646 174 H ILE 23 H ILE 23 -16.816 8.955 3.952 175 HA ILE 23 HA ILE 23 -16.168 8.689 6.807 176 HB ILE 23 HB ILE 23 -14.440 9.082 4.378 177 HG12 ILE 23 HG12 ILE 23 -15.114 6.783 5.145 178 HG13 ILE 23 HG13 ILE 23 -13.376 7.058 5.102 179 HG21 ILE 23 HG21 ILE 23 -12.574 9.093 6.222 180 HG22 ILE 23 HG22 ILE 23 -13.368 10.590 5.733 181 HG23 ILE 23 HG23 ILE 23 -13.861 9.773 7.217 182 HD11 ILE 23 HD11 ILE 23 -14.461 7.721 7.684 183 HD12 ILE 23 HD12 ILE 23 -14.871 6.070 7.220 184 HD13 ILE 23 HD13 ILE 23 -13.184 6.584 7.254 185 H LYS 24 H LYS 24 -17.057 10.419 7.804 186 HA LYS 24 HA LYS 24 -16.386 13.085 6.742 187 HB2 LYS 24 HB2 LYS 24 -18.834 11.996 8.017 188 HB3 LYS 24 HB3 LYS 24 -18.382 13.638 8.456 189 HG2 LYS 24 HG2 LYS 24 -18.253 14.102 5.959 190 HG3 LYS 24 HG3 LYS 24 -19.083 12.558 5.747 191 HD2 LYS 24 HD2 LYS 24 -21.034 13.324 6.700 192 HD3 LYS 24 HD3 LYS 24 -20.208 14.559 7.653 193 HE2 LYS 24 HE2 LYS 24 -19.664 15.603 5.335 194 HE3 LYS 24 HE3 LYS 24 -21.001 14.602 4.769 195 HZ1 LYS 24 HZ1 LYS 24 -22.386 16.143 5.504 196 HZ2 LYS 24 HZ2 LYS 24 -21.844 15.894 7.087 197 HZ3 LYS 24 HZ3 LYS 24 -21.107 17.067 6.115 198 H ASN 25 H ASN 25 -14.735 13.933 7.822 199 HA ASN 25 HA ASN 25 -13.324 14.531 9.505 200 HB2 ASN 25 HB2 ASN 25 -15.861 14.378 11.148 201 HB3 ASN 25 HB3 ASN 25 -14.377 15.194 11.631 202 HD21 ASN 25 HD21 ASN 25 -13.892 17.173 10.791 203 HD22 ASN 25 HD22 ASN 25 -14.980 18.079 9.801 204 H ALA 26 H ALA 26 -13.181 11.867 8.931 205 HA ALA 26 HA ALA 26 -13.226 10.428 11.475 206 HB1 ALA 26 HB1 ALA 26 -13.154 8.457 10.275 207 HB2 ALA 26 HB2 ALA 26 -14.056 9.512 9.187 208 HB3 ALA 26 HB3 ALA 26 -12.344 9.202 8.897 209 H TYR 27 H TYR 27 -11.302 12.583 10.953 210 HA TYR 27 HA TYR 27 -8.997 11.398 12.027 211 HB2 TYR 27 HB2 TYR 27 -9.016 10.710 9.479 212 HB3 TYR 27 HB3 TYR 27 -8.394 12.341 9.254 213 HD1 TYR 27 HD1 TYR 27 -6.165 12.929 9.957 214 HD2 TYR 27 HD2 TYR 27 -7.705 9.031 10.695 215 HE1 TYR 27 HE1 TYR 27 -3.899 12.143 10.501 216 HE2 TYR 27 HE2 TYR 27 -5.443 8.235 11.242 217 HH TYR 27 HH TYR 27 -3.316 8.805 11.556 218 H LYS 28 H LYS 28 -7.467 12.921 12.673 219 HA LYS 28 HA LYS 28 -7.948 15.712 11.915 220 HB2 LYS 28 HB2 LYS 28 -7.796 14.667 14.747 221 HB3 LYS 28 HB3 LYS 28 -7.708 16.371 14.319 222 HG2 LYS 28 HG2 LYS 28 -10.038 14.563 13.713 223 HG3 LYS 28 HG3 LYS 28 -9.944 15.678 15.079 224 HD2 LYS 28 HD2 LYS 28 -9.769 17.563 13.556 225 HD3 LYS 28 HD3 LYS 28 -9.777 16.470 12.170 226 HE2 LYS 28 HE2 LYS 28 -11.982 17.036 12.196 227 HE3 LYS 28 HE3 LYS 28 -12.036 15.662 13.300 228 HZ1 LYS 28 HZ1 LYS 28 -13.037 18.059 13.875 229 HZ2 LYS 28 HZ2 LYS 28 -12.483 16.976 15.050 230 HZ3 LYS 28 HZ3 LYS 28 -11.484 18.235 14.522 231 H LYS 29 H LYS 29 -6.158 17.046 13.322 232 HA LYS 29 HA LYS 29 -3.660 16.181 12.219 233 HB2 LYS 29 HB2 LYS 29 -2.769 18.243 13.323 234 HB3 LYS 29 HB3 LYS 29 -4.124 18.533 12.240 235 HG2 LYS 29 HG2 LYS 29 -5.629 18.785 14.080 236 HG3 LYS 29 HG3 LYS 29 -4.387 18.275 15.226 237 HD2 LYS 29 HD2 LYS 29 -3.142 20.255 14.910 238 HD3 LYS 29 HD3 LYS 29 -4.054 20.688 13.462 239 HE2 LYS 29 HE2 LYS 29 -4.950 22.093 15.074 240 HE3 LYS 29 HE3 LYS 29 -6.092 20.750 15.051 241 HZ1 LYS 29 HZ1 LYS 29 -4.240 19.999 16.896 242 HZ2 LYS 29 HZ2 LYS 29 -4.397 21.660 17.172 243 HZ3 LYS 29 HZ3 LYS 29 -5.760 20.660 17.235 244 H GLY 30 H GLY 30 -1.675 16.627 13.856 245 HA2 GLY 30 HA2 GLY 30 -0.549 15.991 15.779 246 HA3 GLY 30 HA3 GLY 30 -2.092 15.551 16.497 247 H GLU 31 H GLU 31 -3.112 13.602 15.093 248 HA GLU 31 HA GLU 31 -1.004 11.597 14.686 249 HB2 GLU 31 HB2 GLU 31 -1.998 11.393 16.977 250 HB3 GLU 31 HB3 GLU 31 -3.553 11.074 16.221 251 HG2 GLU 31 HG2 GLU 31 -2.894 8.940 16.546 252 HG3 GLU 31 HG3 GLU 31 -2.132 9.208 14.980 253 H1 TYR 1 H TYR 1 -4.420 5.582 6.400 254 HA TYR 1 HA TYR 1 -6.151 4.805 8.599 255 HB2 TYR 1 HB2 TYR 1 -4.133 7.036 8.920 256 HB3 TYR 1 HB3 TYR 1 -5.363 6.575 10.091 257 HD1 TYR 1 HD1 TYR 1 -2.080 6.577 9.897 258 HD2 TYR 1 HD2 TYR 1 -5.174 3.667 10.136 259 HE1 TYR 1 HE1 TYR 1 -0.502 4.992 10.921 260 HE2 TYR 1 HE2 TYR 1 -3.606 2.074 11.162 261 HH TYR 1 HH TYR 1 -0.450 3.027 12.221 262 H GLY 2 H GLY 2 -7.363 6.922 9.370 263 HA2 GLY 2 HA2 GLY 2 -8.478 8.907 8.793 264 HA3 GLY 2 HA3 GLY 2 -7.803 8.790 7.175 265 H GLY 3 H GLY 3 -8.681 6.997 5.802 266 HA2 GLY 3 HA2 GLY 3 -11.516 7.190 5.720 267 HA3 GLY 3 HA3 GLY 3 -10.518 6.169 4.694 268 H PHE 4 H PHE 4 -11.687 4.311 4.772 269 HA PHE 4 HA PHE 4 -12.685 3.259 7.258 270 HB2 PHE 4 HB2 PHE 4 -12.785 2.454 4.393 271 HB3 PHE 4 HB3 PHE 4 -13.018 1.193 5.600 272 HD1 PHE 4 HD1 PHE 4 -15.263 0.658 5.542 273 HD2 PHE 4 HD2 PHE 4 -14.101 4.752 5.601 274 HE1 PHE 4 HE1 PHE 4 -17.621 1.320 5.778 275 HE2 PHE 4 HE2 PHE 4 -16.457 5.421 5.839 276 HZ PHE 4 HZ PHE 4 -18.221 3.704 5.928 277 H MET 5 H MET 5 -12.126 1.121 8.073 278 HA MET 5 HA MET 5 -9.263 0.545 7.696 279 HB2 MET 5 HB2 MET 5 -10.328 1.295 9.997 280 HB3 MET 5 HB3 MET 5 -10.764 -0.406 10.096 281 HG2 MET 5 HG2 MET 5 -8.328 -0.920 9.668 282 HG3 MET 5 HG3 MET 5 -8.020 0.795 9.929 283 HE1 MET 5 HE1 MET 5 -7.782 -2.365 11.100 284 HE2 MET 5 HE2 MET 5 -6.633 -1.580 12.184 285 HE3 MET 5 HE3 MET 5 -8.029 -2.430 12.845 286 H THR 6 H THR 6 -9.035 -1.129 6.358 287 HA THR 6 HA THR 6 -10.920 -3.375 6.557 288 HB THR 6 HB THR 6 -8.937 -3.241 4.341 289 HG1 THR 6 HG1 THR 6 -11.094 -1.449 4.714 290 HG21 THR 6 HG21 THR 6 -10.253 -4.893 3.632 291 HG22 THR 6 HG22 THR 6 -11.369 -4.623 4.972 292 HG23 THR 6 HG23 THR 6 -11.570 -3.732 3.463 293 H SER 7 H SER 7 -10.011 -4.448 8.316 294 HA SER 7 HA SER 7 -7.246 -5.389 8.010 295 HB2 SER 7 HB2 SER 7 -8.278 -4.249 10.174 296 HB3 SER 7 HB3 SER 7 -8.821 -5.895 10.498 297 HG SER 7 HG SER 7 -6.215 -4.871 10.341 298 H GLU 8 H GLU 8 -7.316 -7.159 6.731 299 HA GLU 8 HA GLU 8 -9.107 -9.346 7.567 300 HB2 GLU 8 HB2 GLU 8 -8.267 -8.416 4.847 301 HB3 GLU 8 HB3 GLU 8 -8.674 -10.107 5.097 302 HG2 GLU 8 HG2 GLU 8 -10.619 -9.011 4.304 303 HG3 GLU 8 HG3 GLU 8 -10.872 -9.368 6.011 304 H LYS 9 H LYS 9 -8.052 -10.955 8.499 305 HA LYS 9 HA LYS 9 -5.249 -11.440 7.740 306 HB2 LYS 9 HB2 LYS 9 -5.611 -10.838 10.106 307 HB3 LYS 9 HB3 LYS 9 -6.696 -12.211 10.282 308 HG2 LYS 9 HG2 LYS 9 -4.712 -13.647 9.560 309 HG3 LYS 9 HG3 LYS 9 -3.728 -12.214 9.865 310 HD2 LYS 9 HD2 LYS 9 -5.634 -13.252 11.934 311 HD3 LYS 9 HD3 LYS 9 -4.018 -13.939 11.760 312 HE2 LYS 9 HE2 LYS 9 -4.373 -10.979 11.987 313 HE3 LYS 9 HE3 LYS 9 -4.429 -11.985 13.433 314 HZ1 LYS 9 HZ1 LYS 9 -2.176 -11.471 11.617 315 HZ2 LYS 9 HZ2 LYS 9 -2.215 -11.456 13.309 316 HZ3 LYS 9 HZ3 LYS 9 -2.228 -12.929 12.476 317 H SER 10 H SER 10 -5.092 -13.038 6.311 318 HA SER 10 HA SER 10 -6.144 -15.641 6.941 319 HB2 SER 10 HB2 SER 10 -7.378 -15.896 4.793 320 HB3 SER 10 HB3 SER 10 -8.114 -14.708 5.868 321 HG SER 10 HG SER 10 -6.637 -14.293 3.506 322 H GLN 11 H GLN 11 -5.012 -17.269 5.954 323 HA GLN 11 HA GLN 11 -2.594 -16.464 4.567 324 HB2 GLN 11 HB2 GLN 11 -1.978 -18.868 4.797 325 HB3 GLN 11 HB3 GLN 11 -2.332 -18.080 6.328 326 HG2 GLN 11 HG2 GLN 11 -4.481 -19.120 6.442 327 HG3 GLN 11 HG3 GLN 11 -4.305 -19.769 4.812 328 HE21 GLN 11 HE21 GLN 11 -2.069 -20.999 4.631 329 HE22 GLN 11 HE22 GLN 11 -1.833 -22.193 5.857 330 H THR 12 H THR 12 -4.910 -16.025 3.064 331 HA THR 12 HA THR 12 -4.341 -17.732 0.769 332 HB THR 12 HB THR 12 -7.075 -17.523 0.558 333 HG1 THR 12 HG1 THR 12 -7.084 -16.887 2.832 334 HG21 THR 12 HG21 THR 12 -5.096 -19.596 1.006 335 HG22 THR 12 HG22 THR 12 -6.656 -20.014 1.715 336 HG23 THR 12 HG23 THR 12 -6.544 -19.621 -0.001 337 HA PRO 13 HA PRO 13 -4.869 -14.073 -1.597 338 HB2 PRO 13 HB2 PRO 13 -6.080 -14.979 -3.851 339 HB3 PRO 13 HB3 PRO 13 -4.387 -15.315 -3.469 340 HG2 PRO 13 HG2 PRO 13 -6.795 -17.054 -3.095 341 HG3 PRO 13 HG3 PRO 13 -5.188 -17.486 -3.707 342 HD2 PRO 13 HD2 PRO 13 -5.964 -17.999 -1.164 343 HD3 PRO 13 HD3 PRO 13 -4.282 -17.627 -1.592 344 H LEU 14 H LEU 14 -6.412 -13.122 -0.090 345 HA LEU 14 HA LEU 14 -9.233 -13.445 -0.624 346 HB2 LEU 14 HB2 LEU 14 -9.607 -12.049 1.228 347 HB3 LEU 14 HB3 LEU 14 -8.223 -13.053 1.653 348 HG LEU 14 HG LEU 14 -7.784 -10.312 0.542 349 HD11 LEU 14 HD11 LEU 14 -7.632 -10.036 3.289 350 HD12 LEU 14 HD12 LEU 14 -8.886 -9.381 2.235 351 HD13 LEU 14 HD13 LEU 14 -9.128 -10.935 3.033 352 HD21 LEU 14 HD21 LEU 14 -5.786 -11.482 0.747 353 HD22 LEU 14 HD22 LEU 14 -5.862 -10.553 2.244 354 HD23 LEU 14 HD23 LEU 14 -6.284 -12.266 2.247 355 H VAL 15 H VAL 15 -10.110 -10.806 -0.211 356 HA VAL 15 HA VAL 15 -8.943 -8.976 -2.040 357 HB VAL 15 HB VAL 15 -9.800 -10.487 -3.735 358 HG11 VAL 15 HG11 VAL 15 -12.511 -10.073 -2.478 359 HG12 VAL 15 HG12 VAL 15 -12.165 -11.002 -3.937 360 HG13 VAL 15 HG13 VAL 15 -11.551 -11.549 -2.378 361 HG21 VAL 15 HG21 VAL 15 -11.856 -8.451 -4.055 362 HG22 VAL 15 HG22 VAL 15 -10.292 -7.781 -3.592 363 HG23 VAL 15 HG23 VAL 15 -10.429 -8.783 -5.037 364 H THR 16 H THR 16 -9.646 -6.974 -1.593 365 HA THR 16 HA THR 16 -11.777 -6.685 0.366 366 HB THR 16 HB THR 16 -9.783 -5.444 0.852 367 HG1 THR 16 HG1 THR 16 -11.007 -3.848 1.485 368 HG21 THR 16 HG21 THR 16 -9.738 -5.015 -1.976 369 HG22 THR 16 HG22 THR 16 -9.690 -3.455 -1.153 370 HG23 THR 16 HG23 THR 16 -8.479 -4.684 -0.786 371 H LEU 17 H LEU 17 -13.790 -6.537 -0.380 372 HA LEU 17 HA LEU 17 -14.349 -5.473 -3.009 373 HB2 LEU 17 HB2 LEU 17 -15.503 -7.443 -1.737 374 HB3 LEU 17 HB3 LEU 17 -16.462 -6.155 -1.012 375 HG LEU 17 HG LEU 17 -16.268 -6.736 -3.967 376 HD11 LEU 17 HD11 LEU 17 -18.772 -7.067 -2.411 377 HD12 LEU 17 HD12 LEU 17 -18.204 -7.923 -3.845 378 HD13 LEU 17 HD13 LEU 17 -17.537 -8.316 -2.260 379 HD21 LEU 17 HD21 LEU 17 -18.460 -5.214 -3.665 380 HD22 LEU 17 HD22 LEU 17 -17.455 -4.551 -2.376 381 HD23 LEU 17 HD23 LEU 17 -16.867 -4.559 -4.039 382 H PHE 18 H PHE 18 -13.987 -3.299 -3.033 383 HA PHE 18 HA PHE 18 -15.541 -1.676 -1.127 384 HB2 PHE 18 HB2 PHE 18 -12.816 -1.373 -2.249 385 HB3 PHE 18 HB3 PHE 18 -13.764 0.103 -2.106 386 HD1 PHE 18 HD1 PHE 18 -15.137 0.082 0.290 387 HD2 PHE 18 HD2 PHE 18 -11.358 -1.699 -0.524 388 HE1 PHE 18 HE1 PHE 18 -14.561 0.221 2.678 389 HE2 PHE 18 HE2 PHE 18 -10.776 -1.563 1.863 390 HZ PHE 18 HZ PHE 18 -12.379 -0.603 3.468 391 H LYS 19 H LYS 19 -17.408 -1.265 -2.173 392 HA LYS 19 HA LYS 19 -17.462 -0.671 -4.998 393 HB2 LYS 19 HB2 LYS 19 -19.481 -1.067 -2.849 394 HB3 LYS 19 HB3 LYS 19 -19.960 -0.103 -4.240 395 HG2 LYS 19 HG2 LYS 19 -18.933 -2.158 -5.554 396 HG3 LYS 19 HG3 LYS 19 -19.339 -2.995 -4.054 397 HD2 LYS 19 HD2 LYS 19 -21.595 -2.686 -4.333 398 HD3 LYS 19 HD3 LYS 19 -21.384 -1.217 -5.289 399 HE2 LYS 19 HE2 LYS 19 -20.401 -2.734 -7.087 400 HE3 LYS 19 HE3 LYS 19 -21.057 -4.078 -6.153 401 HZ1 LYS 19 HZ1 LYS 19 -23.231 -3.357 -6.511 402 HZ2 LYS 19 HZ2 LYS 19 -22.753 -1.811 -7.005 403 HZ3 LYS 19 HZ3 LYS 19 -22.483 -3.143 -8.014 404 H ASN 20 H ASN 20 -19.042 1.129 -2.376 405 HA ASN 20 HA ASN 20 -18.268 3.618 -3.722 406 HB2 ASN 20 HB2 ASN 20 -20.720 2.937 -3.041 407 HB3 ASN 20 HB3 ASN 20 -20.224 3.530 -1.458 408 HD21 ASN 20 HD21 ASN 20 -21.272 5.397 -1.272 409 HD22 ASN 20 HD22 ASN 20 -21.176 6.710 -2.391 410 H ALA 21 H ALA 21 -16.627 4.736 -2.925 411 HA ALA 21 HA ALA 21 -16.121 4.637 -0.025 412 HB1 ALA 21 HB1 ALA 21 -14.103 4.477 -2.254 413 HB2 ALA 21 HB2 ALA 21 -13.679 4.825 -0.578 414 HB3 ALA 21 HB3 ALA 21 -14.426 3.283 -0.996 415 H ILE 22 H ILE 22 -16.675 6.593 0.699 416 HA ILE 22 HA ILE 22 -15.874 8.950 -0.874 417 HB ILE 22 HB ILE 22 -17.981 8.834 1.283 418 HG12 ILE 22 HG12 ILE 22 -18.306 8.829 -1.726 419 HG13 ILE 22 HG13 ILE 22 -18.633 7.470 -0.656 420 HG21 ILE 22 HG21 ILE 22 -18.067 10.966 -0.714 421 HG22 ILE 22 HG22 ILE 22 -18.236 11.045 1.040 422 HG23 ILE 22 HG23 ILE 22 -16.631 10.999 0.309 423 HD11 ILE 22 HD11 ILE 22 -20.264 9.805 -1.283 424 HD12 ILE 22 HD12 ILE 22 -20.736 8.204 -0.713 425 HD13 ILE 22 HD13 ILE 22 -20.182 9.422 0.437 426 H ILE 23 H ILE 23 -14.106 9.909 -0.136 427 HA ILE 23 HA ILE 23 -13.508 9.779 2.739 428 HB ILE 23 HB ILE 23 -11.750 10.171 0.333 429 HG12 ILE 23 HG12 ILE 23 -12.310 7.871 1.181 430 HG13 ILE 23 HG13 ILE 23 -10.590 8.243 1.168 431 HG21 ILE 23 HG21 ILE 23 -9.929 10.361 2.214 432 HG22 ILE 23 HG22 ILE 23 -10.789 11.790 1.640 433 HG23 ILE 23 HG23 ILE 23 -11.275 11.015 3.148 434 HD11 ILE 23 HD11 ILE 23 -11.775 8.949 3.693 435 HD12 ILE 23 HD12 ILE 23 -12.083 7.260 3.290 436 HD13 ILE 23 HD13 ILE 23 -10.428 7.867 3.341 437 H LYS 24 H LYS 24 -14.507 11.493 3.653 438 HA LYS 24 HA LYS 24 -13.960 14.151 2.503 439 HB2 LYS 24 HB2 LYS 24 -16.371 12.979 3.778 440 HB3 LYS 24 HB3 LYS 24 -16.017 14.661 4.153 441 HG2 LYS 24 HG2 LYS 24 -15.867 15.030 1.644 442 HG3 LYS 24 HG3 LYS 24 -16.599 13.432 1.479 443 HD2 LYS 24 HD2 LYS 24 -18.612 14.114 2.365 444 HD3 LYS 24 HD3 LYS 24 -17.882 15.437 3.277 445 HE2 LYS 24 HE2 LYS 24 -17.354 16.410 0.924 446 HE3 LYS 24 HE3 LYS 24 -18.617 15.307 0.380 447 HZ1 LYS 24 HZ1 LYS 24 -20.107 16.792 1.022 448 HZ2 LYS 24 HZ2 LYS 24 -19.582 16.645 2.624 449 HZ3 LYS 24 HZ3 LYS 24 -18.897 17.817 1.613 450 H ASN 25 H ASN 25 -12.392 15.142 3.584 451 HA ASN 25 HA ASN 25 -11.048 15.875 5.269 452 HB2 ASN 25 HB2 ASN 25 -13.605 15.639 6.871 453 HB3 ASN 25 HB3 ASN 25 -12.180 16.560 7.345 454 HD21 ASN 25 HD21 ASN 25 -11.790 18.527 6.430 455 HD22 ASN 25 HD22 ASN 25 -12.911 19.329 5.388 456 H ALA 26 H ALA 26 -10.751 13.200 4.800 457 HA ALA 26 HA ALA 26 -10.770 11.856 7.395 458 HB1 ALA 26 HB1 ALA 26 -10.578 9.853 6.273 459 HB2 ALA 26 HB2 ALA 26 -11.487 10.820 5.112 460 HB3 ALA 26 HB3 ALA 26 -9.754 10.580 4.894 461 H TYR 27 H TYR 27 -8.958 14.097 6.833 462 HA TYR 27 HA TYR 27 -6.616 13.086 8.001 463 HB2 TYR 27 HB2 TYR 27 -6.539 12.299 5.481 464 HB3 TYR 27 HB3 TYR 27 -5.998 13.951 5.207 465 HD1 TYR 27 HD1 TYR 27 -3.822 14.684 5.939 466 HD2 TYR 27 HD2 TYR 27 -5.172 10.739 6.789 467 HE1 TYR 27 HE1 TYR 27 -1.532 14.042 6.565 468 HE2 TYR 27 HE2 TYR 27 -2.885 10.087 7.418 469 HH TYR 27 HH TYR 27 -0.800 10.782 7.762 470 H LYS 28 H LYS 28 -5.185 14.717 8.612 471 HA LYS 28 HA LYS 28 -5.802 17.444 7.730 472 HB2 LYS 28 HB2 LYS 28 -5.660 16.525 10.606 473 HB3 LYS 28 HB3 LYS 28 -5.656 18.212 10.109 474 HG2 LYS 28 HG2 LYS 28 -7.868 16.253 9.527 475 HG3 LYS 28 HG3 LYS 28 -7.868 17.421 10.851 476 HD2 LYS 28 HD2 LYS 28 -7.760 19.256 9.259 477 HD3 LYS 28 HD3 LYS 28 -7.680 18.111 7.918 478 HE2 LYS 28 HE2 LYS 28 -9.912 18.555 7.879 479 HE3 LYS 28 HE3 LYS 28 -9.915 17.225 9.036 480 HZ1 LYS 28 HZ1 LYS 28 -11.058 19.583 9.495 481 HZ2 LYS 28 HZ2 LYS 28 -10.467 18.581 10.724 482 HZ3 LYS 28 HZ3 LYS 28 -9.530 19.873 10.161 483 H LYS 29 H LYS 29 -4.122 18.928 9.133 484 HA LYS 29 HA LYS 29 -1.554 18.164 8.115 485 HB2 LYS 29 HB2 LYS 29 -0.804 20.311 9.158 486 HB3 LYS 29 HB3 LYS 29 -2.149 20.487 8.038 487 HG2 LYS 29 HG2 LYS 29 -3.705 20.718 9.838 488 HG3 LYS 29 HG3 LYS 29 -2.461 20.324 11.027 489 HD2 LYS 29 HD2 LYS 29 -1.325 22.359 10.658 490 HD3 LYS 29 HD3 LYS 29 -2.229 22.684 9.177 491 HE2 LYS 29 HE2 LYS 29 -3.238 24.094 10.715 492 HE3 LYS 29 HE3 LYS 29 -4.300 22.687 10.723 493 HZ1 LYS 29 HZ1 LYS 29 -2.449 22.115 12.631 494 HZ2 LYS 29 HZ2 LYS 29 -2.704 23.775 12.838 495 HZ3 LYS 29 HZ3 LYS 29 -4.010 22.701 12.915 496 H GLY 30 H GLY 30 0.362 18.784 9.779 497 HA2 GLY 30 HA2 GLY 30 1.479 18.276 11.744 498 HA3 GLY 30 HA3 GLY 30 -0.055 17.787 12.449 499 H GLU 31 H GLU 31 -0.945 15.733 11.111 500 HA GLU 31 HA GLU 31 1.269 13.824 10.825 501 HB2 GLU 31 HB2 GLU 31 0.231 13.664 13.103 502 HB3 GLU 31 HB3 GLU 31 -1.284 13.228 12.324 503 HG2 GLU 31 HG2 GLU 31 -0.516 11.150 12.759 504 HG3 GLU 31 HG3 GLU 31 0.263 11.394 11.197 505 H1 TYR 1 H TYR 1 -1.618 7.333 2.730 506 HA TYR 1 HA TYR 1 -3.359 6.542 4.917 507 HB2 TYR 1 HB2 TYR 1 -1.477 8.894 5.195 508 HB3 TYR 1 HB3 TYR 1 -2.709 8.410 6.355 509 HD1 TYR 1 HD1 TYR 1 0.574 8.588 6.235 510 HD2 TYR 1 HD2 TYR 1 -2.362 5.522 6.522 511 HE1 TYR 1 HE1 TYR 1 2.210 7.135 7.358 512 HE2 TYR 1 HE2 TYR 1 -0.734 4.061 7.647 513 HH TYR 1 HH TYR 1 2.338 5.228 8.737 514 H GLY 2 H GLY 2 -4.700 8.623 5.579 515 HA2 GLY 2 HA2 GLY 2 -5.914 10.513 4.899 516 HA3 GLY 2 HA3 GLY 2 -5.191 10.377 3.304 517 H GLY 3 H GLY 3 -5.929 8.484 1.980 518 HA2 GLY 3 HA2 GLY 3 -8.766 8.512 1.819 519 HA3 GLY 3 HA3 GLY 3 -7.686 7.512 0.860 520 H PHE 4 H PHE 4 -8.767 5.600 0.984 521 HA PHE 4 HA PHE 4 -9.765 4.588 3.485 522 HB2 PHE 4 HB2 PHE 4 -9.753 3.673 0.652 523 HB3 PHE 4 HB3 PHE 4 -9.946 2.447 1.901 524 HD1 PHE 4 HD1 PHE 4 -12.159 1.788 1.801 525 HD2 PHE 4 HD2 PHE 4 -11.218 5.939 1.757 526 HE1 PHE 4 HE1 PHE 4 -14.554 2.328 1.961 527 HE2 PHE 4 HE2 PHE 4 -13.612 6.486 1.918 528 HZ PHE 4 HZ PHE 4 -15.283 4.680 2.021 529 H MET 5 H MET 5 -9.111 2.519 4.398 530 HA MET 5 HA MET 5 -6.215 2.079 4.102 531 HB2 MET 5 HB2 MET 5 -7.360 2.870 6.347 532 HB3 MET 5 HB3 MET 5 -7.718 1.157 6.512 533 HG2 MET 5 HG2 MET 5 -5.252 