NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
641378 | 6rh5 | 34394 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY -4 H1 GLY -4 -11.556 39.950 10.944 2 H2 GLY -4 H2 GLY -4 -10.351 39.543 9.909 3 H3 GLY -4 H3 GLY -4 -9.992 40.085 11.412 4 HA2 GLY -4 HA2 GLY -4 -10.981 38.144 12.426 5 HA3 GLY -4 HA3 GLY -4 -11.391 37.560 10.802 6 H SER -3 H SER -3 -9.669 36.380 12.926 7 HA SER -3 HA SER -3 -7.053 36.160 11.468 8 HB2 SER -3 HB2 SER -3 -7.519 36.268 14.459 9 HB3 SER -3 HB3 SER -3 -5.970 35.965 13.653 10 HG SER -3 HG SER -3 -6.239 38.176 14.232 11 HA PRO -2 HA PRO -2 -8.462 31.827 11.863 12 HB2 PRO -2 HB2 PRO -2 -7.092 30.719 9.807 13 HB3 PRO -2 HB3 PRO -2 -8.446 31.854 9.529 14 HG2 PRO -2 HG2 PRO -2 -5.473 32.493 9.575 15 HG3 PRO -2 HG3 PRO -2 -6.668 32.906 8.302 16 HD2 PRO -2 HD2 PRO -2 -5.967 34.656 10.283 17 HD3 PRO -2 HD3 PRO -2 -7.628 34.600 9.620 18 H ASN -1 H ASN -1 -5.627 33.192 12.817 19 HA ASN -1 HA ASN -1 -3.713 31.132 12.801 20 HB2 ASN -1 HB2 ASN -1 -3.886 33.581 14.614 21 HB3 ASN -1 HB3 ASN -1 -2.425 32.683 14.211 22 HD21 ASN -1 HD21 ASN -1 -2.071 34.235 11.010 23 HD22 ASN -1 HD22 ASN -1 -1.528 32.908 12.030 24 H SER 0 H SER 0 -6.440 31.090 14.753 25 HA SER 0 HA SER 0 -5.390 29.908 17.181 26 HB2 SER 0 HB2 SER 0 -7.765 29.252 17.525 27 HB3 SER 0 HB3 SER 0 -7.551 30.977 17.179 28 HG SER 0 HG SER 0 -9.273 30.044 15.962 29 H MET 1 H MET 1 -5.794 28.678 13.973 30 HA MET 1 HA MET 1 -5.117 25.932 14.932 31 HB2 MET 1 HB2 MET 1 -7.032 26.634 12.673 32 HB3 MET 1 HB3 MET 1 -6.404 25.014 13.011 33 HG2 MET 1 HG2 MET 1 -7.381 25.151 15.310 34 HG3 MET 1 HG3 MET 1 -8.142 26.680 14.870 35 HE1 MET 1 HE1 MET 1 -10.126 26.961 13.218 36 HE2 MET 1 HE2 MET 1 -9.209 26.225 11.881 37 HE3 MET 1 HE3 MET 1 -10.843 25.647 12.260 38 H ALA 2 H ALA 2 -3.791 24.718 13.587 39 HA ALA 2 HA ALA 2 -2.589 25.858 11.164 40 HB1 ALA 2 HB1 ALA 2 -0.900 25.385 13.670 41 HB2 ALA 2 HB2 ALA 2 -0.275 25.773 12.051 42 HB3 ALA 2 HB3 ALA 2 -1.258 26.960 12.927 43 H THR 3 H THR 3 -2.395 23.261 13.635 44 HA THR 3 HA THR 3 -2.020 21.219 11.473 45 HB THR 3 HB THR 3 -1.479 20.929 14.447 46 HG1 THR 3 HG1 THR 3 0.044 22.237 13.390 47 HG21 THR 3 HG21 THR 3 -2.082 18.779 13.390 48 HG22 THR 3 HG22 THR 3 -0.917 19.080 12.078 49 HG23 THR 3 HG23 THR 3 -0.350 18.828 13.745 50 H GLU 4 H GLU 4 -4.014 20.854 10.820 51 HA GLU 4 HA GLU 4 -6.172 20.219 12.787 52 HB2 GLU 4 HB2 GLU 4 -7.728 21.492 11.417 53 HB3 GLU 4 HB3 GLU 4 -6.394 22.490 11.984 54 HG2 GLU 4 HG2 GLU 4 -5.295 22.339 9.774 55 HG3 GLU 4 HG3 GLU 4 -6.584 21.289 9.185 56 H LEU 5 H LEU 5 -4.421 18.431 11.082 57 HA LEU 5 HA LEU 5 -6.261 17.114 9.268 58 HB2 LEU 5 HB2 LEU 5 -3.595 17.402 9.267 59 HB3 LEU 5 HB3 LEU 5 -3.657 15.835 10.058 60 HG LEU 5 HG LEU 5 -4.923 16.601 7.393 61 HD11 LEU 5 HD11 LEU 5 -2.461 16.546 7.322 62 HD12 LEU 5 HD12 LEU 5 -2.468 14.895 7.984 63 HD13 LEU 5 HD13 LEU 5 -3.153 15.221 6.375 64 HD21 LEU 5 HD21 LEU 5 -6.191 14.729 8.355 65 HD22 LEU 5 HD22 LEU 5 -5.223 14.167 6.996 66 HD23 LEU 5 HD23 LEU 5 -4.684 13.836 8.658 67 H GLU 6 H GLU 6 -7.599 17.185 11.485 68 HA GLU 6 HA GLU 6 -7.456 14.550 12.876 69 HB2 GLU 6 HB2 GLU 6 -7.469 16.737 14.161 70 HB3 GLU 6 HB3 GLU 6 -9.142 16.955 13.645 71 HG2 GLU 6 HG2 GLU 6 -9.718 14.769 14.759 72 HG3 GLU 6 HG3 GLU 6 -8.029 14.581 15.221 73 H TYR 7 H TYR 7 -8.103 14.007 10.427 74 HA TYR 7 HA TYR 7 -10.963 13.356 10.353 75 HB2 TYR 7 HB2 TYR 7 -11.375 14.401 8.241 76 HB3 TYR 7 HB3 TYR 7 -10.868 15.628 9.371 77 HD1 TYR 7 HD1 TYR 7 -9.622 13.469 6.546 78 HD2 TYR 7 HD2 TYR 7 -9.070 17.107 8.811 79 HE1 TYR 7 HE1 TYR 7 -7.983 14.237 4.885 80 HE2 TYR 7 HE2 TYR 7 -7.409 17.884 7.121 81 HH TYR 7 HH TYR 7 -6.535 15.902 4.260 82 H GLU 8 H GLU 8 -11.330 11.489 9.240 83 HA GLU 8 HA GLU 8 -9.992 10.654 6.961 84 HB2 GLU 8 HB2 GLU 8 -8.887 8.585 7.781 85 HB3 GLU 8 HB3 GLU 8 -8.046 10.053 8.240 86 HG2 GLU 8 HG2 GLU 8 -8.991 9.855 10.546 87 HG3 GLU 8 HG3 GLU 8 -9.794 8.355 10.050 88 H SER 9 H SER 9 -11.481 9.520 5.938 89 HA SER 9 HA SER 9 -13.572 8.013 7.407 90 HB2 SER 9 HB2 SER 9 -13.115 8.612 4.461 91 HB3 SER 9 HB3 SER 9 -14.395 7.542 5.066 92 HG SER 9 HG SER 9 -15.301 9.533 4.842 93 H VAL 10 H VAL 10 -12.826 6.025 8.083 94 HA VAL 10 HA VAL 10 -10.674 4.585 6.785 95 HB VAL 10 HB VAL 10 -11.212 4.468 9.190 96 HG11 VAL 10 HG11 VAL 10 -12.900 2.933 10.033 97 HG12 VAL 10 HG12 VAL 10 -13.681 4.196 9.071 98 HG13 VAL 10 HG13 VAL 10 -13.458 2.570 8.390 99 HG21 VAL 10 HG21 VAL 10 -10.599 2.166 9.485 100 HG22 VAL 10 HG22 VAL 10 -11.137 1.743 7.850 101 HG23 VAL 10 HG23 VAL 10 -9.734 2.818 8.085 102 H LEU 11 H LEU 11 -10.603 2.740 5.588 103 HA LEU 11 HA LEU 11 -13.061 2.030 4.015 104 HB2 LEU 11 HB2 LEU 11 -10.243 2.618 3.019 105 HB3 LEU 11 HB3 LEU 11 -11.536 1.963 2.030 106 HG LEU 11 HG LEU 11 -11.560 4.720 3.316 107 HD11 LEU 11 HD11 LEU 11 -9.932 4.608 1.523 108 HD12 LEU 11 HD12 LEU 11 -11.093 3.785 0.457 109 HD13 LEU 11 HD13 LEU 11 -11.364 5.468 0.935 110 HD21 LEU 11 HD21 LEU 11 -13.861 3.863 3.025 111 HD22 LEU 11 HD22 LEU 11 -13.518 5.119 1.836 112 HD23 LEU 11 HD23 LEU 11 -13.491 3.412 1.343 113 H CYS 12 H CYS 12 -9.802 0.973 5.071 114 HA CYS 12 HA CYS 12 -10.802 -1.771 5.383 115 HB2 CYS 12 HB2 CYS 12 -9.947 -1.657 2.993 116 HB3 CYS 12 HB3 CYS 12 -8.361 -1.216 3.663 117 HG CYS 12 HG CYS 12 -10.136 -3.993 4.066 118 H VAL 13 H VAL 13 -9.915 -2.663 7.140 119 HA VAL 13 HA VAL 13 -7.232 -1.776 8.077 120 HB VAL 13 HB VAL 13 -9.662 -2.166 9.851 121 HG11 VAL 13 HG11 VAL 13 -6.751 -1.679 10.641 122 HG12 VAL 13 HG12 VAL 13 -8.143 -1.612 11.742 123 HG13 VAL 13 HG13 VAL 13 -7.702 -3.143 10.989 124 HG21 VAL 13 HG21 VAL 13 -9.506 0.067 8.800 125 HG22 VAL 13 HG22 VAL 13 -9.222 0.153 10.541 126 HG23 VAL 13 HG23 VAL 13 -7.848 0.236 9.410 127 H LYS 14 H LYS 14 -5.876 -3.416 8.272 128 HA LYS 14 HA LYS 14 -6.910 -6.083 9.024 129 HB2 LYS 14 HB2 LYS 14 -4.893 -5.664 6.788 130 HB3 LYS 14 HB3 LYS 14 -5.353 -7.220 7.490 131 HG2 LYS 14 HG2 LYS 14 -7.761 -6.695 6.885 132 HG3 LYS 14 HG3 LYS 14 -7.158 -5.287 5.989 133 HD2 LYS 14 HD2 LYS 14 -5.706 -6.873 4.652 134 HD3 LYS 14 HD3 LYS 14 -6.544 -8.224 5.434 135 HE2 LYS 14 HE2 LYS 14 -7.894 -5.973 3.866 136 HE3 LYS 14 HE3 LYS 14 -7.488 -7.543 3.176 137 HZ1 LYS 14 HZ1 LYS 14 -9.247 -7.305 5.540 138 HZ2 LYS 14 HZ2 LYS 14 -9.838 -7.247 4.029 139 HZ3 LYS 14 HZ3 LYS 14 -9.040 -8.612 4.559 140 HA PRO 15 HA PRO 15 -3.827 -5.771 12.107 141 HB2 PRO 15 HB2 PRO 15 -3.651 -8.343 13.001 142 HB3 PRO 15 HB3 PRO 15 -5.119 -7.335 13.226 143 HG2 PRO 15 HG2 PRO 15 -4.567 -9.353 11.009 144 HG3 PRO 15 HG3 PRO 15 -6.015 -9.257 12.073 145 HD2 PRO 15 HD2 PRO 15 -6.010 -8.172 9.612 146 HD3 PRO 15 HD3 PRO 15 -6.785 -7.316 10.980 147 H ASP 16 H ASP 16 -3.139 -7.703 9.297 148 HA ASP 16 HA ASP 16 -0.261 -7.969 10.060 149 HB2 ASP 16 HB2 ASP 16 -1.487 -10.063 10.499 150 HB3 ASP 16 HB3 ASP 16 -2.064 -10.081 8.830 151 H VAL 17 H VAL 17 0.712 -6.631 8.765 152 HA VAL 17 HA VAL 17 0.780 -7.295 5.898 153 HB VAL 17 HB VAL 17 -0.845 -5.434 6.092 154 HG11 VAL 17 HG11 VAL 17 1.523 -3.721 6.952 155 HG12 VAL 17 HG12 VAL 17 -0.105 -3.150 6.546 156 HG13 VAL 17 HG13 VAL 17 0.142 -4.173 7.969 157 HG21 VAL 17 HG21 VAL 17 0.042 -4.091 4.283 158 HG22 VAL 17 HG22 VAL 17 1.693 -4.648 4.613 159 HG23 VAL 17 HG23 VAL 17 0.457 -5.789 4.022 160 H SER 18 H SER 18 2.758 -6.975 4.944 161 HA SER 18 HA SER 18 5.034 -6.361 6.814 162 HB2 SER 18 HB2 SER 18 4.863 -8.525 4.694 163 HB3 SER 18 HB3 SER 18 6.245 -8.190 5.758 164 HG SER 18 HG SER 18 4.867 -9.928 6.491 165 H VAL 19 H VAL 19 6.531 -4.984 6.123 166 HA VAL 19 HA VAL 19 6.396 -3.899 3.362 167 HB VAL 19 HB VAL 19 7.587 -2.784 5.896 168 HG11 VAL 19 HG11 VAL 19 7.748 -1.666 3.054 169 HG12 VAL 19 HG12 VAL 19 8.063 -0.719 4.527 170 HG13 VAL 19 HG13 VAL 19 9.109 -2.074 4.121 171 HG21 VAL 19 HG21 VAL 19 5.061 -2.616 5.450 172 HG22 VAL 19 HG22 VAL 19 5.917 -1.087 5.671 173 HG23 VAL 19 HG23 VAL 19 5.476 -1.620 4.041 174 H TYR 20 H TYR 20 7.838 -3.989 1.943 175 HA TYR 20 HA TYR 20 10.603 -4.855 2.616 176 HB2 TYR 20 HB2 TYR 20 9.455 -5.580 -0.046 177 HB3 TYR 20 HB3 TYR 20 10.735 -6.340 0.894 178 HD1 TYR 20 HD1 TYR 20 7.210 -6.349 0.035 179 HD2 TYR 20 HD2 TYR 20 10.091 -7.773 2.889 180 HE1 TYR 20 HE1 TYR 20 5.604 -8.104 0.768 181 HE2 TYR 20 HE2 TYR 20 8.494 -9.545 3.619 182 HH TYR 20 HH TYR 20 5.238 -9.895 2.192 183 H ARG 21 H ARG 21 11.992 -3.346 2.047 184 HA ARG 21 HA ARG 21 11.419 -1.185 0.158 185 HB2 ARG 21 HB2 ARG 21 13.043 -1.073 2.102 186 HB3 ARG 21 HB3 ARG 21 14.148 -2.092 1.164 187 HG2 ARG 21 HG2 ARG 21 14.162 -0.376 -0.645 188 HG3 