0.742 6.151 534 HG3 MET 5 HG3 MET 5 -5.031 2.479 6.345 535 HE1 MET 5 HE1 MET 5 -4.685 -0.622 7.655 536 HE2 MET 5 HE2 MET 5 -3.587 0.255 8.721 537 HE3 MET 5 HE3 MET 5 -4.960 -0.622 9.397 538 H THR 6 H THR 6 -5.862 0.359 2.854 539 HA THR 6 HA THR 6 -7.642 -1.966 3.102 540 HB THR 6 HB THR 6 -5.601 -1.841 0.940 541 HG1 THR 6 HG1 THR 6 -7.845 -0.129 1.161 542 HG21 THR 6 HG21 THR 6 -6.830 -3.574 0.269 543 HG22 THR 6 HG22 THR 6 -7.997 -3.289 1.560 544 HG23 THR 6 HG23 THR 6 -8.184 -2.475 0.007 545 H SER 7 H SER 7 -6.753 -2.950 4.910 546 HA SER 7 HA SER 7 -3.930 -3.740 4.750 547 HB2 SER 7 HB2 SER 7 -5.116 -2.598 6.833 548 HB3 SER 7 HB3 SER 7 -5.579 -4.263 7.184 549 HG SER 7 HG SER 7 -3.029 -3.098 7.102 550 H GLU 8 H GLU 8 -3.847 -5.548 3.524 551 HA GLU 8 HA GLU 8 -5.542 -7.810 4.359 552 HB2 GLU 8 HB2 GLU 8 -4.664 -6.906 1.642 553 HB3 GLU 8 HB3 GLU 8 -4.981 -8.611 1.927 554 HG2 GLU 8 HG2 GLU 8 -6.959 -7.660 1.042 555 HG3 GLU 8 HG3 GLU 8 -7.247 -7.971 2.753 556 H LYS 9 H LYS 9 -4.425 -9.320 5.380 557 HA LYS 9 HA LYS 9 -1.576 -9.663 4.726 558 HB2 LYS 9 HB2 LYS 9 -2.079 -9.019 7.064 559 HB3 LYS 9 HB3 LYS 9 -3.055 -10.472 7.237 560 HG2 LYS 9 HG2 LYS 9 -0.942 -11.760 6.627 561 HG3 LYS 9 HG3 LYS 9 -0.083 -10.245 6.911 562 HD2 LYS 9 HD2 LYS 9 -1.964 -11.361 8.962 563 HD3 LYS 9 HD3 LYS 9 -0.297 -11.930 8.854 564 HE2 LYS 9 HE2 LYS 9 -0.876 -8.999 8.972 565 HE3 LYS 9 HE3 LYS 9 -0.899 -9.960 10.449 566 HZ1 LYS 9 HZ1 LYS 9 1.361 -9.336 8.678 567 HZ2 LYS 9 HZ2 LYS 9 1.272 -9.273 10.367 568 HZ3 LYS 9 HZ3 LYS 9 1.392 -10.767 9.580 569 H SER 10 H SER 10 -1.260 -11.295 3.365 570 HA SER 10 HA SER 10 -2.187 -13.934 4.029 571 HB2 SER 10 HB2 SER 10 -3.339 -14.328 1.866 572 HB3 SER 10 HB3 SER 10 -4.167 -13.128 2.858 573 HG SER 10 HG SER 10 -2.628 -12.755 0.530 574 H GLN 11 H GLN 11 -0.919 -15.514 3.143 575 HA GLN 11 HA GLN 11 1.490 -14.605 1.805 576 HB2 GLN 11 HB2 GLN 11 2.253 -16.949 2.146 577 HB3 GLN 11 HB3 GLN 11 1.785 -16.141 3.636 578 HG2 GLN 11 HG2 GLN 11 -0.290 -17.322 3.704 579 HG3 GLN 11 HG3 GLN 11 -0.009 -18.005 2.103 580 HE21 GLN 11 HE21 GLN 11 2.307 -19.086 2.041 581 HE22 GLN 11 HE22 GLN 11 2.576 -20.226 3.312 582 H THR 12 H THR 12 -0.795 -14.366 0.213 583 HA THR 12 HA THR 12 -0.040 -16.106 -2.000 584 HB THR 12 HB THR 12 -2.777 -16.091 -2.296 585 HG1 THR 12 HG1 THR 12 -2.898 -15.396 -0.045 586 HG21 THR 12 HG21 THR 12 -0.674 -18.010 -1.730 587 HG22 THR 12 HG22 THR 12 -2.226 -18.515 -1.060 588 HG23 THR 12 HG23 THR 12 -2.082 -18.160 -2.781 589 HA PRO 13 HA PRO 13 -0.748 -12.578 -4.512 590 HB2 PRO 13 HB2 PRO 13 -1.844 -13.637 -6.759 591 HB3 PRO 13 HB3 PRO 13 -0.144 -13.851 -6.328 592 HG2 PRO 13 HG2 PRO 13 -2.445 -15.727 -5.944 593 HG3 PRO 13 HG3 PRO 13 -0.799 -16.075 -6.505 594 HD2 PRO 13 HD2 PRO 13 -1.603 -16.549 -3.963 595 HD3 PRO 13 HD3 PRO 13 0.063 -16.084 -4.367 596 H LEU 14 H LEU 14 -2.378 -11.652 -3.098 597 HA LEU 14 HA LEU 14 -5.162 -12.182 -3.675 598 HB2 LEU 14 HB2 LEU 14 -5.669 -10.745 -1.885 599 HB3 LEU 14 HB3 LEU 14 -4.239 -11.649 -1.391 600 HG LEU 14 HG LEU 14 -3.935 -8.926 -2.589 601 HD11 LEU 14 HD11 LEU 14 -3.868 -8.540 0.145 602 HD12 LEU 14 HD12 LEU 14 -5.140 -8.011 -0.957 603 HD13 LEU 14 HD13 LEU 14 -5.295 -9.547 -0.103 604 HD21 LEU 14 HD21 LEU 14 -1.875 -9.957 -2.297 605 HD22 LEU 14 HD22 LEU 14 -2.049 -8.997 -0.827 606 HD23 LEU 14 HD23 LEU 14 -2.364 -10.732 -0.790 607 H VAL 15 H VAL 15 -6.207 -9.586 -3.375 608 HA VAL 15 HA VAL 15 -5.112 -7.755 -5.245 609 HB VAL 15 HB VAL 15 -5.836 -9.376 -6.900 610 HG11 VAL 15 HG11 VAL 15 -8.596 -9.077 -5.719 611 HG12 VAL 15 HG12 VAL 15 -8.163 -10.035 -7.136 612 HG13 VAL 15 HG13 VAL 15 -7.555 -10.490 -5.544 613 HG21 VAL 15 HG21 VAL 15 -7.998 -7.472 -7.334 614 HG22 VAL 15 HG22 VAL 15 -6.479 -6.702 -6.875 615 HG23 VAL 15 HG23 VAL 15 -6.539 -7.765 -8.281 616 H THR 16 H THR 16 -5.949 -5.784 -4.894 617 HA THR 16 HA THR 16 -8.140 -5.559 -2.993 618 HB THR 16 HB THR 16 -6.236 -4.186 -2.501 619 HG1 THR 16 HG1 THR 16 -7.570 -2.645 -1.955 620 HG21 THR 16 HG21 THR 16 -6.145 -3.846 -5.341 621 HG22 THR 16 HG22 THR 16 -6.204 -2.262 -4.569 622 HG23 THR 16 HG23 THR 16 -4.936 -3.408 -4.133 623 H LEU 17 H LEU 17 -10.140 -5.545 -3.784 624 HA LEU 17 HA LEU 17 -10.693 -4.614 -6.464 625 HB2 LEU 17 HB2 LEU 17 -11.767 -6.596 -5.142 626 HB3 LEU 17 HB3 LEU 17 -12.813 -5.337 -4.489 627 HG LEU 17 HG LEU 17 -12.515 -6.013 -7.415 628 HD11 LEU 17 HD11 LEU 17 -15.032 -6.439 -5.905 629 HD12 LEU 17 HD12 LEU 17 -14.379 -7.310 -7.293 630 HD13 LEU 17 HD13 LEU 17 -13.729 -7.606 -5.681 631 HD21 LEU 17 HD21 LEU 17 -14.799 -4.617 -7.220 632 HD22 LEU 17 HD22 LEU 17 -13.871 -3.851 -5.931 633 HD23 LEU 17 HD23 LEU 17 -13.237 -3.878 -7.576 634 H PHE 18 H PHE 18 -10.448 -2.425 -6.562 635 HA PHE 18 HA PHE 18 -12.135 -0.821 -4.755 636 HB2 PHE 18 HB2 PHE 18 -9.404 -0.410 -5.828 637 HB3 PHE 18 HB3 PHE 18 -10.436 1.016 -5.766 638 HD1 PHE 18 HD1 PHE 18 -11.862 1.016 -3.403 639 HD2 PHE 18 HD2 PHE 18 -7.976 -0.592 -4.057 640 HE1 PHE 18 HE1 PHE 18 -11.354 1.281 -1.010 641 HE2 PHE 18 HE2 PHE 18 -7.462 -0.330 -1.665 642 HZ PHE 18 HZ PHE 18 -9.152 0.606 -0.138 643 H LYS 19 H LYS 19 -13.996 -0.547 -5.853 644 HA LYS 19 HA LYS 19 -14.017 -0.067 -8.701 645 HB2 LYS 19 HB2 LYS 19 -16.062 -0.487 -6.581 646 HB3 LYS 19 HB3 LYS 19 -16.559 0.390 -8.022 647 HG2 LYS 19 HG2 LYS 19 -15.388 -1.659 -9.222 648 HG3 LYS 19 HG3 LYS 19 -15.788 -2.453 -7.697 649 HD2 LYS 19 HD2 LYS 19 -18.049 -2.278 -8.043 650 HD3 LYS 19 HD3 LYS 19 -17.892 -0.842 -9.058 651 HE2 LYS 19 HE2 LYS 19 -16.784 -2.377 -10.765 652 HE3 LYS 19 HE3 LYS 19 -17.387 -3.715 -9.788 653 HZ1 LYS 19 HZ1 LYS 19 -19.589 -3.133 -10.226 654 HZ2 LYS 19 HZ2 LYS 19 -19.183 -1.585 -10.777 655 HZ3 LYS 19 HZ3 LYS 19 -18.816 -2.942 -11.719 656 H ASN 20 H ASN 20 -15.755 1.742 -6.187 657 HA ASN 20 HA ASN 20 -15.087 4.216 -7.612 658 HB2 ASN 20 HB2 ASN 20 -17.512 3.426 -6.950 659 HB3 ASN 20 HB3 ASN 20 -17.083 4.110 -5.385 660 HD21 ASN 20 HD21 ASN 20 -18.234 5.923 -5.296 661 HD22 ASN 20 HD22 ASN 20 -18.187 7.191 -6.468 662 H ALA 21 H ALA 21 -13.533 5.461 -6.827 663 HA ALA 21 HA ALA 21 -13.082 5.496 -3.917 664 HB1 ALA 21 HB1 ALA 21 -11.011 5.368 -6.098 665 HB2 ALA 21 HB2 ALA 21 -10.643 5.800 -4.428 666 HB3 ALA 21 HB3 ALA 21 -11.294 4.204 -4.804 667 H ILE 22 H ILE 22 -13.761 7.443 -3.280 668 HA ILE 22 HA ILE 22 -13.055 9.781 -4.925 669 HB ILE 22 HB ILE 22 -15.205 9.626 -2.812 670 HG12 ILE 22 HG12 ILE 22 -15.454 9.491 -5.825 671 HG13 ILE 22 HG13 ILE 22 -15.734 8.157 -4.711 672 HG21 ILE 22 HG21 ILE 22 -15.361 11.675 -4.890 673 HG22 ILE 22 HG22 ILE 22 -15.575 11.809 -3.144 674 HG23 ILE 22 HG23 ILE 22 -13.953 11.827 -3.839 675 HD11 ILE 22 HD11 ILE 22 -17.472 10.373 -5.468 676 HD12 ILE 22 HD12 ILE 22 -17.871 8.773 -4.844 677 HD13 ILE 22 HD13 ILE 22 -17.413 10.063 -3.732 678 H ILE 23 H ILE 23 -11.359 10.861 -4.186 679 HA ILE 23 HA ILE 23 -10.826 10.874 -1.295 680 HB ILE 23 HB ILE 23 -9.034 11.273 -3.675 681 HG12 ILE 23 HG12 ILE 23 -9.488 8.979 -2.751 682 HG13 ILE 23 HG13 ILE 23 -7.791 9.445 -2.740 683 HG21 ILE 23 HG21 ILE 23 -7.272 11.635 -1.763 684 HG22 ILE 23 HG22 ILE 23 -8.197 12.991 -2.409 685 HG23 ILE 23 HG23 ILE 23 -8.674 12.246 -0.884 686 HD11 ILE 23 HD11 ILE 23 -9.074 10.178 -0.271 687 HD12 ILE 23 HD12 ILE 23 -9.279 8.461 -0.615 688 HD13 ILE 23 HD13 ILE 23 -7.661 9.161 -0.551 689 H LYS 24 H LYS 24 -11.940 12.563 -0.470 690 HA LYS 24 HA LYS 24 -11.509 15.203 -1.710 691 HB2 LYS 24 HB2 LYS 24 -13.885 13.946 -0.451 692 HB3 LYS 24 HB3 LYS 24 -13.634 15.657 -0.128 693 HG2 LYS 24 HG2 LYS 24 -13.440 15.948 -2.643 694 HG3 LYS 24 HG3 LYS 24 -14.076 14.306 -2.770 695 HD2 LYS 24 HD2 LYS 24 -16.147 14.903 -1.957 696 HD3 LYS 24 HD3 LYS 24 -15.516 16.296 -1.076 697 HE2 LYS 24 HE2 LYS 24 -14.982 17.215 -3.450 698 HE3 LYS 24 HE3 LYS 24 -16.167 16.024 -3.983 699 HZ1 LYS 24 HZ1 LYS 24 -17.754 17.442 -3.431 700 HZ2 LYS 24 HZ2 LYS 24 -17.263 17.383 -1.813 701 HZ3 LYS 24 HZ3 LYS 24 -16.620 18.555 -2.850 702 H ASN 25 H ASN 25 -10.028 16.320 -0.631 703 HA ASN 25 HA ASN 25 -8.770 17.189 1.055 704 HB2 ASN 25 HB2 ASN 25 -11.348 16.867 2.608 705 HB3 ASN 25 HB3 ASN 25 -9.990 17.886 3.076 706 HD21 ASN 25 HD21 ASN 25 -9.691 19.836 2.093 707 HD22 ASN 25 HD22 ASN 25 -10.831 20.532 0.996 708 H ALA 26 H ALA 26 -8.314 14.520 0.694 709 HA ALA 26 HA ALA 26 -8.322 13.273 3.338 710 HB1 ALA 26 HB1 ALA 26 -7.997 11.244 2.299 711 HB2 ALA 26 HB2 ALA 26 -8.923 12.117 1.077 712 HB3 ALA 26 HB3 ALA 26 -7.174 11.962 0.914 713 H TYR 27 H TYR 27 -6.623 15.590 2.729 714 HA TYR 27 HA TYR 27 -4.259 14.758 3.988 715 HB2 TYR 27 HB2 TYR 27 -4.076 13.877 1.506 716 HB3 TYR 27 HB3 TYR 27 -3.621 15.545 1.174 717 HD1 TYR 27 HD1 TYR 27 -1.509 16.431 1.927 718 HD2 TYR 27 HD2 TYR 27 -2.653 12.451 2.902 719 HE1 TYR 27 HE1 TYR 27 0.798 15.947 2.628 720 HE2 TYR 27 HE2 TYR 27 -0.349 11.956 3.608 721 HH TYR 27 HH TYR 27 1.684 12.782 3.968 722 H LYS 28 H LYS 28 -2.926 16.489 4.554 723 HA LYS 28 HA LYS 28 -3.672 19.140 3.552 724 HB2 LYS 28 HB2 LYS 28 -3.551 18.347 6.466 725 HB3 LYS 28 HB3 LYS 28 -3.628 20.010 5.899 726 HG2 LYS 28 HG2 LYS 28 -5.713 17.909 5.346 727 HG3 LYS 28 HG3 LYS 28 -5.810 19.123 6.624 728 HD2 LYS 28 HD2 LYS 28 -5.765 20.901 4.966 729 HD3 LYS 28 HD3 LYS 28 -5.588 19.714 3.671 730 HE2 LYS 28 HE2 LYS 28 -7.840 20.028 3.564 731 HE3 LYS 28 HE3 LYS 28 -7.797 18.745 4.772 732 HZ1 LYS 28 HZ1 LYS 28 -9.082 21.049 5.112 733 HZ2 LYS 28 HZ2 LYS 28 -8.466 20.130 6.393 734 HZ3 LYS 28 HZ3 LYS 28 -7.589 21.450 5.801 735 H LYS 29 H LYS 29 -2.110 20.768 4.936 736 HA LYS 29 HA LYS 29 0.519 20.110 4.006 737 HB2 LYS 29 HB2 LYS 29 1.126 22.333 4.981 738 HB3 LYS 29 HB3 LYS 29 -0.199 22.392 3.826 739 HG2 LYS 29 HG2 LYS 29 -1.809 22.605 5.579 740 HG3 LYS 29 HG3 LYS 29 -0.576 22.322 6.810 741 HD2 LYS 29 HD2 LYS 29 0.460 24.401 6.390 742 HD3 LYS 29 HD3 LYS 29 -0.425 24.623 4.878 743 HE2 LYS 29 HE2 LYS 29 -1.544 26.031 6.341 744 HE3 LYS 29 HE3 LYS 29 -2.529 24.570 6.379 745 HZ1 LYS 29 HZ1 LYS 29 -0.694 24.169 8.346 746 HZ2 LYS 29 HZ2 LYS 29 -1.044 25.819 8.485 747 HZ3 LYS 29 HZ3 LYS 29 -2.291 24.679 8.574 748 H GLY 30 H GLY 30 2.357 20.897 5.688 749 HA2 GLY 30 HA2 GLY 30 3.454 20.523 7.694 750 HA3 GLY 30 HA3 GLY 30 1.931 19.983 8.385 751 H GLU 31 H GLU 31 1.179 17.833 7.115 752 HA GLU 31 HA GLU 31 3.495 16.034 6.950 753 HB2 GLU 31 HB2 GLU 31 2.417 15.910 9.213 754 HB3 GLU 31 HB3 GLU 31 0.944 15.364 8.423 755 HG2 GLU 31 HG2 GLU 31 1.808 13.347 8.952 756 HG3 GLU 31 HG3 GLU 31 2.616 13.573 7.402 757 H1 TYR 1 H TYR 1 1.204 9.107 -0.949 758 HA TYR 1 HA TYR 1 -0.548 8.290 1.217 759 HB2 TYR 1 HB2 TYR 1 1.185 10.757 1.466 760 HB3 TYR 1 HB3 TYR 1 -0.051 10.240 2.607 761 HD1 TYR 1 HD1 TYR 1 3.222 10.604 2.563 762 HD2 TYR 1 HD2 TYR 1 0.455 7.388 2.893 763 HE1 TYR 1 HE1 TYR 1 4.905 9.288 3.781 764 HE2 TYR 1 HE2 TYR 1 2.131 6.064 4.112 765 HH TYR 1 HH TYR 1 5.102 7.443 5.234 766 H GLY 2 H GLY 2 -2.022 10.315 1.770 767 HA2 GLY 2 HA2 GLY 2 -3.318 12.109 0.989 768 HA3 GLY 2 HA3 GLY 2 -2.549 11.952 -0.583 769 H GLY 3 H GLY 3 -3.149 9.972 -1.847 770 HA2 GLY 3 HA2 GLY 3 -5.979 9.836 -2.075 771 HA3 GLY 3 HA3 GLY 3 -4.821 8.860 -2.967 772 H PHE 4 H PHE 4 -5.802 6.898 -2.791 773 HA PHE 4 HA PHE 4 -6.807 5.932 -0.275 774 HB2 PHE 4 HB2 PHE 4 -6.670 4.908 -3.067 775 HB3 PHE 4 HB3 PHE 4 -6.826 3.722 -1.776 776 HD1 PHE 4 HD1 PHE 4 -8.995 2.935 -1.899 777 HD2 PHE 4 HD2 PHE 4 -8.289 7.128 -2.091 778 HE1 PHE 4 HE1 PHE 4 -11.420 3.344 -1.818 779 HE2 PHE 4 HE2 PHE 4 -10.712 7.543 -2.008 780 HZ PHE 4 HZ PHE 4 -12.281 5.650 -1.871 781 H MET 5 H MET 5 -6.069 3.929 0.727 782 HA MET 5 HA MET 5 -3.145 3.641 0.520 783 HB2 MET 5 HB2 MET 5 -4.382 4.464 2.703 784 HB3 MET 5 HB3 MET 5 -4.657 2.743 2.935 785 HG2 MET 5 HG2 MET 5 -2.164 2.442 2.647 786 HG3 MET 5 HG3 MET 5 -2.037 4.195 2.772 787 HE1 MET 5 HE1 MET 5 -1.584 1.162 4.220 788 HE2 MET 5 HE2 MET 5 -0.548 2.133 5.265 789 HE3 MET 5 HE3 MET 5 -1.894 1.227 5.955 790 H THR 6 H THR 6 -2.675 1.892 -0.646 791 HA THR 6 HA THR 6 -4.337 -0.512 -0.342 792 HB THR 6 HB THR 6 -2.239 -0.382 -2.446 793 HG1 THR 6 HG1 THR 6 -4.563 1.235 -2.372 794 HG21 THR 6 HG21 THR 6 -3.373 -2.192 -3.080 795 HG22 THR 6 HG22 THR 6 -4.589 -1.906 -1.835 796 HG23 THR 6 HG23 THR 6 -4.764 -1.165 -3.426 797 H SER 7 H SER 7 -3.465 -1.396 1.518 798 HA SER 7 HA SER 7 -0.597 -2.025 1.489 799 HB2 SER 7 HB2 SER 7 -1.927 -0.892 3.488 800 HB3 SER 7 HB3 SER 7 -2.309 -2.569 3.875 801 HG SER 7 HG SER 7 0.172 -1.262 3.851 802 H GLU 8 H GLU 8 -0.361 -3.862 0.330 803 HA GLU 8 HA GLU 8 -1.951 -6.194 1.179 804 HB2 GLU 8 HB2 GLU 8 -1.039 -5.325 -1.540 805 HB3 GLU 8 HB3 GLU 8 -1.279 -7.035 -1.207 806 HG2 GLU 8 HG2 GLU 8 -3.274 -6.217 -2.181 807 HG3 GLU 8 HG3 GLU 8 -3.599 -6.485 -0.470 808 H LYS 9 H LYS 9 -0.776 -7.600 2.281 809 HA LYS 9 HA LYS 9 2.106 -7.792 1.718 810 HB2 LYS 9 HB2 LYS 9 1.485 -7.109 4.020 811 HB3 LYS 9 HB3 LYS 9 0.609 -8.623 4.211 812 HG2 LYS 9 HG2 LYS 9 2.820 -9.779 3.705 813 HG3 LYS 9 HG3 LYS 9 3.567 -8.199 3.951 814 HD2 LYS 9 HD2 LYS 9 1.714 -9.368 5.999 815 HD3 LYS 9 HD3 LYS 9 3.418 -9.824 5.951 816 HE2 LYS 9 HE2 LYS 9 2.638 -6.938 5.945 817 HE3 LYS 9 HE3 LYS 9 2.640 -7.845 7.456 818 HZ1 LYS 9 HZ1 LYS 9 4.899 -7.128 5.719 819 HZ2 LYS 9 HZ2 LYS 9 4.762 -7.015 7.402 820 HZ3 LYS 9 HZ3 LYS 9 5.004 -8.522 6.672 821 H SER 10 H SER 10 2.565 -9.445 0.425 822 HA SER 10 HA SER 10 1.772 -12.112 1.144 823 HB2 SER 10 HB2 SER 10 0.717 -12.639 -1.042 824 HB3 SER 10 HB3 SER 10 -0.213 -11.465 -0.111 825 HG SER 10 HG SER 10 1.376 -11.062 -2.401 826 H GLN 11 H GLN 11 3.156 -13.642 0.346 827 HA GLN 11 HA GLN 11 5.548 -12.631 -0.950 828 HB2 GLN 11 HB2 GLN 11 6.450 -14.900 -0.497 829 HB3 GLN 11 HB3 GLN 11 5.866 -14.086 0.949 830 HG2 GLN 11 HG2 GLN 11 3.881 -15.410 0.978 831 HG3 GLN 11 HG3 GLN 11 4.261 -16.105 -0.596 832 HE21 GLN 11 HE21 GLN 11 6.640 -17.034 -0.561 833 HE22 GLN 11 HE22 GLN 11 6.944 -18.123 0.745 834 H THR 12 H THR 12 3.308 -12.584 -2.616 835 HA THR 12 HA THR 12 4.234 -14.346 -4.744 836 HB THR 12 HB THR 12 1.513 -14.520 -5.117 837 HG1 THR 12 HG1 THR 12 1.277 -13.758 -2.896 838 HG21 THR 12 HG21 THR 12 3.716 -16.277 -4.424 839 HG22 THR 12 HG22 THR 12 2.181 -16.860 -3.778 840 HG23 THR 12 HG23 THR 12 2.351 -16.556 -5.507 841 HA PRO 13 HA PRO 13 3.374 -10.959 -7.398 842 HB2 PRO 13 HB2 PRO 13 2.408 -12.160 -9.632 843 HB3 PRO 13 HB3 PRO 13 4.106 -12.251 -9.151 844 HG2 PRO 13 HG2 PRO 13 1.917 -14.254 -8.760 845 HG3 PRO 13 HG3 PRO 13 3.596 -14.516 -9.266 846 HD2 PRO 13 HD2 PRO 13 2.754 -14.955 -6.730 847 HD3 PRO 13 HD3 PRO 13 4.397 -14.400 -7.109 848 H LEU 14 H LEU 14 1.655 -10.082 -6.067 849 HA LEU 14 HA LEU 14 -1.076 -10.807 -6.693 850 HB2 LEU 14 HB2 LEU 14 -1.720 -9.346 -4.967 851 HB3 LEU 14 HB3 LEU 14 -0.252 -10.144 -4.405 852 HG LEU 14 HG LEU 14 -0.088 -7.444 -5.685 853 HD11 LEU 14 HD11 LEU 14 -0.103 -6.978 -2.962 854 HD12 LEU 14 HD12 LEU 14 -1.380 -6.559 -4.104 855 HD13 LEU 14 HD13 LEU 14 -1.460 -8.076 -3.210 856 HD21 LEU 14 HD21 LEU 14 2.026 -8.337 -5.322 857 HD22 LEU 14 HD22 LEU 14 1.763 -7.344 -3.888 858 HD23 LEU 14 HD23 LEU 14 1.555 -9.093 -3.799 859 H VAL 15 H VAL 15 -2.286 -8.273 -6.509 860 HA VAL 15 HA VAL 15 -1.254 -6.442 -8.416 861 HB VAL 15 HB VAL 15 -1.843 -8.168 -10.023 862 HG11 VAL 15 HG11 VAL 15 -4.647 -7.967 -8.931 863 HG12 VAL 15 HG12 VAL 15 -4.124 -8.957 -10.293 864 HG13 VAL 15 HG13 VAL 15 -3.542 -9.315 -8.667 865 HG21 VAL 15 HG21 VAL 15 -4.085 -6.391 -10.582 866 HG22 VAL 15 HG22 VAL 15 -2.614 -5.532 -10.123 867 HG23 VAL 15 HG23 VAL 15 -2.593 -6.652 -11.486 868 H THR 16 H THR 16 -2.222 -4.514 -8.167 869 HA THR 16 HA THR 16 -4.469 -4.357 -6.322 870 HB THR 16 HB THR 16 -2.664 -2.858 -5.829 871 HG1 THR 16 HG1 THR 16 -4.099 -1.382 -5.372 872 HG21 THR 16 HG21 THR 16 -2.525 -2.598 -8.681 873 HG22 THR 16 HG22 THR 16 -2.673 -1.001 -7.949 874 HG23 THR 16 HG23 THR 16 -1.364 -2.076 -7.461 875 H LEU 17 H LEU 17 -6.447 -4.476 -7.156 876 HA LEU 17 HA LEU 17 -6.981 -3.676 -9.883 877 HB2 LEU 17 HB2 LEU 17 -7.978 -5.667 -8.516 878 HB3 LEU 17 HB3 LEU 17 -9.107 -4.446 -7.931 879 HG LEU 17 HG LEU 17 -8.702 -5.204 -10.825 880 HD11 LEU 17 HD11 LEU 17 -11.227 -5.719 -9.355 881 HD12 LEU 17 HD12 LEU 17 -10.494 -6.598 -10.698 882 HD13 LEU 17 HD13 LEU 17 -9.867 -6.803 -9.062 883 HD21 LEU 17 HD21 LEU 17 -11.063 -3.932 -10.730 884 HD22 LEU 17 HD22 LEU 17 -10.211 -3.073 -9.446 885 HD23 LEU 17 HD23 LEU 17 -9.536 -3.118 -11.075 886 H PHE 18 H PHE 18 -6.850 -1.481 -10.052 887 HA PHE 18 HA PHE 18 -8.668 0.090 -8.348 888 HB2 PHE 18 HB2 PHE 18 -5.939 0.614 -9.375 889 HB3 PHE 18 HB3 PHE 18 -7.048 1.981 -9.390 890 HD1 PHE 18 HD1 PHE 18 -8.528 1.990 -7.061 891 HD2 PHE 18 HD2 PHE 18 -4.546 0.575 -7.568 892 HE1 PHE 18 HE1 PHE 18 -8.092 2.370 -4.669 893 HE2 PHE 18 HE2 PHE 18 -4.104 0.952 -5.177 894 HZ PHE 18 HZ PHE 18 -5.878 1.850 -3.724 895 H LYS 19 H LYS 19 -10.514 0.213 -9.497 896 HA LYS 19 HA LYS 19 -10.494 0.588 -12.360 897 HB2 LYS 19 HB2 LYS 19 -12.564 0.140 -10.269 898 HB3 LYS 19 HB3 LYS 19 -13.072 0.929 -11.756 899 HG2 LYS 19 HG2 LYS 19 -11.757 -1.103 -12.838 900 HG3 LYS 19 HG3 LYS 19 -12.166 -1.853 -11.293 901 HD2 LYS 19 HD2 LYS 19 -14.419 -1.814 -11.716 902 HD3 LYS 19 HD3 LYS 19 -14.305 -0.408 -12.778 903 HE2 LYS 19 HE2 LYS 19 -13.065 -1.942 -14.393 904 HE3 LYS 19 HE3 LYS 19 -13.630 -3.274 -13.386 905 HZ1 LYS 19 HZ1 LYS 19 -15.844 -2.823 -13.910 906 HZ2 LYS 19 HZ2 LYS 19 -15.501 -1.277 -14.507 907 HZ3 LYS 19 HZ3 LYS 19 -15.036 -2.646 -15.386 908 H ASN 20 H ASN 20 -12.388 2.393 -9.958 909 HA ASN 20 HA ASN 20 -11.820 4.844 -11.464 910 HB2 ASN 20 HB2 ASN 20 -14.214 3.948 -10.824 911 HB3 ASN 20 HB3 ASN 20 -13.859 4.713 -9.277 912 HD21 ASN 20 HD21 ASN 20 -15.105 6.464 -9.284 913 HD22 ASN 20 HD22 ASN 20 -15.101 7.687 -10.504 914 H ALA 21 H ALA 21 -10.362 6.209 -10.694 915 HA ALA 21 HA ALA 21 -9.980 6.377 -7.778 916 HB1 ALA 21 HB1 ALA 21 -7.853 6.284 -9.908 917 HB2 ALA 21 HB2 ALA 21 -7.550 6.795 -8.247 918 HB3 ALA 21 HB3 ALA 21 -8.104 5.153 -8.578 919 H ILE 22 H ILE 22 -10.783 8.305 -7.236 920 HA ILE 22 HA ILE 22 -10.166 10.615 -8.955 921 HB ILE 22 HB ILE 22 -12.357 10.417 -6.887 922 HG12 ILE 22 HG12 ILE 22 -12.522 10.164 -9.899 923 HG13 ILE 22 HG13 ILE 22 -12.755 8.856 -8.744 924 HG21 ILE 22 HG21 ILE 22 -12.573 12.380 -9.041 925 HG22 ILE 22 HG22 ILE 22 -12.835 12.563 -7.306 926 HG23 ILE 22 HG23 ILE 22 -11.201 12.647 -7.965 927 HD11 ILE 22 HD11 ILE 22 -14.595 10.941 -9.620 928 HD12 ILE 22 HD12 ILE 22 -14.918 9.344 -8.946 929 HD13 ILE 22 HD13 ILE 22 -14.560 10.697 -7.873 930 H ILE 23 H ILE 23 -8.548 11.812 -8.219 931 HA ILE 23 HA ILE 23 -8.089 11.965 -5.320 932 HB ILE 23 HB ILE 23 -6.264 12.373 -7.673 933 HG12 ILE 23 HG12 ILE 23 -6.613 10.094 -6.671 934 HG13 ILE 23 HG13 ILE 23 -4.945 10.655 -6.639 935 HG21 ILE 23 HG21 ILE 23 -4.572 12.906 -5.738 936 HG22 ILE 23 HG22 ILE 23 -5.554 14.183 -6.457 937 HG23 ILE 23 HG23 ILE 23 -6.027 13.470 -4.915 938 HD11 ILE 23 HD11 ILE 23 -6.328 11.408 -4.231 939 HD12 ILE 23 HD12 ILE 23 -6.431 9.670 -4.513 940 HD13 ILE 23 HD13 ILE 23 -4.855 10.459 -4.439 941 H LYS 24 H LYS 24 -9.310 13.620 -4.584 942 HA LYS 24 HA LYS 24 -8.996 16.230 -5.916 943 HB2 LYS 24 HB2 LYS 24 -11.331 14.892 -4.662 944 HB3 LYS 24 HB3 LYS 24 -11.181 16.626 -4.403 945 HG2 LYS 24 HG2 LYS 24 -10.941 16.828 -6.923 946 HG3 LYS 24 HG3 LYS 24 -11.483 15.149 -6.998 947 HD2 LYS 24 HD2 LYS 24 -13.603 15.661 -6.256 948 HD3 LYS 24 HD3 LYS 24 -13.072 17.121 -5.418 949 HE2 LYS 24 HE2 LYS 24 -12.530 17.973 -7.816 950 HE3 LYS 24 HE3 LYS 24 -13.637 16.699 -8.325 951 HZ1 LYS 24 HZ1 LYS 24 -15.310 18.050 -7.865 952 HZ2 LYS 24 HZ2 LYS 24 -14.854 18.082 -6.236 953 HZ3 LYS 24 HZ3 LYS 24 -14.250 19.245 -7.308 954 H ASN 25 H ASN 25 -7.607 17.469 -4.848 955 HA ASN 25 HA ASN 25 -6.440 18.470 -3.168 956 HB2 ASN 25 HB2 ASN 25 -9.034 18.060 -1.661 957 HB3 ASN 25 HB3 ASN 25 -7.746 19.172 -1.204 958 HD21 ASN 25 HD21 ASN 25 -7.532 21.096 -2.260 959 HD22 ASN 25 HD22 ASN 25 -8.684 21.684 -3.406 960 H ALA 26 H ALA 26 -5.829 15.818 -3.416 961 HA ALA 26 HA ALA 26 -5.832 14.672 -0.728 962 HB1 ALA 26 HB1 ALA 26 -5.371 12.627 -1.681 963 HB2 ALA 26 HB2 ALA 26 -6.313 13.401 -2.956 964 HB3 ALA 26 HB3 ALA 26 -4.554 13.339 -3.072 965 H TYR 27 H TYR 27 -4.249 17.057 -1.393 966 HA TYR 27 HA TYR 27 -1.875 16.408 -0.047 967 HB2 TYR 27 HB2 TYR 27 -1.582 15.444 -2.488 968 HB3 TYR 27 HB3 TYR 27 -1.211 17.121 -2.874 969 HD1 TYR 27 HD1 TYR 27 0.829 18.151 -2.108 970 HD2 TYR 27 HD2 TYR 27 -0.120 14.152 -1.006 971 HE1 TYR 27 HE1 TYR 27 3.141 17.822 -1.335 972 HE2 TYR 27 HE2 TYR 27 2.189 13.813 -0.229 973 HH TYR 27 HH TYR 27 4.165 14.762 0.144 974 H LYS 28 H LYS 28 -0.646 18.232 0.472 975 HA LYS 28 HA LYS 28 -1.514 20.797 -0.649 976 HB2 LYS 28 HB2 LYS 28 -1.422 20.125 2.296 977 HB3 LYS 28 HB3 LYS 28 -1.577 21.758 1.661 978 HG2 LYS 28 HG2 LYS 28 -3.528 19.522 1.148 979 HG3 LYS 28 HG3 LYS 28 -3.724 20.779 2.372 980 HD2 LYS 28 HD2 LYS 28 -3.737 22.489 0.644 981 HD3 LYS 28 HD3 LYS 28 -3.461 21.264 -0.596 982 HE2 LYS 28 HE2 LYS 28 -5.724 21.448 -0.767 983 HE3 LYS 28 HE3 LYS 28 -5.641 20.216 0.491 984 HZ1 LYS 28 HZ1 LYS 28 -7.059 22.454 0.713 985 HZ2 LYS 28 HZ2 LYS 28 -6.424 21.622 2.041 986 HZ3 LYS 28 HZ3 LYS 28 -5.609 22.967 1.417 987 H LYS 29 H LYS 29 -0.079 22.561 0.704 988 HA LYS 29 HA LYS 29 2.605 22.016 -0.140 989 HB2 LYS 29 HB2 LYS 29 3.064 24.304 0.761 990 HB3 LYS 29 HB3 LYS 29 1.768 24.245 -0.426 991 HG2 LYS 29 HG2 LYS 29 0.105 24.431 1.283 992 HG3 LYS 29 HG3 LYS 29 1.324 24.271 2.550 993 HD2 LYS 29 HD2 LYS 29 2.249 26.388 2.062 994 HD3 LYS 29 HD3 LYS 29 1.384 26.497 0.528 995 HE2 LYS 29 HE2 LYS 29 0.154 27.895 1.909 996 HE3 LYS 29 HE3 LYS 29 -0.744 26.380 1.991 997 HZ1 LYS 29 HZ1 LYS 29 1.071 26.170 4.006 998 HZ2 LYS 29 HZ2 LYS 29 0.622 27.800 4.069 999 HZ3 LYS 29 HZ3 LYS 29 -0.557 26.593 4.184 1000 H GLY 30 H GLY 30 4.353 22.972 1.553 1001 HA2 GLY 30 HA2 GLY 30 5.421 22.733 3.593 1002 HA3 GLY 30 HA3 GLY 30 3.913 22.139 4.272 1003 H GLU 31 H GLU 31 3.307 19.904 3.072 1004 HA GLU 31 HA GLU 31 5.719 18.227 3.033 1005 HB2 GLU 31 HB2 GLU 31 4.592 18.134 5.273 1006 HB3 GLU 31 HB3 GLU 31 3.172 17.477 4.472 1007 HG2 GLU 31 HG2 GLU 31 4.129 15.533 5.102 1008 HG3 GLU 31 HG3 GLU 31 4.965 15.743 3.564 1009 H1 TYR 1 H TYR 1 4.002 10.879 -4.602 1010 HA TYR 1 HA TYR 1 2.241 10.049 -2.449 1011 HB2 TYR 1 HB2 TYR 1 3.828 12.616 -2.252 1012 HB3 TYR 1 HB3 TYR 1 2.595 12.070 -1.121 1013 HD1 TYR 1 HD1 TYR 1 5.842 12.619 -1.103 1014 HD2 TYR 1 HD2 TYR 1 3.253 9.265 -0.717 1015 HE1 TYR 1 HE1 TYR 1 7.566 11.446 0.202 1016 HE2 TYR 1 HE2 TYR 1 4.969 8.083 0.589 1017 HH TYR 1 HH TYR 1 7.830 9.669 1.726 1018 H GLY 2 H GLY 2 0.640 12.000 -2.013 1019 HA2 GLY 2 HA2 GLY 2 -0.729 13.693 -2.894 1020 HA3 GLY 2 HA3 GLY 2 0.090 13.521 -4.439 1021 H GLY 3 H GLY 3 -0.363 11.459 -5.635 1022 HA2 GLY 3 HA2 GLY 3 -3.175 11.159 -5.931 1023 HA3 GLY 3 HA3 GLY 3 -1.942 10.216 -6.755 1024 H PHE 4 H PHE 4 -2.822 8.212 -6.528 1025 HA PHE 4 HA PHE 4 -3.837 7.286 -4.000 1026 HB2 PHE 4 HB2 PHE 4 -3.580 6.171 -6.748 1027 HB3 PHE 4 HB3 PHE 4 -3.702 5.025 -5.417 1028 HD1 PHE 4 HD1 PHE 4 -5.821 4.117 -5.553 1029 HD2 PHE 4 HD2 PHE 4 -5.337 8.332 -5.892 1030 HE1 PHE 4 HE1 PHE 4 -8.266 4.395 -5.537 1031 HE2 PHE 4 HE2 PHE 4 -7.781 8.617 -5.876 1032 HZ PHE 4 HZ PHE 4 -9.249 6.648 -5.698 1033 H MET 5 H MET 5 -3.014 5.387 -2.887 1034 HA MET 5 HA MET 5 -0.077 5.236 -3.030 1035 HB2 MET 5 HB2 MET 5 -1.394 6.092 -0.910 1036 HB3 MET 5 HB3 MET 5 -1.595 4.372 -0.606 1037 HG2 MET 5 HG2 MET 5 0.914 4.174 -0.833 1038 HG3 MET 5 HG3 MET 5 0.959 5.935 -0.784 1039 HE1 MET 5 HE1 MET 5 1.535 3.003 0.808 1040 HE2 MET 5 HE2 MET 5 2.494 4.074 1.829 1041 HE3 MET 5 HE3 MET 5 1.183 3.127 2.532 1042 H THR 6 H THR 6 0.503 3.464 -4.110 1043 HA THR 6 HA THR 6 -1.045 0.995 -3.734 1044 HB THR 6 HB THR 6 1.100 1.140 -5.790 1045 HG1 THR 6 HG1 THR 6 -1.306 2.633 -5.845 1046 HG21 THR 6 HG21 THR 6 0.079 -0.753 -6.370 1047 HG22 THR 6 HG22 THR 6 -1.180 -0.480 -5.166 1048 HG23 THR 6 HG23 THR 6 -1.356 0.182 -6.791 1049 H SER 7 H SER 7 -0.188 0.212 -1.829 1050 HA SER 7 HA SER 7 2.710 -0.256 -1.744 1051 HB2 SER 7 HB2 SER 7 1.253 0.866 0.171 1052 HB3 SER 7 HB3 SER 7 0.951 -0.816 0.604 1053 HG SER 7 HG SER 7 3.357 0.627 0.611 1054 H GLU 8 H GLU 8 3.099 -2.116 -2.816 1055 HA GLU 8 HA GLU 8 1.615 -4.505 -1.933 1056 HB2 GLU 8 HB2 GLU 8 2.543 -3.681 -4.662 1057 HB3 GLU 8 HB3 GLU 8 2.379 -5.387 -4.272 1058 HG2 GLU 8 HG2 GLU 8 0.369 -4.713 -5.315 1059 HG3 GLU 8 HG3 GLU 8 0.017 -4.921 -3.601 1060 H LYS 9 H LYS 9 2.853 -5.770 -0.731 1061 HA LYS 9 HA LYS 9 5.751 -5.819 -1.234 1062 HB2 LYS 9 HB2 LYS 9 5.033 -5.107 1.030 1063 HB3 LYS 9 HB3 LYS 9 4.241 -6.663 1.247 1064 HG2 LYS 9 HG2 LYS 9 6.522 -7.706 0.839 1065 HG3 LYS 9 HG3 LYS 9 7.176 -6.079 1.038 1066 HD2 LYS 9 HD2 LYS 9 5.347 -7.274 3.092 1067 HD3 LYS 9 HD3 LYS 9 7.076 -7.628 3.097 1068 HE2 LYS 9 HE2 LYS 9 6.126 -4.796 2.960 1069 HE3 LYS 9 HE3 LYS 9 6.146 -5.642 4.506 1070 HZ1 LYS 9 HZ1 LYS 9 8.400 -4.862 2.789 1071 HZ2 LYS 9 HZ2 LYS 9 8.215 -4.687 4.461 1072 HZ3 LYS 9 HZ3 LYS 9 8.564 -6.206 3.803 1073 H SER 10 H SER 10 6.354 -7.482 -2.450 1074 HA SER 10 HA SER 10 5.703 -10.168 -1.671 1075 HB2 SER 10 HB2 SER 10 4.741 -10.825 -3.866 1076 HB3 SER 10 HB3 SER 10 3.715 -9.688 -2.992 1077 HG SER 10 HG SER 10 5.330 -9.248 -5.256 1078 H GLN 11 H GLN 11 7.217 -11.618 -2.357 1079 HA GLN 11 HA GLN 11 9.566 -10.504 -3.642 1080 HB2 GLN 11 HB2 GLN 11 10.599 -12.693 -3.086 1081 HB3 GLN 11 HB3 GLN 11 9.930 -11.866 -1.686 1082 HG2 GLN 11 HG2 GLN 11 8.037 -13.312 -1.642 1083 HG3 GLN 11 HG3 GLN 11 8.488 -14.035 -3.186 1084 HE21 GLN 11 HE21 GLN 11 10.923 -14.806 -3.077 1085 HE22 GLN 11 HE22 GLN 11 11.268 -15.833 -1.731 1086 H THR 12 H THR 12 7.380 -10.654 -5.366 1087 HA THR 12 HA THR 12 8.469 -12.430 -7.403 1088 HB THR 12 HB THR 12 5.779 -12.795 -7.838 1089 HG1 THR 12 HG1 THR 12 5.430 -11.963 -5.657 1090 HG21 THR 12 HG21 THR 12 8.067 -14.377 -7.020 1091 HG22 THR 12 HG22 THR 12 6.559 -15.030 -6.382 1092 HG23 THR 12 HG23 THR 12 6.750 -14.788 -8.118 1093 HA PRO 13 HA PRO 13 7.470 -9.197 -10.197 1094 HB2 PRO 13 HB2 PRO 13 6.652 -10.536 -12.413 1095 HB3 PRO 13 HB3 PRO 13 8.337 -10.496 -11.882 1096 HG2 PRO 13 HG2 PRO 13 6.274 -12.628 -11.479 1097 HG3 PRO 13 HG3 PRO 13 7.981 -12.794 -11.930 1098 HD2 PRO 13 HD2 PRO 13 7.095 -13.201 -9.404 1099 HD3 PRO 13 HD3 PRO 13 8.709 -12.550 -9.756 1100 H LEU 14 H LEU 14 5.661 -8.375 -8.965 1101 HA LEU 14 HA LEU 14 3.003 -9.307 -9.635 1102 HB2 LEU 14 HB2 LEU 14 2.212 -7.836 -7.981 1103 HB3 LEU 14 HB3 LEU 14 3.709 -8.518 -7.349 1104 HG LEU 14 HG LEU 14 3.727 -5.852 -8.711 1105 HD11 LEU 14 HD11 LEU 14 3.629 -5.314 -6.003 1106 HD12 LEU 14 HD12 LEU 14 2.351 -5.011 -7.179 1107 HD13 LEU 14 HD13 LEU 14 2.352 -6.506 -6.244 1108 HD21 LEU 14 HD21 LEU 14 5.889 -6.579 -8.288 1109 HD22 LEU 14 HD22 LEU 14 5.530 -5.582 -6.878 1110 HD23 LEU 14 HD23 LEU 14 5.443 -7.339 -6.760 1111 H VAL 15 H VAL 15 1.626 -6.852 -9.573 1112 HA VAL 15 HA VAL 15 2.600 -5.028 -11.521 1113 HB VAL 15 HB VAL 15 2.148 -6.834 -13.080 1114 HG11 VAL 15 HG11 VAL 15 -0.682 -6.783 -12.036 1115 HG12 VAL 15 HG12 VAL 15 -0.073 -7.779 -13.358 1116 HG13 VAL 15 HG13 VAL 15 0.505 -8.047 -11.713 1117 HG21 VAL 15 HG21 VAL 15 -0.195 -5.237 -13.743 1118 HG22 VAL 15 HG22 VAL 15 1.196 -4.258 -13.275 1119 HG23 VAL 15 HG23 VAL 15 1.336 -5.413 -14.601 1120 H THR 16 H THR 16 1.509 -3.153 -11.383 1121 HA THR 16 HA THR 16 -0.779 -3.057 -9.583 1122 HB THR 16 HB THR 16 0.925 -1.438 -9.113 1123 HG1 THR 16 HG1 THR 16 -0.601 -0.029 -8.745 1124 HG21 THR 16 HG21 THR 16 1.109 -1.276 -11.971 1125 HG22 THR 16 HG22 THR 16 0.862 0.336 -11.301 1126 HG23 THR 16 HG23 THR 16 2.216 -0.650 -10.749 1127 H LEU 17 H LEU 17 -2.729 -3.321 -10.449 1128 HA LEU 17 HA LEU 17 -3.249 -2.658 -13.215 1129 HB2 LEU 17 HB2 LEU 17 -4.161 -4.647 -11.780 1130 HB3 LEU 17 HB3 LEU 17 -5.375 -3.469 -11.283 1131 HG LEU 17 HG LEU 17 -4.844 -4.332 -14.126 1132 HD11 LEU 17 HD11 LEU 17 -7.374 -4.927 -12.694 1133 HD12 LEU 17 HD12 LEU 17 -6.562 -5.817 -13.982 1134 HD13 LEU 17 HD13 LEU 17 -5.963 -5.918 -12.326 1135 HD21 LEU 17 HD21 LEU 17 -7.274 -3.197 -14.155 1136 HD22 LEU 17 HD22 LEU 17 -6.512 -2.233 -12.890 1137 HD23 LEU 17 HD23 LEU 17 -5.787 -2.312 -14.496 1138 H PHE 18 H PHE 18 -3.241 -0.468 -13.471 1139 HA PHE 18 HA PHE 18 -5.185 1.059 -11.867 1140 HB2 PHE 18 HB2 PHE 18 -2.465 1.702 -12.853 1141 HB3 PHE 18 HB3 PHE 18 -3.650 3.001 -12.941 1142 HD1 PHE 18 HD1 PHE 18 -5.182 3.010 -10.648 1143 HD2 PHE 18 HD2 PHE 18 -1.116 1.803 -11.014 1144 HE1 PHE 18 HE1 PHE 18 -4.825 3.498 -8.263 1145 HE2 PHE 18 HE2 PHE 18 -0.754 2.289 -8.630 1146 HZ PHE 18 HZ PHE 18 -2.609 3.137 -7.250 1147 H LYS 19 H LYS 19 -7.005 1.030 -13.065 1148 HA LYS 19 HA LYS 19 -6.935 1.299 -15.938 1149 HB2 LYS 19 HB2 LYS 19 -9.030 0.819 -13.878 1150 HB3 LYS 19 HB3 LYS 19 -9.541 1.517 -15.409 1151 HG2 LYS 19 HG2 LYS 19 -8.089 -0.480 -16.374 1152 HG3 LYS 19 HG3 LYS 19 -8.493 -1.188 -14.808 1153 HD2 LYS 19 HD2 LYS 19 -10.736 -1.288 -15.281 1154 HD3 LYS 19 HD3 LYS 19 -10.669 0.070 -16.406 1155 HE2 LYS 19 HE2 LYS 19 -9.307 -1.470 -17.915 1156 HE3 LYS 19 HE3 LYS 19 -9.829 -2.781 -16.858 1157 HZ1 LYS 19 HZ1 LYS 19 -12.049 -2.472 -17.457 1158 HZ2 LYS 19 HZ2 LYS 19 -11.768 -0.942 -18.123 1159 HZ3 LYS 19 HZ3 LYS 19 -11.210 -2.326 -18.920 1160 H ASN 20 H ASN 20 -8.970 3.088 -13.640 1161 HA ASN 20 HA ASN 20 -8.506 5.507 -15.233 1162 HB2 ASN 20 HB2 ASN 20 -10.862 4.502 -14.602 1163 HB3 ASN 20 HB3 ASN 20 -10.584 5.355 -13.086 1164 HD21 ASN 20 HD21 ASN 20 -11.930 7.027 -13.201 1165 HD22 ASN 20 HD22 ASN 20 -11.964 8.193 -14.475 1166 H ALA 21 H ALA 21 -7.145 6.981 -14.487 1167 HA ALA 21 HA ALA 21 -6.838 7.278 -11.573 1168 HB1 ALA 21 HB1 ALA 21 -4.658 7.241 -13.651 1169 HB2 ALA 21 HB2 ALA 21 -4.427 7.804 -11.996 1170 HB3 ALA 21 HB3 ALA 21 -4.881 6.127 -12.302 1171 H ILE 22 H ILE 22 -7.759 9.177 -11.122 1172 HA ILE 22 HA ILE 22 -7.231 11.453 -12.916 1173 HB ILE 22 HB ILE 22 -9.454 11.211 -10.888 1174 HG12 ILE 22 HG12 ILE 22 -9.535 10.829 -13.889 1175 HG13 ILE 22 HG13 ILE 22 -9.726 9.558 -12.686 1176 HG21 ILE 22 HG21 ILE 22 -9.731 13.073 -13.123 1177 HG22 ILE 22 HG22 ILE 22 -10.042 13.309 -11.403 1178 HG23 ILE 22 HG23 ILE 22 -8.401 13.458 -12.030 1179 HD11 ILE 22 HD11 ILE 22 -11.653 11.503 -13.689 1180 HD12 ILE 22 HD12 ILE 22 -11.907 9.919 -12.955 1181 HD13 ILE 22 HD13 ILE 22 -11.647 11.333 -11.933 1182 H ILE 23 H ILE 23 -5.691 12.754 -12.193 1183 HA ILE 23 HA ILE 23 -5.310 13.044 -9.293 1184 HB ILE 23 HB ILE 23 -3.458 13.465 -11.622 1185 HG12 ILE 23 HG12 ILE 23 -3.702 11.210 -10.538 1186 HG13 ILE 23 HG13 ILE 23 -2.069 11.865 -10.494 1187 HG21 ILE 23 HG21 ILE 23 -1.839 14.170 -9.684 1188 HG22 ILE 23 HG22 ILE 23 -2.885 15.360 -10.460 1189 HG23 ILE 23 HG23 ILE 23 -3.337 14.671 -8.900 1190 HD11 ILE 23 HD11 ILE 23 -3.542 12.633 -8.146 1191 HD12 ILE 23 HD12 ILE 23 -3.550 10.882 -8.360 1192 HD13 ILE 23 HD13 ILE 23 -2.019 11.754 -8.286 1193 H LYS 24 H LYS 24 -6.649 14.651 -8.655 1194 HA LYS 24 HA LYS 24 -6.443 17.226 -10.075 1195 HB2 LYS 24 HB2 LYS 24 -8.730 15.804 -8.827 1196 HB3 LYS 24 HB3 LYS 24 -8.683 17.550 -8.624 1197 HG2 LYS 24 HG2 LYS 24 -8.391 17.682 -11.144 1198 HG3 LYS 24 HG3 LYS 24 -8.841 15.975 -11.173 1199 HD2 LYS 24 HD2 LYS 24 -11.002 16.396 -10.494 1200 HD3 LYS 24 HD3 LYS 24 -10.570 17.912 -9.700 1201 HE2 LYS 24 HE2 LYS 24 -10.019 18.706 -12.115 1202 HE3 LYS 24 HE3 LYS 24 -11.041 17.355 -12.602 1203 HZ1 LYS 24 HZ1 LYS 24 -12.797 18.625 -12.228 1204 HZ2 LYS 24 HZ2 LYS 24 -12.382 18.743 -10.592 1205 HZ3 LYS 24 HZ3 LYS 24 -11.818 19.897 -11.694 1206 H ASN 25 H ASN 25 -5.160 18.587 -9.024 1207 HA ASN 25 HA ASN 25 -4.089 19.710 -7.358 1208 HB2 ASN 25 HB2 ASN 25 -6.694 19.212 -5.898 1209 HB3 ASN 25 HB3 ASN 25 -5.482 20.409 -5.452 1210 HD21 ASN 25 HD21 ASN 25 -5.344 22.303 -6.574 1211 HD22 ASN 25 HD22 ASN 25 -6.496 22.784 -7.769 1212 H ALA 26 H ALA 26 -3.329 17.088 -7.489 1213 HA ALA 26 HA ALA 26 -3.335 16.045 -4.759 1214 HB1 ALA 26 HB1 ALA 26 -2.738 13.995 -5.621 1215 HB2 ALA 26 HB2 ALA 26 -3.689 14.667 -6.946 1216 HB3 ALA 26 HB3 ALA 26 -1.928 14.699 -7.021 1217 H TYR 27 H TYR 27 -1.868 18.488 -5.486 1218 HA TYR 27 HA TYR 27 0.503 18.026 -4.059 1219 HB2 TYR 27 HB2 TYR 27 0.911 16.982 -6.449 1220 HB3 TYR 27 HB3 TYR 27 1.197 18.660 -6.898 1221 HD1 TYR 27 HD1 TYR 27 3.154 19.839 -6.123 1222 HD2 TYR 27 HD2 TYR 27 2.409 15.836 -4.888 1223 HE1 TYR 27 HE1 TYR 27 5.460 19.674 -5.285 1224 HE2 TYR 27 HE2 TYR 27 4.713 15.661 -4.045 1225 HH TYR 27 HH TYR 27 6.620 16.738 -3.662 1226 H LYS 28 H LYS 28 1.619 19.935 -3.590 1227 HA LYS 28 HA LYS 28 0.640 22.400 -4.834 1228 HB2 LYS 28 HB2 LYS 28 0.698 21.855 -1.862 1229 HB3 LYS 28 HB3 LYS 28 0.466 23.449 -2.569 1230 HG2 LYS 28 HG2 LYS 28 -1.343 21.087 -3.033 1231 HG3 LYS 28 HG3 LYS 28 -1.638 22.375 -1.863 1232 HD2 LYS 28 HD2 LYS 28 -1.705 24.016 -3.657 1233 HD3 LYS 28 HD3 LYS 28 -1.336 22.761 -4.842 1234 HE2 LYS 28 HE2 LYS 28 -3.601 22.811 -5.064 1235 HE3 LYS 28 HE3 LYS 28 -3.478 21.637 -3.755 1236 HZ1 LYS 28 HZ1 LYS 28 -5.022 23.800 -3.654 1237 HZ2 LYS 28 HZ2 LYS 28 -4.370 23.059 -2.280 1238 HZ3 LYS 28 HZ3 LYS 28 -3.617 24.420 -2.944 1239 H LYS 29 H LYS 29 1.943 24.293 -3.518 1240 HA LYS 29 HA LYS 29 4.672 23.866 -4.282 1241 HB2 LYS 29 HB2 LYS 29 4.984 26.209 -3.463 1242 HB3 LYS 29 HB3 LYS 29 3.720 26.033 -4.673 1243 HG2 LYS 29 HG2 LYS 29 2.012 26.193 -3.006 1244 HG3 LYS 29 HG3 LYS 29 3.208 26.147 -1.709 1245 HD2 LYS 29 HD2 LYS 29 4.030 28.292 -2.260 1246 