ARG 21 HG3 ARG 21 13.011 0.607 0.291 189 HD2 ARG 21 HD2 ARG 21 14.659 0.818 2.115 190 HD3 ARG 21 HD3 ARG 21 15.813 -0.177 1.201 191 HE ARG 21 HE ARG 21 15.048 1.981 -0.465 192 HH11 ARG 21 HH11 ARG 21 16.305 3.790 -0.768 193 HH12 ARG 21 HH12 ARG 21 17.502 4.225 0.415 194 HH21 ARG 21 HH21 ARG 21 16.855 1.589 2.511 195 HH22 ARG 21 HH22 ARG 21 17.812 3.017 2.226 196 H ILE 22 H ILE 22 11.506 -1.255 -1.981 197 HA ILE 22 HA ILE 22 12.173 -3.829 -3.254 198 HB ILE 22 HB ILE 22 10.745 -3.050 -5.094 199 HG12 ILE 22 HG12 ILE 22 10.330 -0.529 -3.427 200 HG13 ILE 22 HG13 ILE 22 11.138 -0.639 -4.996 201 HG21 ILE 22 HG21 ILE 22 9.305 -2.718 -2.448 202 HG22 ILE 22 HG22 ILE 22 8.663 -3.338 -3.988 203 HG23 ILE 22 HG23 ILE 22 9.853 -4.281 -3.085 204 HD11 ILE 22 HD11 ILE 22 8.213 -1.061 -4.383 205 HD12 ILE 22 HD12 ILE 22 8.954 0.144 -5.445 206 HD13 ILE 22 HD13 ILE 22 8.947 -1.575 -5.921 207 HA PRO 23 HA PRO 23 15.284 -2.045 -6.078 208 HB2 PRO 23 HB2 PRO 23 14.936 -3.600 -8.298 209 HB3 PRO 23 HB3 PRO 23 15.729 -4.210 -6.812 210 HG2 PRO 23 HG2 PRO 23 12.819 -4.539 -7.635 211 HG3 PRO 23 HG3 PRO 23 13.964 -5.810 -7.100 212 HD2 PRO 23 HD2 PRO 23 12.215 -4.666 -5.380 213 HD3 PRO 23 HD3 PRO 23 13.868 -5.086 -4.853 214 HA PRO 24 HA PRO 24 12.733 0.801 -8.368 215 HB2 PRO 24 HB2 PRO 24 14.367 1.673 -10.398 216 HB3 PRO 24 HB3 PRO 24 14.595 2.103 -8.676 217 HG2 PRO 24 HG2 PRO 24 15.987 -0.086 -10.245 218 HG3 PRO 24 HG3 PRO 24 16.718 1.137 -9.163 219 HD2 PRO 24 HD2 PRO 24 16.170 -1.395 -8.322 220 HD3 PRO 24 HD3 PRO 24 15.972 0.009 -7.232 221 H ARG 25 H ARG 25 11.340 0.989 -10.136 222 HA ARG 25 HA ARG 25 10.619 -1.473 -11.442 223 HB2 ARG 25 HB2 ARG 25 8.939 0.172 -10.788 224 HB3 ARG 25 HB3 ARG 25 9.701 1.387 -11.828 225 HG2 ARG 25 HG2 ARG 25 7.671 0.668 -12.861 226 HG3 ARG 25 HG3 ARG 25 9.013 0.107 -13.828 227 HD2 ARG 25 HD2 ARG 25 7.618 -1.716 -13.838 228 HD3 ARG 25 HD3 ARG 25 8.730 -2.157 -12.541 229 HE ARG 25 HE ARG 25 6.653 -0.758 -11.264 230 HH11 ARG 25 HH11 ARG 25 4.832 -1.401 -10.489 231 HH12 ARG 25 HH12 ARG 25 4.189 -3.019 -10.784 232 HH21 ARG 25 HH21 ARG 25 6.424 -3.546 -13.376 233 HH22 ARG 25 HH22 ARG 25 5.028 -4.136 -12.527 234 H ALA 26 H ALA 26 10.930 -2.227 -13.395 235 HA ALA 26 HA ALA 26 11.203 -0.486 -15.684 236 HB1 ALA 26 HB1 ALA 26 13.299 -1.549 -16.511 237 HB2 ALA 26 HB2 ALA 26 13.548 -0.652 -14.990 238 HB3 ALA 26 HB3 ALA 26 13.429 -2.423 -14.957 239 H SER 27 H SER 27 10.144 -1.467 -17.371 240 HA SER 27 HA SER 27 8.591 -3.751 -17.032 241 HB2 SER 27 HB2 SER 27 9.404 -2.473 -19.668 242 HB3 SER 27 HB3 SER 27 7.961 -3.463 -19.366 243 HG SER 27 HG SER 27 7.501 -1.210 -19.284 244 H ASN 28 H ASN 28 11.887 -3.689 -18.110 245 HA ASN 28 HA ASN 28 11.892 -6.317 -19.379 246 HB2 ASN 28 HB2 ASN 28 14.141 -4.566 -18.291 247 HB3 ASN 28 HB3 ASN 28 14.373 -6.048 -19.211 248 HD21 ASN 28 HD21 ASN 28 13.749 -2.666 -21.256 249 HD22 ASN 28 HD22 ASN 28 14.096 -2.681 -19.535 250 H ARG 29 H ARG 29 11.596 -5.371 -16.130 251 HA ARG 29 HA ARG 29 12.203 -8.147 -15.191 252 HB2 ARG 29 HB2 ARG 29 12.969 -7.344 -13.080 253 HB3 ARG 29 HB3 ARG 29 14.019 -6.975 -14.449 254 HG2 ARG 29 HG2 ARG 29 13.305 -4.641 -14.444 255 HG3 ARG 29 HG3 ARG 29 12.166 -4.952 -13.101 256 HD2 ARG 29 HD2 ARG 29 13.950 -5.658 -11.665 257 HD3 ARG 29 HD3 ARG 29 15.112 -5.614 -12.986 258 HE ARG 29 HE ARG 29 13.926 -3.254 -11.558 259 HH11 ARG 29 HH11 ARG 29 14.774 -1.324 -11.821 260 HH12 ARG 29 HH12 ARG 29 16.107 -1.033 -12.929 261 HH21 ARG 29 HH21 ARG 29 16.226 -4.299 -14.011 262 HH22 ARG 29 HH22 ARG 29 16.901 -2.700 -14.154 263 H GLY 30 H GLY 30 10.344 -5.135 -14.446 264 HA2 GLY 30 HA2 GLY 30 8.287 -4.849 -13.550 265 HA3 GLY 30 HA3 GLY 30 7.960 -6.584 -13.636 266 H TYR 31 H TYR 31 7.341 -4.835 -11.430 267 HA TYR 31 HA TYR 31 8.863 -5.930 -9.172 268 HB2 TYR 31 HB2 TYR 31 6.030 -4.851 -9.418 269 HB3 TYR 31 HB3 TYR 31 6.850 -5.276 -7.924 270 HD1 TYR 31 HD1 TYR 31 9.551 -3.822 -9.485 271 HD2 TYR 31 HD2 TYR 31 5.578 -2.760 -8.129 272 HE1 TYR 31 HE1 TYR 31 10.315 -1.544 -8.967 273 HE2 TYR 31 HE2 TYR 31 6.322 -0.418 -7.819 274 HH TYR 31 HH TYR 31 9.733 0.576 -8.270 275 H ARG 32 H ARG 32 8.778 -8.163 -8.755 276 HA ARG 32 HA ARG 32 6.354 -9.678 -9.690 277 HB2 ARG 32 HB2 ARG 32 7.756 -11.580 -10.282 278 HB3 ARG 32 HB3 ARG 32 8.008 -10.179 -11.297 279 HG2 ARG 32 HG2 ARG 32 9.900 -10.841 -9.006 280 HG3 ARG 32 HG3 ARG 32 10.010 -11.616 -10.590 281 HD2 ARG 32 HD2 ARG 32 10.060 -9.268 -11.611 282 HD3 ARG 32 HD3 ARG 32 10.346 -8.669 -9.980 283 HE ARG 32 HE ARG 32 12.456 -9.848 -9.894 284 HH11 ARG 32 HH11 ARG 32 14.220 -10.438 -10.713 285 HH12 ARG 32 HH12 ARG 32 14.419 -10.777 -12.434 286 HH21 ARG 32 HH21 ARG 32 11.160 -9.833 -13.169 287 HH22 ARG 32 HH22 ARG 32 12.640 -10.521 -13.796 288 H ALA 33 H ALA 33 6.911 -8.655 -7.072 289 HA ALA 33 HA ALA 33 6.995 -9.121 -4.880 290 HB1 ALA 33 HB1 ALA 33 5.591 -11.662 -5.761 291 HB2 ALA 33 HB2 ALA 33 5.526 -10.897 -4.154 292 HB3 ALA 33 HB3 ALA 33 4.849 -10.069 -5.580 293 H SER 34 H SER 34 8.062 -12.140 -6.520 294 HA SER 34 HA SER 34 9.585 -13.162 -4.377 295 HB2 SER 34 HB2 SER 34 9.860 -13.674 -7.357 296 HB3 SER 34 HB3 SER 34 10.530 -14.690 -6.065 297 HG SER 34 HG SER 34 8.501 -15.468 -6.827 298 H ASP 35 H ASP 35 10.451 -10.570 -6.472 299 HA ASP 35 HA ASP 35 13.353 -10.856 -6.079 300 HB2 ASP 35 HB2 ASP 35 11.795 -9.550 -7.953 301 HB3 ASP 35 HB3 ASP 35 12.270 -8.218 -6.919 302 H TRP 36 H TRP 36 10.718 -9.695 -4.172 303 HA TRP 36 HA TRP 36 12.248 -7.696 -2.678 304 HB2 TRP 36 HB2 TRP 36 9.476 -8.778 -2.139 305 HB3 TRP 36 HB3 TRP 36 10.182 -7.295 -1.554 306 HD1 TRP 36 HD1 TRP 36 11.038 -6.796 -4.950 307 HE1 TRP 36 HE1 TRP 36 9.208 -5.524 -6.262 308 HE3 TRP 36 HE3 TRP 36 7.065 -7.625 -1.836 309 HZ2 TRP 36 HZ2 TRP 36 6.494 -4.738 -5.850 310 HZ3 TRP 36 HZ3 TRP 36 4.871 -6.520 -2.278 311 HH2 TRP 36 HH2 TRP 36 4.584 -5.088 -4.275 312 H LYS 37 H LYS 37 12.082 -7.852 -0.297 313 HA LYS 37 HA LYS 37 13.316 -10.283 0.661 314 HB2 LYS 37 HB2 LYS 37 12.717 -7.626 2.002 315 HB3 LYS 37 HB3 LYS 37 13.593 -8.961 2.751 316 HG2 LYS 37 HG2 LYS 37 15.179 -8.917 0.733 317 HG3 LYS 37 HG3 LYS 37 14.440 -7.360 0.325 318 HD2 LYS 37 HD2 LYS 37 16.123 -8.112 2.726 319 HD3 LYS 37 HD3 LYS 37 16.412 -6.855 1.515 320 HE2 LYS 37 HE2 LYS 37 14.327 -5.683 2.387 321 HE3 LYS 37 HE3 LYS 37 14.267 -6.890 3.681 322 HZ1 LYS 37 HZ1 LYS 37 15.407 -4.789 4.293 323 HZ2 LYS 37 HZ2 LYS 37 16.394 -6.092 4.477 324 HZ3 LYS 37 HZ3 LYS 37 16.578 -5.080 3.198 325 H LEU 38 H LEU 38 11.141 -11.328 0.043 326 HA LEU 38 HA LEU 38 8.910 -11.302 1.796 327 HB2 LEU 38 HB2 LEU 38 10.018 -13.566 0.094 328 HB3 LEU 38 HB3 LEU 38 8.382 -13.485 0.753 329 HG LEU 38 HG LEU 38 9.589 -11.679 -1.368 330 HD11 LEU 38 HD11 LEU 38 7.263 -13.663 -1.396 331 HD12 LEU 38 HD12 LEU 38 7.793 -12.680 -2.770 332 HD13 LEU 38 HD13 LEU 38 8.868 -13.927 -2.116 333 HD21 LEU 38 HD21 LEU 38 7.278 -10.691 -1.546 334 HD22 LEU 38 HD22 LEU 38 6.879 -11.496 -0.008 335 HD23 LEU 38 HD23 LEU 38 8.144 -10.248 -0.075 336 H ASP 39 H ASP 39 12.011 -12.731 2.429 337 HA ASP 39 HA ASP 39 10.914 -14.560 4.510 338 HB2 ASP 39 HB2 ASP 39 12.491 -15.459 2.825 339 HB3 ASP 39 HB3 ASP 39 13.718 -14.338 3.404 340 H GLN 40 H GLN 40 12.156 -11.443 4.147 341 HA GLN 40 HA GLN 40 12.824 -11.079 7.003 342 HB2 GLN 40 HB2 GLN 40 15.061 -10.313 6.511 343 HB3 GLN 40 HB3 GLN 40 14.840 -11.995 6.093 344 HG2 GLN 40 HG2 GLN 40 15.124 -9.690 4.134 345 HG3 GLN 40 HG3 GLN 40 16.335 -10.850 4.574 346 HE21 GLN 40 HE21 GLN 40 15.284 -13.040 1.990 347 HE22 GLN 40 HE22 GLN 40 16.606 -12.594 3.092 348 HA PRO 41 HA PRO 41 10.545 -7.484 5.048 349 HB2 PRO 41 HB2 PRO 41 9.415 -7.428 7.835 350 HB3 PRO 41 HB3 PRO 41 8.575 -7.147 6.290 351 HG2 PRO 41 HG2 PRO 41 8.322 -9.519 7.612 352 HG3 PRO 41 HG3 PRO 41 8.476 -9.488 5.833 353 HD2 PRO 41 HD2 PRO 41 10.598 -10.094 7.895 354 HD3 PRO 41 HD3 PRO 41 10.257 -10.906 6.340 355 H ASP 42 H ASP 42 10.924 -5.304 5.330 356 HA ASP 42 HA ASP 42 13.092 -4.428 7.126 357 HB2 ASP 42 HB2 ASP 42 11.248 -2.949 5.204 358 HB3 ASP 42 HB3 ASP 42 12.528 -2.181 6.149 359 H TRP 43 H TRP 43 9.583 -4.440 7.065 360 HA TRP 43 HA TRP 43 9.460 -3.935 9.945 361 HB2 TRP 43 HB2 TRP 43 9.484 -1.638 9.205 362 HB3 TRP 43 HB3 TRP 43 8.322 -1.964 7.937 363 HD1 TRP 43 HD1 TRP 43 8.541 -1.110 11.610 364 HE1 TRP 43 HE1 TRP 43 6.203 -0.481 12.469 365 HE3 TRP 43 HE3 TRP 43 5.771 -2.768 7.658 366 HZ2 TRP 43 HZ2 TRP 43 3.500 -0.415 11.411 367 HZ3 TRP 43 HZ3 TRP 43 3.319 -2.280 7.548 368 HH2 TRP 43 HH2 TRP 43 2.179 -1.143 9.429 369 H THR 44 H THR 44 7.383 -4.507 10.850 370 HA THR 44 HA THR 44 5.291 -5.463 9.001 371 HB THR 44 HB THR 44 4.749 -7.391 10.404 372 HG1 THR 44 HG1 THR 44 7.303 -6.989 11.565 373 HG21 THR 44 HG21 THR 44 6.137 -7.669 8.367 374 HG22 THR 44 HG22 THR 44 7.597 -7.614 9.378 375 HG23 THR 44 HG23 THR 44 6.405 -8.921 9.590 376 H GLY 45 H GLY 45 3.209 -5.282 9.742 377 HA2 GLY 45 HA2 GLY 45 2.417 -4.624 12.408 378 HA3 GLY 45 HA3 GLY 45 2.690 -3.126 11.527 379 H ARG 46 H ARG 46 0.658 -2.409 11.382 380 HA ARG 46 HA ARG 46 -1.526 -4.151 10.316 381 HB2 ARG 46 HB2 ARG 46 -1.698 -1.627 12.000 382 HB3 ARG 46 HB3 ARG 46 -3.047 -2.654 11.499 383 HG2 ARG 46 HG2 ARG 46 -2.039 -4.546 12.810 384 HG3 ARG 46 HG3 ARG 46 -0.786 -3.447 13.395 385 HD2 ARG 46 HD2 ARG 46 -3.781 -3.040 13.829 386 HD3 ARG 46 HD3 ARG 46 -2.691 -3.798 14.985 387 HE ARG 46 HE ARG 46 -1.535 -1.728 15.328 388 HH11 ARG 46 HH11 ARG 46 -1.383 0.383 15.399 389 HH12 ARG 46 HH12 ARG 46 -2.592 1.394 14.571 390 HH21 ARG 46 HH21 ARG 46 -4.345 -1.109 13.229 391 HH22 ARG 46 HH22 ARG 46 -4.030 0.625 13.384 392 H LEU 47 H LEU 47 -2.950 -3.401 8.873 393 HA LEU 47 HA LEU 47 -2.148 -1.190 7.048 394 HB2 LEU 47 HB2 LEU 47 -2.594 -3.443 6.098 395 HB3 LEU 47 HB3 LEU 47 -4.180 -3.455 6.864 396 HG LEU 47 HG LEU 47 -4.862 -1.501 5.429 397 HD11 LEU 47 HD11 LEU 47 -2.193 -2.047 4.049 398 HD12 LEU 47 HD12 LEU 47 -3.490 -1.016 3.413 399 HD13 LEU 47 HD13 LEU 47 -2.646 -0.547 4.891 400 HD21 LEU 47 HD21 LEU 47 -5.443 -3.785 4.823 401 HD22 LEU 47 HD22 LEU 47 -5.063 -2.860 3.367 402 HD23 LEU 47 HD23 LEU 47 -3.866 -3.999 4.033 403 H ARG 48 H ARG 48 -3.323 0.686 6.962 404 HA ARG 48 HA ARG 48 -6.183 0.683 7.731 405 HB2 ARG 48 HB2 ARG 48 -4.949 1.373 9.759 406 HB3 ARG 48 HB3 ARG 48 -4.147 2.665 8.859 407 HG2 ARG 48 HG2 ARG 48 -6.294 3.800 8.492 408 HG3 ARG 48 HG3 ARG 48 -7.175 2.438 9.205 409 HD2 ARG 48 HD2 ARG 48 -5.939 2.857 11.369 410 HD3 ARG 48 HD3 ARG 48 -5.191 4.266 10.610 411 HE ARG 48 HE ARG 48 -7.150 5.480 10.861 412 HH11 ARG 48 HH11 ARG 48 -8.963 5.982 11.630 413 HH12 ARG 48 HH12 ARG 48 -10.120 4.806 12.269 414 HH21 ARG 48 HH21 ARG 48 -7.986 2.148 11.631 415 HH22 ARG 48 HH22 ARG 48 -9.537 2.631 12.263 416 H ILE 49 H ILE 49 -6.698 0.772 5.633 417 HA ILE 49 HA ILE 49 -5.824 3.021 3.920 418 HB ILE 49 HB ILE 49 -8.089 1.078 3.397 419 HG12 ILE 49 HG12 ILE 49 -5.153 0.870 2.573 420 HG13 ILE 49 HG13 ILE 49 -6.024 -0.205 3.675 421 HG21 ILE 49 HG21 ILE 49 -6.478 2.883 1.530 422 HG22 ILE 49 HG22 ILE 49 -7.835 1.833 1.065 423 HG23 ILE 49 HG23 ILE 49 -8.121 3.219 2.107 424 HD11 ILE 49 HD11 ILE 49 -7.634 -0.620 1.680 425 HD12 ILE 49 HD12 ILE 49 -6.291 -0.007 0.689 426 HD13 ILE 49 HD13 ILE 49 -6.077 -1.426 1.748 427 H THR 50 H THR 50 -6.742 4.898 3.904 428 HA THR 50 HA THR 50 -9.437 5.410 5.030 429 HB THR 50 HB THR 50 -8.254 7.533 6.042 430 HG1 THR 50 HG1 THR 50 -6.128 5.721 5.815 431 HG21 THR 50 HG21 THR 50 -8.137 4.780 7.288 432 HG22 THR 50 HG22 THR 50 -7.640 6.250 8.146 433 HG23 THR 50 HG23 THR 50 -9.305 6.097 7.572 434 H SER 51 H SER 51 -10.146 7.712 4.460 435 HA SER 51 HA SER 51 -8.703 9.082 2.296 436 HB2 SER 51 HB2 SER 51 -10.030 7.269 1.151 437 HB3 SER 51 HB3 SER 51 -11.509 7.982 1.831 438 HG SER 51 HG SER 51 -11.074 8.729 -0.282 439 H LYS 52 H LYS 52 -9.539 11.149 1.774 440 HA LYS 52 HA LYS 52 -12.071 11.880 2.951 441 HB2 LYS 52 HB2 LYS 52 -10.340 12.506 4.683 442 HB3 LYS 52 HB3 LYS 52 -9.743 13.711 3.540 443 HG2 LYS 52 HG2 LYS 52 -11.237 14.715 5.160 444 HG3 LYS 52 HG3 LYS 52 -11.917 14.829 3.540 445 HD2 LYS 52 HD2 LYS 52 -13.649 14.359 5.182 446 HD3 LYS 52 HD3 LYS 52 -13.504 12.984 4.091 447 HE2 LYS 52 HE2 LYS 52 -12.121 11.791 5.795 448 HE3 LYS 52 HE3 LYS 52 -12.249 13.200 6.862 449 HZ1 LYS 52 HZ1 LYS 52 -13.913 11.646 7.537 450 HZ2 LYS 52 HZ2 LYS 52 -14.736 12.823 6.760 451 HZ3 LYS 52 HZ3 LYS 52 -14.433 11.377 6.032 452 H GLY 53 H GLY 53 -13.175 12.565 1.323 453 HA2 GLY 53 HA2 GLY 53 -13.958 13.825 -0.435 454 HA3 GLY 53 HA3 GLY 53 -12.507 14.831 -0.345 455 H LYS 54 H LYS 54 -11.307 14.709 -2.050 456 HA LYS 54 HA LYS 54 -11.306 12.357 -3.876 457 HB2 LYS 54 HB2 LYS 54 -10.526 15.261 -4.104 458 HB3 LYS 54 HB3 LYS 54 -10.211 14.077 -5.402 459 HG2 LYS 54 HG2 LYS 54 -12.681 13.549 -5.418 460 HG3 LYS 54 HG3 LYS 54 -12.933 14.903 -4.311 461 HD2 LYS 54 HD2 LYS 54 -11.750 15.086 -7.114 462 HD3 LYS 54 HD3 LYS 54 -13.414 15.485 -6.656 463 HE2 LYS 54 HE2 LYS 54 -12.563 17.254 -5.118 464 HE3 LYS 54 HE3 LYS 54 -10.907 16.885 -5.617 465 HZ1 LYS 54 HZ1 LYS 54 -13.050 17.868 -7.428 466 HZ2 LYS 54 HZ2 LYS 54 -11.805 18.760 -6.866 467 HZ3 LYS 54 HZ3 LYS 54 -11.520 17.523 -7.890 468 H THR 55 H THR 55 -9.653 12.810 -1.230 469 HA THR 55 HA THR 55 -7.088 11.841 -2.423 470 HB THR 55 HB THR 55 -7.316 13.451 0.123 471 HG1 THR 55 HG1 THR 55 -6.527 15.162 -1.112 472 HG21 THR 55 HG21 THR 55 -5.299 12.009 -0.109 473 HG22 THR 55 HG22 THR 55 -4.991 12.693 -1.719 474 HG23 THR 55 HG23 THR 55 -4.860 13.717 -0.266 475 H ALA 56 H ALA 56 -6.882 9.753 -2.010 476 HA ALA 56 HA ALA 56 -7.891 8.584 0.522 477 HB1 ALA 56 HB1 ALA 56 -8.459 7.389 -1.522 478 HB2 ALA 56 HB2 ALA 56 -6.726 7.188 -1.885 479 HB3 ALA 56 HB3 ALA 56 -7.428 6.425 -0.448 480 H TYR 57 H TYR 57 -6.483 7.231 1.776 481 HA TYR 57 HA TYR 57 -3.604 7.991 1.826 482 HB2 TYR 57 HB2 TYR 57 -5.550 8.069 4.161 483 HB3 TYR 57 HB3 TYR 57 -3.838 8.453 4.216 484 HD1 TYR 57 HD1 TYR 57 -3.066 10.473 2.709 485 HD2 TYR 57 HD2 TYR 57 -7.154 9.812 3.960 486 HE1 TYR 57 HE1 TYR 57 -3.580 12.884 2.356 487 HE2 TYR 57 HE2 TYR 57 -7.661 12.200 3.559 488 HH TYR 57 HH TYR 57 -5.172 14.530 2.463 489 H ILE 58 H ILE 58 -2.696 5.959 1.475 490 HA ILE 58 HA ILE 58 -3.701 3.604 3.030 491 HB ILE 58 HB ILE 58 -1.344 3.819 1.118 492 HG12 ILE 58 HG12 ILE 58 -2.710 2.061 -0.158 493 HG13 ILE 58 HG13 ILE 58 -4.099 2.539 0.812 494 HG21 ILE 58 HG21 ILE 58 -2.483 1.395 2.592 495 HG22 ILE 58 HG22 ILE 58 -1.175 1.369 1.386 496 HG23 ILE 58 HG23 ILE 58 -0.915 2.163 2.922 497 HD11 ILE 58 HD11 ILE 58 -4.058 4.765 -0.209 498 HD12 ILE 58 HD12 ILE 58 -2.471 4.423 -0.955 499 HD13 ILE 58 HD13 ILE 58 -3.921 3.558 -1.491 500 H LYS 59 H LYS 59 -3.449 4.173 5.157 501 HA LYS 59 HA LYS 59 -0.725 4.953 6.063 502 HB2 LYS 59 HB2 LYS 59 -3.219 4.686 7.766 503 HB3 LYS 59 HB3 LYS 59 -1.685 5.451 8.170 504 HG2 LYS 59 HG2 LYS 59 -2.223 6.969 6.050 505 HG3 LYS 59 HG3 LYS 59 -3.870 6.402 6.310 506 HD2 LYS 59 HD2 LYS 59 -3.649 7.256 8.727 507 HD3 LYS 59 HD3 LYS 59 -2.084 7.933 8.241 508 HE2 LYS 59 HE2 LYS 59 -3.488 9.761 7.986 509 HE3 LYS 59 HE3 LYS 59 -3.385 9.124 6.337 510 HZ1 LYS 59 HZ1 LYS 59 -5.538 7.983 6.781 511 HZ2 LYS 59 HZ2 LYS 59 -5.604 8.659 8.270 512 HZ3 LYS 59 HZ3 LYS 59 -5.672 9.616 6.944 513 H LEU 60 H LEU 60 0.599 3.741 7.178 514 HA LEU 60 HA LEU 60 -0.135 0.942 7.956 515 HB2 LEU 60 HB2 LEU 60 2.298 2.189 6.715 516 HB3 LEU 60 HB3 LEU 60 2.577 1.003 7.981 517 HG LEU 60 HG LEU 60 1.396 -0.713 6.826 518 HD11 LEU 60 HD11 LEU 60 0.816 1.346 4.649 519 HD12 LEU 60 HD12 LEU 60 0.617 -0.411 4.455 520 HD13 LEU 60 HD13 LEU 60 -0.376 0.455 5.624 521 HD21 LEU 60 HD21 LEU 60 2.918 -1.005 4.950 522 HD22 LEU 60 HD22 LEU 60 3.244 0.742 4.883 523 HD23 LEU 60 HD23 LEU 60 3.786 -0.219 6.272 524 H GLU 61 H GLU 61 0.122 0.340 10.048 525 HA GLU 61 HA GLU 61 1.191 2.346 12.013 526 HB2 GLU 61 HB2 GLU 61 -1.455 0.903 12.235 527 HB3 GLU 61 HB3 GLU 61 -0.714 1.993 13.426 528 HG2 GLU 61 HG2 GLU 61 -0.899 3.853 11.769 529 HG3 GLU 61 HG3 GLU 61 -1.836 2.773 10.720 530 H ASP 62 H ASP 62 1.784 1.564 14.072 531 HA ASP 62 HA ASP 62 2.954 -1.067 13.995 532 HB2 ASP 62 HB2 ASP 62 3.835 1.089 15.066 533 HB3 ASP 62 HB3 ASP 62 2.671 0.775 16.370 534 H LYS 63 H LYS 63 2.522 -2.826 15.174 535 HA LYS 63 HA LYS 63 -0.256 -3.292 16.002 536 HB2 LYS 63 HB2 LYS 63 0.562 -5.727 16.064 537 HB3 LYS 63 HB3 LYS 63 0.600 -4.933 14.493 538 HG2 LYS 63 HG2 LYS 63 2.978 -4.530 14.642 539 HG3 LYS 63 HG3 LYS 63 3.042 -5.134 16.305 540 HD2 LYS 63 HD2 LYS 63 2.637 -7.379 15.604 541 HD3 LYS 63 HD3 LYS 63 2.129 -6.859 13.974 542 HE2 LYS 63 HE2 LYS 63 4.400 -5.953 13.555 543 HE3 LYS 63 HE3 LYS 63 4.933 -6.508 15.142 544 HZ1 LYS 63 HZ1 LYS 63 4.669 -8.768 14.445 545 HZ2 LYS 63 HZ2 LYS 63 3.869 -8.358 13.075 546 HZ3 LYS 63 HZ3 LYS 63 5.453 -8.007 13.212 547 H VAL 64 H VAL 64 2.434 -2.344 17.677 548 HA VAL 64 HA VAL 64 1.280 -3.384 20.235 549 HB VAL 64 HB VAL 64 4.164 -2.808 19.473 550 HG11 VAL 64 HG11 VAL 64 3.859 -2.140 21.812 551 HG12 VAL 64 HG12 VAL 64 3.025 -3.672 22.170 552 HG13 VAL 64 HG13 VAL 64 4.753 -3.658 21.749 553 HG21 VAL 64 HG21 VAL 64 3.394 -4.989 18.647 554 HG22 VAL 64 HG22 VAL 64 4.521 -5.217 19.983 555 HG23 VAL 