HD3 LYS 29 HD3 LYS 29 3.193 28.297 -3.814 1247 HE2 LYS 29 HE2 LYS 29 1.862 29.675 -2.510 1248 HE3 LYS 29 HE3 LYS 29 1.044 28.118 -2.388 1249 HZ1 LYS 29 HZ1 LYS 29 2.826 28.081 -0.333 1250 HZ2 LYS 29 HZ2 LYS 29 2.288 29.686 -0.340 1251 HZ3 LYS 29 HZ3 LYS 29 1.173 28.420 -0.202 1252 H GLY 30 H GLY 30 6.319 24.991 -2.584 1253 HA2 GLY 30 HA2 GLY 30 7.350 24.888 -0.514 1254 HA3 GLY 30 HA3 GLY 30 5.861 24.235 0.153 1255 H GLU 31 H GLU 31 5.409 21.925 -0.964 1256 HA GLU 31 HA GLU 31 7.912 20.387 -0.890 1257 HB2 GLU 31 HB2 GLU 31 6.747 20.317 1.330 1258 HB3 GLU 31 HB3 GLU 31 5.379 19.554 0.531 1259 HG2 GLU 31 HG2 GLU 31 6.425 17.690 1.253 1260 HG3 GLU 31 HG3 GLU 31 7.279 17.886 -0.276 1261 H1 TYR 1 H TYR 1 6.804 12.661 -8.267 1262 HA TYR 1 HA TYR 1 5.029 11.815 -6.129 1263 HB2 TYR 1 HB2 TYR 1 6.463 14.476 -6.002 1264 HB3 TYR 1 HB3 TYR 1 5.229 13.909 -4.883 1265 HD1 TYR 1 HD1 TYR 1 8.439 14.640 -4.801 1266 HD2 TYR 1 HD2 TYR 1 6.027 11.166 -4.336 1267 HE1 TYR 1 HE1 TYR 1 10.186 13.622 -3.399 1268 HE2 TYR 1 HE2 TYR 1 7.766 10.139 -2.932 1269 HH TYR 1 HH TYR 1 10.502 11.930 -1.791 1270 H GLY 2 H GLY 2 3.320 13.708 -5.815 1271 HA2 GLY 2 HA2 GLY 2 1.879 15.274 -6.804 1272 HA3 GLY 2 HA3 GLY 2 2.749 15.084 -8.319 1273 H GLY 3 H GLY 3 2.439 12.959 -9.442 1274 HA2 GLY 3 HA2 GLY 3 -0.339 12.487 -9.798 1275 HA3 GLY 3 HA3 GLY 3 0.967 11.575 -10.541 1276 H PHE 4 H PHE 4 0.195 9.538 -10.244 1277 HA PHE 4 HA PHE 4 -0.848 8.675 -7.704 1278 HB2 PHE 4 HB2 PHE 4 -0.453 7.452 -10.389 1279 HB3 PHE 4 HB3 PHE 4 -0.552 6.362 -9.010 1280 HD1 PHE 4 HD1 PHE 4 -2.615 5.333 -9.172 1281 HD2 PHE 4 HD2 PHE 4 -2.347 9.552 -9.669 1282 HE1 PHE 4 HE1 PHE 4 -5.071 5.479 -9.233 1283 HE2 PHE 4 HE2 PHE 4 -4.802 9.704 -9.731 1284 HZ PHE 4 HZ PHE 4 -6.167 7.666 -9.512 1285 H MET 5 H MET 5 0.036 6.809 -6.534 1286 HA MET 5 HA MET 5 2.982 6.837 -6.567 1287 HB2 MET 5 HB2 MET 5 1.544 7.689 -4.519 1288 HB3 MET 5 HB3 MET 5 1.445 5.972 -4.157 1289 HG2 MET 5 HG2 MET 5 3.967 5.930 -4.305 1290 HG3 MET 5 HG3 MET 5 3.898 7.690 -4.324 1291 HE1 MET 5 HE1 MET 5 4.598 4.853 -2.603 1292 HE2 MET 5 HE2 MET 5 5.467 6.018 -1.604 1293 HE3 MET 5 HE3 MET 5 4.193 5.025 -0.895 1294 H THR 6 H THR 6 3.702 5.062 -7.548 1295 HA THR 6 HA THR 6 2.271 2.528 -7.144 1296 HB THR 6 HB THR 6 4.495 2.685 -9.104 1297 HG1 THR 6 HG1 THR 6 2.052 4.102 -9.337 1298 HG21 THR 6 HG21 THR 6 3.547 0.753 -9.678 1299 HG22 THR 6 HG22 THR 6 2.231 1.027 -8.536 1300 HG23 THR 6 HG23 THR 6 2.107 1.638 -10.186 1301 H SER 7 H SER 7 3.082 1.868 -5.171 1302 HA SER 7 HA SER 7 5.993 1.562 -4.941 1303 HB2 SER 7 HB2 SER 7 4.382 2.654 -3.134 1304 HB3 SER 7 HB3 SER 7 4.158 0.970 -2.660 1305 HG SER 7 HG SER 7 6.473 2.553 -2.590 1306 H GLU 8 H GLU 8 6.527 -0.303 -5.945 1307 HA GLU 8 HA GLU 8 5.154 -2.748 -5.039 1308 HB2 GLU 8 HB2 GLU 8 6.125 -1.955 -7.762 1309 HB3 GLU 8 HB3 GLU 8 6.041 -3.655 -7.322 1310 HG2 GLU 8 HG2 GLU 8 4.033 -3.133 -8.447 1311 HG3 GLU 8 HG3 GLU 8 3.634 -3.291 -6.738 1312 H LYS 9 H LYS 9 6.431 -3.851 -3.721 1313 HA LYS 9 HA LYS 9 9.339 -3.744 -4.129 1314 HB2 LYS 9 HB2 LYS 9 8.468 -3.052 -1.908 1315 HB3 LYS 9 HB3 LYS 9 7.792 -4.662 -1.698 1316 HG2 LYS 9 HG2 LYS 9 10.145 -5.544 -1.971 1317 HG3 LYS 9 HG3 LYS 9 10.685 -3.869 -1.826 1318 HD2 LYS 9 HD2 LYS 9 8.865 -5.072 0.228 1319 HD3 LYS 9 HD3 LYS 9 10.607 -5.352 0.294 1320 HE2 LYS 9 HE2 LYS 9 9.551 -2.570 0.006 1321 HE3 LYS 9 HE3 LYS 9 9.553 -3.348 1.589 1322 HZ1 LYS 9 HZ1 LYS 9 11.830 -2.549 -0.088 1323 HZ2 LYS 9 HZ2 LYS 9 11.585 -2.318 1.570 1324 HZ3 LYS 9 HZ3 LYS 9 12.012 -3.846 0.983 1325 H SER 10 H SER 10 10.087 -5.375 -5.310 1326 HA SER 10 HA SER 10 9.595 -8.090 -4.506 1327 HB2 SER 10 HB2 SER 10 8.780 -8.831 -6.745 1328 HB3 SER 10 HB3 SER 10 7.633 -7.791 -5.902 1329 HG SER 10 HG SER 10 9.273 -7.206 -8.114 1330 H GLN 11 H GLN 11 11.184 -9.485 -5.196 1331 HA GLN 11 HA GLN 11 13.508 -8.215 -6.408 1332 HB2 GLN 11 HB2 GLN 11 14.688 -10.293 -5.739 1333 HB3 GLN 11 HB3 GLN 11 13.909 -9.479 -4.389 1334 HG2 GLN 11 HG2 GLN 11 12.136 -11.071 -4.356 1335 HG3 GLN 11 HG3 GLN 11 12.695 -11.802 -5.860 1336 HE21 GLN 11 HE21 GLN 11 15.185 -12.362 -5.644 1337 HE22 GLN 11 HE22 GLN 11 15.562 -13.318 -4.256 1338 H THR 12 H THR 12 11.413 -8.572 -8.194 1339 HA THR 12 HA THR 12 12.681 -10.343 -10.125 1340 HB THR 12 HB THR 12 10.049 -10.921 -10.638 1341 HG1 THR 12 HG1 THR 12 9.545 -10.010 -8.519 1342 HG21 THR 12 HG21 THR 12 12.400 -12.296 -9.647 1343 HG22 THR 12 HG22 THR 12 10.915 -13.021 -9.031 1344 HG23 THR 12 HG23 THR 12 11.160 -12.856 -10.769 1345 HA PRO 13 HA PRO 13 11.547 -7.302 -13.078 1346 HB2 PRO 13 HB2 PRO 13 10.856 -8.774 -15.251 1347 HB3 PRO 13 HB3 PRO 13 12.524 -8.614 -14.691 1348 HG2 PRO 13 HG2 PRO 13 10.581 -10.846 -14.239 1349 HG3 PRO 13 HG3 PRO 13 12.304 -10.928 -14.650 1350 HD2 PRO 13 HD2 PRO 13 11.389 -11.285 -12.127 1351 HD3 PRO 13 HD3 PRO 13 12.970 -10.555 -12.475 1352 H LEU 14 H LEU 14 9.661 -6.571 -11.880 1353 HA LEU 14 HA LEU 14 7.080 -7.673 -12.590 1354 HB2 LEU 14 HB2 LEU 14 6.165 -6.229 -10.983 1355 HB3 LEU 14 HB3 LEU 14 7.697 -6.781 -10.309 1356 HG LEU 14 HG LEU 14 7.551 -4.160 -11.747 1357 HD11 LEU 14 HD11 LEU 14 7.344 -3.559 -9.056 1358 HD12 LEU 14 HD12 LEU 14 6.082 -3.373 -10.274 1359 HD13 LEU 14 HD13 LEU 14 6.158 -4.841 -9.299 1360 HD21 LEU 14 HD21 LEU 14 9.748 -4.739 -11.246 1361 HD22 LEU 14 HD22 LEU 14 9.286 -3.697 -9.901 1362 HD23 LEU 14 HD23 LEU 14 9.311 -5.447 -9.691 1363 H VAL 15 H VAL 15 5.517 -5.372 -12.665 1364 HA VAL 15 HA VAL 15 6.435 -3.507 -14.614 1365 HB VAL 15 HB VAL 15 6.153 -5.389 -16.131 1366 HG11 VAL 15 HG11 VAL 15 3.289 -5.469 -15.187 1367 HG12 VAL 15 HG12 VAL 15 3.996 -6.460 -16.463 1368 HG13 VAL 15 HG13 VAL 15 4.531 -6.657 -14.794 1369 HG21 VAL 15 HG21 VAL 15 3.755 -3.957 -16.939 1370 HG22 VAL 15 HG22 VAL 15 5.051 -2.876 -16.426 1371 HG23 VAL 15 HG23 VAL 15 5.336 -4.044 -17.716 1372 H THR 16 H THR 16 5.218 -1.708 -14.542 1373 HA THR 16 HA THR 16 2.871 -1.735 -12.818 1374 HB THR 16 HB THR 16 4.441 0.006 -12.327 1375 HG1 THR 16 HG1 THR 16 2.813 1.318 -12.046 1376 HG21 THR 16 HG21 THR 16 4.747 0.103 -15.167 1377 HG22 THR 16 HG22 THR 16 4.319 1.711 -14.582 1378 HG23 THR 16 HG23 THR 16 5.727 0.879 -13.923 1379 H LEU 17 H LEU 17 0.953 -2.097 -13.713 1380 HA LEU 17 HA LEU 17 0.483 -1.564 -16.517 1381 HB2 LEU 17 HB2 LEU 17 -0.368 -3.546 -15.036 1382 HB3 LEU 17 HB3 LEU 17 -1.655 -2.417 -14.616 1383 HG LEU 17 HG LEU 17 -0.996 -3.347 -17.411 1384 HD11 LEU 17 HD11 LEU 17 -3.532 -4.032 -16.031 1385 HD12 LEU 17 HD12 LEU 17 -2.632 -4.920 -17.261 1386 HD13 LEU 17 HD13 LEU 17 -2.080 -4.930 -15.586 1387 HD21 LEU 17 HD21 LEU 17 -3.482 -2.349 -17.546 1388 HD22 LEU 17 HD22 LEU 17 -2.812 -1.303 -16.293 1389 HD23 LEU 17 HD23 LEU 17 -2.036 -1.394 -17.874 1390 H PHE 18 H PHE 18 0.378 0.609 -16.860 1391 HA PHE 18 HA PHE 18 -1.678 2.092 -15.358 1392 HB2 PHE 18 HB2 PHE 18 1.026 2.838 -16.313 1393 HB3 PHE 18 HB3 PHE 18 -0.222 4.070 -16.478 1394 HD1 PHE 18 HD1 PHE 18 -1.805 4.081 -14.216 1395 HD2 PHE 18 HD2 PHE 18 2.327 3.087 -14.455 1396 HE1 PHE 18 HE1 PHE 18 -1.527 4.680 -11.846 1397 HE2 PHE 18 HE2 PHE 18 2.611 3.683 -12.085 1398 HZ PHE 18 HZ PHE 18 0.682 4.480 -10.777 1399 H LYS 19 H LYS 19 -3.464 1.895 -16.597 1400 HA LYS 19 HA LYS 19 -3.345 2.065 -19.474 1401 HB2 LYS 19 HB2 LYS 19 -5.456 1.552 -17.438 1402 HB3 LYS 19 HB3 LYS 19 -5.972 2.167 -19.004 1403 HG2 LYS 19 HG2 LYS 19 -4.388 0.212 -19.857 1404 HG3 LYS 19 HG3 LYS 19 -4.811 -0.458 -18.280 1405 HD2 LYS 19 HD2 LYS 19 -7.028 -0.685 -18.819 1406 HD3 LYS 19 HD3 LYS 19 -6.991 0.638 -19.987 1407 HE2 LYS 19 HE2 LYS 19 -5.512 -0.878 -21.404 1408 HE3 LYS 19 HE3 LYS 19 -5.996 -2.180 -20.319 1409 HZ1 LYS 19 HZ1 LYS 19 -8.212 -2.004 -20.985 1410 HZ2 LYS 19 HZ2 LYS 19 -7.989 -0.487 -21.699 1411 HZ3 LYS 19 HZ3 LYS 19 -7.340 -1.869 -22.429 1412 H ASN 20 H ASN 20 -5.520 3.834 -17.291 1413 HA ASN 20 HA ASN 20 -5.144 6.210 -18.970 1414 HB2 ASN 20 HB2 ASN 20 -7.460 5.107 -18.362 1415 HB3 ASN 20 HB3 ASN 20 -7.269 6.027 -16.873 1416 HD21 ASN 20 HD21 ASN 20 -8.692 7.624 -17.081 1417 HD22 ASN 20 HD22 ASN 20 -8.753 8.739 -18.399 1418 H ALA 21 H ALA 21 -3.888 7.786 -18.248 1419 HA ALA 21 HA ALA 21 -3.677 8.210 -15.341 1420 HB1 ALA 21 HB1 ALA 21 -1.440 8.209 -17.359 1421 HB2 ALA 21 HB2 ALA 21 -1.286 8.846 -15.721 1422 HB3 ALA 21 HB3 ALA 21 -1.643 7.137 -15.973 1423 H ILE 22 H ILE 22 -4.700 10.075 -14.986 1424 HA ILE 22 HA ILE 22 -4.248 12.303 -16.858 1425 HB ILE 22 HB ILE 22 -6.504 12.025 -14.872 1426 HG12 ILE 22 HG12 ILE 22 -6.492 11.521 -17.856 1427 HG13 ILE 22 HG13 ILE 22 -6.646 10.290 -16.608 1428 HG21 ILE 22 HG21 ILE 22 -6.820 13.781 -17.187 1429 HG22 ILE 22 HG22 ILE 22 -7.187 14.066 -15.486 1430 HG23 ILE 22 HG23 ILE 22 -5.540 14.278 -16.080 1431 HD11 ILE 22 HD11 ILE 22 -8.645 12.092 -17.731 1432 HD12 ILE 22 HD12 ILE 22 -8.836 10.526 -16.942 1433 HD13 ILE 22 HD13 ILE 22 -8.675 11.989 -15.971 1434 H ILE 23 H ILE 23 -2.810 13.728 -16.157 1435 HA ILE 23 HA ILE 23 -2.508 14.143 -13.263 1436 HB ILE 23 HB ILE 23 -0.628 14.598 -15.566 1437 HG12 ILE 23 HG12 ILE 23 -0.759 12.354 -14.469 1438 HG13 ILE 23 HG13 ILE 23 0.826 13.109 -14.346 1439 HG21 ILE 23 HG21 ILE 23 0.895 15.407 -13.571 1440 HG22 ILE 23 HG22 ILE 23 -0.145 16.531 -14.446 1441 HG23 ILE 23 HG23 ILE 23 -0.658 15.887 -12.887 1442 HD11 ILE 23 HD11 ILE 23 -0.826 13.788 -12.086 1443 HD12 ILE 23 HD12 ILE 23 -0.687 12.041 -12.284 1444 HD13 ILE 23 HD13 ILE 23 0.766 13.030 -12.136 1445 H LYS 24 H LYS 24 -3.969 15.687 -12.732 1446 HA LYS 24 HA LYS 24 -3.864 18.217 -14.240 1447 HB2 LYS 24 HB2 LYS 24 -6.100 16.719 -12.985 1448 HB3 LYS 24 HB3 LYS 24 -6.155 18.473 -12.865 1449 HG2 LYS 24 HG2 LYS 24 -5.806 18.505 -15.381 1450 HG3 LYS 24 HG3 LYS 24 -6.156 16.775 -15.339 1451 HD2 LYS 24 HD2 LYS 24 -8.356 17.100 -14.738 1452 HD3 LYS 24 HD3 LYS 24 -8.032 18.670 -13.998 1453 HE2 LYS 24 HE2 LYS 24 -7.459 19.391 -16.433 1454 HE3 LYS 24 HE3 LYS 24 -8.395 17.967 -16.883 1455 HZ1 LYS 24 HZ1 LYS 24 -10.224 19.156 -16.608 1456 HZ2 LYS 24 HZ2 LYS 24 -9.859 19.364 -14.969 1457 HZ3 LYS 24 HZ3 LYS 24 -9.328 20.500 -16.104 1458 H ASN 25 H ASN 25 -2.667 19.673 -13.210 1459 HA ASN 25 HA ASN 25 -1.710 20.920 -11.564 1460 HB2 ASN 25 HB2 ASN 25 -4.319 20.332 -10.145 1461 HB3 ASN 25 HB3 ASN 25 -3.187 21.613 -9.722 1462 HD21 ASN 25 HD21 ASN 25 -3.130 23.466 -10.917 1463 HD22 ASN 25 HD22 ASN 25 -4.278 23.833 -12.155 1464 H ALA 26 H ALA 26 -0.795 18.349 -11.576 1465 HA ALA 26 HA ALA 26 -0.818 17.406 -8.809 1466 HB1 ALA 26 HB1 ALA 26 -0.084 15.363 -9.578 1467 HB2 ALA 26 HB2 ALA 26 -1.040 15.929 -10.948 1468 HB3 ALA 26 HB3 ALA 26 0.719 16.060 -10.986 1469 H TYR 27 H TYR 27 0.532 19.899 -9.600 1470 HA TYR 27 HA TYR 27 2.885 19.626 -8.098 1471 HB2 TYR 27 HB2 TYR 27 3.414 18.515 -10.433 1472 HB3 TYR 27 HB3 TYR 27 3.617 20.187 -10.942 1473 HD1 TYR 27 HD1 TYR 27 5.486 21.503 -10.172 1474 HD2 TYR 27 HD2 TYR 27 4.931 17.518 -8.789 1475 HE1 TYR 27 HE1 TYR 27 7.775 21.503 -9.273 1476 HE2 TYR 27 HE2 TYR 27 7.219 17.508 -7.885 1477 HH TYR 27 HH TYR 27 9.053 18.705 -7.502 1478 H LYS 28 H LYS 28 3.901 21.612 -7.697 1479 HA LYS 28 HA LYS 28 2.813 23.968 -9.055 1480 HB2 LYS 28 HB2 LYS 28 2.832 23.549 -6.062 1481 HB3 LYS 28 HB3 LYS 28 2.522 25.094 -6.843 1482 HG2 LYS 28 HG2 LYS 28 0.868 22.611 -7.241 1483 HG3 LYS 28 HG3 LYS 28 0.471 23.925 -6.131 1484 HD2 LYS 28 HD2 LYS 28 0.354 25.486 -7.997 1485 HD3 LYS 28 HD3 LYS 28 0.810 24.202 -9.119 1486 HE2 LYS 28 HE2 LYS 28 -1.451 24.123 -9.377 1487 HE3 LYS 28 HE3 LYS 28 -1.288 23.011 -8.018 1488 HZ1 LYS 28 HZ1 LYS 28 -2.946 25.090 -8.029 1489 HZ2 LYS 28 HZ2 LYS 28 -2.280 24.441 -6.616 1490 HZ3 LYS 28 HZ3 LYS 28 -1.589 25.813 -7.324 1491 H LYS 29 H LYS 29 3.979 25.980 -7.787 1492 HA LYS 29 HA LYS 29 6.743 25.679 -8.476 1493 HB2 LYS 29 HB2 LYS 29 6.908 28.062 -7.731 1494 HB3 LYS 29 HB3 LYS 29 5.686 27.775 -8.963 1495 HG2 LYS 29 HG2 LYS 29 3.931 27.889 -7.339 1496 HG3 LYS 29 HG3 LYS 29 5.098 27.967 -6.017 1497 HD2 LYS 29 HD2 LYS 29 5.802 30.134 -6.635 1498 HD3 LYS 29 HD3 LYS 29 5.004 30.028 -8.207 1499 HE2 LYS 29 HE2 LYS 29 3.561 31.372 -6.990 1500 HE3 LYS 29 HE3 LYS 29 2.835 29.774 -6.822 1501 HZ1 LYS 29 HZ1 LYS 29 4.564 29.926 -4.728 1502 HZ2 LYS 29 HZ2 LYS 29 3.935 31.494 -4.813 1503 HZ3 LYS 29 HZ3 LYS 29 2.892 30.172 -4.648 1504 H GLY 30 H GLY 30 8.287 26.956 -6.786 1505 HA2 GLY 30 HA2 GLY 30 9.281 26.976 -4.696 1506 HA3 GLY 30 HA3 GLY 30 7.813 26.272 -4.033 1507 H GLU 31 H GLU 31 7.498 23.902 -5.042 1508 HA GLU 31 HA GLU 31 10.074 22.499 -4.871 1509 HB2 GLU 31 HB2 GLU 31 8.861 22.454 -2.674 1510 HB3 GLU 31 HB3 GLU 31 7.558 21.586 -3.473 1511 HG2 GLU 31 HG2 GLU 31 8.684 19.811 -2.658 1512 HG3 GLU 31 HG3 GLU 31 9.570 19.998 -4.170 Start of MODEL 10 1 H1 TYR 1 H TYR 1 -4.445 4.824 9.345 2 HA TYR 1 HA TYR 1 -6.084 2.870 10.813 3 HB2 TYR 1 HB2 TYR 1 -4.127 4.868 11.933 4 HB3 TYR 1 HB3 TYR 1 -5.436 4.205 12.905 5 HD1 TYR 1 HD1 TYR 1 -2.168 3.953 12.781 6 HD2 TYR 1 HD2 TYR 1 -5.499 1.404 12.063 7 HE1 TYR 1 HE1 TYR 1 -0.776 1.994 13.307 8 HE2 TYR 1 HE2 TYR 1 -4.117 -0.561 12.589 9 HH TYR 1 HH TYR 1 -1.401 -0.985 12.466 10 H GLY 2 H GLY 2 -8.117 3.502 11.181 11 HA2 GLY 2 HA2 GLY 2 -9.324 5.651 12.026 12 HA3 GLY 2 HA3 GLY 2 -8.838 6.253 10.449 13 H GLY 3 H GLY 3 -11.270 6.529 10.388 14 HA2 GLY 3 HA2 GLY 3 -13.326 5.886 9.590 15 HA3 GLY 3 HA3 GLY 3 -12.405 4.815 8.544 16 H PHE 4 H PHE 4 -13.847 3.122 8.599 17 HA PHE 4 HA PHE 4 -14.822 2.065 11.090 18 HB2 PHE 4 HB2 PHE 4 -15.159 1.416 8.206 19 HB3 PHE 4 HB3 PHE 4 -15.462 0.127 9.366 20 HD1 PHE 4 HD1 PHE 4 -17.751 -0.166 9.419 21 HD2 PHE 4 HD2 PHE 4 -16.154 3.776 9.587 22 HE1 PHE 4 HE1 PHE 4 -20.008 0.727 9.823 23 HE2 PHE 4 HE2 PHE 4 -18.408 4.675 9.992 24 HZ PHE 4 HZ PHE 4 -20.339 3.150 10.111 25 H MET 5 H MET 5 -14.438 -0.121 11.827 26 HA MET 5 HA MET 5 -11.717 -1.049 11.181 27 HB2 MET 5 HB2 MET 5 -12.426 -0.139 13.571 28 HB3 MET 5 HB3 MET 5 -13.028 -1.781 13.758 29 HG2 MET 5 HG2 MET 5 -10.653 -2.447 12.923 30 HG3 MET 5 HG3 MET 5 -10.230 -0.815 13.434 31 HE1 MET 5 HE1 MET 5 -10.519 -4.430 14.486 32 HE2 MET 5 HE2 MET 5 -8.983 -3.564 14.528 33 HE3 MET 5 HE3 MET 5 -9.687 -4.185 16.021 34 H THR 6 H THR 6 -11.861 -2.760 9.880 35 HA THR 6 HA THR 6 -13.989 -4.732 10.357 36 HB THR 6 HB THR 6 -12.270 -4.338 7.899 37 HG1 THR 6 HG1 THR 6 -13.963 -2.733 8.369 38 HG21 THR 6 HG21 THR 6 -13.786 -5.943 6.836 39 HG22 THR 6 HG22 THR 6 -12.942 -6.674 8.201 40 HG23 THR 6 HG23 THR 6 -14.624 -6.173 8.371 41 H SER 7 H SER 7 -13.113 -6.017 11.937 42 HA SER 7 HA SER 7 -10.482 -7.214 11.425 43 HB2 SER 7 HB2 SER 7 -11.334 -6.098 13.703 44 HB3 SER 7 HB3 SER 7 -11.933 -7.735 13.972 45 HG SER 7 HG SER 7 -9.968 -8.305 14.402 46 H GLU 8 H GLU 8 -10.811 -8.892 10.060 47 HA GLU 8 HA GLU 8 -12.816 -10.902 10.848 48 HB2 GLU 8 HB2 GLU 8 -11.852 -9.960 8.183 49 HB3 GLU 8 HB3 GLU 8 -12.373 -11.631 8.346 50 HG2 GLU 8 HG2 GLU 8 -14.547 -11.080 8.576 51 HG3 GLU 8 HG3 GLU 8 -14.192 -9.587 9.443 52 H LYS 9 H LYS 9 -11.880 -12.522 11.900 53 HA LYS 9 HA LYS 9 -9.181 -13.371 11.104 54 HB2 LYS 9 HB2 LYS 9 -9.460 -12.746 13.465 55 HB3 LYS 9 HB3 LYS 9 -10.727 -13.953 13.638 56 HG2 LYS 9 HG2 LYS 9 -8.788 -15.541 12.749 57 HG3 LYS 9 HG3 LYS 9 -7.791 -14.287 13.490 58 HD2 LYS 9 HD2 LYS 9 -10.068 -15.654 14.913 59 HD3 LYS 9 HD3 LYS 9 -8.396 -16.216 14.991 60 HE2 LYS 9 HE2 LYS 9 -9.308 -13.449 15.770 61 HE3 LYS 9 HE3 LYS 9 -9.074 -14.777 16.906 62 HZ1 LYS 9 HZ1 LYS 9 -7.132 -13.063 15.685 63 HZ2 LYS 9 HZ2 LYS 9 -6.990 -14.052 17.050 64 HZ3 LYS 9 HZ3 LYS 9 -6.743 -14.700 15.507 65 H SER 10 H SER 10 -9.346 -14.874 9.549 66 HA SER 10 HA SER 10 -10.565 -17.401 10.197 67 HB2 SER 10 HB2 SER 10 -11.986 -17.482 8.160 68 HB3 SER 10 HB3 SER 10 -12.519 -16.253 9.307 69 HG SER 10 HG SER 10 -11.162 -15.919 6.855 70 H GLN 11 H GLN 11 -9.588 -19.071 9.159 71 HA GLN 11 HA GLN 11 -7.261 -18.425 7.558 72 HB2 GLN 11 HB2 GLN 11 -6.779 -20.856 7.733 73 HB3 GLN 11 HB3 GLN 11 -6.982 -20.075 9.296 74 HG2 GLN 11 HG2 GLN 11 -9.171 -20.993 9.548 75 HG3 GLN 11 HG3 GLN 11 -9.155 -21.613 7.898 76 HE21 GLN 11 HE21 GLN 11 -8.156 -22.112 11.150 77 HE22 GLN 11 HE22 GLN 11 -7.465 -23.679 10.929 78 H THR 12 H THR 12 -9.507 -17.734 6.175 79 HA THR 12 HA THR 12 -9.311 -19.490 3.871 80 HB THR 12 HB THR 12 -12.019 -19.065 3.850 81 HG1 THR 12 HG1 THR 12 -11.361 -19.892 6.493 82 HG21 THR 12 HG21 THR 12 -10.195 -21.297 4.230 83 HG22 THR 12 HG22 THR 12 -11.756 -21.568 5.005 84 HG23 THR 12 HG23 THR 12 -11.678 -21.203 3.281 85 HA PRO 13 HA PRO 13 -9.678 -15.769 1.574 86 HB2 PRO 13 HB2 PRO 13 -11.067 -16.563 -0.620 87 HB3 PRO 13 HB3 PRO 13 -9.385 -17.022 -0.329 88 HG2 PRO 13 HG2 PRO 13 -11.888 -18.590 0.159 89 HG3 PRO 13 HG3 PRO 13 -10.349 -19.128 -0.540 90 HD2 PRO 13 HD2 PRO 13 -11.027 -19.611 2.037 91 HD3 PRO 13 HD3 PRO 13 -9.347 -19.355 1.523 92 H LEU 14 H LEU 14 -10.924 -14.264 2.572 93 HA LEU 14 HA LEU 14 -13.845 -14.488 2.282 94 HB2 LEU 14 HB2 LEU 14 -14.094 -13.157 4.221 95 HB3 LEU 14 HB3 LEU 14 -12.895 -14.393 4.596 96 HG LEU 14 HG LEU 14 -12.057 -11.640 3.751 97 HD11 LEU 14 HD11 LEU 14 -11.804 -11.591 6.452 98 HD12 LEU 14 HD12 LEU 14 -13.124 -10.842 5.554 99 HD13 LEU 14 HD13 LEU 14 -13.337 -12.442 6.265 100 HD21 LEU 14 HD21 LEU 14 -10.187 -12.960 3.779 101 HD22 LEU 14 HD22 LEU 14 -10.208 -12.412 5.455 102 HD23 LEU 14 HD23 LEU 14 -10.814 -14.016 5.044 103 H VAL 15 H VAL 15 -14.373 -11.771 2.934 104 HA VAL 15 HA VAL 15 -12.991 -9.996 1.197 105 HB VAL 15 HB VAL 15 -14.075 -11.190 -0.586 106 HG11 VAL 15 HG11 VAL 15 -16.531 -11.382 -0.709 107 HG12 VAL 15 HG12 VAL 15 -15.851 -12.267 0.657 108 HG13 VAL 15 HG13 VAL 15 -16.646 -10.714 0.919 109 HG21 VAL 15 HG21 VAL 15 -14.260 -8.493 -0.202 110 HG22 VAL 15 HG22 VAL 15 -14.658 -9.333 -1.701 111 HG23 VAL 15 HG23 VAL 15 -15.933 -8.928 -0.551 112 H THR 16 H THR 16 -13.350 -7.968 1.855 113 HA THR 16 HA THR 16 -15.355 -7.512 3.902 114 HB THR 16 HB THR 16 -13.231 -6.569 4.402 115 HG1 THR 16 HG1 THR 16 -15.358 -5.144 4.365 116 HG21 THR 16 HG21 THR 16 -13.221 -5.926 1.561 117 HG22 THR 16 HG22 THR 16 -12.687 -4.578 2.565 118 HG23 THR 16 HG23 THR 16 -11.870 -6.137 2.676 119 H LEU 17 H LEU 17 -17.311 -7.520 2.794 120 HA LEU 17 HA LEU 17 -17.807 -6.029 0.439 121 HB2 LEU 17 HB2 LEU 17 -19.156 -7.960 1.266 122 HB3 LEU 17 HB3 LEU 17 -19.808 -6.902 2.516 123 HG LEU 17 HG LEU 17 -21.264 -7.315 0.478 124 HD11 LEU 17 HD11 LEU 17 -20.729 -4.397 0.795 125 HD12 LEU 17 HD12 LEU 17 -22.266 -5.257 0.707 126 HD13 LEU 17 HD13 LEU 17 -21.294 -5.336 2.177 127 HD21 LEU 17 HD21 LEU 17 -20.702 -6.559 -1.575 128 HD22 LEU 17 HD22 LEU 17 -19.799 -5.182 -0.943 129 HD23 LEU 17 HD23 LEU 17 -19.063 -6.784 -0.965 130 H PHE 18 H PHE 18 -17.276 -3.900 0.561 131 HA PHE 18 HA PHE 18 -18.611 -2.304 2.646 132 HB2 PHE 18 HB2 PHE 18 -15.919 -2.178 1.452 133 HB3 PHE 18 HB3 PHE 18 -16.724 -0.622 1.625 134 HD1 PHE 18 HD1 PHE 18 -18.090 -0.622 4.062 135 HD2 PHE 18 HD2 PHE 18 -14.423 -2.574 3.132 136 HE1 PHE 18 HE1 PHE 18 -17.458 -0.560 6.439 137 HE2 PHE 18 HE2 PHE 18 -13.786 -2.516 5.507 138 HZ PHE 18 HZ PHE 18 -15.304 -1.508 7.165 139 H LYS 19 H LYS 19 -20.478 -1.633 1.761 140 HA LYS 19 HA LYS 19 -20.653 -0.865 -1.016 141 HB2 LYS 19 HB2 LYS 19 -22.670 -0.745 1.232 142 HB3 LYS 19 HB3 LYS 19 -23.023 -0.335 -0.442 143 HG2 LYS 19 HG2 LYS 19 -22.044 -2.765 -0.848 144 HG3 LYS 19 HG3 LYS 19 -22.587 -2.981 0.817 145 HD2 LYS 19 HD2 LYS 19 -24.811 -2.625 0.273 146 HD3 LYS 19 HD3 LYS 19 -24.413 -1.743 -1.203 147 HE2 LYS 19 HE2 LYS 19 -23.937 -3.695 -2.383 148 HE3 LYS 19 HE3 LYS 19 -23.722 -4.644 -0.914 149 HZ1 LYS 19 HZ1 LYS 19 -26.358 -3.479 -1.397 150 HZ2 LYS 19 HZ2 LYS 19 -25.902 -4.794 -2.359 151 HZ3 LYS 19 HZ3 LYS 19 -25.943 -4.951 -0.674 152 H ASN 20 H ASN 20 -21.857 0.923 1.808 153 HA ASN 20 HA ASN 20 -20.936 3.400 0.537 154 HB2 ASN 20 HB2 ASN 20 -23.382 2.921 1.387 155 HB3 ASN 20 HB3 ASN 20 -22.706 3.366 2.951 156 HD21 ASN 20 HD21 ASN 20 -24.704 4.853 1.928 157 HD22 ASN 20 HD22 ASN 20 -24.112 6.393 1.415 158 H ALA 21 H ALA 21 -19.192 4.396 1.283 159 HA ALA 21 HA ALA 21 -18.450 4.039 4.108 160 HB1 ALA 21 HB1 ALA 21 -16.066 3.991 3.411 161 HB2 ALA 21 HB2 ALA 21 -16.993 2.594 2.863 162 HB3 ALA 21 HB3 ALA 21 -16.600 3.890 1.733 163 H ILE 22 H ILE 22 -18.904 6.011 4.905 164 HA ILE 22 HA ILE 22 -17.927 8.365 3.435 165 HB ILE 22 HB ILE 22 -19.963 8.288 5.663 166 HG12 ILE 22 HG12 ILE 22 -20.369 8.586 2.679 167 HG13 ILE 22 HG13 ILE 22 -20.782 7.163 3.630 168 HG21 ILE 22 HG21 ILE 22 -20.396 10.585 5.123 169 HG22 ILE 22 HG22 ILE 22 -18.667 10.394 5.413 170 HG23 ILE 22 HG23 ILE 22 -19.275 10.523 3.763 171 HD11 ILE 22 HD11 ILE 22 -22.166 9.008 4.980 172 HD12 ILE 22 HD12 ILE 22 -22.170 9.748 3.379 173 HD13 ILE 22 HD13 ILE 22 -22.816 8.122 3.601 174 H ILE 23 H ILE 23 -16.059 9.139 4.139 175 HA ILE 23 HA ILE 23 -15.338 8.779 6.965 176 HB ILE 23 HB ILE 23 -13.680 9.201 4.496 177 HG12 ILE 23 HG12 ILE 23 -14.355 6.899 5.250 178 HG13 ILE 23 HG13 ILE 23 -12.616 7.155 5.158 179 HG21 ILE 23 HG21 ILE 23 -13.043 9.936 7.291 180 HG22 ILE 23 HG22 ILE 23 -11.784 9.117 6.367 181 HG23 ILE 23 HG23 ILE 23 -12.469 10.631 5.775 182 HD11 ILE 23 HD11 ILE 23 -13.604 7.795 7.781 183 HD12 ILE 23 HD12 ILE 23 -14.065 6.160 7.309 184 HD13 ILE 23 HD13 ILE 23 -12.367 6.637 7.293 185 H LYS 24 H LYS 24 -16.116 10.489 8.068 186 HA LYS 24 HA LYS 24 -15.498 13.179 7.036 187 HB2 LYS 24 HB2 LYS 24 -17.956 12.322 7.548 188 HB3 LYS 24 HB3 LYS 24 -17.518 12.762 9.193 189 HG2 LYS 24 HG2 LYS 24 -16.773 15.007 8.047 190 HG3 LYS 24 HG3 LYS 24 -17.917 14.489 6.806 191 HD2 LYS 24 HD2 LYS 24 -18.722 14.453 9.686 192 HD3 LYS 24 HD3 LYS 24 -18.732 15.973 8.789 193 HE2 LYS 24 HE2 LYS 24 -20.074 13.535 7.683 194 HE3 LYS 24 HE3 LYS 24 -20.889 14.542 8.878 195 HZ1 LYS 24 HZ1 LYS 24 -19.894 16.289 7.002 196 HZ2 LYS 24 HZ2 LYS 24 -20.520 15.002 6.100 197 HZ3 LYS 24 HZ3 LYS 24 -21.509 15.825 7.198 198 H ASN 25 H ASN 25 -13.607 13.744 7.946 199 HA ASN 25 HA ASN 25 -12.073 14.319 9.524 200 HB2 ASN 25 HB2 ASN 25 -14.447 14.278 11.402 201 HB3 ASN 25 HB3 ASN 25 -12.900 15.067 11.700 202 HD21 ASN 25 HD21 ASN 25 -15.766 15.999 11.388 203 HD22 ASN 25 HD22 ASN 25 -15.658 17.306 10.264 204 H ALA 26 H ALA 26 -12.102 11.663 8.936 205 HA ALA 26 HA ALA 26 -12.050 10.199 11.464 206 HB1 ALA 26 HB1 ALA 26 -12.167 8.248 10.249 207 HB2 ALA 26 HB2 ALA 26 -13.047 9.361 9.202 208 HB3 ALA 26 HB3 ALA 26 -11.371 8.950 8.840 209 H TYR 27 H TYR 27 -10.077 12.250 10.990 210 HA TYR 27 HA TYR 27 -7.751 10.852 11.767 211 HB2 TYR 27 HB2 TYR 27 -7.908 10.476 9.200 212 HB3 TYR 27 HB3 TYR 27 -7.393 12.155 9.084 213 HD1 TYR 27 HD1 TYR 27 -5.246 12.757 10.486 214 HD2 TYR 27 HD2 TYR 27 -6.295 8.818 9.265 215 HE1 TYR 27 HE1 TYR 27 -2.901 12.059 10.741 216 HE2 TYR 27 HE2 TYR 27 -3.954 8.110 9.518 217 HH TYR 27 HH TYR 27 -1.772 9.542 11.218 218 H LYS 28 H LYS 28 -6.770 12.199 13.109 219 HA LYS 28 HA LYS 28 -6.349 14.974 12.392 220 HB2 LYS 28 HB2 LYS 28 -8.080 14.137 14.712 221 HB3 LYS 28 HB3 LYS 28 -7.263 15.694 14.678 222 HG2 LYS 28 HG2 LYS 28 -8.434 16.246 12.591 223 HG3 LYS 28 HG3 LYS 28 -9.282 14.700 12.676 224 HD2 LYS 28 HD2 LYS 28 -10.186 15.397 14.893 225 HD3 LYS 28 HD3 LYS 28 -9.454 16.983 14.640 226 HE2 LYS 28 HE2 LYS 28 -11.218 15.889 12.510 227 HE3 LYS 28 HE3 LYS 28 -11.971 16.484 13.989 228 HZ1 LYS 28 HZ1 LYS 28 -11.912 18.363 12.701 229 HZ2 LYS 28 HZ2 LYS 28 -10.460 18.531 13.552 230 HZ3 LYS 28 HZ3 LYS 28 -10.446 17.963 11.959 231 H LYS 29 H LYS 29 -4.450 15.694 13.149 232 HA LYS 29 HA LYS 29 -2.985 13.953 15.000 233 HB2 LYS 29 HB2 LYS 29 -2.180 15.870 12.855 234 HB3 LYS 29 HB3 LYS 29 -1.062 15.573 14.180 235 HG2 LYS 29 HG2 LYS 29 -2.225 13.190 12.883 236 HG3 LYS 29 HG3 LYS 29 -1.085 14.139 11.927 237 HD2 LYS 29 HD2 LYS 29 0.415 12.790 12.967 238 HD3 LYS 29 HD3 LYS 29 0.281 14.024 14.222 239 HE2 LYS 29 HE2 LYS 29 -0.997 12.685 15.589 240 HE3 LYS 29 HE3 LYS 29 -1.611 11.720 14.248 241 HZ1 LYS 29 HZ1 LYS 29 0.651 11.257 15.903 242 HZ2 LYS 29 HZ2 LYS 29 -0.094 10.218 14.795 243 HZ3 LYS 29 HZ3 LYS 29 1.104 11.293 14.273 244 H GLY 30 H GLY 30 -4.992 15.690 16.035 245 HA2 GLY 30 HA2 GLY 30 -4.837 16.721 18.202 246 HA3 GLY 30 HA3 GLY 30 -3.284 17.391 17.726 247 H GLU 31 H GLU 31 -5.975 17.474 15.530 248 HA GLU 31 HA GLU 31 -7.002 19.238 14.508 249 HB2 GLU 31 HB2 GLU 31 -7.180 20.090 17.401 250 HB3 GLU 31 HB3 GLU 31 -8.066 20.862 16.093 251 HG2 GLU 31 HG2 GLU 31 -9.221 18.775 15.622 252 HG3 GLU 31 HG3 GLU 31 -8.315 17.975 16.904 253 H1 TYR 1 H TYR 1 -1.765 6.601 5.653 254 HA TYR 1 HA TYR 1 -3.330 4.599 7.134 255 HB2 TYR 1 HB2 TYR 1 -1.535 6.747 8.248 256 HB3 TYR 1 HB3 TYR 1 -2.834 6.037 9.200 257 HD1 TYR 1 HD1 TYR 1 0.448 5.978 9.177 258 HD2 TYR 1 HD2 TYR 1 -2.706 3.213 8.463 259 HE1 TYR 1 HE1 TYR 1 1.936 4.125 9.814 260 HE2 TYR 1 HE2 TYR 1 -1.228 1.353 9.100 261 HH TYR 1 HH TYR 1 1.510 1.086 9.068 262 H GLY 2 H GLY 2 -5.407 5.122 7.433 263 HA2 GLY 2 HA2 GLY 2 -6.764 7.224 8.159 264 HA3 GLY 2 HA3 GLY 2 -6.268 7.794 6.573 265 H GLY 3 H GLY 3 -8.705 7.922 6.425 266 HA2 GLY 3 HA2 GLY 3 -10.696 7.127 5.597 267 HA3 GLY 3 HA3 GLY 3 -9.682 6.071 4.625 268 H PHE 4 H PHE 4 -11.024 4.298 4.709 269 HA PHE 4 HA PHE 4 -12.012 3.289 7.215 270 HB2 PHE 4 HB2 PHE 4 -12.234 2.515 4.352 271 HB3 PHE 4 HB3 PHE 4 -12.483 1.249 5.549 272 HD1 PHE 4 HD1 PHE 4 -14.752 0.814 5.548 273 HD2 PHE 4 HD2 PHE 4 -13.407 4.851 5.638 274 HE1 PHE 4 HE1 PHE 4 -17.070 1.575 5.869 275 HE2 PHE 4 HE2 PHE 4 -15.723 5.619 5.960 276 HZ PHE 4 HZ PHE 4 -17.557 3.980 6.077 277 H MET 5 H MET 5 -11.543 1.129 8.018 278 HA MET 5 HA MET 5 -8.752 0.342 7.493 279 HB2 MET 5 HB2 MET 5 -9.572 1.306 9.825 280 HB3 MET 5 HB3 MET 5 -10.090 -0.357 10.066 281 HG2 MET 5 HG2 MET 5 -7.667 -0.935 9.327 282 HG3 MET 5 HG3 MET 5 -7.336 0.742 9.756 283 HE1 MET 5 HE1 MET 5 -7.472 -2.820 10.996 284 HE2 MET 5 HE2 MET 5 -5.980 -1.880 11.027 285 HE3 MET 5 HE3 MET 5 -6.692 -2.455 12.535 286 H THR 6 H THR 6 -8.766 -1.425 6.262 287 HA THR 6 HA THR 6 -10.801 -3.488 6.761 288 HB THR 6 HB THR 6 -9.021 -3.109 4.344 289 HG1 THR 6 HG1 THR 6 -10.809 -1.576 4.691 290 HG21 THR 6 HG21 THR 6 -10.422 -4.833 3.306 291 HG22 THR 6 HG22 THR 6 -9.581 -5.461 4.723 292 HG23 THR 6 HG23 THR 6 -11.292 -5.043 4.825 293 H SER 7 H SER 7 -9.937 -4.695 8.396 294 HA SER 7 HA SER 7 -7.218 -5.745 8.045 295 HB2 SER 7 HB2 SER 7 -8.228 -4.617 10.245 296 HB3 SER 7 HB3 SER 7 -8.766 -6.271 10.536 297 HG SER 7 HG SER 7 -6.801 -6.739 11.074 298 H GLU 8 H GLU 8 -7.414 -7.461 6.691 299 HA GLU 8 HA GLU 8 -9.327 -9.567 7.453 300 HB2 GLU 8 HB2 GLU 8 -8.305 -8.624 4.815 301 HB3 GLU 8 HB3 GLU 8 -8.695 -10.329 4.990 302 HG2 GLU 8 HG2 GLU 8 -10.916 -9.954 5.103 303 HG3 GLU 8 HG3 GLU 8 -10.727 -8.423 5.955 304 H LYS 9 H LYS 9 -8.384 -11.147 8.551 305 HA LYS 9 HA LYS 9 -5.594 -11.840 7.938 306 HB2 LYS 9 HB2 LYS 9 -6.116 -11.184 10.278 307 HB3 LYS 9 HB3 LYS 9 -7.227 -12.543 10.384 308 HG2 LYS 9 HG2 LYS 9 -5.086 -13.902 9.658 309 HG3 LYS 9 HG3 LYS 9 -4.259 -12.511 10.363 310 HD2 LYS 9 HD2 LYS 9 -6.410 -14.056 11.798 311 HD3 LYS 9 HD3 LYS 9 -4.692 -14.439 11.932 312 HE2 LYS 9 HE2 LYS 9 -5.898 -11.750 12.571 313 HE3 LYS 9 HE3 LYS 9 -5.560 -12.999 13.769 314 HZ1 LYS 9 HZ1 LYS 9 -3.771 -11.147 12.517 315 HZ2 LYS 9 HZ2 LYS 9 -3.563 -12.064 13.924 316 HZ3 LYS 9 HZ3 LYS 9 -3.215 -12.742 12.413 317 H SER 10 H SER 10 -5.559 -13.388 6.424 318 HA SER 10 HA SER 10 -6.684 -15.964 7.041 319 HB2 SER 10 HB2 SER 10 -7.953 -16.154 4.905 320 HB3 SER 10 HB3 SER 10 -8.638 -14.960 6.007 321 HG SER 10 HG SER 10 -7.143 -14.540 3.651 322 H GLN 11 H GLN 11 -5.546 -17.593 6.110 323 HA GLN 11 HA GLN 11 -3.167 -16.842 4.633 324 HB2 GLN 11 HB2 GLN 11 -2.551 -19.235 4.909 325 HB3 GLN 11 HB3 GLN 11 -2.886 -18.422 6.432 326 HG2 GLN 11 HG2 GLN 11 -5.031 -19.462 6.592 327 HG3 GLN 11 HG3 GLN 11 -4.879 -20.134 4.970 328 HE21 GLN 11 HE21 GLN 11 -4.046 -20.460 8.290 329 HE22 GLN 11 HE22 GLN 11 -3.249 -21.988 8.167 330 H THR 12 H THR 12 -5.443 -16.375 3.140 331 HA THR 12 HA THR 12 -4.970 -18.152 0.887 332 HB THR 12 HB THR 12 -7.705 -17.925 0.730 333 HG1 THR 12 HG1 THR 12 -7.108 -18.692 3.404 334 HG21 THR 12 HG21 THR 12 -5.738 -20.014 1.225 335 HG22 THR 12 HG22 THR 12 -7.318 -20.394 1.909 336 HG23 THR 12 HG23 THR 12 -7.165 -20.031 0.190 337 HA PRO 13 HA PRO 13 -5.521 -14.542 -1.546 338 HB2 PRO 13 HB2 PRO 13 -6.799 -15.482 -3.749 339 HB3 PRO 13 HB3 PRO 13 -5.100 -15.829 -3.402 340 HG2 PRO 13 HG2 PRO 13 -7.516 -17.533 -2.930 341 HG3 PRO 13 HG3 PRO 13 -5.930 -17.995 -3.573 342 HD2 PRO 13 HD2 PRO 13 -6.647 -18.445 -1.001 343 HD3 PRO 13 HD3 PRO 13 -4.972 -18.101 -1.479 344 H LEU 14 H LEU 14 -6.884 -13.090 -0.623 345 HA LEU 14 HA LEU 14 -9.776 -13.502 -0.979 346 HB2 LEU 14 HB2 LEU 14 -10.156 -12.128 0.908 347 HB3 LEU 14 HB3 LEU 14 -8.894 -13.275 1.353 348 HG LEU 14 HG LEU 14 -8.194 -10.510 0.432 349 HD11 LEU 14 HD11 LEU 14 -8.035 -10.307 3.118 350 HD12 LEU 14 HD12 LEU 14 -9.398 -9.726 2.162 351 HD13 LEU 14 HD13 LEU 14 -9.483 -11.299 2.955 352 HD21 LEU 14 HD21 LEU 14 -6.255 -11.721 0.574 353 HD22 LEU 14 HD22 LEU 14 -6.362 -11.103 2.222 354 HD23 LEU 14 HD23 LEU 14 -6.864 -12.756 1.865 355 H VAL 15 H VAL 15 -10.477 -10.798 -0.423 356 HA VAL 15 HA VAL 15 -9.166 -8.995 -2.181 357 HB VAL 15 HB VAL 15 -10.118 -10.316 -3.953 358 HG11 VAL 15 HG11 VAL 15 -12.565 -10.638 -4.140 359 HG12 VAL 15 HG12 VAL 15 -11.864 -11.465 -2.749 360 HG13 VAL 15 HG13 VAL 15 -12.749 -9.956 -2.524 361 HG21 VAL 15 HG21 VAL 15 -10.486 -7.620 -3.659 362 HG22 VAL 15 HG22 VAL 15 -10.758 -8.530 -5.145 363 HG23 VAL 15 HG23 VAL 15 -12.109 -8.178 -4.067 364 H THR 16 H THR 16 -9.694 -6.967 -1.634 365 HA THR 16 HA THR 16 -11.775 -6.580 0.353 366 HB THR 16 HB THR 16 -9.748 -5.471 0.884 367 HG1 THR 16 HG1 THR 16 -11.964 -4.174 0.654 368 HG21 THR 16 HG21 THR 16 -9.670 -4.948 -1.984 369 HG22 THR 16 HG22 THR 16 -9.236 -3.540 -1.014 370 HG23 THR 16 HG23 THR 16 -8.351 -5.053 -0.818 371 H LEU 17 H LEU 17 -13.716 -6.706 -0.739 372 HA LEU 17 HA LEU 17 -14.245 -5.361 -3.183 373 HB2 LEU 17 HB2 LEU 17 -15.490 -7.338 -2.302 374 HB3 LEU 17 HB3 LEU 17 -16.234 -6.273 -1.112 375 HG LEU 17 HG LEU 17 -17.611 -6.861 -3.164 376 HD11 LEU 17 HD11 LEU 17 -17.280 -3.904 -2.946 377 HD12 LEU 17 HD12 LEU 17 -18.753 -4.871 -3.030 378 HD13 LEU 17 HD13 LEU 17 -17.809 -4.828 -1.540 379 HD21 LEU 17 HD21 LEU 17 -17.053 -6.135 -5.232 380 HD22 LEU 17 HD22 LEU 17 -16.250 -4.686 -4.628 381 HD23 LEU 17 HD23 LEU 17 -15.418 -6.240 -4.580 382 H PHE 18 H PHE 18 -13.819 -3.200 -3.113 383 HA PHE 18 HA PHE 18 -15.304 -1.609 -1.129 384 HB2 PHE 18 HB2 PHE 18 -12.598 -1.368 -2.270 385 HB3 PHE 18 HB3 PHE 18 -13.497 0.143 -2.177 386 HD1 PHE 18 HD1 PHE 18 -14.912 0.171 0.224 387 HD2 PHE 18 HD2 PHE 18 -11.128 -1.621 -0.541 388 HE1 PHE 18 HE1 PHE 18 -14.342 0.364 2.610 389 HE2 PHE 18 HE2 PHE 18 -10.552 -1.432 1.844 390 HZ PHE 18 HZ PHE 18 -12.160 -0.439 3.423 391 H LYS 19 H LYS 19 -17.184 -1.071 -2.072 392 HA LYS 19 HA LYS 19 -17.346 -0.432 -4.882 393 HB2 LYS 19 HB2 LYS 19 -19.409 -0.327 -2.674 394 HB3 LYS 19 HB3 LYS 19 -19.752 -0.004 -4.369 395 HG2 LYS 19 HG2 LYS 19 -18.617 -2.399 -4.634 396 HG3 LYS 19 HG3 LYS 19 -19.234 -2.567 -2.989 397 HD2 LYS 19 HD2 LYS 19 -21.439 -2.353 -3.655 398 HD3 LYS 19 HD3 LYS 19 -21.014 -1.505 -5.144 399 HE2 LYS 19 HE2 LYS 19 -20.388 -3.470 -6.226 400 HE3 LYS 19 HE3 LYS 19 -20.192 -4.353 -4.713 401 HZ1 LYS 19 HZ1 LYS 19 -22.860 -3.349 -5.353 402 HZ2 LYS 19 HZ2 LYS 19 -22.293 -4.670 -6.246 403 HZ3 LYS 19 HZ3 LYS 19 -22.402 -4.772 -4.561 404 H ASN 20 H ASN 20 -18.722 1.410 -2.177 405 HA ASN 20 HA ASN 20 -17.889 3.875 -3.528 406 HB2 ASN 20 HB2 ASN 20 -20.334 3.302 -2.729 407 HB3 ASN 20 HB3 ASN 20 -19.731 3.855 -1.170 408 HD21 ASN 20 HD21 ASN 20 -21.770 5.186 -2.309 409 HD22 ASN 20 HD22 ASN 20 -21.245 6.729 -2.882 410 H ALA 21 H ALA 21 -16.227 4.998 -2.775 411 HA ALA 21 HA ALA 21 -15.554 4.794 0.083 412 HB1 ALA 21 HB1 ALA 21 -13.150 4.869 -0.551 413 HB2 ALA 21 HB2 ALA 21 -13.976 3.395 -1.057 414 HB3 ALA 21 HB3 ALA 21 -13.633 4.662 -2.235 415 H ILE 22 H ILE 22 -16.158 6.764 0.784 416 HA ILE 22 HA ILE 22 -15.278 9.117 -0.747 417 HB ILE 22 HB ILE 22 -17.361 8.999 1.436 418 HG12 ILE 22 HG12 ILE 22 -17.710 9.159 -1.566 419 HG13 ILE 22 HG13 ILE 22 -18.060 7.751 -0.570 420 HG21 ILE 22 HG21 ILE 22 -17.917 11.244 0.799 421 HG22 ILE 22 HG22 ILE 22 -16.186 11.170 1.131 422 HG23 ILE 22 HG23 ILE 22 -16.764 11.199 -0.535 423 HD11 ILE 22 HD11 ILE 22 -19.585 9.559 0.675 424 HD12 ILE 22 HD12 ILE 22 -19.595 10.234 -0.954 425 HD13 ILE 22 HD13 ILE 22 -20.147 8.582 -0.681 426 H ILE 23 H ILE 23 -13.470 10.015 -0.032 427 HA ILE 23 HA ILE 23 -12.805 9.809 2.823 428 HB ILE 23 HB ILE 23 -11.113 10.231 0.377 429 HG12 ILE 23 HG12 ILE 23 -11.668 7.925 1.210 430 HG13 ILE 23 HG13 ILE 23 -9.945 8.281 1.151 431 HG21 ILE 23 HG21 ILE 23 -10.595 11.126 3.148 432 HG22 ILE 23 HG22 ILE 23 -9.266 10.332 2.302 433 HG23 ILE 23 HG23 ILE 23 -10.011 11.776 1.617 434 HD11 ILE 23 HD11 ILE 23 -11.043 8.966 3.720 435 HD12 ILE 23 HD12 ILE 23 -11.390 7.287 3.304 436 HD13 ILE 23 HD13 ILE 23 -9.725 7.867 3.312 437 H LYS 24 H LYS 24 -13.724 11.511 3.830 438 HA LYS 24 HA LYS 24 -13.225 14.191 2.714 439 HB2 LYS 24 HB2 LYS 24 -15.646 13.218 3.178 440 HB3 LYS 24 HB3 LYS 24 -15.289 13.734 4.821 441 HG2 LYS 24 HG2 LYS 24 -14.631 15.979 3.622 442 HG3 LYS 24 HG3 LYS 24 -15.706 15.358 2.368 443 HD2 LYS 24 HD2 LYS 24 -16.588 15.382 5.227 444 HD3 LYS 24 HD3 LYS 24 -16.668 16.859 4.263 445 HE2 LYS 24 HE2 LYS 24 -17.826 14.296 3.233 446 HE3 