64 HG23 VAL 64 2.774 -5.408 20.260 556 H SER 65 H SER 65 2.982 -0.612 18.685 557 HA SER 65 HA SER 65 2.402 1.048 21.060 558 HB2 SER 65 HB2 SER 65 3.890 1.644 18.484 559 HB3 SER 65 HB3 SER 65 3.729 2.764 19.851 560 HG SER 65 HG SER 65 5.681 1.572 19.937 561 H GLY 66 H GLY 66 1.061 0.596 17.852 562 HA2 GLY 66 HA2 GLY 66 -0.955 1.401 17.009 563 HA3 GLY 66 HA3 GLY 66 -1.170 2.415 18.434 564 H GLU 67 H GLU 67 1.914 2.842 17.096 565 HA GLU 67 HA GLU 67 1.273 5.569 16.298 566 HB2 GLU 67 HB2 GLU 67 3.608 5.955 16.388 567 HB3 GLU 67 HB3 GLU 67 3.160 4.957 17.780 568 HG2 GLU 67 HG2 GLU 67 4.031 2.945 16.630 569 HG3 GLU 67 HG3 GLU 67 4.491 3.927 15.237 570 H LEU 68 H LEU 68 1.988 6.558 14.311 571 HA LEU 68 HA LEU 68 1.416 4.964 11.951 572 HB2 LEU 68 HB2 LEU 68 0.786 7.391 12.259 573 HB3 LEU 68 HB3 LEU 68 2.499 7.798 12.192 574 HG LEU 68 HG LEU 68 2.531 6.707 9.852 575 HD11 LEU 68 HD11 LEU 68 -0.490 7.029 10.160 576 HD12 LEU 68 HD12 LEU 68 0.387 6.579 8.678 577 HD13 LEU 68 HD13 LEU 68 0.359 5.478 10.055 578 HD21 LEU 68 HD21 LEU 68 2.554 9.144 10.184 579 HD22 LEU 68 HD22 LEU 68 1.591 8.700 8.767 580 HD23 LEU 68 HD23 LEU 68 0.779 9.160 10.283 581 H PHE 69 H PHE 69 2.807 3.815 10.759 582 HA PHE 69 HA PHE 69 5.750 4.081 11.077 583 HB2 PHE 69 HB2 PHE 69 4.955 1.839 11.002 584 HB3 PHE 69 HB3 PHE 69 3.944 2.149 9.598 585 HD1 PHE 69 HD1 PHE 69 7.553 2.154 10.665 586 HD2 PHE 69 HD2 PHE 69 4.752 1.668 7.419 587 HE1 PHE 69 HE1 PHE 69 9.412 1.506 9.151 588 HE2 PHE 69 HE2 PHE 69 6.619 1.081 5.902 589 HZ PHE 69 HZ PHE 69 8.948 0.973 6.765 590 H ALA 70 H ALA 70 3.313 4.264 8.441 591 HA ALA 70 HA ALA 70 4.696 6.481 7.135 592 HB1 ALA 70 HB1 ALA 70 4.500 3.751 5.763 593 HB2 ALA 70 HB2 ALA 70 5.127 5.254 5.052 594 HB3 ALA 70 HB3 ALA 70 6.003 4.480 6.372 595 H GLN 71 H GLN 71 3.447 7.293 5.253 596 HA GLN 71 HA GLN 71 0.825 6.072 4.792 597 HB2 GLN 71 HB2 GLN 71 -0.482 8.035 5.128 598 HB3 GLN 71 HB3 GLN 71 0.408 7.683 6.593 599 HG2 GLN 71 HG2 GLN 71 0.671 9.964 6.494 600 HG3 GLN 71 HG3 GLN 71 2.148 9.454 5.695 601 HE21 GLN 71 HE21 GLN 71 1.223 11.770 3.150 602 HE22 GLN 71 HE22 GLN 71 2.486 11.163 4.221 603 H ALA 72 H ALA 72 0.095 6.225 2.739 604 HA ALA 72 HA ALA 72 1.654 7.891 0.799 605 HB1 ALA 72 HB1 ALA 72 1.106 6.161 -0.858 606 HB2 ALA 72 HB2 ALA 72 2.080 5.545 0.487 607 HB3 ALA 72 HB3 ALA 72 0.343 5.190 0.418 608 HA PRO 73 HA PRO 73 -2.510 9.659 0.245 609 HB2 PRO 73 HB2 PRO 73 -1.819 12.095 -0.707 610 HB3 PRO 73 HB3 PRO 73 -1.625 11.656 1.019 611 HG2 PRO 73 HG2 PRO 73 0.485 11.628 -1.157 612 HG3 PRO 73 HG3 PRO 73 0.607 12.311 0.494 613 HD2 PRO 73 HD2 PRO 73 1.526 9.800 -0.186 614 HD3 PRO 73 HD3 PRO 73 0.919 10.192 1.444 615 H VAL 74 H VAL 74 -3.817 9.615 -1.520 616 HA VAL 74 HA VAL 74 -2.656 9.217 -4.258 617 HB VAL 74 HB VAL 74 -5.013 7.652 -3.172 618 HG11 VAL 74 HG11 VAL 74 -3.085 7.128 -5.467 619 HG12 VAL 74 HG12 VAL 74 -4.440 6.085 -4.987 620 HG13 VAL 74 HG13 VAL 74 -4.764 7.706 -5.595 621 HG21 VAL 74 HG21 VAL 74 -3.244 6.976 -1.677 622 HG22 VAL 74 HG22 VAL 74 -3.561 5.698 -2.846 623 HG23 VAL 74 HG23 VAL 74 -2.127 6.727 -3.034 624 H GLU 75 H GLU 75 -3.695 10.424 -5.834 625 HA GLU 75 HA GLU 75 -6.166 11.908 -5.057 626 HB2 GLU 75 HB2 GLU 75 -4.229 12.254 -7.369 627 HB3 GLU 75 HB3 GLU 75 -5.670 13.242 -7.094 628 HG2 GLU 75 HG2 GLU 75 -4.782 13.904 -4.858 629 HG3 GLU 75 HG3 GLU 75 -3.304 12.999 -5.188 630 H GLN 76 H GLN 76 -5.297 9.245 -7.038 631 HA GLN 76 HA GLN 76 -8.008 8.596 -7.660 632 HB2 GLN 76 HB2 GLN 76 -8.011 8.648 -10.028 633 HB3 GLN 76 HB3 GLN 76 -7.589 10.261 -9.502 634 HG2 GLN 76 HG2 GLN 76 -5.669 8.177 -10.640 635 HG3 GLN 76 HG3 GLN 76 -6.335 9.557 -11.487 636 HE21 GLN 76 HE21 GLN 76 -3.123 10.110 -9.021 637 HE22 GLN 76 HE22 GLN 76 -4.039 8.590 -8.952 638 H TYR 77 H TYR 77 -8.188 6.395 -8.400 639 HA TYR 77 HA TYR 77 -5.671 4.818 -8.249 640 HB2 TYR 77 HB2 TYR 77 -6.914 4.700 -6.163 641 HB3 TYR 77 HB3 TYR 77 -8.359 4.175 -7.039 642 HD1 TYR 77 HD1 TYR 77 -8.770 1.864 -7.257 643 HD2 TYR 77 HD2 TYR 77 -4.743 3.258 -6.568 644 HE1 TYR 77 HE1 TYR 77 -7.959 -0.482 -7.267 645 HE2 TYR 77 HE2 TYR 77 -3.926 0.908 -6.683 646 HH TYR 77 HH TYR 77 -6.086 -1.842 -7.338 647 HA PRO 78 HA PRO 78 -4.595 3.047 -9.140 648 HB2 PRO 78 HB2 PRO 78 -4.102 2.759 -12.089 649 HB3 PRO 78 HB3 PRO 78 -3.468 1.780 -10.728 650 HG2 PRO 78 HG2 PRO 78 -5.488 0.818 -12.243 651 HG3 PRO 78 HG3 PRO 78 -5.581 0.669 -10.455 652 HD2 PRO 78 HD2 PRO 78 -6.854 2.790 -12.224 653 HD3 PRO 78 HD3 PRO 78 -7.612 1.799 -10.938 654 H GLY 79 H GLY 79 -2.730 4.324 -9.170 655 HA2 GLY 79 HA2 GLY 79 -2.326 6.576 -10.987 656 HA3 GLY 79 HA3 GLY 79 -2.853 7.048 -9.369 657 H ILE 80 H ILE 80 -0.668 8.170 -9.619 658 HA ILE 80 HA ILE 80 1.757 6.777 -9.815 659 HB ILE 80 HB ILE 80 1.534 9.162 -10.191 660 HG12 ILE 80 HG12 ILE 80 3.506 10.057 -9.025 661 HG13 ILE 80 HG13 ILE 80 3.497 8.695 -7.905 662 HG21 ILE 80 HG21 ILE 80 1.214 9.545 -7.177 663 HG22 ILE 80 HG22 ILE 80 1.331 10.816 -8.402 664 HG23 ILE 80 HG23 ILE 80 -0.076 9.759 -8.382 665 HD11 ILE 80 HD11 ILE 80 3.914 8.490 -10.916 666 HD12 ILE 80 HD12 ILE 80 5.192 8.469 -9.680 667 HD13 ILE 80 HD13 ILE 80 4.017 7.148 -9.747 668 H ALA 81 H ALA 81 -0.161 7.258 -6.905 669 HA ALA 81 HA ALA 81 2.081 6.481 -5.157 670 HB1 ALA 81 HB1 ALA 81 -0.710 7.501 -4.582 671 HB2 ALA 81 HB2 ALA 81 0.552 7.209 -3.361 672 HB3 ALA 81 HB3 ALA 81 0.787 8.452 -4.601 673 H VAL 82 H VAL 82 0.192 4.540 -6.912 674 HA VAL 82 HA VAL 82 0.416 2.362 -4.952 675 HB VAL 82 HB VAL 82 -2.257 2.845 -6.256 676 HG11 VAL 82 HG11 VAL 82 -1.304 0.922 -4.076 677 HG12 VAL 82 HG12 VAL 82 -2.995 1.111 -4.559 678 HG13 VAL 82 HG13 VAL 82 -1.811 0.482 -5.712 679 HG21 VAL 82 HG21 VAL 82 -2.091 4.607 -4.617 680 HG22 VAL 82 HG22 VAL 82 -3.222 3.377 -4.067 681 HG23 VAL 82 HG23 VAL 82 -1.595 3.448 -3.362 682 H GLU 83 H GLU 83 1.029 0.543 -5.917 683 HA GLU 83 HA GLU 83 0.576 0.035 -8.822 684 HB2 GLU 83 HB2 GLU 83 3.221 0.464 -7.416 685 HB3 GLU 83 HB3 GLU 83 3.114 -0.744 -8.696 686 HG2 GLU 83 HG2 GLU 83 2.157 1.012 -10.207 687 HG3 GLU 83 HG3 GLU 83 2.474 2.219 -8.946 688 H THR 84 H THR 84 1.143 -2.127 -9.496 689 HA THR 84 HA THR 84 0.718 -4.266 -7.421 690 HB THR 84 HB THR 84 -0.329 -5.510 -9.311 691 HG1 THR 84 HG1 THR 84 -0.917 -4.342 -11.147 692 HG21 THR 84 HG21 THR 84 -1.631 -2.811 -8.725 693 HG22 THR 84 HG22 THR 84 -2.451 -4.260 -9.356 694 HG23 THR 84 HG23 THR 84 -1.750 -4.285 -7.735 695 H VAL 85 H VAL 85 1.663 -6.300 -7.828 696 HA VAL 85 HA VAL 85 4.208 -6.308 -9.295 697 HB VAL 85 HB VAL 85 4.549 -8.492 -8.312 698 HG11 VAL 85 HG11 VAL 85 4.720 -7.835 -5.986 699 HG12 VAL 85 HG12 VAL 85 5.068 -6.435 -7.009 700 HG13 VAL 85 HG13 VAL 85 3.499 -6.573 -6.195 701 HG21 VAL 85 HG21 VAL 85 2.982 -9.527 -6.789 702 HG22 VAL 85 HG22 VAL 85 1.807 -8.214 -7.014 703 HG23 VAL 85 HG23 VAL 85 2.191 -9.318 -8.344 704 H THR 86 H THR 86 4.616 -8.387 -10.599 705 HA THR 86 HA THR 86 2.484 -8.778 -12.608 706 HB THR 86 HB THR 86 4.236 -9.813 -13.939 707 HG1 THR 86 HG1 THR 86 6.304 -10.010 -13.114 708 HG21 THR 86 HG21 THR 86 4.138 -7.304 -13.837 709 HG22 THR 86 HG22 THR 86 5.367 -7.345 -12.557 710 HG23 THR 86 HG23 THR 86 5.770 -7.932 -14.181 711 H ASP 87 H ASP 87 4.193 -10.668 -10.170 712 HA ASP 87 HA ASP 87 3.381 -13.186 -11.384 713 HB2 ASP 87 HB2 ASP 87 5.653 -12.706 -10.489 714 HB3 ASP 87 HB3 ASP 87 4.963 -12.692 -8.859 715 H SER 88 H SER 88 2.595 -11.566 -8.275 716 HA SER 88 HA SER 88 0.369 -13.548 -7.935 717 HB2 SER 88 HB2 SER 88 2.356 -14.377 -6.701 718 HB3 SER 88 HB3 SER 88 2.300 -12.916 -5.700 719 HG SER 88 HG SER 88 1.138 -14.627 -4.724 720 H SER 89 H SER 89 -1.506 -12.771 -7.348 721 HA SER 89 HA SER 89 -1.885 -9.981 -7.174 722 HB2 SER 89 HB2 SER 89 -3.982 -12.059 -6.523 723 HB3 SER 89 HB3 SER 89 -4.214 -10.456 -7.231 724 HG SER 89 HG SER 89 -3.217 -11.186 -9.127 725 H ARG 90 H ARG 90 -0.505 -11.262 -4.695 726 HA ARG 90 HA ARG 90 -2.210 -9.939 -2.669 727 HB2 ARG 90 HB2 ARG 90 -1.687 -11.430 -0.983 728 HB3 ARG 90 HB3 ARG 90 -2.138 -12.387 -2.377 729 HG2 ARG 90 HG2 ARG 90 0.253 -12.846 -2.859 730 HG3 ARG 90 HG3 ARG 90 0.719 -11.836 -1.477 731 HD2 ARG 90 HD2 ARG 90 -0.560 -13.384 0.030 732 HD3 ARG 90 HD3 ARG 90 -0.812 -14.454 -1.364 733 HE ARG 90 HE ARG 90 1.972 -13.815 -1.131 734 HH11 ARG 90 HH11 ARG 90 -0.265 -15.658 0.882 735 HH12 ARG 90 HH12 ARG 90 0.947 -16.854 1.213 736 HH21 ARG 90 HH21 ARG 90 3.436 -15.252 -0.526 737 HH22 ARG 90 HH22 ARG 90 3.012 -16.604 0.496 738 H TYR 91 H TYR 91 -0.038 -8.727 -4.363 739 HA TYR 91 HA TYR 91 1.530 -7.545 -2.146 740 HB2 TYR 91 HB2 TYR 91 2.618 -8.666 -4.741 741 HB3 TYR 91 HB3 TYR 91 3.539 -7.757 -3.570 742 HD1 TYR 91 HD1 TYR 91 4.058 -8.735 -1.330 743 HD2 TYR 91 HD2 TYR 91 2.182 -11.031 -4.460 744 HE1 TYR 91 HE1 TYR 91 4.648 -10.843 -0.139 745 HE2 TYR 91 HE2 TYR 91 2.856 -13.141 -3.312 746 HH TYR 91 HH TYR 91 4.603 -13.124 -0.190 747 H PHE 92 H PHE 92 1.850 -5.405 -2.344 748 HA PHE 92 HA PHE 92 1.283 -4.022 -4.926 749 HB2 PHE 92 HB2 PHE 92 0.223 -3.176 -2.201 750 HB3 PHE 92 HB3 PHE 92 0.061 -2.267 -3.694 751 HD1 PHE 92 HD1 PHE 92 -1.362 -4.848 -1.635 752 HD2 PHE 92 HD2 PHE 92 -1.244 -3.282 -5.639 753 HE1 PHE 92 HE1 PHE 92 -3.452 -6.052 -2.154 754 HE2 PHE 92 HE2 PHE 92 -3.305 -4.579 -6.196 755 HZ PHE 92 HZ PHE 92 -4.404 -5.965 -4.466 756 H VAL 93 H VAL 93 2.099 -1.835 -4.955 757 HA VAL 93 HA VAL 93 4.232 -1.217 -2.960 758 HB VAL 93 HB VAL 93 4.319 -0.757 -5.955 759 HG11 VAL 93 HG11 VAL 93 6.256 0.297 -3.857 760 HG12 VAL 93 HG12 VAL 93 6.464 0.385 -5.617 761 HG13 VAL 93 HG13 VAL 93 5.152 1.271 -4.853 762 HG21 VAL 93 HG21 VAL 93 5.035 -2.966 -5.326 763 HG22 VAL 93 HG22 VAL 93 6.469 -2.024 -5.730 764 HG23 VAL 93 HG23 VAL 93 6.084 -2.324 -4.042 765 H ILE 94 H ILE 94 4.194 0.901 -2.153 766 HA ILE 94 HA ILE 94 2.296 2.761 -3.445 767 HB ILE 94 HB ILE 94 1.405 3.580 -1.398 768 HG12 ILE 94 HG12 ILE 94 3.200 2.694 0.176 769 HG13 ILE 94 HG13 ILE 94 1.539 2.642 0.730 770 HG21 ILE 94 HG21 ILE 94 0.737 0.660 -1.864 771 HG22 ILE 94 HG22 ILE 94 -0.266 1.845 -0.994 772 HG23 ILE 94 HG23 ILE 94 0.097 2.074 -2.709 773 HD11 ILE 94 HD11 ILE 94 1.433 0.217 0.318 774 HD12 ILE 94 HD12 ILE 94 3.100 0.228 -0.291 775 HD13 ILE 94 HD13 ILE 94 2.766 0.640 1.398 776 H ARG 95 H ARG 95 2.653 4.915 -3.217 777 HA ARG 95 HA ARG 95 5.500 5.589 -2.636 778 HB2 ARG 95 HB2 ARG 95 4.380 6.248 -4.816 779 HB3 ARG 95 HB3 ARG 95 3.473 7.454 -3.885 780 HG2 ARG 95 HG2 ARG 95 5.647 8.402 -3.072 781 HG3 ARG 95 HG3 ARG 95 6.508 7.238 -4.098 782 HD2 ARG 95 HD2 ARG 95 5.380 8.211 -6.094 783 HD3 ARG 95 HD3 ARG 95 4.561 9.386 -5.046 784 HE ARG 95 HE ARG 95 7.313 9.641 -4.497 785 HH11 ARG 95 HH11 ARG 95 8.569 11.164 -5.267 786 HH12 ARG 95 HH12 ARG 95 8.241 11.946 -6.801 787 HH21 ARG 95 HH21 ARG 95 5.319 10.192 -7.328 788 HH22 ARG 95 HH22 ARG 95 6.409 11.403 -7.946 789 H ILE 96 H ILE 96 5.456 5.467 -0.387 790 HA ILE 96 HA ILE 96 3.661 7.140 1.165 791 HB ILE 96 HB ILE 96 4.836 6.536 3.123 792 HG12 ILE 96 HG12 ILE 96 6.673 4.591 2.718 793 HG13 ILE 96 HG13 ILE 96 7.002 5.533 1.278 794 HG21 ILE 96 HG21 ILE 96 4.379 4.155 1.322 795 HG22 ILE 96 HG22 ILE 96 4.456 4.113 3.089 796 HG23 ILE 96 HG23 ILE 96 3.164 5.008 2.311 797 HD11 ILE 96 HD11 ILE 96 7.066 6.521 4.166 798 HD12 ILE 96 HD12 ILE 96 8.469 6.148 3.151 799 HD13 ILE 96 HD13 ILE 96 7.437 7.529 2.745 800 H GLN 97 H GLN 97 4.029 9.020 2.259 801 HA GLN 97 HA GLN 97 6.312 10.735 1.374 802 HB2 GLN 97 HB2 GLN 97 3.350 11.175 0.908 803 HB3 GLN 97 HB3 GLN 97 4.490 12.527 0.984 804 HG2 GLN 97 HG2 GLN 97 5.608 11.935 -0.945 805 HG3 GLN 97 HG3 GLN 97 5.150 10.237 -0.866 806 HE21 GLN 97 HE21 GLN 97 2.320 10.617 -2.899 807 HE22 GLN 97 HE22 GLN 97 3.317 9.519 -1.945 808 H ASP 98 H ASP 98 6.798 12.427 2.637 809 HA ASP 98 HA ASP 98 5.861 12.270 5.454 810 HB2 ASP 98 HB2 ASP 98 8.298 12.156 4.736 811 HB3 ASP 98 HB3 ASP 98 8.152 13.863 4.316 812 H GLY 99 H GLY 99 4.788 13.936 2.871 813 HA2 GLY 99 HA2 GLY 99 3.171 15.604 2.768 814 HA3 GLY 99 HA3 GLY 99 3.406 15.951 4.481 815 H THR 100 H THR 100 6.302 15.977 2.694 816 HA THR 100 HA THR 100 6.325 18.941 2.330 817 HB THR 100 HB THR 100 7.073 18.312 4.598 818 HG1 THR 100 HG1 THR 100 9.034 19.395 2.882 819 HG21 THR 100 HG21 THR 100 9.445 16.976 3.239 820 HG22 THR 100 HG22 THR 100 9.208 17.227 4.980 821 HG23 THR 100 HG23 THR 100 8.134 16.134 4.095 822 H GLY 101 H GLY 101 6.466 16.428 0.485 823 HA2 GLY 101 HA2 GLY 101 7.288 16.337 -1.708 824 HA3 GLY 101 HA3 GLY 101 8.539 17.515 -1.323 825 H ARG 102 H ARG 102 8.744 15.282 1.101 826 HA ARG 102 HA ARG 102 10.864 13.592 -0.048 827 HB2 ARG 102 HB2 ARG 102 9.389 13.513 2.615 828 HB3 ARG 102 HB3 ARG 102 10.736 12.461 2.185 829 HG2 ARG 102 HG2 ARG 102 12.259 14.306 2.084 830 HG3 ARG 102 HG3 ARG 102 10.938 15.483 2.287 831 HD2 ARG 102 HD2 ARG 102 10.431 14.564 4.512 832 HD3 ARG 102 HD3 ARG 102 11.765 13.408 4.362 833 HE ARG 102 HE ARG 102 13.144 15.649 4.023 834 HH11 ARG 102 HH11 ARG 102 14.003 17.056 5.483 835 HH12 ARG 102 HH12 ARG 102 13.218 17.325 7.010 836 HH21 ARG 102 HH21 ARG 102 10.587 15.183 6.458 837 HH22 ARG 102 HH22 ARG 102 11.375 16.294 7.542 838 H SER 103 H SER 103 10.521 11.652 -0.832 839 HA SER 103 HA SER 103 8.187 10.132 -0.022 840 HB2 SER 103 HB2 SER 103 7.292 9.645 -2.209 841 HB3 SER 103 HB3 SER 103 7.392 11.401 -2.035 842 HG SER 103 HG SER 103 9.481 11.207 -3.147 843 H ALA 104 H ALA 104 8.154 7.896 -0.554 844 HA ALA 104 HA ALA 104 10.476 6.704 -1.921 845 HB1 ALA 104 HB1 ALA 104 9.652 5.906 0.908 846 HB2 ALA 104 HB2 ALA 104 10.853 5.073 -0.100 847 HB3 ALA 104 HB3 ALA 104 11.164 6.728 0.459 848 H PHE 105 H PHE 105 9.994 4.748 -2.911 849 HA PHE 105 HA PHE 105 7.155 3.830 -2.867 850 HB2 PHE 105 HB2 PHE 105 9.476 3.244 -4.721 851 HB3 PHE 105 HB3 PHE 105 7.995 2.306 -4.708 852 HD1 PHE 105 HD1 PHE 105 5.835 3.265 -5.404 853 HD2 PHE 105 HD2 PHE 105 9.486 5.534 -5.680 854 HE1 PHE 105 HE1 PHE 105 4.748 4.788 -7.022 855 HE2 PHE 105 HE2 PHE 105 8.388 7.089 -7.279 856 HZ PHE 105 HZ PHE 105 6.029 6.702 -7.973 857 H ILE 106 H ILE 106 6.645 2.339 -1.423 858 HA ILE 106 HA ILE 106 8.690 0.299 -0.618 859 HB ILE 106 HB ILE 106 7.772 0.126 1.538 860 HG12 ILE 106 HG12 ILE 106 5.747 2.304 0.882 861 HG13 ILE 106 HG13 ILE 106 5.372 0.588 1.042 862 HG21 ILE 106 HG21 ILE 106 8.144 3.089 0.959 863 HG22 ILE 106 HG22 ILE 106 8.511 2.233 2.473 864 HG23 ILE 106 HG23 ILE 106 9.471 1.907 1.026 865 HD11 ILE 106 HD11 ILE 106 6.370 2.364 3.289 866 HD12 ILE 106 HD12 ILE 106 4.756 1.666 3.083 867 HD13 ILE 106 HD13 ILE 106 6.141 0.607 3.393 868 H GLY 107 H GLY 107 8.098 -1.837 -0.486 869 HA2 GLY 107 HA2 GLY 107 5.631 -2.607 -1.958 870 HA3 GLY 107 HA3 GLY 107 7.017 -3.643 -1.616 871 H ILE 108 H ILE 108 4.054 -3.830 -1.025 872 HA ILE 108 HA ILE 108 4.386 -4.733 1.758 873 HB ILE 108 HB ILE 108 2.055 -4.245 2.280 874 HG12 ILE 108 HG12 ILE 108 2.019 -2.417 -0.162 875 HG13 ILE 108 HG13 ILE 108 1.194 -3.973 -0.071 876 HG21 ILE 108 HG21 ILE 108 3.908 -2.872 3.062 877 HG22 ILE 108 HG22 ILE 108 3.741 -1.793 1.658 878 HG23 ILE 108 HG23 ILE 108 2.444 -1.908 2.866 879 HD11 ILE 108 HD11 ILE 108 0.580 -1.545 1.661 880 HD12 ILE 108 HD12 ILE 108 -0.413 -2.238 0.371 881 HD13 ILE 108 HD13 ILE 108 -0.147 -3.151 1.869 882 H GLY 109 H GLY 109 3.594 -6.662 2.274 883 HA2 GLY 109 HA2 GLY 109 2.202 -8.271 0.152 884 HA3 GLY 109 HA3 GLY 109 3.400 -8.937 1.252 885 H PHE 110 H PHE 110 0.542 -9.514 0.660 886 HA PHE 110 HA PHE 110 -0.712 -9.320 3.369 887 HB2 PHE 110 HB2 PHE 110 -1.818 -9.769 0.578 888 HB3 PHE 110 HB3 PHE 110 -2.770 -10.016 2.022 889 HD1 PHE 110 HD1 PHE 110 -4.135 -8.286 2.763 890 HD2 PHE 110 HD2 PHE 110 -0.625 -7.318 0.440 891 HE1 PHE 110 HE1 PHE 110 -4.765 -5.882 2.784 892 HE2 PHE 110 HE2 PHE 110 -1.203 -4.924 0.572 893 HZ PHE 110 HZ PHE 110 -3.300 -4.207 1.679 894 H THR 111 H THR 111 -2.059 -11.248 3.963 895 HA THR 111 HA THR 111 -0.440 -13.655 3.917 896 HB THR 111 HB THR 111 -1.722 -12.943 5.871 897 HG1 THR 111 HG1 THR 111 -2.426 -14.999 6.383 898 HG21 THR 111 HG21 THR 111 -4.107 -13.326 6.086 899 HG22 THR 111 HG22 THR 111 -3.840 -12.174 4.773 900 HG23 THR 111 HG23 THR 111 -4.231 -13.870 4.404 901 H ASP 112 H ASP 112 -3.361 -12.618 2.143 902 HA ASP 112 HA ASP 112 -3.030 -14.863 0.285 903 HB2 ASP 112 HB2 ASP 112 -4.453 -15.706 2.210 904 HB3 ASP 112 HB3 ASP 112 -5.647 -14.476 1.799 905 H ARG 113 H ARG 113 -4.211 -14.639 -1.667 906 HA ARG 113 HA ARG 113 -4.489 -11.996 -2.751 907 HB2 ARG 113 HB2 ARG 113 -5.680 -14.647 -3.716 908 HB3 ARG 113 HB3 ARG 113 -5.562 -13.151 -4.666 909 HG2 ARG 113 HG2 ARG 113 -3.112 -13.177 -4.379 910 HG3 ARG 113 HG3 ARG 113 -3.241 -14.712 -3.494 911 HD2 ARG 113 HD2 ARG 113 -4.167 -15.821 -5.469 912 HD3 ARG 113 HD3 ARG 113 -4.147 -14.298 -6.377 913 HE ARG 113 HE ARG 113 -1.495 -14.760 -5.480 914 HH11 ARG 113 HH11 ARG 113 0.063 -15.617 -6.702 915 HH12 ARG 113 HH12 ARG 113 -0.310 -16.618 -8.090 916 HH21 ARG 113 HH21 ARG 113 -3.719 -16.329 -7.702 917 HH22 ARG 113 HH22 ARG 113 -2.420 -17.016 -8.639 918 H GLY 114 H GLY 114 -6.860 -14.197 -1.301 919 HA2 GLY 114 HA2 GLY 114 -9.175 -12.695 -2.021 920 HA3 GLY 114 HA3 GLY 114 -9.040 -13.918 -0.742 921 H ASP 115 H ASP 115 -6.733 -11.992 0.321 922 HA