LYS 24 HE3 LYS 24 -18.733 15.298 4.365 447 HZ1 LYS 24 HZ1 LYS 24 -17.801 17.025 2.438 448 HZ2 LYS 24 HZ2 LYS 24 -18.322 15.664 1.578 449 HZ3 LYS 24 HZ3 LYS 24 -19.389 16.467 2.616 450 H ASN 25 H ASN 25 -11.393 14.887 3.658 451 HA ASN 25 HA ASN 25 -9.951 15.616 5.259 452 HB2 ASN 25 HB2 ASN 25 -12.374 15.495 7.069 453 HB3 ASN 25 HB3 ASN 25 -10.889 16.389 7.380 454 HD21 ASN 25 HD21 ASN 25 -13.792 17.134 6.961 455 HD22 ASN 25 HD22 ASN 25 -13.733 18.402 5.789 456 H ALA 26 H ALA 26 -9.799 12.946 4.767 457 HA ALA 26 HA ALA 26 -9.742 11.574 7.346 458 HB1 ALA 26 HB1 ALA 26 -9.722 9.584 6.201 459 HB2 ALA 26 HB2 ALA 26 -10.602 10.609 5.067 460 HB3 ALA 26 HB3 ALA 26 -8.891 10.269 4.804 461 H TYR 27 H TYR 27 -7.880 13.730 6.831 462 HA TYR 27 HA TYR 27 -5.500 12.503 7.738 463 HB2 TYR 27 HB2 TYR 27 -5.557 12.040 5.177 464 HB3 TYR 27 HB3 TYR 27 -5.131 13.741 5.027 465 HD1 TYR 27 HD1 TYR 27 -3.065 14.503 6.466 466 HD2 TYR 27 HD2 TYR 27 -3.862 10.475 5.353 467 HE1 TYR 27 HE1 TYR 27 -0.695 13.944 6.815 468 HE2 TYR 27 HE2 TYR 27 -1.495 9.904 5.701 469 HH TYR 27 HH TYR 27 0.551 11.506 7.414 470 H LYS 28 H LYS 28 -4.623 13.950 9.048 471 HA LYS 28 HA LYS 28 -4.362 16.722 8.254 472 HB2 LYS 28 HB2 LYS 28 -6.097 15.853 10.558 473 HB3 LYS 28 HB3 LYS 28 -5.380 17.457 10.489 474 HG2 LYS 28 HG2 LYS 28 -6.529 17.858 8.354 475 HG3 LYS 28 HG3 LYS 28 -7.283 16.267 8.480 476 HD2 LYS 28 HD2 LYS 28 -8.280 16.990 10.650 477 HD3 LYS 28 HD3 LYS 28 -7.642 18.609 10.348 478 HE2 LYS 28 HE2 LYS 28 -9.284 17.322 8.228 479 HE3 LYS 28 HE3 LYS 28 -10.107 17.925 9.665 480 HZ1 LYS 28 HZ1 LYS 28 -10.137 19.753 8.305 481 HZ2 LYS 28 HZ2 LYS 28 -8.717 20.045 9.178 482 HZ3 LYS 28 HZ3 LYS 28 -8.631 19.418 7.609 483 H LYS 29 H LYS 29 -2.536 17.589 9.040 484 HA LYS 29 HA LYS 29 -1.017 16.003 10.985 485 HB2 LYS 29 HB2 LYS 29 -0.271 17.887 8.790 486 HB3 LYS 29 HB3 LYS 29 0.827 17.707 10.152 487 HG2 LYS 29 HG2 LYS 29 -0.159 15.217 8.902 488 HG3 LYS 29 HG3 LYS 29 0.967 16.198 7.961 489 HD2 LYS 29 HD2 LYS 29 2.493 14.964 9.102 490 HD3 LYS 29 HD3 LYS 29 2.243 16.227 10.310 491 HE2 LYS 29 HE2 LYS 29 0.985 14.863 11.670 492 HE3 LYS 29 HE3 LYS 29 0.475 13.827 10.338 493 HZ1 LYS 29 HZ1 LYS 29 2.691 13.532 12.092 494 HZ2 LYS 29 HZ2 LYS 29 2.045 12.424 10.988 495 HZ3 LYS 29 HZ3 LYS 29 3.206 13.546 10.480 496 H GLY 30 H GLY 30 -3.159 17.671 11.882 497 HA2 GLY 30 HA2 GLY 30 -3.116 18.776 14.024 498 HA3 GLY 30 HA3 GLY 30 -1.600 19.531 13.553 499 H GLU 31 H GLU 31 -4.232 19.353 11.295 500 HA GLU 31 HA GLU 31 -5.346 21.007 10.183 501 HB2 GLU 31 HB2 GLU 31 -5.671 21.947 13.036 502 HB3 GLU 31 HB3 GLU 31 -6.577 22.594 11.675 503 HG2 GLU 31 HG2 GLU 31 -7.557 20.408 11.266 504 HG3 GLU 31 HG3 GLU 31 -6.622 19.729 12.598 505 H1 TYR 1 H TYR 1 0.901 8.407 1.956 506 HA TYR 1 HA TYR 1 -0.589 6.368 3.463 507 HB2 TYR 1 HB2 TYR 1 1.040 8.658 4.549 508 HB3 TYR 1 HB3 TYR 1 -0.246 7.907 5.487 509 HD1 TYR 1 HD1 TYR 1 3.032 8.043 5.570 510 HD2 TYR 1 HD2 TYR 1 0.072 5.071 4.858 511 HE1 TYR 1 HE1 TYR 1 4.604 6.307 6.321 512 HE2 TYR 1 HE2 TYR 1 1.635 3.327 5.608 513 HH TYR 1 HH TYR 1 4.384 3.224 5.673 514 H GLY 2 H GLY 2 -2.701 6.778 3.695 515 HA2 GLY 2 HA2 GLY 2 -4.200 8.820 4.297 516 HA3 GLY 2 HA3 GLY 2 -3.693 9.357 2.703 517 H GLY 3 H GLY 3 -6.128 9.333 2.485 518 HA2 GLY 3 HA2 GLY 3 -8.044 8.388 1.638 519 HA3 GLY 3 HA3 GLY 3 -6.942 7.358 0.736 520 H PHE 4 H PHE 4 -8.182 5.514 0.856 521 HA PHE 4 HA PHE 4 -9.176 4.543 3.375 522 HB2 PHE 4 HB2 PHE 4 -9.274 3.648 0.540 523 HB3 PHE 4 HB3 PHE 4 -9.485 2.417 1.781 524 HD1 PHE 4 HD1 PHE 4 -11.726 1.852 1.719 525 HD2 PHE 4 HD2 PHE 4 -10.613 5.960 1.721 526 HE1 PHE 4 HE1 PHE 4 -14.092 2.489 1.949 527 HE2 PHE 4 HE2 PHE 4 -12.976 6.604 1.951 528 HZ PHE 4 HZ PHE 4 -14.719 4.867 2.067 529 H MET 5 H MET 5 -8.609 2.433 4.261 530 HA MET 5 HA MET 5 -5.763 1.797 3.838 531 HB2 MET 5 HB2 MET 5 -6.693 2.803 6.110 532 HB3 MET 5 HB3 MET 5 -7.123 1.124 6.406 533 HG2 MET 5 HG2 MET 5 -4.653 0.657 5.745 534 HG3 MET 5 HG3 MET 5 -4.429 2.365 6.117 535 HE1 MET 5 HE1 MET 5 -4.390 -1.151 7.490 536 HE2 MET 5 HE2 MET 5 -2.958 -0.122 7.518 537 HE3 MET 5 HE3 MET 5 -3.670 -0.683 9.030 538 H THR 6 H THR 6 -5.654 -0.011 2.671 539 HA THR 6 HA THR 6 -7.582 -2.166 3.201 540 HB THR 6 HB THR 6 -5.746 -1.780 0.828 541 HG1 THR 6 HG1 THR 6 -7.637 -0.349 1.056 542 HG21 THR 6 HG21 THR 6 -7.001 -3.628 -0.180 543 HG22 THR 6 HG22 THR 6 -6.176 -4.145 1.290 544 HG23 THR 6 HG23 THR 6 -7.911 -3.831 1.317 545 H SER 7 H SER 7 -6.723 -3.279 4.897 546 HA SER 7 HA SER 7 -3.934 -4.172 4.695 547 HB2 SER 7 HB2 SER 7 -5.107 -3.046 6.814 548 HB3 SER 7 HB3 SER 7 -5.557 -4.721 7.132 549 HG SER 7 HG SER 7 -3.595 -5.051 7.771 550 H GLU 8 H GLU 8 -3.960 -5.936 3.392 551 HA GLU 8 HA GLU 8 -5.775 -8.134 4.137 552 HB2 GLU 8 HB2 GLU 8 -4.708 -7.199 1.514 553 HB3 GLU 8 HB3 GLU 8 -4.993 -8.921 1.724 554 HG2 GLU 8 HG2 GLU 8 -7.238 -8.690 1.747 555 HG3 GLU 8 HG3 GLU 8 -7.180 -7.122 2.549 556 H LYS 9 H LYS 9 -4.783 -9.620 5.318 557 HA LYS 9 HA LYS 9 -1.932 -10.156 4.834 558 HB2 LYS 9 HB2 LYS 9 -2.608 -9.464 7.133 559 HB3 LYS 9 HB3 LYS 9 -3.607 -10.908 7.237 560 HG2 LYS 9 HG2 LYS 9 -1.341 -12.109 6.638 561 HG3 LYS 9 HG3 LYS 9 -0.650 -10.632 7.316 562 HD2 LYS 9 HD2 LYS 9 -2.724 -12.285 8.743 563 HD3 LYS 9 HD3 LYS 9 -0.988 -12.538 8.939 564 HE2 LYS 9 HE2 LYS 9 -2.400 -9.922 9.446 565 HE3 LYS 9 HE3 LYS 9 -2.014 -11.102 10.697 566 HZ1 LYS 9 HZ1 LYS 9 -0.321 -9.171 9.435 567 HZ2 LYS 9 HZ2 LYS 9 -0.092 -10.026 10.877 568 HZ3 LYS 9 HZ3 LYS 9 0.349 -10.725 9.400 569 H SER 10 H SER 10 -1.739 -11.744 3.376 570 HA SER 10 HA SER 10 -2.728 -14.365 4.029 571 HB2 SER 10 HB2 SER 10 -3.900 -14.695 1.852 572 HB3 SER 10 HB3 SER 10 -4.701 -13.521 2.896 573 HG SER 10 HG SER 10 -3.150 -13.064 0.583 574 H GLN 11 H GLN 11 -1.459 -15.946 3.187 575 HA GLN 11 HA GLN 11 0.921 -15.088 1.770 576 HB2 GLN 11 HB2 GLN 11 1.684 -17.420 2.152 577 HB3 GLN 11 HB3 GLN 11 1.234 -16.587 3.634 578 HG2 GLN 11 HG2 GLN 11 -0.837 -17.768 3.751 579 HG3 GLN 11 HG3 GLN 11 -0.581 -18.473 2.156 580 HE21 GLN 11 HE21 GLN 11 0.150 -18.649 5.511 581 HE22 GLN 11 HE22 GLN 11 1.051 -20.122 5.462 582 H THR 12 H THR 12 -1.322 -14.819 0.185 583 HA THR 12 HA THR 12 -0.655 -16.633 -1.988 584 HB THR 12 HB THR 12 -3.394 -16.594 -2.241 585 HG1 THR 12 HG1 THR 12 -2.838 -17.247 0.472 586 HG21 THR 12 HG21 THR 12 -1.309 -18.531 -1.616 587 HG22 THR 12 HG22 THR 12 -2.886 -18.997 -0.977 588 HG23 THR 12 HG23 THR 12 -2.693 -18.672 -2.700 589 HA PRO 13 HA PRO 13 -1.366 -13.152 -4.564 590 HB2 PRO 13 HB2 PRO 13 -2.515 -14.245 -6.767 591 HB3 PRO 13 HB3 PRO 13 -0.809 -14.470 -6.361 592 HG2 PRO 13 HG2 PRO 13 -3.126 -16.309 -5.897 593 HG3 PRO 13 HG3 PRO 13 -1.495 -16.689 -6.479 594 HD2 PRO 13 HD2 PRO 13 -2.258 -17.099 -3.914 595 HD3 PRO 13 HD3 PRO 13 -0.595 -16.664 -4.357 596 H LEU 14 H LEU 14 -2.844 -11.761 -3.729 597 HA LEU 14 HA LEU 14 -5.693 -12.369 -4.149 598 HB2 LEU 14 HB2 LEU 14 -6.214 -10.961 -2.323 599 HB3 LEU 14 HB3 LEU 14 -4.895 -12.008 -1.804 600 HG LEU 14 HG LEU 14 -4.344 -9.237 -2.804 601 HD11 LEU 14 HD11 LEU 14 -4.286 -8.922 -0.127 602 HD12 LEU 14 HD12 LEU 14 -5.657 -8.476 -1.143 603 HD13 LEU 14 HD13 LEU 14 -5.657 -10.019 -0.289 604 HD21 LEU 14 HD21 LEU 14 -2.337 -10.310 -2.557 605 HD22 LEU 14 HD22 LEU 14 -2.540 -9.651 -0.934 606 HD23 LEU 14 HD23 LEU 14 -2.922 -11.343 -1.252 607 H VAL 15 H VAL 15 -6.576 -9.696 -3.706 608 HA VAL 15 HA VAL 15 -5.331 -7.875 -5.492 609 HB VAL 15 HB VAL 15 -6.152 -9.313 -7.239 610 HG11 VAL 15 HG11 VAL 15 -8.572 -9.784 -7.477 611 HG12 VAL 15 HG12 VAL 15 -7.860 -10.523 -6.043 612 HG13 VAL 15 HG13 VAL 15 -8.837 -9.064 -5.889 613 HG21 VAL 15 HG21 VAL 15 -6.693 -6.634 -7.048 614 HG22 VAL 15 HG22 VAL 15 -6.855 -7.608 -8.509 615 HG23 VAL 15 HG23 VAL 15 -8.262 -7.308 -7.489 616 H THR 16 H THR 16 -6.013 -5.861 -5.058 617 HA THR 16 HA THR 16 -8.160 -5.539 -3.128 618 HB THR 16 HB THR 16 -6.222 -4.284 -2.590 619 HG1 THR 16 HG1 THR 16 -8.509 -3.141 -2.922 620 HG21 THR 16 HG21 THR 16 -6.101 -3.861 -5.473 621 HG22 THR 16 HG22 THR 16 -5.784 -2.393 -4.547 622 HG23 THR 16 HG23 THR 16 -4.809 -3.836 -4.272 623 H LEU 17 H LEU 17 -10.072 -5.798 -4.231 624 HA LEU 17 HA LEU 17 -10.617 -4.587 -6.746 625 HB2 LEU 17 HB2 LEU 17 -11.760 -6.607 -5.820 626 HB3 LEU 17 HB3 LEU 17 -12.598 -5.547 -4.688 627 HG LEU 17 HG LEU 17 -13.884 -6.292 -6.747 628 HD11 LEU 17 HD11 LEU 17 -13.736 -3.315 -6.635 629 HD12 LEU 17 HD12 LEU 17 -15.146 -4.371 -6.717 630 HD13 LEU 17 HD13 LEU 17 -14.246 -4.217 -5.209 631 HD21 LEU 17 HD21 LEU 17 -13.321 -5.612 -8.828 632 HD22 LEU 17 HD22 LEU 17 -12.619 -4.096 -8.263 633 HD23 LEU 17 HD23 LEU 17 -11.699 -5.595 -8.136 634 H PHE 18 H PHE 18 -10.314 -2.402 -6.736 635 HA PHE 18 HA PHE 18 -11.948 -0.838 -4.850 636 HB2 PHE 18 HB2 PHE 18 -9.232 -0.471 -5.934 637 HB3 PHE 18 HB3 PHE 18 -10.223 0.984 -5.916 638 HD1 PHE 18 HD1 PHE 18 -11.698 1.009 -3.552 639 HD2 PHE 18 HD2 PHE 18 -7.796 -0.576 -4.162 640 HE1 PHE 18 HE1 PHE 18 -11.203 1.319 -1.162 641 HE2 PHE 18 HE2 PHE 18 -7.294 -0.271 -1.772 642 HZ PHE 18 HZ PHE 18 -8.999 0.677 -0.269 643 H LYS 19 H LYS 19 -13.832 -0.450 -5.856 644 HA LYS 19 HA LYS 19 -13.961 0.079 -8.690 645 HB2 LYS 19 HB2 LYS 19 -16.080 0.138 -6.535 646 HB3 LYS 19 HB3 LYS 19 -16.400 0.383 -8.247 647 HG2 LYS 19 HG2 LYS 19 -15.117 -1.950 -8.398 648 HG3 LYS 19 HG3 LYS 19 -15.773 -2.096 -6.766 649 HD2 LYS 19 HD2 LYS 19 -17.966 -2.036 -7.501 650 HD3 LYS 19 HD3 LYS 19 -17.546 -1.213 -9.006 651 HE2 LYS 19 HE2 LYS 19 -16.777 -3.172 -10.003 652 HE3 LYS 19 HE3 LYS 19 -16.572 -3.992 -8.456 653 HZ1 LYS 19 HZ1 LYS 19 -19.275 -3.171 -9.199 654 HZ2 LYS 19 HZ2 LYS 19 -18.607 -4.484 -10.032 655 HZ3 LYS 19 HZ3 LYS 19 -18.756 -4.537 -8.347 656 H ASN 20 H ASN 20 -15.508 1.933 -6.087 657 HA ASN 20 HA ASN 20 -14.788 4.392 -7.512 658 HB2 ASN 20 HB2 ASN 20 -17.213 3.702 -6.742 659 HB3 ASN 20 HB3 ASN 20 -16.680 4.352 -5.195 660 HD21 ASN 20 HD21 ASN 20 -18.768 5.512 -6.427 661 HD22 ASN 20 HD22 ASN 20 -18.322 7.059 -7.054 662 H ALA 21 H ALA 21 -13.212 5.637 -6.765 663 HA ALA 21 HA ALA 21 -12.597 5.576 -3.887 664 HB1 ALA 21 HB1 ALA 21 -10.188 5.768 -4.468 665 HB2 ALA 21 HB2 ALA 21 -10.914 4.233 -4.945 666 HB3 ALA 21 HB3 ALA 21 -10.614 5.481 -6.155 667 H ILE 22 H ILE 22 -13.340 7.531 -3.278 668 HA ILE 22 HA ILE 22 -12.560 9.876 -4.873 669 HB ILE 22 HB ILE 22 -14.688 9.710 -2.737 670 HG12 ILE 22 HG12 ILE 22 -14.966 9.744 -5.751 671 HG13 ILE 22 HG13 ILE 22 -15.262 8.354 -4.712 672 HG21 ILE 22 HG21 ILE 22 -15.358 11.894 -3.469 673 HG22 ILE 22 HG22 ILE 22 -13.636 11.935 -3.090 674 HG23 ILE 22 HG23 ILE 22 -14.168 11.872 -4.770 675 HD11 ILE 22 HD11 ILE 22 -16.920 10.114 -3.573 676 HD12 ILE 22 HD12 ILE 22 -16.925 10.729 -5.226 677 HD13 ILE 22 HD13 ILE 22 -17.389 9.057 -4.906 678 H ILE 23 H ILE 23 -10.828 10.907 -4.149 679 HA ILE 23 HA ILE 23 -10.225 10.843 -1.274 680 HB ILE 23 HB ILE 23 -8.498 11.277 -3.694 681 HG12 ILE 23 HG12 ILE 23 -8.938 8.974 -2.789 682 HG13 ILE 23 HG13 ILE 23 -7.238 9.430 -2.819 683 HG21 ILE 23 HG21 ILE 23 -8.106 12.302 -0.947 684 HG22 ILE 23 HG22 ILE 23 -6.712 11.556 -1.728 685 HG23 ILE 23 HG23 ILE 23 -7.519 12.928 -2.488 686 HD11 ILE 23 HD11 ILE 23 -8.442 10.139 -0.305 687 HD12 ILE 23 HD12 ILE 23 -8.679 8.429 -0.666 688 HD13 ILE 23 HD13 ILE 23 -7.051 9.107 -0.639 689 H LYS 24 H LYS 24 -11.271 12.522 -0.356 690 HA LYS 24 HA LYS 24 -10.896 15.186 -1.556 691 HB2 LYS 24 HB2 LYS 24 -13.270 14.091 -1.130 692 HB3 LYS 24 HB3 LYS 24 -12.995 14.679 0.505 693 HG2 LYS 24 HG2 LYS 24 -12.427 16.919 -0.752 694 HG3 LYS 24 HG3 LYS 24 -13.430 16.197 -2.013 695 HD2 LYS 24 HD2 LYS 24 -14.392 16.266 0.821 696 HD3 LYS 24 HD3 LYS 24 -14.530 17.701 -0.198 697 HE2 LYS 24 HE2 LYS 24 -15.509 15.040 -1.163 698 HE3 LYS 24 HE3 LYS 24 -16.504 16.026 -0.093 699 HZ1 LYS 24 HZ1 LYS 24 -15.620 17.736 -2.057 700 HZ2 LYS 24 HZ2 LYS 24 -16.036 16.318 -2.880 701 HZ3 LYS 24 HZ3 LYS 24 -17.177 17.093 -1.900 702 H ASN 25 H ASN 25 -9.135 16.018 -0.585 703 HA ASN 25 HA ASN 25 -7.791 16.890 1.028 704 HB2 ASN 25 HB2 ASN 25 -10.257 16.681 2.772 705 HB3 ASN 25 HB3 ASN 25 -8.837 17.672 3.096 706 HD21 ASN 25 HD21 ASN 25 -11.763 18.231 2.570 707 HD22 ASN 25 HD22 ASN 25 -11.742 19.462 1.358 708 H ALA 26 H ALA 26 -7.464 14.220 0.634 709 HA ALA 26 HA ALA 26 -7.401 12.940 3.260 710 HB1 ALA 26 HB1 ALA 26 -7.236 10.919 2.187 711 HB2 ALA 26 HB2 ALA 26 -8.129 11.853 0.987 712 HB3 ALA 26 HB3 ALA 26 -6.394 11.601 0.796 713 H TYR 27 H TYR 27 -5.655 15.188 2.709 714 HA TYR 27 HA TYR 27 -3.235 14.140 3.728 715 HB2 TYR 27 HB2 TYR 27 -3.192 13.589 1.183 716 HB3 TYR 27 HB3 TYR 27 -2.857 15.306 0.987 717 HD1 TYR 27 HD1 TYR 27 -0.881 16.232 2.452 718 HD2 TYR 27 HD2 TYR 27 -1.418 12.129 1.464 719 HE1 TYR 27 HE1 TYR 27 1.505 15.821 2.887 720 HE2 TYR 27 HE2 TYR 27 0.966 11.706 1.897 721 HH TYR 27 HH TYR 27 2.868 13.482 3.607 722 H LYS 28 H LYS 28 -2.485 15.682 5.009 723 HA LYS 28 HA LYS 28 -2.367 18.436 4.121 724 HB2 LYS 28 HB2 LYS 28 -4.113 17.543 6.408 725 HB3 LYS 28 HB3 LYS 28 -3.492 19.185 6.299 726 HG2 LYS 28 HG2 LYS 28 -4.600 19.439 4.120 727 HG3 LYS 28 HG3 LYS 28 -5.262 17.811 4.287 728 HD2 LYS 28 HD2 LYS 28 -6.362 18.551 6.400 729 HD3 LYS 28 HD3 LYS 28 -5.811 20.193 6.055 730 HE2 LYS 28 HE2 LYS 28 -7.313 18.737 3.942 731 HE3 LYS 28 HE3 LYS 28 -8.212 19.342 5.333 732 HZ1 LYS 28 HZ1 LYS 28 -8.307 21.114 3.905 733 HZ2 LYS 28 HZ2 LYS 28 -6.933 21.521 4.804 734 HZ3 LYS 28 HZ3 LYS 28 -6.766 20.844 3.263 735 H LYS 29 H LYS 29 -0.613 19.430 4.914 736 HA LYS 29 HA LYS 29 0.939 18.011 6.959 737 HB2 LYS 29 HB2 LYS 29 1.635 19.857 4.716 738 HB3 LYS 29 HB3 LYS 29 2.702 19.793 6.113 739 HG2 LYS 29 HG2 LYS 29 1.900 17.205 4.930 740 HG3 LYS 29 HG3 LYS 29 2.994 18.218 3.984 741 HD2 LYS 29 HD2 LYS 29 4.554 17.115 5.211 742 HD3 LYS 29 HD3 LYS 29 4.199 18.406 6.362 743 HE2 LYS 29 HE2 LYS 29 2.982 17.024 7.741 744 HE3 LYS 29 HE3 LYS 29 2.570 15.910 6.438 745 HZ1 LYS 29 HZ1 LYS 29 4.749 15.814 8.260 746 HZ2 LYS 29 HZ2 LYS 29 4.199 14.627 7.187 747 HZ3 LYS 29 HZ3 LYS 29 5.307 15.793 6.663 748 H GLY 30 H GLY 30 -1.322 19.576 7.741 749 HA2 GLY 30 HA2 GLY 30 -1.402 20.759 9.840 750 HA3 GLY 30 HA3 GLY 30 0.076 21.588 9.378 751 H GLU 31 H GLU 31 -2.483 21.165 7.068 752 HA GLU 31 HA GLU 31 -3.674 22.702 5.872 753 HB2 GLU 31 HB2 GLU 31 -4.105 23.727 8.681 754 HB3 GLU 31 HB3 GLU 31 -5.011 24.287 7.282 755 HG2 GLU 31 HG2 GLU 31 -5.874 22.042 6.922 756 HG3 GLU 31 HG3 GLU 31 -4.941 21.455 8.298 757 H1 TYR 1 H TYR 1 3.568 10.227 -1.709 758 HA TYR 1 HA TYR 1 2.150 8.154 -0.177 759 HB2 TYR 1 HB2 TYR 1 3.603 10.574 0.876 760 HB3 TYR 1 HB3 TYR 1 2.336 9.777 1.801 761 HD1 TYR 1 HD1 TYR 1 5.596 10.116 1.974 762 HD2 TYR 1 HD2 TYR 1 2.843 6.947 1.285 763 HE1 TYR 1 HE1 TYR 1 7.245 8.506 2.833 764 HE2 TYR 1 HE2 TYR 1 4.483 5.328 2.144 765 HH TYR 1 HH TYR 1 7.229 5.394 2.292 766 H GLY 2 H GLY 2 0.011 8.447 -0.012 767 HA2 GLY 2 HA2 GLY 2 -1.622 10.418 0.465 768 HA3 GLY 2 HA3 GLY 2 -1.100 10.922 -1.135 769 H GLY 3 H GLY 3 -3.522 10.745 -1.418 770 HA2 GLY 3 HA2 GLY 3 -5.354 9.655 -2.277 771 HA3 GLY 3 HA3 GLY 3 -4.167 8.659 -3.108 772 H PHE 4 H PHE 4 -5.305 6.752 -2.948 773 HA PHE 4 HA PHE 4 -6.310 5.820 -0.419 774 HB2 PHE 4 HB2 PHE 4 -6.278 4.815 -3.219 775 HB3 PHE 4 HB3 PHE 4 -6.452 3.621 -1.936 776 HD1 PHE 4 HD1 PHE 4 -8.654 2.923 -2.035 777 HD2 PHE 4 HD2 PHE 4 -7.780 7.087 -2.161 778 HE1 PHE 4 HE1 PHE 4 -11.058 3.429 -1.890 779 HE2 PHE 4 HE2 PHE 4 -10.182 7.599 -2.015 780 HZ PHE 4 HZ PHE 4 -11.824 5.769 -1.879 781 H MET 5 H MET 5 -5.649 3.776 0.557 782 HA MET 5 HA MET 5 -2.761 3.290 0.230 783 HB2 MET 5 HB2 MET 5 -3.794 4.336 2.435 784 HB3 MET 5 HB3 MET 5 -4.149 2.651 2.793 785 HG2 MET 5 HG2 MET 5 -1.644 2.278 2.214 786 HG3 MET 5 HG3 MET 5 -1.511 4.010 2.510 787 HE1 MET 5 HE1 MET 5 -1.356 0.563 4.048 788 HE2 MET 5 HE2 MET 5 0.033 1.651 4.057 789 HE3 MET 5 HE3 MET 5 -0.691 1.133 5.579 790 H THR 6 H THR 6 -2.527 1.445 -0.861 791 HA THR 6 HA THR 6 -4.345 -0.790 -0.285 792 HB THR 6 HB THR 6 -2.469 -0.398 -2.626 793 HG1 THR 6 HG1 THR 6 -4.445 0.928 -2.504 794 HG21 THR 6 HG21 THR 6 -3.583 -2.357 -3.585 795 HG22 THR 6 HG22 THR 6 -2.779 -2.765 -2.070 796 HG23 THR 6 HG23 THR 6 -4.528 -2.548 -2.109 797 H SER 7 H SER 7 -3.481 -1.802 1.466 798 HA SER 7 HA SER 7 -0.638 -2.529 1.387 799 HB2 SER 7 HB2 SER 7 -1.952 -1.414 3.428 800 HB3 SER 7 HB3 SER 7 -2.313 -3.102 3.784 801 HG SER 7 HG SER 7 -0.359 -3.293 4.501 802 H GLU 8 H GLU 8 -0.508 -4.331 0.146 803 HA GLU 8 HA GLU 8 -2.211 -6.613 0.900 804 HB2 GLU 8 HB2 GLU 8 -1.115 -5.693 -1.716 805 HB3 GLU 8 HB3 GLU 8 -1.302 -7.423 -1.460 806 HG2 GLU 8 HG2 GLU 8 -3.556 -7.331 -1.517 807 HG3 GLU 8 HG3 GLU 8 -3.621 -5.738 -0.764 808 H LYS 9 H LYS 9 -1.166 -7.987 2.170 809 HA LYS 9 HA LYS 9 1.724 -8.364 