ASP 115 HA ASP 115 -8.523 -10.017 1.715 923 HB2 ASP 115 HB2 ASP 115 -6.053 -11.490 2.591 924 HB3 ASP 115 HB3 ASP 115 -6.300 -9.846 3.167 925 H ALA 116 H ALA 116 -5.514 -10.296 -0.208 926 HA ALA 116 HA ALA 116 -4.964 -7.480 -0.312 927 HB1 ALA 116 HB1 ALA 116 -4.470 -9.763 -2.251 928 HB2 ALA 116 HB2 ALA 116 -3.737 -8.162 -2.386 929 HB3 ALA 116 HB3 ALA 116 -3.377 -9.173 -0.972 930 H PHE 117 H PHE 117 -7.225 -9.512 -2.202 931 HA PHE 117 HA PHE 117 -8.144 -7.581 -4.051 932 HB2 PHE 117 HB2 PHE 117 -9.325 -9.990 -2.732 933 HB3 PHE 117 HB3 PHE 117 -10.447 -8.840 -3.424 934 HD1 PHE 117 HD1 PHE 117 -7.047 -9.922 -4.716 935 HD2 PHE 117 HD2 PHE 117 -11.314 -9.782 -5.355 936 HE1 PHE 117 HE1 PHE 117 -6.743 -10.881 -6.977 937 HE2 PHE 117 HE2 PHE 117 -10.999 -10.738 -7.622 938 HZ PHE 117 HZ PHE 117 -8.714 -11.292 -8.438 939 H ASP 118 H ASP 118 -8.800 -7.717 -0.551 940 HA ASP 118 HA ASP 118 -10.953 -5.795 -0.602 941 HB2 ASP 118 HB2 ASP 118 -10.303 -7.577 1.172 942 HB3 ASP 118 HB3 ASP 118 -9.107 -6.400 1.717 943 H PHE 119 H PHE 119 -7.406 -5.509 -0.354 944 HA PHE 119 HA PHE 119 -7.241 -2.688 0.239 945 HB2 PHE 119 HB2 PHE 119 -5.356 -4.105 0.554 946 HB3 PHE 119 HB3 PHE 119 -5.355 -4.632 -1.112 947 HD1 PHE 119 HD1 PHE 119 -4.112 -2.124 1.179 948 HD2 PHE 119 HD2 PHE 119 -4.721 -3.082 -2.976 949 HE1 PHE 119 HE1 PHE 119 -2.577 -0.315 0.541 950 HE2 PHE 119 HE2 PHE 119 -3.164 -1.273 -3.619 951 HZ PHE 119 HZ PHE 119 -2.082 0.130 -1.864 952 H ASN 120 H ASN 120 -7.231 -4.436 -2.918 953 HA ASN 120 HA ASN 120 -7.267 -1.873 -4.316 954 HB2 ASN 120 HB2 ASN 120 -7.282 -3.131 -6.378 955 HB3 ASN 120 HB3 ASN 120 -6.019 -3.678 -5.282 956 HD21 ASN 120 HD21 ASN 120 -9.059 -6.252 -6.276 957 HD22 ASN 120 HD22 ASN 120 -9.376 -4.533 -6.392 958 H VAL 121 H VAL 121 -9.865 -4.067 -3.348 959 HA VAL 121 HA VAL 121 -11.843 -2.708 -5.017 960 HB VAL 121 HB VAL 121 -12.082 -4.687 -2.740 961 HG11 VAL 121 HG11 VAL 121 -14.499 -4.870 -3.344 962 HG12 VAL 121 HG12 VAL 121 -14.109 -3.319 -2.606 963 HG13 VAL 121 HG13 VAL 121 -14.335 -3.427 -4.368 964 HG21 VAL 121 HG21 VAL 121 -11.303 -5.539 -4.969 965 HG22 VAL 121 HG22 VAL 121 -12.888 -6.176 -4.533 966 HG23 VAL 121 HG23 VAL 121 -12.756 -4.859 -5.721 967 H SER 122 H SER 122 -10.883 -2.422 -1.533 968 HA SER 122 HA SER 122 -12.897 -0.488 -0.925 969 HB2 SER 122 HB2 SER 122 -11.606 -0.006 1.069 970 HB3 SER 122 HB3 SER 122 -11.698 -1.754 0.794 971 HG SER 122 HG SER 122 -9.654 -1.810 0.181 972 H LEU 123 H LEU 123 -9.649 -0.052 -2.303 973 HA LEU 123 HA LEU 123 -9.722 2.838 -2.328 974 HB2 LEU 123 HB2 LEU 123 -8.176 0.750 -3.890 975 HB3 LEU 123 HB3 LEU 123 -7.980 2.476 -4.190 976 HG LEU 123 HG LEU 123 -7.481 1.177 -1.475 977 HD11 LEU 123 HD11 LEU 123 -5.100 1.420 -2.013 978 HD12 LEU 123 HD12 LEU 123 -5.892 0.371 -3.191 979 HD13 LEU 123 HD13 LEU 123 -5.506 2.049 -3.629 980 HD21 LEU 123 HD21 LEU 123 -7.987 3.587 -1.294 981 HD22 LEU 123 HD22 LEU 123 -6.282 3.282 -0.989 982 HD23 LEU 123 HD23 LEU 123 -6.787 3.945 -2.558 983 H GLN 124 H GLN 124 -10.458 0.480 -5.002 984 HA GLN 124 HA GLN 124 -11.233 2.608 -6.745 985 HB2 GLN 124 HB2 GLN 124 -11.743 0.998 -8.335 986 HB3 GLN 124 HB3 GLN 124 -10.468 0.265 -7.358 987 HG2 GLN 124 HG2 GLN 124 -12.280 -0.945 -6.085 988 HG3 GLN 124 HG3 GLN 124 -13.437 -0.376 -7.291 989 HE21 GLN 124 HE21 GLN 124 -10.596 -3.166 -8.406 990 HE22 GLN 124 HE22 GLN 124 -10.299 -2.119 -7.003 991 H ASP 125 H ASP 125 -13.147 0.822 -4.362 992 HA ASP 125 HA ASP 125 -15.672 1.915 -5.332 993 HB2 ASP 125 HB2 ASP 125 -15.461 -0.372 -4.359 994 HB3 ASP 125 HB3 ASP 125 -15.073 0.360 -2.796 995 H HIS 126 H HIS 126 -13.134 3.257 -3.563 996 HA HIS 126 HA HIS 126 -14.963 5.320 -2.447 997 HB2 HIS 126 HB2 HIS 126 -12.990 4.740 -1.071 998 HB3 HIS 126 HB3 HIS 126 -11.923 5.238 -2.391 999 HD2 HIS 126 HD2 HIS 126 -11.783 7.896 -2.947 1000 HE1 HIS 126 HE1 HIS 126 -14.182 9.291 0.292 1001 HE2 HIS 126 HE2 HIS 126 -12.676 10.007 -1.628 1002 H PHE 127 H PHE 127 -12.536 4.862 -5.040 1003 HA PHE 127 HA PHE 127 -12.909 7.610 -5.948 1004 HB2 PHE 127 HB2 PHE 127 -11.211 5.278 -6.879 1005 HB3 PHE 127 HB3 PHE 127 -11.277 6.797 -7.755 1006 HD1 PHE 127 HD1 PHE 127 -10.991 8.997 -6.260 1007 HD2 PHE 127 HD2 PHE 127 -9.454 5.093 -5.282 1008 HE1 PHE 127 HE1 PHE 127 -9.165 10.042 -4.943 1009 HE2 PHE 127 HE2 PHE 127 -7.623 6.137 -3.979 1010 HZ PHE 127 HZ PHE 127 -7.473 8.615 -3.819 1011 H LYS 128 H LYS 128 -14.746 4.823 -6.740 1012 HA LYS 128 HA LYS 128 -15.068 4.999 -9.412 1013 HB2 LYS 128 HB2 LYS 128 -17.084 3.881 -9.341 1014 HB3 LYS 128 HB3 LYS 128 -16.125 3.302 -7.999 1015 HG2 LYS 128 HG2 LYS 128 -18.421 5.315 -7.770 1016 HG3 LYS 128 HG3 LYS 128 -18.550 3.572 -7.536 1017 HD2 LYS 128 HD2 LYS 128 -16.834 3.742 -5.704 1018 HD3 LYS 128 HD3 LYS 128 -16.894 5.500 -5.859 1019 HE2 LYS 128 HE2 LYS 128 -18.293 4.961 -4.056 1020 HE3 LYS 128 HE3 LYS 128 -19.347 5.420 -5.405 1021 HZ1 LYS 128 HZ1 LYS 128 -20.094 3.387 -4.208 1022 HZ2 LYS 128 HZ2 LYS 128 -19.785 3.055 -5.775 1023 HZ3 LYS 128 HZ3 LYS 128 -18.720 2.600 -4.621 1024 H TRP 129 H TRP 129 -16.588 7.334 -7.261 1025 HA TRP 129 HA TRP 129 -18.141 8.601 -9.389 1026 HB2 TRP 129 HB2 TRP 129 -18.715 10.252 -7.727 1027 HB3 TRP 129 HB3 TRP 129 -18.879 8.643 -7.046 1028 HD1 TRP 129 HD1 TRP 129 -16.906 7.869 -5.305 1029 HE1 TRP 129 HE1 TRP 129 -15.352 9.172 -3.784 1030 HE3 TRP 129 HE3 TRP 129 -17.602 12.555 -7.272 1031 HZ2 TRP 129 HZ2 TRP 129 -14.768 11.964 -3.215 1032 HZ3 TRP 129 HZ3 TRP 129 -16.571 14.530 -6.173 1033 HH2 TRP 129 HH2 TRP 129 -15.182 14.252 -4.135 1034 H VAL 130 H VAL 130 -14.955 9.163 -7.934 1035 HA VAL 130 HA VAL 130 -14.343 11.620 -9.347 1036 HB VAL 130 HB VAL 130 -12.365 9.566 -8.287 1037 HG11 VAL 130 HG11 VAL 130 -11.353 11.306 -9.716 1038 HG12 VAL 130 HG12 VAL 130 -12.136 12.572 -8.743 1039 HG13 VAL 130 HG13 VAL 130 -10.886 11.527 -8.031 1040 HG21 VAL 130 HG21 VAL 130 -13.759 11.848 -6.830 1041 HG22 VAL 130 HG22 VAL 130 -13.804 10.120 -6.417 1042 HG23 VAL 130 HG23 VAL 130 -12.305 11.026 -6.227 1043 H LYS 131 H LYS 131 -13.992 8.181 -10.001 1044 HA LYS 131 HA LYS 131 -12.770 8.486 -12.631 1045 HB2 LYS 131 HB2 LYS 131 -13.992 6.086 -11.205 1046 HB3 LYS 131 HB3 LYS 131 -13.060 5.984 -12.696 1047 HG2 LYS 131 HG2 LYS 131 -11.018 6.598 -11.611 1048 HG3 LYS 131 HG3 LYS 131 -11.842 7.156 -10.164 1049 HD2 LYS 131 HD2 LYS 131 -10.866 5.030 -9.641 1050 HD3 LYS 131 HD3 LYS 131 -12.612 4.861 -9.663 1051 HE2 LYS 131 HE2 LYS 131 -11.745 2.929 -10.722 1052 HE3 LYS 131 HE3 LYS 131 -12.460 3.914 -11.997 1053 HZ1 LYS 131 HZ1 LYS 131 -9.563 3.856 -11.320 1054 HZ2 LYS 131 HZ2 LYS 131 -10.234 3.031 -12.575 1055 HZ3 LYS 131 HZ3 LYS 131 -10.222 4.665 -12.585 1056 H GLN 132 H GLN 132 -15.623 9.339 -11.820 1057 HA GLN 132 HA GLN 132 -17.685 9.654 -12.744 1058 HB2 GLN 132 HB2 GLN 132 -16.100 9.521 -15.302 1059 HB3 GLN 132 HB3 GLN 132 -17.671 10.311 -15.080 1060 HG2 GLN 132 HG2 GLN 132 -16.637 11.886 -13.438 1061 HG3 GLN 132 HG3 GLN 132 -15.058 11.163 -13.753 1062 HE21 GLN 132 HE21 GLN 132 -15.058 14.138 -15.872 1063 HE22 GLN 132 HE22 GLN 132 -14.906 13.719 -14.170 1064 H GLU 133 H GLU 133 -17.156 6.944 -12.251 1065 HA GLU 133 HA GLU 133 -18.545 5.395 -14.309 1066 HB2 GLU 133 HB2 GLU 133 -17.668 4.559 -11.521 1067 HB3 GLU 133 HB3 GLU 133 -18.330 3.491 -12.758 1068 HG2 GLU 133 HG2 GLU 133 -16.410 4.103 -14.264 1069 HG3 GLU 133 HG3 GLU 133 -15.712 5.042 -12.941 Start of MODEL 2 1 H1 GLY -4 H1 GLY -4 -6.081 35.737 14.832 2 H2 GLY -4 H2 GLY -4 -5.815 34.929 16.231 3 H3 GLY -4 H3 GLY -4 -7.249 34.768 15.454 4 HA2 GLY -4 HA2 GLY -4 -5.898 32.807 15.104 5 HA3 GLY -4 HA3 GLY -4 -6.208 33.675 13.590 6 H SER -3 H SER -3 -4.041 31.875 14.006 7 HA SER -3 HA SER -3 -1.590 33.150 14.660 8 HB2 SER -3 HB2 SER -3 -2.083 30.750 12.862 9 HB3 SER -3 HB3 SER -3 -0.530 31.209 13.587 10 HG SER -3 HG SER -3 -1.642 29.618 14.830 11 HA PRO -2 HA PRO -2 -0.757 35.405 10.887 12 HB2 PRO -2 HB2 PRO -2 1.879 36.010 11.163 13 HB3 PRO -2 HB3 PRO -2 0.627 36.663 12.263 14 HG2 PRO -2 HG2 PRO -2 2.410 34.244 12.709 15 HG3 PRO -2 HG3 PRO -2 2.129 35.625 13.817 16 HD2 PRO -2 HD2 PRO -2 0.747 33.279 14.042 17 HD3 PRO -2 HD3 PRO -2 -0.019 34.859 14.385 18 H ASN -1 H ASN -1 0.480 32.274 11.398 19 HA ASN -1 HA ASN -1 1.168 31.937 8.541 20 HB2 ASN -1 HB2 ASN -1 3.217 30.776 9.021 21 HB3 ASN -1 HB3 ASN -1 3.299 32.328 9.840 22 HD21 ASN -1 HD21 ASN -1 3.494 30.827 13.071 23 HD22 ASN -1 HD22 ASN -1 3.415 32.329 12.161 24 H SER 0 H SER 0 1.314 29.602 7.952 25 HA SER 0 HA SER 0 -1.105 28.292 8.923 26 HB2 SER 0 HB2 SER 0 0.698 27.561 6.597 27 HB3 SER 