1.790 810 HB2 LYS 9 HB2 LYS 9 0.936 -7.642 4.041 811 HB3 LYS 9 HB3 LYS 9 0.019 -9.137 4.163 812 HG2 LYS 9 HG2 LYS 9 2.364 -10.226 3.681 813 HG3 LYS 9 HG3 LYS 9 2.952 -8.689 4.319 814 HD2 LYS 9 HD2 LYS 9 0.934 -10.406 5.751 815 HD3 LYS 9 HD3 LYS 9 2.675 -10.542 6.009 816 HE2 LYS 9 HE2 LYS 9 1.090 -8.002 6.365 817 HE3 LYS 9 HE3 LYS 9 1.506 -9.105 7.675 818 HZ1 LYS 9 HZ1 LYS 9 3.118 -7.122 6.388 819 HZ2 LYS 9 HZ2 LYS 9 3.354 -7.907 7.868 820 HZ3 LYS 9 HZ3 LYS 9 3.883 -8.631 6.433 821 H SER 10 H SER 10 2.066 -9.985 0.396 822 HA SER 10 HA SER 10 1.217 -12.638 1.107 823 HB2 SER 10 HB2 SER 10 0.143 -13.109 -1.097 824 HB3 SER 10 HB3 SER 10 -0.766 -11.961 -0.114 825 HG SER 10 HG SER 10 0.828 -11.471 -2.392 826 H GLN 11 H GLN 11 2.598 -14.169 0.348 827 HA GLN 11 HA GLN 11 4.970 -13.210 -1.021 828 HB2 GLN 11 HB2 GLN 11 5.865 -15.472 -0.531 829 HB3 GLN 11 HB3 GLN 11 5.310 -14.623 0.906 830 HG2 GLN 11 HG2 GLN 11 3.317 -15.933 0.995 831 HG3 GLN 11 HG3 GLN 11 3.671 -16.668 -0.568 832 HE21 GLN 11 HE21 GLN 11 4.302 -16.693 2.813 833 HE22 GLN 11 HE22 GLN 11 5.295 -18.107 2.840 834 H THR 12 H THR 12 2.782 -13.125 -2.689 835 HA THR 12 HA THR 12 3.624 -14.968 -4.773 836 HB THR 12 HB THR 12 0.897 -15.113 -5.107 837 HG1 THR 12 HG1 THR 12 1.409 -15.644 -2.359 838 HG21 THR 12 HG21 THR 12 3.080 -16.891 -4.358 839 HG22 THR 12 HG22 THR 12 1.517 -17.437 -3.751 840 HG23 THR 12 HG23 THR 12 1.742 -17.154 -5.477 841 HA PRO 13 HA PRO 13 2.778 -11.626 -7.488 842 HB2 PRO 13 HB2 PRO 13 1.772 -12.862 -9.685 843 HB3 PRO 13 HB3 PRO 13 3.474 -12.964 -9.221 844 HG2 PRO 13 HG2 PRO 13 1.265 -14.932 -8.763 845 HG3 PRO 13 HG3 PRO 13 2.935 -15.225 -9.282 846 HD2 PRO 13 HD2 PRO 13 2.117 -15.599 -6.728 847 HD3 PRO 13 HD3 PRO 13 3.763 -15.072 -7.136 848 H LEU 14 H LEU 14 1.187 -10.309 -6.741 849 HA LEU 14 HA LEU 14 -1.602 -11.113 -7.226 850 HB2 LEU 14 HB2 LEU 14 -2.269 -9.680 -5.468 851 HB3 LEU 14 HB3 LEU 14 -0.903 -10.620 -4.873 852 HG LEU 14 HG LEU 14 -0.496 -7.856 -5.958 853 HD11 LEU 14 HD11 LEU 14 -0.548 -7.449 -3.291 854 HD12 LEU 14 HD12 LEU 14 -1.904 -7.117 -4.369 855 HD13 LEU 14 HD13 LEU 14 -1.847 -8.629 -3.462 856 HD21 LEU 14 HD21 LEU 14 1.565 -8.791 -5.607 857 HD22 LEU 14 HD22 LEU 14 1.267 -8.085 -4.019 858 HD23 LEU 14 HD23 LEU 14 1.003 -9.809 -4.282 859 H VAL 15 H VAL 15 -2.661 -8.484 -6.901 860 HA VAL 15 HA VAL 15 -1.480 -6.653 -8.721 861 HB VAL 15 HB VAL 15 -2.166 -8.206 -10.431 862 HG11 VAL 15 HG11 VAL 15 -4.547 -8.823 -10.715 863 HG12 VAL 15 HG12 VAL 15 -3.839 -9.463 -9.233 864 HG13 VAL 15 HG13 VAL 15 -4.900 -8.056 -9.167 865 HG21 VAL 15 HG21 VAL 15 -2.864 -5.556 -10.358 866 HG22 VAL 15 HG22 VAL 15 -2.921 -6.590 -11.785 867 HG23 VAL 15 HG23 VAL 15 -4.376 -6.337 -10.820 868 H THR 16 H THR 16 -2.301 -4.670 -8.390 869 HA THR 16 HA THR 16 -4.513 -4.412 -6.523 870 HB THR 16 HB THR 16 -2.672 -3.019 -5.987 871 HG1 THR 16 HG1 THR 16 -5.015 -2.033 -6.426 872 HG21 THR 16 HG21 THR 16 -2.488 -2.710 -8.878 873 HG22 THR 16 HG22 THR 16 -2.306 -1.182 -8.016 874 HG23 THR 16 HG23 THR 16 -1.242 -2.537 -7.642 875 H LEU 17 H LEU 17 -6.385 -4.811 -7.641 876 HA LEU 17 HA LEU 17 -6.935 -3.737 -10.220 877 HB2 LEU 17 HB2 LEU 17 -7.974 -5.790 -9.246 878 HB3 LEU 17 HB3 LEU 17 -8.905 -4.745 -8.175 879 HG LEU 17 HG LEU 17 -10.092 -5.642 -10.231 880 HD11 LEU 17 HD11 LEU 17 -10.120 -2.658 -10.236 881 HD12 LEU 17 HD12 LEU 17 -11.464 -3.797 -10.312 882 HD13 LEU 17 HD13 LEU 17 -10.617 -3.534 -8.788 883 HD21 LEU 17 HD21 LEU 17 -9.516 -5.012 -12.324 884 HD22 LEU 17 HD22 LEU 17 -8.920 -3.436 -11.806 885 HD23 LEU 17 HD23 LEU 17 -7.916 -4.870 -11.596 886 H PHE 18 H PHE 18 -6.763 -1.537 -10.280 887 HA PHE 18 HA PHE 18 -8.541 -0.013 -8.494 888 HB2 PHE 18 HB2 PHE 18 -5.825 0.484 -9.525 889 HB3 PHE 18 HB3 PHE 18 -6.903 1.874 -9.585 890 HD1 PHE 18 HD1 PHE 18 -8.437 1.900 -7.262 891 HD2 PHE 18 HD2 PHE 18 -4.435 0.522 -7.713 892 HE1 PHE 18 HE1 PHE 18 -8.025 2.324 -4.873 893 HE2 PHE 18 HE2 PHE 18 -4.017 0.942 -5.326 894 HZ PHE 18 HZ PHE 18 -5.813 1.844 -3.902 895 H LYS 19 H LYS 19 -10.417 0.223 -9.559 896 HA LYS 19 HA LYS 19 -10.507 0.636 -12.413 897 HB2 LYS 19 HB2 LYS 19 -12.676 0.655 -10.308 898 HB3 LYS 19 HB3 LYS 19 -12.970 0.819 -12.034 899 HG2 LYS 19 HG2 LYS 19 -11.551 -1.442 -12.065 900 HG3 LYS 19 HG3 LYS 19 -12.246 -1.565 -10.447 901 HD2 LYS 19 HD2 LYS 19 -14.413 -1.664 -11.243 902 HD3 LYS 19 HD3 LYS 19 -14.002 -0.862 -12.761 903 HE2 LYS 19 HE2 LYS 19 -13.093 -2.799 -13.678 904 HE3 LYS 19 HE3 LYS 19 -12.879 -3.560 -12.102 905 HZ1 LYS 19 HZ1 LYS 19 -15.607 -2.926 -12.936 906 HZ2 LYS 19 HZ2 LYS 19 -14.840 -4.219 -13.711 907 HZ3 LYS 19 HZ3 LYS 19 -15.029 -4.233 -12.030 908 H ASN 20 H ASN 20 -12.219 2.499 -9.922 909 HA ASN 20 HA ASN 20 -11.602 4.938 -11.429 910 HB2 ASN 20 HB2 ASN 20 -14.005 4.139 -10.691 911 HB3 ASN 20 HB3 ASN 20 -13.552 4.881 -9.159 912 HD21 ASN 20 HD21 ASN 20 -15.667 5.867 -10.491 913 HD22 ASN 20 HD22 ASN 20 -15.294 7.411 -11.171 914 H ALA 21 H ALA 21 -10.125 6.304 -10.692 915 HA ALA 21 HA ALA 21 -9.584 6.388 -7.800 916 HB1 ALA 21 HB1 ALA 21 -7.177 6.692 -8.321 917 HB2 ALA 21 HB2 ALA 21 -7.800 5.106 -8.776 918 HB3 ALA 21 HB3 ALA 21 -7.535 6.337 -10.011 919 H ILE 22 H ILE 22 -10.453 8.316 -7.284 920 HA ILE 22 HA ILE 22 -9.769 10.642 -8.950 921 HB ILE 22 HB ILE 22 -11.940 10.432 -6.863 922 HG12 ILE 22 HG12 ILE 22 -12.139 10.333 -9.881 923 HG13 ILE 22 HG13 ILE 22 -12.381 8.969 -8.795 924 HG21 ILE 22 HG21 ILE 22 -12.717 12.542 -7.697 925 HG22 ILE 22 HG22 ILE 22 -11.011 12.700 -7.279 926 HG23 ILE 22 HG23 ILE 22 -11.493 12.541 -8.968 927 HD11 ILE 22 HD11 ILE 22 -14.169 10.668 -7.768 928 HD12 ILE 22 HD12 ILE 22 -14.166 11.219 -9.443 929 HD13 ILE 22 HD13 ILE 22 -14.540 9.537 -9.069 930 H ILE 23 H ILE 23 -8.118 11.797 -8.224 931 HA ILE 23 HA ILE 23 -7.591 11.878 -5.335 932 HB ILE 23 HB ILE 23 -5.828 12.323 -7.726 933 HG12 ILE 23 HG12 ILE 23 -6.157 10.033 -6.741 934 HG13 ILE 23 HG13 ILE 23 -4.486 10.588 -6.751 935 HG21 ILE 23 HG21 ILE 23 -5.571 13.473 -5.014 936 HG22 ILE 23 HG22 ILE 23 -4.115 12.782 -5.729 937 HG23 ILE 23 HG23 ILE 23 -4.979 14.073 -6.563 938 HD11 ILE 23 HD11 ILE 23 -5.790 11.320 -4.295 939 HD12 ILE 23 HD12 ILE 23 -5.919 9.587 -4.592 940 HD13 ILE 23 HD13 ILE 23 -4.334 10.360 -4.557 941 H LYS 24 H LYS 24 -8.759 13.523 -4.508 942 HA LYS 24 HA LYS 24 -8.505 16.160 -5.799 943 HB2 LYS 24 HB2 LYS 24 -10.823 14.944 -5.398 944 HB3 LYS 24 HB3 LYS 24 -10.631 15.602 -3.778 945 HG2 LYS 24 HG2 LYS 24 -10.157 17.827 -5.100 946 HG3 LYS 24 HG3 LYS 24 -11.080 17.004 -6.359 947 HD2 LYS 24 HD2 LYS 24 -12.125 17.113 -3.557 948 HD3 LYS 24 HD3 LYS 24 -12.314 18.504 -4.627 949 HE2 LYS 24 HE2 LYS 24 -13.114 15.762 -5.527 950 HE3 LYS 24 HE3 LYS 24 -14.193 16.724 -4.518 951 HZ1 LYS 24 HZ1 LYS 24 -13.351 18.417 -6.514 952 HZ2 LYS 24 HZ2 LYS 24 -13.662 16.951 -7.300 953 HZ3 LYS 24 HZ3 LYS 24 -14.873 17.691 -6.377 954 H ASN 25 H ASN 25 -6.825 17.129 -4.813 955 HA ASN 25 HA ASN 25 -5.582 18.138 -3.198 956 HB2 ASN 25 HB2 ASN 25 -8.080 17.843 -1.514 957 HB3 ASN 25 HB3 ASN 25 -6.731 18.928 -1.190 958 HD21 ASN 25 HD21 ASN 25 -9.669 19.293 -1.810 959 HD22 ASN 25 HD22 ASN 25 -9.686 20.478 -3.068 960 H ALA 26 H ALA 26 -5.090 15.478 -3.484 961 HA ALA 26 HA ALA 26 -5.026 14.298 -0.812 962 HB1 ALA 26 HB1 ALA 26 -4.715 12.254 -1.804 963 HB2 ALA 26 HB2 ALA 26 -5.622 13.091 -3.065 964 HB3 ALA 26 HB3 ALA 26 -3.870 12.934 -3.195 965 H TYR 27 H TYR 27 -3.401 16.627 -1.400 966 HA TYR 27 HA TYR 27 -0.953 15.762 -0.278 967 HB2 TYR 27 HB2 TYR 27 -0.805 15.125 -2.800 968 HB3 TYR 27 HB3 TYR 27 -0.565 16.851 -3.049 969 HD1 TYR 27 HD1 TYR 27 1.313 17.944 -1.574 970 HD2 TYR 27 HD2 TYR 27 1.040 13.782 -2.410 971 HE1 TYR 27 HE1 TYR 27 3.705 17.691 -1.060 972 HE2 TYR 27 HE2 TYR 27 3.431 13.516 -1.898 973 HH TYR 27 HH TYR 27 5.179 15.468 -0.211 974 H LYS 28 H LYS 28 -0.335 17.391 0.965 975 HA LYS 28 HA LYS 28 -0.354 20.114 -0.020 976 HB2 LYS 28 HB2 LYS 28 -2.110 19.198 2.249 977 HB3 LYS 28 HB3 LYS 28 -1.583 20.869 2.100 978 HG2 LYS 28 HG2 LYS 28 -2.639 20.982 -0.118 979 HG3 LYS 28 HG3 LYS 28 -3.211 19.326 0.090 980 HD2 LYS 28 HD2 LYS 28 -4.411 20.076 2.146 981 HD3 LYS 28 HD3 LYS 28 -3.947 21.733 1.753 982 HE2 LYS 28 HE2 LYS 28 -5.302 20.114 -0.342 983 HE3 LYS 28 HE3 LYS 28 -6.273 20.715 1.001 984 HZ1 LYS 28 HZ1 LYS 28 -6.431 22.425 -0.497 985 HZ2 LYS 28 HZ2 LYS 28 -5.110 22.945 0.423 986 HZ3 LYS 28 HZ3 LYS 28 -4.858 22.223 -1.087 987 H LYS 29 H LYS 29 1.317 21.236 0.779 988 HA LYS 29 HA LYS 29 2.887 19.988 2.920 989 HB2 LYS 29 HB2 LYS 29 3.543 21.788 0.627 990 HB3 LYS 29 HB3 LYS 29 4.571 21.833 2.052 991 HG2 LYS 29 HG2 LYS 29 3.949 19.163 0.948 992 HG3 LYS 29 HG3 LYS 29 5.009 20.201 -0.009 993 HD2 LYS 29 HD2 LYS 29 6.595 19.237 1.297 994 HD3 LYS 29 HD3 LYS 29 6.137 20.545 2.390 995 HE2 LYS 29 HE2 LYS 29 4.963 19.145 3.788 996 HE3 LYS 29 HE3 LYS 29 4.652 17.962 2.518 997 HZ1 LYS 29 HZ1 LYS 29 6.781 18.058 4.397 998 HZ2 LYS 29 HZ2 LYS 29 6.332 16.805 3.353 999 HZ3 LYS 29 HZ3 LYS 29 7.385 18.016 2.817 1000 H GLY 30 H GLY 30 0.520 21.446 3.578 1001 HA2 GLY 30 HA2 GLY 30 0.313 22.701 5.628 1002 HA3 GLY 30 HA3 GLY 30 1.752 23.600 5.169 1003 H GLU 31 H GLU 31 -0.715 22.935 2.816 1004 HA GLU 31 HA GLU 31 -1.959 24.351 1.529 1005 HB2 GLU 31 HB2 GLU 31 -2.530 25.458 4.281 1006 HB3 GLU 31 HB3 GLU 31 -3.431 25.900 2.838 1007 HG2 GLU 31 HG2 GLU 31 -4.140 23.591 2.555 1008 HG3 GLU 31 HG3 GLU 31 -3.212 23.123 3.979 1009 H1 TYR 1 H TYR 1 6.233 12.060 -5.373 1010 HA TYR 1 HA TYR 1 4.891 9.964 -3.804 1011 HB2 TYR 1 HB2 TYR 1 6.166 12.505 -2.806 1012 HB3 TYR 1 HB3 TYR 1 4.920 11.668 -1.888 1013 HD1 TYR 1 HD1 TYR 1 8.150 12.208 -1.639 1014 HD2 TYR 1 HD2 TYR 1 5.606 8.857 -2.273 1015 HE1 TYR 1 HE1 TYR 1 9.863 10.732 -0.671 1016 HE2 TYR 1 HE2 TYR 1 7.312 7.372 -1.305 1017 HH TYR 1 HH TYR 1 10.044 7.606 -1.086 1018 H GLY 2 H GLY 2 2.734 10.135 -3.713 1019 HA2 GLY 2 HA2 GLY 2 0.975 12.022 -3.360 1020 HA3 GLY 2 HA3 GLY 2 1.516 12.496 -4.963 1021 H GLY 3 H GLY 3 -0.884 12.163 -5.303 1022 HA2 GLY 3 HA2 GLY 3 -2.621 10.935 -6.175 1023 HA3 GLY 3 HA3 GLY 3 -1.353 9.981 -6.930 1024 H PHE 4 H PHE 4 -2.392 8.020 -6.728 1025 HA PHE 4 HA PHE 4 -3.413 7.126 -4.192 1026 HB2 PHE 4 HB2 PHE 4 -3.249 6.023 -6.950 1027 HB3 PHE 4 HB3 PHE 4 -3.389 4.869 -5.628 1028 HD1 PHE 4 HD1 PHE 4 -5.545 4.043 -5.750 1029 HD2 PHE 4 HD2 PHE 4 -4.905 8.242 -6.020 1030 HE1 PHE 4 HE1 PHE 4 -7.976 4.414 -5.682 1031 HE2 PHE 4 HE2 PHE 4 -7.335 8.620 -5.952 1032 HZ PHE 4 HZ PHE 4 -8.874 6.705 -5.782 1033 H MET 5 H MET 5 -2.665 5.168 -3.115 1034 HA MET 5 HA MET 5 0.253 4.830 -3.354 1035 HB2 MET 5 HB2 MET 5 -0.890 5.903 -1.219 1036 HB3 MET 5 HB3 MET 5 -1.168 4.217 -0.802 1037 HG2 MET 5 HG2 MET 5 1.366 3.951 -1.300 1038 HG3 MET 5 HG3 MET 5 1.404 5.698 -1.077 1039 HE1 MET 5 HE1 MET 5 1.698 2.334 0.614 1040 HE2 MET 5 HE2 MET 5 3.025 3.495 0.610 1041 HE3 MET 5 HE3 MET 5 2.289 3.004 2.135 1042 H THR 6 H THR 6 0.621 2.959 -4.359 1043 HA THR 6 HA THR 6 -1.089 0.651 -3.743 1044 HB THR 6 HB THR 6 0.833 1.055 -6.043 1045 HG1 THR 6 HG1 THR 6 -1.217 2.269 -6.033 1046 HG21 THR 6 HG21 THR 6 -0.138 -1.001 -6.953 1047 HG22 THR 6 HG22 THR 6 0.640 -1.301 -5.399 1048 HG23 THR 6 HG23 THR 6 -1.117 -1.187 -5.498 1049 H SER 7 H SER 7 -0.232 -0.256 -1.936 1050 HA SER 7 HA SER 7 2.649 -0.813 -1.891 1051 HB2 SER 7 HB2 SER 7 1.199 0.282 0.064 1052 HB3 SER 7 HB3 SER 7 0.918 -1.413 0.460 1053 HG SER 7 HG SER 7 2.851 -1.471 1.255 1054 H GLU 8 H GLU 8 2.947 -2.644 -3.055 1055 HA GLU 8 HA GLU 8 1.356 -5.002 -2.289 1056 HB2 GLU 8 HB2 GLU 8 2.480 -4.097 -4.899 1057 HB3 GLU 8 HB3 GLU 8 2.384 -5.826 -4.592 1058 HG2 GLU 8 HG2 GLU 8 0.131 -5.867 -4.719 1059 HG3 GLU 8 HG3 GLU 8 -0.049 -4.257 -4.025 1060 H LYS 9 H LYS 9 2.447 -6.252 -0.931 1061 HA LYS 9 HA LYS 9 5.365 -6.464 -1.218 1062 HB2 LYS 9 HB2 LYS 9 4.457 -5.720 0.983 1063 HB3 LYS 9 HB3 LYS 9 3.641 -7.271 1.131 1064 HG2 LYS 9 HG2 LYS 9 6.071 -8.207 0.752 1065 HG3 LYS 9 HG3 LYS 9 6.529 -6.614 1.358 1066 HD2 LYS 9 HD2 LYS 9 4.592 -8.430 2.781 1067 HD3 LYS 9 HD3 LYS 9 6.329 -8.429 3.097 1068 HE2 LYS 9 HE2 LYS 9 4.552 -6.003 3.322 1069 HE3 LYS 9 HE3 LYS 9 5.003 -7.034 4.679 1070 HZ1 LYS 9 HZ1 LYS 9 6.509 -4.976 3.381 1071 HZ2 LYS 9 HZ2 LYS 9 6.751 -5.698 4.892 1072 HZ3 LYS 9 HZ3 LYS 9 7.379 -6.423 3.498 1073 H SER 10 H SER 10 5.847 -8.104 -2.546 1074 HA SER 10 HA SER 10 5.145 -10.782 -1.768 1075 HB2 SER 10 HB2 SER 10 4.169 -11.390 -3.985 1076 HB3 SER 10 HB3 SER 10 3.160 -10.276 -3.064 1077 HG SER 10 HG SER 10 4.780 -9.751 -5.313 1078 H GLN 11 H GLN 11 6.660 -12.230 -2.407 1079 HA GLN 11 HA GLN 11 8.998 -11.171 -3.756 1080 HB2 GLN 11 HB2 GLN 11 10.022 -13.352 -3.158 1081 HB3 GLN 11 HB3 GLN 11 9.371 -12.492 -1.769 1082 HG2 GLN 11 HG2 GLN 11 7.469 -13.927 -1.680 1083 HG3 GLN 11 HG3 GLN 11 7.905 -14.685 -3.211 1084 HE21 GLN 11 HE21 GLN 11 8.456 -14.567 0.182 1085 HE22 GLN 11 HE22 GLN 11 9.535 -15.913 0.276 1086 H THR 12 H THR 12 6.880 -11.273 -5.496 1087 HA THR 12 HA THR 12 7.895 -13.133 -7.483 1088 HB THR 12 HB THR 12 5.196 -13.470 -7.890 1089 HG1 THR 12 HG1 THR 12 5.653 -13.868 -5.110 1090 HG21 THR 12 HG21 THR 12 7.465 -15.072 -7.015 1091 HG22 THR 12 HG22 THR 12 5.924 -15.698 -6.428 1092 HG23 THR 12 HG23 THR 12 6.179 -15.464 -8.157 1093 HA PRO 13 HA PRO 13 6.918 -9.948 -10.339 1094 HB2 PRO 13 HB2 PRO 13 6.064 -11.322 -12.519 1095 HB3 PRO 13 HB3 PRO 13 7.754 -11.295 -12.002 1096 HG2 PRO 13 HG2 PRO 13 5.665 -13.388 -11.538 1097 HG3 PRO 13 HG3 PRO 13 7.366 -13.587 -11.998 1098 HD2 PRO 13 HD2 PRO 13 6.494 -13.928 -9.457 1099 HD3 PRO 13 HD3 PRO 13 8.114 -13.307 -9.835 1100 H LEU 14 H LEU 14 5.225 -8.706 -9.708 1101 HA LEU 14 HA LEU 14 2.509 -9.711 -10.239 1102 HB2 LEU 14 HB2 LEU 14 1.694 -8.268 -8.553 1103 HB3 LEU 14 HB3 LEU 14 3.097 -9.098 -7.884 1104 HG LEU 14 HG LEU 14 3.358 -6.348 -9.049 1105 HD11 LEU 14 HD11 LEU 14 3.204 -5.877 -6.391 1106 HD12 LEU 14 HD12 LEU 14 1.870 -5.645 -7.521 1107 HD13 LEU 14 HD13 LEU 14 1.977 -7.131 -6.576 1108 HD21 LEU 14 HD21 LEU 14 5.465 -7.123 -8.613 1109 HD22 LEU 14 HD22 LEU 14 5.072 -6.407 -7.050 1110 HD23 LEU 14 HD23 LEU 14 4.934 -8.149 -7.281 1111 H VAL 15 H VAL 15 1.269 -7.152 -10.040 1112 HA VAL 15 HA VAL 15 2.392 -5.313 -11.894 1113 HB VAL 15 HB VAL 15 1.838 -6.963 -13.560 1114 HG11 VAL 15 HG11 VAL 15 -0.494 -7.731 -13.874 1115 HG12 VAL 15 HG12 VAL 15 0.211 -8.272 -12.351 1116 HG13 VAL 15 HG13 VAL 15 -0.931 -6.928 -12.366 1117 HG21 VAL 15 HG21 VAL 15 0.985 -4.357 -13.598 1118 HG22 VAL 15 HG22 VAL 15 1.027 -5.442 -14.988 1119 HG23 VAL 15 HG23 VAL 15 -0.465 -5.244 -14.069 1120 H THR 16 H THR 16 1.437 -3.371 -11.676 1121 HA THR 16 HA THR 16 -0.823 -3.176 -9.858 1122 HB THR 16 HB THR 16 0.920 -1.652 -9.346 1123 HG1 THR 16 HG1 THR 16 -1.469 -0.832 -9.859 1124 HG21 THR 16 HG21 THR 16 1.132 -1.435 -12.246 1125 HG22 THR 16 HG22 THR 16 1.220 0.126 -11.431 1126 HG23 THR 16 HG23 THR 16 2.349 -1.158 -11.000 1127 H LEU 17 H LEU 17 -2.649 -3.723 -10.984 1128 HA LEU 17 HA LEU 17 -3.206 -2.790 -13.618 1129 HB2 LEU 17 HB2 LEU 17 -4.137 -4.865 -12.583 1130 HB3 LEU 17 HB3 LEU 17 -5.154 -3.839 -11.573 1131 HG LEU 17 HG LEU 17 -6.240 -4.887 -13.612 1132 HD11 LEU 17 HD11 LEU 17 -6.443 -1.912 -13.742 1133 HD12 LEU 17 HD12 LEU 17 -7.715 -3.132 -13.802 1134 HD13 LEU 17 HD13 LEU 17 -6.923 -2.759 -12.271 1135 HD21 LEU 17 HD21 LEU 17 -5.655 -4.311 -15.719 1136 HD22 LEU 17 HD22 LEU 17 -5.167 -2.681 -15.257 1137 HD23 LEU 17 HD23 LEU 17 -4.084 -4.042 -14.966 1138 H PHE 18 H PHE 18 -3.175 -0.589 -13.768 1139 HA PHE 18 HA PHE 18 -5.085 0.887 -12.079 1140 HB2 PHE 18 HB2 PHE 18 -2.377 1.515 -13.060 1141 HB3 PHE 18 HB3 PHE 18 -3.536 2.833 -13.196 1142 HD1 PHE 18 HD1 PHE 18 -5.127 2.850 -10.915 1143 HD2 PHE 18 HD2 PHE 18 -1.042 1.693 -11.216 1144 HE1 PHE 18 HE1 PHE 18 -4.805 3.380 -8.534 1145 HE2 PHE 18 HE2 PHE 18 -0.713 2.220 -8.836 1146 HZ PHE 18 HZ PHE 18 -2.596 3.064 -7.491 1147 H LYS 19 H LYS 19 -6.942 0.963 -13.201 1148 HA LYS 19 HA LYS 19 -6.980 1.265 -16.068 1149 HB2 LYS 19 HB2 LYS 19 -9.202 1.242 -14.019 1150 HB3 LYS 19 HB3 LYS 19 -9.458 1.317 -15.758 1151 HG2 LYS 19 HG2 LYS 19 -7.905 -0.856 -15.648 1152 HG3 LYS 19 HG3 LYS 19 -8.651 -0.953 -14.051 1153 HD2 LYS 19 HD2 LYS 19 -10.777 -1.215 -14.916 1154 HD3 LYS 19 HD3 LYS 19 -10.360 -0.447 -16.450 1155 HE2 LYS 19 HE2 LYS 19 -9.305 -2.359 -17.258 1156 HE3 LYS 19 HE3 LYS 19 -9.109 -3.048 -15.647 1157 HZ1 LYS 19 HZ1 LYS 19 -11.834 -2.604 -16.602 1158 HZ2 LYS 19 HZ2 LYS 19 -10.966 -3.879 -17.298 1159 HZ3 LYS 19 HZ3 LYS 19 -11.219 -3.841 -15.626 1160 H ASN 20 H ASN 20 -8.846 3.123 -13.685 1161 HA ASN 20 HA ASN 20 -8.336 5.532 -15.278 1162 HB2 ASN 20 HB2 ASN 20 -10.708 4.627 -14.566 1163 HB3 ASN 20 HB3 ASN 20 -10.336 5.450 -13.054 1164 HD21 ASN 20 HD21 ASN 20 -12.469 6.261 -14.478 1165 HD22 ASN 20 HD22 ASN 20 -12.165 7.799 -15.205 1166 H ALA 21 H ALA 21 -6.960 7.011 -14.562 1167 HA ALA 21 HA ALA 21 -6.494 7.234 -11.664 1168 HB1 ALA 21 HB1 ALA 21 -4.099 7.654 -12.136 1169 HB2 ALA 21 HB2 ALA 21 -4.617 6.023 -12.563 1170 HB3 ALA 21 HB3 ALA 21 -4.391 7.235 -13.824 1171 H ILE 22 H ILE 22 -7.490 9.125 -11.242 1172 HA ILE 22 HA ILE 22 -6.900 11.425 -12.979 1173 HB ILE 22 HB ILE 22 -9.112 11.159 -10.941 1174 HG12 ILE 22 HG12 ILE 22 -9.220 10.944 -13.958 1175 HG13 ILE 22 HG13 ILE 22 -9.413 9.607 -12.830 1176 HG21 ILE 22 HG21 ILE 22 -9.988 13.190 -11.870 1177 HG22 ILE 22 HG22 ILE 22 -8.307 13.463 -11.414 1178 HG23 ILE 22 HG23 ILE 22 -8.732 13.218 -13.108 1179 HD11 ILE 22 HD11 ILE 22 -11.326 11.232 -11.912 1180 HD12 ILE 22 HD12 ILE 22 -11.307 11.725 -13.605 1181 HD13 ILE 22 HD13 ILE 22 -11.593 10.037 -13.181 1182 H ILE 23 H ILE 23 -5.335 12.696 -12.256 1183 HA ILE 23 HA ILE 23 -4.895 12.915 -9.360 1184 HB ILE 23 HB ILE 23 -3.097 13.377 -11.721 1185 HG12 ILE 23 HG12 ILE 23 -3.315 11.109 -10.661 1186 HG13 ILE 23 HG13 ILE 23 -1.681 11.764 -10.643 1187 HG21 ILE 23 HG21 ILE 23 -2.979 14.637 -9.047 1188 HG22 ILE 23 HG22 ILE 23 -1.467 14.012 -9.704 1189 HG23 ILE 23 HG23 ILE 23 -2.388 15.218 -10.604 1190 HD11 ILE 23 HD11 ILE 23 -3.099 12.504 -8.255 1191 HD12 ILE 23 HD12 ILE 23 -3.120 10.756 -8.491 1192 HD13 ILE 23 HD13 ILE 23 -1.584 11.620 -8.439 1193 H LYS 24 H LYS 24 -6.178 14.517 -8.624 1194 HA LYS 24 HA LYS 24 -6.043 17.116 -10.006 1195 HB2 LYS 24 HB2 LYS 24 -8.297 15.778 -9.620 1196 HB3 LYS 24 HB3 LYS 24 -8.191 16.507 -8.024 1197 HG2 LYS 24 HG2 LYS 24 -7.807 18.705 -9.423 1198 HG3 LYS 24 HG3 LYS 24 -8.651 17.780 -10.668 1199 HD2 LYS 24 HD2 LYS 24 -9.770 17.937 -7.897 1200 HD3 LYS 24 HD3 LYS 24 -10.009 19.274 -9.024 1201 HE2 LYS 24 HE2 LYS 24 -10.632 16.460 -9.836 1202 HE3 LYS 24 HE3 LYS 24 -11.788 17.395 -8.889 1203 HZ1 LYS 24 HZ1 LYS 24 -10.991 19.059 -10.930 1204 HZ2 LYS 24 HZ2 LYS 24 -11.205 17.550 -11.664 1205 HZ3 LYS 24 HZ3 LYS 24 -12.475 18.256 -10.798 1206 H ASN 25 H ASN 25 -4.457 18.223 -9.013 1207 HA ASN 25 HA ASN 25 -3.322 19.360 -7.403 1208 HB2 ASN 25 HB2 ASN 25 -5.844 18.972 -5.775 1209 HB3 ASN 25 HB3 ASN 25 -4.573 20.149 -5.456 1210 HD21 ASN 25 HD21 ASN 25 -7.509 20.308 -6.169 1211 HD22 ASN 25 HD22 ASN 25 -7.562 21.446 -7.468 1212 H ALA 26 H ALA 26 -2.671 16.721 -7.579 1213 HA ALA 26 HA ALA 26 -2.610 15.644 -4.865 1214 HB1 ALA 26 HB1 ALA 26 -2.151 13.589 -5.774 1215 HB2 ALA 26 HB2 ALA 26 -3.067 14.325 -7.088 1216 HB3 ALA 26 HB3 ALA 26 -1.306 14.269 -7.164 1217 H TYR 27 H TYR 27 -1.110 18.044 -5.496 1218 HA TYR 27 HA TYR 27 1.352 17.370 -4.278 1219 HB2 TYR 27 HB2 TYR 27 1.608 16.653 -6.770 1220 HB3 TYR 27 HB3 TYR 27 1.756 18.380 -7.076 1221 HD1 TYR 27 HD1 TYR 27 3.526 19.633 -5.598 1222 HD2 TYR 27 HD2 TYR 27 3.513 15.433 -6.274 1223 HE1 TYR 27 HE1 TYR 27 5.913 19.537 -5.011 1224 HE2 TYR 27 HE2 TYR 27 5.899 15.325 -5.688 1225 HH TYR 27 HH TYR 27 7.484 17.438 -4.035 1226 H LYS 28 H LYS 28 1.832 19.076 -3.080 1227 HA LYS 28 HA LYS 28 1.682 21.756 -4.168 1228 HB2 LYS 28 HB2 LYS 28 -0.081 20.818 -1.913 1229 HB3 LYS 28 HB3 LYS 28 0.351 22.511 -2.111 1230 HG2 LYS 28 HG2 LYS 28 -0.646 22.481 -4.359 1231 HG3 LYS 28 HG3 LYS 28 -1.126 20.802 -4.103 1232 HD2 LYS 28 HD2 LYS 28 -2.426 21.551 -2.111 1233 HD3 LYS 28 HD3 LYS 28 -2.050 23.218 -2.552 1234 HE2 LYS 28 HE2 LYS 28 -3.246 21.447 -4.620 1235 HE3 LYS 28 HE3 LYS 28 -4.289 22.038 -3.328 1236 HZ1 LYS 28 HZ1 LYS 28 -4.502 23.680 -4.893 1237 HZ2 LYS 28 HZ2 LYS 28 -3.241 24.311 -3.959 1238 HZ3 LYS 28 HZ3 LYS 28 -2.904 23.551 -5.432 1239 H LYS 29 H LYS 29 3.262 23.004 -3.370 1240 HA LYS 29 HA LYS 29 4.841 21.932 -1.142 1241 HB2 LYS 29 HB2 LYS 29 5.453 23.683 -3.484 1242 HB3 LYS 29 HB3 LYS 29 6.436 23.842 -2.034 1243 HG2 LYS 29 HG2 LYS 29 6.005 21.102 -3.053 1244 HG3 LYS 29 HG3 LYS 29 7.030 22.166 -4.019 1245 HD2 LYS 29 HD2 LYS 29 8.630 21.344 -2.634 1246 HD3 LYS 29 HD3 LYS 29 8.065 22.662 -1.605 1247 HE2 LYS 29 HE2 LYS 29 6.934 21.247 -0.187 1248 HE3 LYS 29 HE3 LYS 29 6.729 20.003 -1.419 1249 HZ1 LYS 29 HZ1 LYS 29 8.794 20.292 0.511 1250 HZ2 LYS 29 HZ2 LYS 29 8.446 18.977 -0.495 1251 HZ3 LYS 29 HZ3 LYS 29 9.444 20.226 -1.050 1252 H GLY 30 H GLY 30 2.373 23.267 -0.601 1253 HA2 GLY 30 HA2 GLY 30 2.034 24.581 1.393 1254 HA3 GLY 30 HA3 GLY 30 3.430 25.547 0.939 1255 H GLU 31 H GLU 31 1.074 24.650 -1.451 1256 HA GLU 31 HA GLU 31 -0.214 25.942 -2.824 1257 HB2 GLU 31 HB2 GLU 31 -0.927 27.115 -0.132 1258 HB3 GLU 31 HB3 GLU 31 -1.812 27.446 -1.615 1259 HG2 GLU 31 HG2 GLU 31 -2.374 25.089 -1.824 1260 HG3 GLU 31 HG3 GLU 31 -1.459 24.733 -0.360 1261 H1 TYR 1 H TYR 1 8.894 13.935 -9.033 1262 HA TYR 1 HA TYR 1 7.628 11.812 -7.437 1263 HB2 TYR 1 HB2 TYR 1 8.714 14.457 -6.487 1264 HB3 TYR 1 HB3 TYR 1 7.490 13.576 -5.580 1265 HD1 TYR 1 HD1 TYR 1 10.675 14.320 -5.254 1266 HD2 TYR 1 HD2 TYR 1 8.355 10.802 -5.841 1267 HE1 TYR 1 HE1 TYR 1 12.440 12.984 -4.183 1268 HE2 TYR 1 HE2 TYR 1 10.113 9.457 -4.770 1269 HH TYR 1 HH TYR 1 12.818 9.862 -4.479 1270 H GLY 2 H GLY 2 5.463 11.855 -7.417 1271 HA2 GLY 2 HA2 GLY 2 3.585 13.646 -7.186 1272 HA3 GLY 2 HA3 GLY 2 4.146 14.090 -8.791 1273 H GLY 3 H GLY 3 1.790 13.603 -9.202 1274 HA2 GLY 3 HA2 GLY 3 0.157 12.242 -10.074 1275 HA3 GLY 3 HA3 GLY 3 1.502 11.331 -10.744 1276 H PHE 4 H PHE 4 0.577 9.322 -10.490 1277 HA PHE 4 HA PHE 4 -0.483 8.480 -7.950 1278 HB2 PHE 4 HB2 PHE 4 -0.175 7.279 -10.652 1279 HB3 PHE 4 HB3 PHE 4 -0.283 6.169 -9.290 1280 HD1 PHE 4 HD1 PHE 4 -2.382 5.211 -9.428 1281 HD2 PHE 4 HD2 PHE 4 -1.984 9.427 -9.859 1282 HE1 PHE 4 HE1 PHE 4 -4.832 5.438 -9.437 1283 HE2 PHE 4 HE2 PHE 4 -4.433 9.660 -9.868 1284 HZ PHE 4 HZ PHE 4 -5.861 7.665 -9.656 1285 H MET 5 H MET 5 0.330 6.566 -6.805 1286 HA MET 5 HA MET 5 3.270 6.398 -6.926 1287 HB2 MET 5 HB2 MET 5 1.988 7.481 -4.869 1288 HB3 MET 5 HB3 MET 5 1.815 5.797 -4.394 1289 HG2 MET 5 HG2 MET 5 4.374 5.689 -4.813 1290 HG3 MET 5 HG3 MET 5 4.287 7.442 -4.662 1291 HE1 MET 5 HE1 MET 5 4.753 4.174 -2.826 1292 HE2 MET 5 HE2 MET 5 6.002 5.419 -2.842 1293 HE3 MET 5 HE3 MET 5 5.254 4.940 -1.318 1294 H THR 6 H THR 6 3.782 4.512 -7.830 1295 HA THR 6 HA THR 6 2.176 2.139 -7.180 1296 HB THR 6 HB THR 6 4.145 2.564 -9.436 1297 HG1 THR 6 HG1 THR 6 2.027 3.652 -9.534 1298 HG21 THR 6 HG21 THR 6 3.337 0.420 -10.288 1299 HG22 THR 6 HG22 THR 6 4.065 0.226 -8.693 1300 HG23 THR 6 HG23 THR 6 2.310 0.232 -8.867 1301 H SER 7 H SER 7 3.029 1.386 -5.294 1302 HA SER 7 HA SER 7 5.930 0.991 -5.137 1303 HB2 SER 7 HB2 SER 7 4.346 2.055 -3.275 1304 HB3 SER 7 HB3 SER 7 4.145 0.359 -2.834 1305 HG SER 7 HG SER 7 6.045 0.436 -1.965 1306 H GLU 8 H GLU 8 6.374 -0.851 -6.242 1307 HA GLU 8 HA GLU 8 4.907 -3.281 -5.453 1308 HB2 GLU 8 HB2 GLU 8 6.075 -2.386 -8.046 1309 HB3 GLU 8 HB3 GLU 8 6.079 -4.107 -7.687 1310 HG2 GLU 8 HG2 GLU 8 3.839 -4.300 -7.890 1311 HG3 GLU 8 HG3 GLU 8 3.530 -2.681 -7.267 1312 H LYS 9 H LYS 9 6.018 -4.417 -4.012 1313 HA LYS 9 HA LYS 9 8.951 -4.442 -4.166 1314 HB2 LYS 9 HB2 LYS 9 7.856 -3.733 -2.026 1315 HB3 LYS 9 HB3 LYS 9 7.193 -5.355 -1.884 1316 HG2 LYS 9 HG2 LYS 9 9.707 -6.064 -2.123 1317 HG3 LYS 9 HG3 LYS 9 9.997 -4.415 -1.562 1318 HD2 LYS 9 HD2 LYS 9 8.154 -6.320 -0.136 1319 HD3 LYS 9 HD3 LYS 9 9.878 -6.210 0.225 1320 HE2 LYS 9 HE2 LYS 9 7.959 -3.887 0.329 1321 HE3 LYS 9 HE3 LYS 9 8.436 -4.847 1.729 1322 HZ1 LYS 9 HZ1 LYS 9 9.852 -2.746 0.397 1323 HZ2 LYS 9 HZ2 LYS 9 10.093 -3.400 1.939 1324 HZ3 LYS 9 HZ3 LYS 9 10.801 -4.133 0.588 1325 H SER 10 H SER 10 9.589 -6.060 -5.460 1326 HA SER 10 HA SER 10 9.051 -8.770 -4.658 1327 HB2 SER 10 HB2 SER 10 8.230 -9.468 -6.923 1328 HB3 SER 10 HB3 SER 10 7.092 -8.457 -6.032 1329 HG SER 10 HG SER 10 8.735 -7.769 -8.222 1330 H GLN 11 H GLN 11 10.660 -10.146 -5.262 1331 HA GLN 11 HA GLN 11 12.974 -8.934 -6.537 1332 HB2 GLN 11 HB2 GLN 11 14.139 -11.011 -5.834 1333 HB3 GLN 11 HB3 GLN 11 13.381 -10.157 -4.497 1334 HG2 GLN 11 HG2 GLN 11 11.586 -11.727 -4.419 1335 HG3 GLN 11 HG3 GLN 11 12.135 -12.504 -5.903 1336 HE21 GLN 11 HE21 GLN 11 12.542 -12.226 -2.500 1337 HE22 GLN 11 HE22 GLN 11 13.718 -13.479 -2.317 1338 H THR 12 H THR 12 10.919 -9.264 -8.332 1339 HA THR 12 HA THR 12 12.141 -11.103 -10.221 1340 HB THR 12 HB THR 12 9.502 -11.662 -10.716 1341 HG1 THR 12 HG1 THR 12 9.851 -11.876 -7.899 1342 HG21 THR 12 HG21 THR 12 11.833 -13.047 -9.657 1343 HG22 THR 12 HG22 THR 12 10.316 -13.756 -9.105 1344 HG23 THR 12 HG23 THR 12 10.634 -13.591 -10.831 1345 HA PRO 13 HA PRO 13 11.028 -8.110 -13.230 1346 HB2 PRO 13 HB2 PRO 13 10.304 -9.616 -15.370 1347 HB3 PRO 13 HB3 PRO 13 11.978 -9.467 -14.822 1348 HG2 PRO 13 HG2 PRO 13 10.008 -11.663 -14.315 1349 HG3 PRO 13 HG3 PRO 13 11.727 -11.777 -14.734 1350 HD2 PRO 13 HD2 PRO 13 10.823 -12.071 -12.198 1351 HD3 PRO 13 HD3 PRO 13 12.410 -11.369 -12.570 1352 H LEU 14 H LEU 14 9.250 -6.954 -12.667 1353 HA LEU 14 HA LEU 14 6.612 -8.137 -13.220 1354 HB2 LEU 14 HB2 LEU 14 5.674 -6.704 -11.597 1355 HB3 LEU 14 HB3 LEU 14 7.122 -7.404 -10.876 1356 HG LEU 14 HG LEU 14 7.190 -4.684 -12.137 1357 HD11 LEU 14 HD11 LEU 14 6.994 -4.197 -9.458 1358 HD12 LEU 14 HD12 LEU 14 5.690 -3.996 -10.628 1359 HD13 LEU 14 HD13 LEU 14 5.810 -5.483 -9.688 1360 HD21 LEU 14 HD21 LEU 14 9.348 -5.281 -11.671 1361 HD22 LEU 14 HD22 LEU 14 8.894 -4.547 -10.132 1362 HD23 LEU 14 HD23 LEU 14 8.890 -6.302 -10.308 1363 H VAL 15 H VAL 15 5.170 -5.717 -13.187 1364 HA VAL 15 HA VAL 15 6.237 -3.855 -15.068 1365 HB VAL 15 HB VAL 15 5.814 -5.608 -16.672 1366 HG11 VAL 15 HG11 VAL 15 3.533 -6.507 -17.004 1367 HG12 VAL 15 HG12 VAL 15 4.227 -6.947 -15.444 1368 HG13 VAL 15 HG13 VAL 15 3.019 -5.667 -15.542 1369 HG21 VAL 15 HG21 VAL 15 4.841 -3.054 -16.845 1370 HG22 VAL 15 HG22 VAL 15 4.951 -4.197 -18.184 1371 HG23 VAL 15 HG23 VAL 15 3.438 -4.024 -17.294 1372 H THR 16 H THR 16 5.138 -1.972 -14.989 1373 HA THR 16 HA THR 16 2.843 -1.845 -13.203 1374 HB THR 16 HB THR 16 4.476 -0.196 -12.721 1375 HG1 THR 16 HG1 THR 16 2.054 0.453 -13.308 1376 HG21 THR 16 HG21 THR 16 4.755 -0.098 -15.616 1377 HG22 THR 16 HG22 THR 16 4.698 1.507 -14.888 1378 HG23 THR 16 HG23 THR 16 5.908 0.340 -14.356 1379 H LEU 17 H LEU 17 1.061 -2.521 -14.317 1380 HA LEU 17 HA LEU 17 0.507 -1.737 -17.004 1381 HB2 LEU 17 HB2 LEU 17 -0.314 -3.825 -15.897 1382 HB3 LEU 17 HB3 LEU 17 -1.418 -2.823 -14.957 1383 HG LEU 17 HG LEU 17 -2.386 -4.023 -16.972 1384 HD11 LEU 17 HD11 LEU 17 -2.766 -1.074 -17.235 1385 HD12 LEU 17 HD12 LEU 17 -3.960 -2.371 -17.275 1386 HD13 LEU 17 HD13 LEU 17 -3.234 -1.889 -15.742 1387 HD21 LEU 17 HD21 LEU 17 -1.784 -3.503 -19.088 1388 HD22 LEU 17 HD22 LEU 17 -1.410 -1.827 -18.688 1389 HD23 LEU 17 HD23 LEU 17 -0.252 -3.103 -18.312 1390 H PHE 18 H PHE 18 0.417 0.459 -17.227 1391 HA PHE 18 HA PHE 18 -1.619 1.873 -15.637 1392 HB2 PHE 18 HB2 PHE 18 1.067 2.631 -16.586 1393 HB3 PHE 18 HB3 PHE 18 -0.167 3.869 -16.793 1394 HD1 PHE 18 HD1 PHE 18 -1.810 3.846 -14.539 1395 HD2 PHE 18 HD2 PHE 18 2.352 2.979 -14.730 1396 HE1 PHE 18 HE1 PHE 18 -1.573 4.478 -12.173 1397 HE2 PHE 18 HE2 PHE 18 2.596 3.608 -12.364 1398 HZ PHE 18 HZ PHE 18 0.631 4.358 -11.082 1399 H LYS 19 H LYS 19 -3.450 1.775 -16.805 1400 HA LYS 19 HA LYS 19 -3.442 1.974 -19.679 1401 HB2 LYS 19 HB2 LYS 19 -5.705 1.898 -17.676 1402 HB3 LYS 19 HB3 LYS 19 -5.925 1.889 -19.421 1403 HG2 LYS 19 HG2 LYS 19 -4.240 -0.180 -19.176 1404 HG3 LYS 19 HG3 LYS 19 -5.044 -0.261 -17.606 1405 HD2 LYS 19 HD2 LYS 19 -7.113 -0.683 -18.541 1406 HD3 LYS 19 HD3 LYS 19 -6.680 0.052 -20.086 1407 HE2 LYS 19 HE2 LYS 19 -5.484 -1.822 -20.780 1408 HE3 LYS 19 HE3 LYS 19 -5.309 -2.437 -19.137 1409 HZ1 LYS 19 HZ1 LYS 19 -8.017 -2.197 -20.210 1410 HZ2 LYS 19 HZ2 LYS 19 -7.048 -3.442 -20.819 1411 HZ3 LYS 19 HZ3 LYS 19 -7.369 -3.355 -19.160 1412 H ASN 20 H ASN 20 -5.454 3.811 -17.398 1413 HA ASN 20 HA ASN 20 -5.051 6.184 -19.076 1414 HB2 ASN 20 HB2 ASN 20 -7.385 5.169 -18.396 1415 HB3 ASN 20 HB3 ASN 20 -7.104 6.059 -16.902 1416 HD21 ASN 20 HD21 ASN 20 -9.240 6.698 -18.410 1417 HD22 ASN 20 HD22 ASN 20 -9.005 8.227 -19.178 1418 H ALA 21 H ALA 21 -3.767 7.753 -18.385 1419 HA ALA 21 HA ALA 21 -3.405 8.118 -15.486 1420 HB1 ALA 21 HB1 ALA 21 -1.021 8.663 -15.922 1421 HB2 ALA 21 HB2 ALA 21 -1.437 6.984 -16.264 1422 HB3 ALA 21 HB3 ALA 21 -1.245 8.132 -17.589 1423 H ILE 22 H ILE 22 -4.491 9.973 -15.154 1424 HA ILE 22 HA ILE 22 -3.983 12.229 -16.973 1425 HB ILE 22 HB ILE 22 -6.232 11.930 -14.981 1426 HG12 ILE 22 HG12 ILE 22 -6.251 11.579 -17.987 1427 HG13 ILE 22 HG13 ILE 22 -6.398 10.282 -16.805 1428 HG21 ILE 22 HG21 ILE 22 -7.191 13.866 -16.027 1429 HG22 ILE 22 HG22 ILE 22 -5.541 14.250 -15.535 1430 HG23 ILE 22 HG23 ILE 22 -5.900 13.909 -17.228 1431 HD11 ILE 22 HD11 ILE 22 -8.420 11.831 -16.002 1432 HD12 ILE 22 HD12 ILE 22 -8.385 12.258 -17.713 1433 HD13 ILE 22 HD13 ILE 22 -8.588 10.575 -17.228 1434 H ILE 23 H ILE 23 -2.519 13.622 -16.264 1435 HA ILE 23 HA ILE 23 -2.161 13.969 -13.369 1436 HB ILE 23 HB ILE 23 -0.336 14.469 -15.704 1437 HG12 ILE 23 HG12 ILE 23 -0.436 12.213 -14.631 1438 HG13 ILE 23 HG13 ILE 23 1.150 12.970 -14.535 1439 HG21 ILE 23 HG21 ILE 23 -0.364 15.796 -13.066 1440 HG22 ILE 23 HG22 ILE 23 1.200 15.222 -13.644 1441 HG23 ILE 23 HG23 ILE 23 0.264 16.359 -14.615 1442 HD11 ILE 23 HD11 ILE 23 -0.443 13.626 -12.230 1443 HD12 ILE 23 HD12 ILE 23 -0.324 11.880 -12.451 1444 HD13 ILE 23 HD13 ILE 23 1.140 12.854 -12.326 1445 H LYS 24 H LYS 24 -3.568 15.514 -12.733 1446 HA LYS 24 HA LYS 24 -3.540 18.068 -14.202 1447 HB2 LYS 24 HB2 LYS 24 -5.723 16.617 -13.834 1448 HB3 LYS 24 HB3 LYS 24 -5.706 17.398 -12.259 1449 HG2 LYS 24 HG2 LYS 24 -5.411 19.572 -13.710 1450 HG3 LYS 24 HG3 LYS 24 -6.156 18.565 -14.954 1451 HD2 LYS 24 HD2 LYS 24 -7.374 18.733 -12.225 1452 HD3 LYS 24 HD3 LYS 24 -7.658 20.017 -13.404 1453 HE2 LYS 24 HE2 LYS 24 -8.079 17.144 -14.139 1454 HE3 LYS 24 HE3 LYS 24 -9.321 18.035 -13.261 1455 HZ1 LYS 24 HZ1 LYS 24 -8.561 19.679 -15.331 1456 HZ2 LYS 24 HZ2 LYS 24 -8.656 18.137 -16.020 1457 HZ3 LYS 24 HZ3 LYS 24 -9.995 18.789 -15.218 1458 H ASN 25 H ASN 25 -2.057 19.307 -13.207 1459 HA ASN 25 HA ASN 25 -1.037 20.563 -11.609 1460 HB2 ASN 25 HB2 ASN 25 -3.580 20.080 -10.040 1461 HB3 ASN 25 HB3 ASN 25 -2.389 21.338 -9.723 1462 HD21 ASN 25 HD21 ASN 25 -5.305 21.305 -10.526 1463 HD22 ASN 25 HD22 ASN 25 -5.383 22.396 -11.863 1464 H ALA 26 H ALA 26 -0.221 17.967 -11.673 1465 HA ALA 26 HA ALA 26 -0.176 16.989 -8.920 1466 HB1 ALA 26 HB1 ALA 26 0.430 14.935 -9.741 1467 HB2 ALA 26 HB2 ALA 26 -0.494 15.568 -11.103 1468 HB3 ALA 26 HB3 ALA 26 1.269 15.615 -11.134 1469 H TYR 27 H TYR 27 1.197 19.451 -9.593 1470 HA TYR 27 HA TYR 27 3.659 18.969 -8.290 1471 HB2 TYR 27 HB2 TYR 27 4.028 18.178 -10.745 1472 HB3 TYR 27 HB3 TYR 27 4.083 19.899 -11.113 1473 HD1 TYR 27 HD1 TYR 27 5.738 21.311 -9.655 1474 HD2 TYR 27 HD2 TYR 27 5.982 17.090 -10.136 1475 HE1 TYR 27 HE1 TYR 27 8.109 21.379 -9.003 1476 HE2 TYR 27 HE2 TYR 27 8.352 17.147 -9.484 1477 HH TYR 27 HH TYR 27 9.768 19.418 -7.889 1478 H LYS 28 H LYS 28 4.002 20.742 -7.144 1479 HA LYS 28 HA LYS 28 3.728 23.368 -8.337 1480 HB2 LYS 28 HB2 LYS 28 1.957 22.409 -6.097 1481 HB3 LYS 28 HB3 LYS 28 2.295 24.116 -6.347 1482 HG2 LYS 28 HG2 LYS 28 1.368 23.948 -8.617 1483 HG3 LYS 28 HG3 LYS 28 0.982 22.253 -8.315 1484 HD2 LYS 28 HD2 LYS 28 -0.418 22.991 -6.385 1485 HD3 LYS 28 HD3 LYS 28 -0.131 24.661 -6.880 1486 HE2 LYS 28 HE2 LYS 28 -1.157 22.745 -8.910 1487 HE3 LYS 28 HE3 LYS 28 -2.271 23.318 -7.669 1488 HZ1 LYS 28 HZ1 LYS 28 -2.537 24.883 -9.305 1489 HZ2 LYS 28 HZ2 LYS 28 -1.347 25.626 -8.359 1490 HZ3 LYS 28 HZ3 LYS 28 -0.918 24.835 -9.792 1491 H LYS 29 H LYS 29 5.198 24.744 -7.535 1492 HA LYS 29 HA LYS 29 6.776 23.845 -5.231 1493 HB2 LYS 29 HB2 LYS 29 7.350 25.557 -7.612 1494 HB3 LYS 29 HB3 LYS 29 8.284 25.811 -6.143 1495 HG2 LYS 29 HG2 LYS 29 8.033 23.024 -7.092 1496 HG3 LYS 29 HG3 LYS 29 9.021 24.117 -8.064 1497 HD2 LYS 29 HD2 LYS 29 10.627 23.417 -6.617 1498 HD3 LYS 29 HD3 LYS 29 9.972 24.742 -5.651 1499 HE2 LYS 29 HE2 LYS 29 8.876 23.323 -4.207 1500 HE3 LYS 29 HE3 LYS 29 8.768 22.025 -5.395 1501 HZ1 LYS 29 HZ1 LYS 29 10.767 22.498 -3.430 1502 HZ2 LYS 29 HZ2 LYS 29 10.510 21.127 -4.387 1503 HZ3 LYS 29 HZ3 LYS 29 11.457 22.402 -4.972 1504 H GLY 30 H GLY 30 4.215 25.050 -4.814 1505 HA2 GLY 30 HA2 GLY 30 3.739 26.406 -2.876 1506 HA3 GLY 30 HA3 GLY 30 5.088 27.438 -3.325 1507 H GLU 31 H GLU 31 2.865 26.320 -5.747 1508 HA GLU 31 HA GLU 31 1.542 27.482 -7.200 1509 HB2 GLU 31 HB2 GLU 31 0.681 28.709 -4.576 1510 HB3 GLU 31 HB3 GLU 31 -0.179 28.924 -6.093 1511 HG2 GLU 31 HG2 GLU 31 -0.589 26.531 -6.220 1512 HG3 GLU 31 HG3 GLU 31 0.305 26.290 -4.720
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