0 HB3 SER 0 -0.949 26.973 6.895 28 HG SER 0 HG SER 0 -0.911 28.711 5.393 29 H MET 1 H MET 1 1.884 27.928 10.212 30 HA MET 1 HA MET 1 2.151 25.018 10.029 31 HB2 MET 1 HB2 MET 1 3.792 26.982 11.657 32 HB3 MET 1 HB3 MET 1 4.180 25.300 11.322 33 HG2 MET 1 HG2 MET 1 4.014 27.566 9.307 34 HG3 MET 1 HG3 MET 1 5.469 26.773 9.881 35 HE1 MET 1 HE1 MET 1 4.750 23.626 9.758 36 HE2 MET 1 HE2 MET 1 5.360 23.276 8.129 37 HE3 MET 1 HE3 MET 1 6.266 24.372 9.195 38 H ALA 2 H ALA 2 -0.185 25.023 10.938 39 HA ALA 2 HA ALA 2 -0.227 24.876 13.923 40 HB1 ALA 2 HB1 ALA 2 -1.836 26.405 12.843 41 HB2 ALA 2 HB2 ALA 2 -2.490 25.052 11.890 42 HB3 ALA 2 HB3 ALA 2 -2.661 25.063 13.658 43 H THR 3 H THR 3 0.009 22.895 11.197 44 HA THR 3 HA THR 3 -0.296 20.732 10.677 45 HB THR 3 HB THR 3 0.293 20.069 13.562 46 HG1 THR 3 HG1 THR 3 1.790 21.611 12.913 47 HG21 THR 3 HG21 THR 3 -0.200 18.214 11.971 48 HG22 THR 3 HG22 THR 3 1.026 18.857 10.859 49 HG23 THR 3 HG23 THR 3 1.512 18.210 12.451 50 H GLU 4 H GLU 4 -2.503 21.276 10.309 51 HA GLU 4 HA GLU 4 -4.462 20.433 12.338 52 HB2 GLU 4 HB2 GLU 4 -5.949 21.969 11.286 53 HB3 GLU 4 HB3 GLU 4 -4.374 22.720 11.576 54 HG2 GLU 4 HG2 GLU 4 -3.766 22.489 9.212 55 HG3 GLU 4 HG3 GLU 4 -5.271 21.635 8.869 56 H LEU 5 H LEU 5 -3.181 18.494 10.403 57 HA LEU 5 HA LEU 5 -5.348 17.448 8.797 58 HB2 LEU 5 HB2 LEU 5 -2.693 17.407 8.531 59 HB3 LEU 5 HB3 LEU 5 -2.842 15.867 9.361 60 HG LEU 5 HG LEU 5 -4.286 16.720 6.816 61 HD11 LEU 5 HD11 LEU 5 -2.751 15.179 5.653 62 HD12 LEU 5 HD12 LEU 5 -1.859 16.455 6.494 63 HD13 LEU 5 HD13 LEU 5 -1.933 14.820 7.191 64 HD21 LEU 5 HD21 LEU 5 -5.598 14.968 7.938 65 HD22 LEU 5 HD22 LEU 5 -4.819 14.307 6.504 66 HD23 LEU 5 HD23 LEU 5 -4.144 13.962 8.113 67 H GLU 6 H GLU 6 -6.491 17.638 11.109 68 HA GLU 6 HA GLU 6 -6.413 15.080 12.612 69 HB2 GLU 6 HB2 GLU 6 -6.284 17.370 13.706 70 HB3 GLU 6 HB3 GLU 6 -7.984 17.585 13.290 71 HG2 GLU 6 HG2 GLU 6 -8.515 15.509 14.622 72 HG3 GLU 6 HG3 GLU 6 -6.802 15.330 14.986 73 H TYR 7 H TYR 7 -7.255 14.409 10.229 74 HA TYR 7 HA TYR 7 -10.118 13.790 10.452 75 HB2 TYR 7 HB2 TYR 7 -10.710 14.735 8.324 76 HB3 TYR 7 HB3 TYR 7 -10.089 16.007 9.341 77 HD1 TYR 7 HD1 TYR 7 -9.131 13.699 6.521 78 HD2 TYR 7 HD2 TYR 7 -8.310 17.414 8.570 79 HE1 TYR 7 HE1 TYR 7 -7.645 14.365 4.684 80 HE2 TYR 7 HE2 TYR 7 -6.791 18.082 6.707 81 HH TYR 7 HH TYR 7 -6.230 15.970 3.860 82 H GLU 8 H GLU 8 -10.645 11.886 9.434 83 HA GLU 8 HA GLU 8 -9.453 10.861 7.135 84 HB2 GLU 8 HB2 GLU 8 -8.331 8.826 8.096 85 HB3 GLU 8 HB3 GLU 8 -7.467 10.309 8.424 86 HG2 GLU 8 HG2 GLU 8 -8.591 10.275 10.759 87 HG3 GLU 8 HG3 GLU 8 -9.106 8.633 10.348 88 H SER 9 H SER 9 -11.085 9.772 6.269 89 HA SER 9 HA SER 9 -13.095 8.391 7.972 90 HB2 SER 9 HB2 SER 9 -12.945 8.970 4.995 91 HB3 SER 9 HB3 SER 9 -14.179 7.931 5.732 92 HG SER 9 HG SER 9 -15.060 9.930 5.626 93 H VAL 10 H VAL 10 -12.349 6.402 8.616 94 HA VAL 10 HA VAL 10 -10.475 4.741 7.182 95 HB VAL 10 HB VAL 10 -12.512 3.898 9.284 96 HG11 VAL 10 HG11 VAL 10 -10.848 2.100 9.789 97 HG12 VAL 10 HG12 VAL 10 -11.557 1.924 8.190 98 HG13 VAL 10 HG13 VAL 10 -9.911 2.589 8.360 99 HG21 VAL 10 HG21 VAL 10 -11.029 5.710 10.135 100 HG22 VAL 10 HG22 VAL 10 -10.690 4.163 10.908 101 HG23 VAL 10 HG23 VAL 10 -9.609 4.767 9.630 102 H LEU 11 H LEU 11 -10.654 2.974 5.901 103 HA LEU 11 HA LEU 11 -13.319 2.401 4.643 104 HB2 LEU 11 HB2 LEU 11 -10.639 2.748 3.240 105 HB3 LEU 11 HB3 LEU 11 -12.148 2.229 2.495 106 HG LEU 11 HG LEU 11 -11.645 4.992 3.653 107 HD11 LEU 11 HD11 LEU 11 -11.831 5.591 1.201 108 HD12 LEU 11 HD12 LEU 11 -10.384 4.666 1.619 109 HD13 LEU 11 HD13 LEU 11 -11.754 3.865 0.823 110 HD21 LEU 11 HD21 LEU 11 -14.027 3.870 2.099 111 HD22 LEU 11 HD22 LEU 11 -14.046 4.388 3.801 112 HD23 LEU 11 HD23 LEU 11 -13.776 5.578 2.525 113 H CYS 12 H CYS 12 -9.973 1.184 5.174 114 HA CYS 12 HA CYS 12 -11.065 -1.518 5.639 115 HB2 CYS 12 HB2 CYS 12 -10.509 -1.394 3.183 116 HB3 CYS 12 HB3 CYS 12 -8.819 -1.068 3.643 117 HG CYS 12 HG CYS 12 -9.132 -3.571 2.851 118 H VAL 13 H VAL 13 -10.043 -2.512 7.211 119 HA VAL 13 HA VAL 13 -7.260 -1.754 7.940 120 HB VAL 13 HB VAL 13 -9.554 -2.178 9.875 121 HG11 VAL 13 HG11 VAL 13 -6.583 -1.797 10.472 122 HG12 VAL 13 HG12 VAL 13 -7.891 -1.768 11.672 123 HG13 VAL 13 HG13 VAL 13 -7.539 -3.262 10.804 124 HG21 VAL 13 HG21 VAL 13 -8.989 0.101 10.641 125 HG22 VAL 13 HG22 VAL 13 -7.718 0.202 9.404 126 HG23 VAL 13 HG23 VAL 13 -9.425 0.111 8.928 127 H LYS 14 H LYS 14 -5.943 -3.395 7.985 128 HA LYS 14 HA LYS 14 -6.935 -6.155 8.499 129 HB2 LYS 14 HB2 LYS 14 -4.789 -5.453 6.459 130 HB3 LYS 14 HB3 LYS 14 -5.244 -7.070 6.937 131 HG2 LYS 14 HG2 LYS 14 -7.161 -5.108 5.596 132 HG3 LYS 14 HG3 LYS 14 -6.191 -6.313 4.747 133 HD2 LYS 14 HD2 LYS 14 -7.283 -8.125 6.024 134 HD3 LYS 14 HD3 LYS 14 -8.308 -6.932 6.855 135 HE2 LYS 14 HE2 LYS 14 -9.328 -6.254 4.755 136 HE3 LYS 14 HE3 LYS 14 -8.202 -7.269 3.837 137 HZ1 LYS 14 HZ1 LYS 14 -10.221 -8.305 5.755 138 HZ2 LYS 14 HZ2 LYS 14 -10.325 -8.397 4.118 139 HZ3 LYS 14 HZ3 LYS 14 -9.147 -9.220 4.908 140 HA PRO 15 HA PRO 15 -4.211 -5.643 11.827 141 HB2 PRO 15 HB2 PRO 15 -3.876 -8.211 12.745 142 HB3 PRO 15 HB3 PRO 15 -5.405 -7.280 12.899 143 HG2 PRO 15 HG2 PRO 15 -4.651 -9.319 10.778 144 HG3 PRO 15 HG3 PRO 15 -6.179 -9.214 11.718 145 HD2 PRO 15 HD2 PRO 15 -5.996 -8.220 9.212 146 HD3 PRO 15 HD3 PRO 15 -6.911 -7.345 10.480 147 H ASP 16 H ASP 16 -3.070 -7.980 9.392 148 HA ASP 16 HA ASP 16 -0.269 -7.362 10.171 149 HB2 ASP 16 HB2 ASP 16 -1.043 -9.498 11.233 150 HB3 ASP 16 HB3 ASP 16 -1.212 -10.165 9.603 151 H VAL 17 H VAL 17 0.583 -6.463 8.590 152 HA VAL 17 HA VAL 17 0.719 -7.674 5.899 153 HB VAL 17 HB VAL 17 -1.084 -5.909 5.959 154 HG11 VAL 17 HG11 VAL 17 1.243 -3.938 6.139 155 HG12 VAL 17 HG12 VAL 17 -0.458 -3.546 5.837 156 HG13 VAL 17 HG13 VAL 17 0.023 -4.220 7.398 157 HG21 VAL 17 HG21 VAL 17 -0.074 -6.616 3.858 158 HG22 VAL 17 HG22 VAL 17 -0.443 -4.893 3.818 159 HG23 VAL 17 HG23 VAL 17 1.235 -5.423 4.047 160 H SER 18 H SER 18 2.655 -7.186 4.807 161 HA SER 18 HA SER 18 4.857 -6.343 6.673 162 HB2 SER 18 HB2 SER 18 4.846 -8.533 4.583 163 HB3 SER 18 HB3 SER 18 6.182 -8.114 5.680 164 HG SER 18 HG SER 18 4.865 -9.911 6.398 165 H VAL 19 H VAL 19 6.382 -4.974 6.008 166 HA VAL 19 HA VAL 19 6.287 -3.874 3.239 167 HB VAL 19 HB VAL 19 7.432 -2.761 5.796 168 HG11 VAL 19 HG11 VAL 19 7.900 -0.686 4.445 169 HG12 VAL 19 HG12 VAL 19 8.956 -2.034 4.043 170 HG13 VAL 19 HG13 VAL 19 7.603 -1.627 2.961 171 HG21 VAL 19 HG21 VAL 19 5.763 -1.087 5.619 172 HG22 VAL 19 HG22 VAL 19 5.338 -1.549 3.962 173 HG23 VAL 19 HG23 VAL 19 4.899 -2.600 5.323 174 H TYR 20 H TYR 20 7.769 -3.910 1.877 175 HA TYR 20 HA TYR 20 10.494 -4.823 2.629 176 HB2 TYR 20 HB2 TYR 20 9.386 -5.497 -0.068 177 HB3 TYR 20 HB3 TYR 20 10.695 -6.240 0.847 178 HD1 TYR 20 HD1 TYR 20 7.184 -6.330 -0.005 179 HD2 TYR 20 HD2 TYR 20 10.099 -7.740 2.829 180 HE1 TYR 20 HE1 TYR 20 5.604 -8.098 0.720 181 HE2 TYR 20 HE2 TYR 20 8.520 -9.526 3.561 182 HH TYR 20 HH TYR 20 5.241 -9.874 2.181 183 H ARG 21 H ARG 21 11.984 -3.506 1.996 184 HA ARG 21 HA ARG 21 11.811 -1.428 -0.048 185 HB2 ARG 21 HB2 ARG 21 14.089 -3.045 1.159 186 HB3 ARG 21 HB3 ARG 21 14.377 -2.071 -0.265 187 HG2 ARG 21 HG2 ARG 21 13.430 -1.051 2.440 188 HG3 ARG 21 HG3 ARG 21 15.023 -0.838 1.710 189 HD2 ARG 21 HD2 ARG 21 12.423 0.510 1.096 190 HD3 ARG 21 HD3 ARG 21 14.005 1.235 1.383 191 HE ARG 21 HE ARG 21 14.529 0.027 -0.954 192 HH11 ARG 21 HH11 ARG 21 13.700 0.158 -3.091 193 HH12 ARG 21 HH12 ARG 21 12.394 1.274 -3.377 194 HH21 ARG 21 HH21 ARG 21 11.846 2.078 -0.119 195 HH22 ARG 21 HH22 ARG 21 11.187 2.061 -1.743 196 H ILE 22 H ILE 22 11.952 -1.508 -2.171 197 HA ILE 22 HA ILE 22 12.041 -4.157 -3.525 198 HB ILE 22 HB ILE 22 10.739 -3.203 -5.317 199 HG12 ILE 22 HG12 ILE 22 10.632 -0.616 -3.709 200 HG13 ILE 22 HG13 ILE 22 11.458 -0.861 -5.254 201 HG21 ILE 22 HG21 ILE 22 9.682 -4.230 -3.252 202 HG22 ILE 22 HG22 ILE 22 9.337 -2.585 -2.698 203 HG23 ILE 22 HG23 ILE 22 8.632 -3.188 -4.217 204 HD11 ILE 22 HD11 ILE 22 9.195 -1.492 -6.243 205 HD12 ILE 22 HD12 ILE 22 8.472 -0.888 -4.735 206 HD13 ILE 22 HD13 ILE 22 9.400 0.211 -5.765 207 HA PRO 23 HA PRO 23 15.708 -2.805 -5.718 208 HB2 PRO 23 HB2 PRO 23 15.616 -4.332 -7.987 209 HB3 PRO 23 HB3 PRO 23 15.934 -5.027 -6.369 210 HG2 PRO 23 HG2 PRO 23 13.284 -4.882 -7.849 211 HG3 PRO 23 HG3 PRO 23 14.046 -6.313 -7.081 212 HD2 PRO 23 HD2 PRO 23 12.160 -4.832 -5.808 213 HD3 PRO 23 HD3 PRO 23 13.537 -5.538 -4.912 214 HA PRO 24 HA PRO 24 14.472 0.389 -8.568 215 HB2 PRO 24 HB2 PRO 24 16.479 0.456 -10.465 216 HB3 PRO 24 HB3 PRO 24 16.638 1.083 -8.796 217 HG2 PRO 24 HG2 PRO 24 17.490 -1.632 -9.851 218 HG3 PRO 24 HG3 PRO 24 18.434 -0.487 -8.844 219 HD2 PRO 24 HD2 PRO 24 17.137 -2.577 -7.734 220 HD3 PRO 24 HD3 PRO 24 17.144 -0.988 -6.916 221 H ARG 25 H ARG 25 12.986 0.478 -10.110 222 HA ARG 25 HA ARG 25 12.118 -1.926 -11.435 223 HB2 ARG 25 HB2 ARG 25 10.685 0.004 -10.533 224 HB3 ARG 25 HB3 ARG 25 11.167 0.905 -11.960 225 HG2 ARG 25 HG2 ARG 25 10.152 -1.656 -12.861 226 HG3 ARG 25 HG3 ARG 25 9.057 -1.080 -11.633 227 HD2 ARG 25 HD2 ARG 25 9.968 0.583 -14.019 228 HD3 ARG 25 HD3 ARG 25 8.484 -0.363 -13.986 229 HE ARG 25 HE ARG 25 8.978 2.191 -12.635 230 HH11 ARG 25 HH11 ARG 25 7.365 3.132 -11.375 231 HH12 ARG 25 HH12 ARG 25 5.946 2.186 -10.961 232 HH21 ARG 25 HH21 ARG 25 6.853 -0.609 -12.647 233 HH22 ARG 25 HH22 ARG 25 5.607 0.246 -11.755 234 H ALA 26 H ALA 26 11.958 -2.434 -13.502 235 HA ALA 26 HA ALA 26 12.187 -0.473 -15.573 236 HB1 ALA 26 HB1 ALA 26 14.132 -2.819 -15.685 237 HB2 ALA 26 HB2 ALA 26 13.813 -1.667 -17.007 238 HB3 ALA 26 HB3 ALA 26 14.555 -1.103 -15.499 239 H SER 27 H SER 27 11.109 -1.195 -17.494 240 HA SER 27 HA SER 27 8.903 -2.900 -17.142 241 HB2 SER 27 HB2 SER 27 10.139 -1.939 -19.747 242 HB3 SER 27 HB3 SER 27 8.467 -2.492 -19.513 243 HG SER 27 HG SER 27 8.634 -0.196 -19.451 244 H ASN 28 H ASN 28 12.081 -3.651 -18.459 245 HA ASN 28 HA ASN 28 11.329 -6.324 -19.420 246 HB2 ASN 28 HB2 ASN 28 14.035 -4.977 -19.009 247 HB3 ASN 28 HB3 ASN 28 13.800 -6.563 -19.734 248 HD21 ASN 28 HD21 ASN 28 13.395 -3.360 -22.098 249 HD22 ASN 28 HD22 ASN 28 14.070 -3.260 -20.480 250 H ARG 29 H ARG 29 11.518 -5.106 -16.366 251 HA ARG 29 HA ARG 29 12.343 -7.692 -15.089 252 HB2 ARG 29 HB2 ARG 29 12.349 -4.947 -13.815 253 HB3 ARG 29 HB3 ARG 29 12.814 -6.480 -13.083 254 HG2 ARG 29 HG2 ARG 29 14.687 -6.690 -14.704 255 HG3 ARG 29 HG3 ARG 29 14.219 -5.138 -15.443 256 HD2 ARG 29 HD2 ARG 29 14.464 -4.033 -13.241 257 HD3 ARG 29 HD3 ARG 29 14.984 -5.579 -12.538 258 HE ARG 29 HE ARG 29 16.767 -5.322 -14.555 259 HH11 ARG 29 HH11 ARG 29 18.695 -4.275 -14.647 260 HH12 ARG 29 HH12 ARG 29 19.001 -2.904 -13.626 261 HH21 ARG 29 HH21 ARG 29 15.937 -2.919 -12.079 262 HH22 ARG 29 HH22 ARG 29 17.486 -2.151 -12.258 263 H GLY 30 H GLY 30 10.229 -4.823 -14.535 264 HA2 GLY 30 HA2 GLY 30 8.183 -4.618 -13.592 265 HA3 GLY 30 HA3 GLY 30 7.855 -6.343 -13.848 266 H TYR 31 H TYR 31 7.196 -4.889 -11.507 267 HA TYR 31 HA TYR 31 8.872 -5.962 -9.343 268 HB2 TYR 31 HB2 TYR 31 6.000 -4.952 -9.388 269 HB3 TYR 31 HB3 TYR 31 6.970 -5.304 -7.967 270 HD1 TYR 31 HD1 TYR 31 9.571 -3.927 -9.460 271 HD2 TYR 31 HD2 TYR 31 5.511 -2.730 -8.523 272 HE1 TYR 31 HE1 TYR 31 10.326 -1.631 -9.157 273 HE2 TYR 31 HE2 TYR 31 6.267 -0.393 -8.309 274 HH TYR 31 HH TYR 31 9.701 0.576 -8.692 275 H ARG 32 H ARG 32 8.796 -8.135 -8.775 276 HA ARG 32 HA ARG 32 6.436 -9.764 -9.674 277 HB2 ARG 32 HB2 ARG 32 7.955 -11.614 -10.172 278 HB3 ARG 32 HB3 ARG 32 8.188 -10.227 -11.212 279 HG2 ARG 32 HG2 ARG 32 9.946 -10.575 -8.772 280 HG3 ARG 32 HG3 ARG 32 10.248 -11.547 -10.208 281 HD2 ARG 32 HD2 ARG 32 9.995 -8.532 -10.335 282 HD3 ARG 32 HD3 ARG 32 11.532 -9.297 -10.016 283 HE ARG 32 HE ARG 32 10.208 -9.011 -12.554 284 HH11 ARG 32 HH11 ARG 32 11.017 -9.795 -14.357 285 HH12 ARG 32 HH12 ARG 32 12.318 -10.970 -14.358 286 HH21 ARG 32 HH21 ARG 32 12.548 -11.068 -10.897 287 HH22 ARG 32 HH22 ARG 32 13.164 -11.681 -12.415 288 H ALA 33 H ALA 33 7.037 -8.632 -7.042 289 HA ALA 33 HA ALA 33 7.134 -9.047 -4.842 290 HB1 ALA 33 HB1 ALA 33 5.664 -10.819 -4.072 291 HB2 ALA 33 HB2 ALA 33 4.983 -9.989 -5.496 292 HB3 ALA 33 HB3 ALA 33 5.704 -11.588 -5.680 293 H SER 34 H SER 34 8.259 -12.043 -6.484 294 HA SER 34 HA SER 34 9.700 -13.100 -4.283 295 HB2 SER 34 HB2 SER 34 10.558 -14.673 -5.947 296 HB3 SER 34 HB3 SER 34 8.815 -14.388 -6.162 297 HG SER 34 HG SER 34 9.978 -14.329 -8.154 298 H ASP 35 H ASP 35 10.660 -10.619 -6.514 299 HA ASP 35 HA ASP 35 13.525 -10.846 -5.798 300 HB2 ASP 35 HB2 ASP 35 11.923 -9.167 -7.720 301 HB3 ASP 35 HB3 ASP 35 13.477 -8.576 -7.173 302 H TRP 36 H TRP 36 10.888 -9.710 -4.096 303 HA TRP 36 HA TRP 36 12.303 -7.461 -2.806 304 HB2 TRP 36 HB2 TRP 36 9.581 -8.631 -2.190 305 HB3 TRP 36 HB3 TRP 36 10.232 -7.098 -1.669 306 HD1 TRP 36 HD1 TRP 36 11.088 -6.775 -5.095 307 HE1 TRP 36 HE1 TRP 36 9.250 -5.597 -6.468 308 HE3 TRP 36 HE3 TRP 36 7.131 -7.518 -1.949 309 HZ2 TRP 36 HZ2 TRP 36 6.563 -4.667 -5.994 310 HZ3 TRP 36 HZ3 TRP 36 4.923 -6.453 -2.434 311 HH2 TRP 36 HH2 TRP 36 4.646 -5.042 -4.435 312 H LYS 37 H LYS 37 12.008 -7.519 -0.355 313 HA LYS 37 HA LYS 37 13.600 -9.705 0.690 314 HB2 LYS 37 HB2 LYS 37 12.587 -7.125 1.861 315 HB3 LYS 37 HB3 LYS 37 13.450 -8.329 2.809 316 HG2 LYS 37 HG2 LYS 37 15.360 -8.295 1.241 317 HG3 LYS 37 HG3 LYS 37 14.528 -7.050 0.287 318 HD2 LYS 37 HD2 LYS 37 16.054 -5.930 1.698 319 HD3 LYS 37 HD3 LYS 37 14.416 -5.646 2.336 320 HE2 LYS 37 HE2 LYS 37 14.805 -7.352 4.080 321 HE3 LYS 37 HE3 LYS 37 16.438 -7.632 3.451 322 HZ1 LYS 37 HZ1 LYS 37 16.953 -5.309 3.999 323 HZ2 LYS 37 HZ2 LYS 37 15.436 -5.048 4.555 324 HZ3 LYS 37 HZ3 LYS 37 16.428 -6.083 5.339 325 H LEU 38 H LEU 38 11.354 -10.981 -0.017 326 HA LEU 38 HA LEU 38 9.156 -11.011 1.696 327 HB2 LEU 38 HB2 LEU 38 10.282 -13.375 0.150 328 HB3 LEU 38 HB3 LEU 38 8.653 -13.252 0.811 329 HG LEU 38 HG LEU 38 9.849 -11.594 -1.433 330 HD11 LEU 38 HD11 LEU 38 7.495 -13.542 -1.269 331 HD12 LEU 38 HD12 LEU 38 7.988 -12.656 -2.718 332 HD13 LEU 38 HD13 LEU 38 9.074 -13.872 -2.018 333 HD21 LEU 38 HD21 LEU 38 8.455 -10.045 -0.226 334 HD22 LEU 38 HD22 LEU 38 7.510 -10.604 -1.606 335 HD23 LEU 38 HD23 LEU 38 7.198 -11.278 0.011 336 H ASP 39 H ASP 39 12.149 -12.832 2.274 337 HA ASP 39 HA ASP 39 10.949 -14.149 4.639 338 HB2 ASP 39 HB2 ASP 39 12.363 -15.363 2.959 339 HB3 ASP 39 HB3 ASP 39 13.747 -14.430 3.516 340 H GLN 40 H GLN 40 12.206 -11.156 4.139 341 HA GLN 40 HA GLN 40 12.872 -10.740 6.975 342 HB2 GLN 40 HB2 GLN 40 14.943 -9.365 6.213 343 HB3 GLN 40 HB3 GLN 40 15.087 -11.085 6.469 344 HG2 GLN 40 HG2 GLN 40 14.592 -9.946 3.699 345 HG3 GLN 40 HG3 GLN 40 16.202 -9.964 4.398 346 HE21 GLN 40 HE21 GLN 40 15.584 -13.079 2.317 347 HE22 GLN 40 HE22 GLN 40 15.259 -11.389 1.972 348 HA PRO 41 HA PRO 41 10.260 -7.345 5.077 349 HB2 PRO 41 HB2 PRO 41 9.150 -7.503 7.867 350 HB3 PRO 41 HB3 PRO 41 8.285 -7.199 6.342 351 HG2 PRO 41 HG2 PRO 41 8.211 -9.653 7.554 352 HG3 PRO 41 HG3 PRO 41 8.333 -9.526 5.776 353 HD2 PRO 41 HD2 PRO 41 10.522 -10.103 7.777 354 HD3 PRO 41 HD3 PRO 41 10.229 -10.835 6.171 355 H ASP 42 H ASP 42 10.773 -5.222 5.327 356 HA ASP 42 HA ASP 42 12.849 -4.407 7.247 357 HB2 ASP 42 HB2 ASP 42 11.216 -2.834 5.216 358 HB3 ASP 42 HB3 ASP 42 12.559 -2.189 6.166 359 H TRP 43 H TRP 43 9.375 -4.343 7.025 360 HA TRP 43 HA TRP 43 9.155 -3.774 9.886 361 HB2 TRP 43 HB2 TRP 43 9.149 -1.492 9.071 362 HB3 TRP 43 HB3 TRP 43 8.007 -1.880 7.805 363 HD1 TRP 43 HD1 TRP 43 8.188 -0.898 11.434 364 HE1 TRP 43 HE1 TRP 43 5.835 -0.306 12.274 365 HE3 TRP 43 HE3 TRP 43 5.452 -2.801 7.560 366 HZ2 TRP 43 HZ2 TRP 43 3.139 -0.319 11.209 367 HZ3 TRP 43 HZ3 TRP 43 2.984 -2.370 7.441 368 HH2 TRP 43 HH2 TRP 43 1.832 -1.158 9.261 369 H THR 44 H THR 44 7.064 -4.439 10.743 370 HA THR 44 HA THR 44 5.027 -5.311 8.810 371 HB THR 44 HB THR 44 4.404 -7.284 10.001 372 HG1 THR 44 HG1 THR 44 6.767 -6.967 11.529 373 HG21 THR 44 HG21 THR 44 7.359 -7.540 9.390 374 HG22 THR 44 HG22 THR 44 6.105 -8.807 9.331 375 HG23 THR 44 HG23 THR 44 6.073 -7.473 8.166 376 H GLY 45 H GLY 45 2.916 -5.225 9.541 377 HA2 GLY 45 HA2 GLY 45 2.017 -4.599 12.148 378 HA3 GLY 45 HA3 GLY 45 2.401 -3.068 11.372 379 H ARG 46 H ARG 46 0.313 -2.349 11.309 380 HA ARG 46 HA ARG 46 -1.862 -3.983 10.142 381 HB2 ARG 46 HB2 ARG 46 -1.920 -1.264 11.515 382 HB3 ARG 46 HB3 ARG 46 -3.320 -2.234 11.058 383 HG2 ARG 46 HG2 ARG 46 -2.729 -3.960 12.671 384 HG3 ARG 46 HG3 ARG 46 -1.214 -3.138 13.083 385 HD2 ARG 46 HD2 ARG 46 -2.324 -1.312 14.110 386 HD3 ARG 46 HD3 ARG 46 -3.864 -1.692 13.344 387 HE ARG 46 HE ARG 46 -4.007 -3.724 14.764 388 HH11 ARG 46 HH11 ARG 46 -4.583 -4.059 16.861 389 HH12 ARG 46 HH12 ARG 46 -3.886 -3.091 18.122 390 HH21 ARG 46 HH21 ARG 46 -1.901 -1.213 16.064 391 HH22 ARG 46 HH22 ARG 46 -2.531 -1.443 17.674 392 H LEU 47 H LEU 47 -2.960 -3.474 8.380 393 HA LEU 47 HA LEU 47 -2.240 -1.173 6.634 394 HB2 LEU 47 HB2 LEU 47 -2.865 -3.370 5.577 395 HB3 LEU 47 HB3 LEU 47 -4.386 -3.320 6.466 396 HG LEU 47 HG LEU 47 -4.935 -1.147 5.226 397 HD11 LEU 47 HD11 LEU 47 -2.658 -2.094 3.440 398 HD12 LEU 47 HD12 LEU 47 -3.773 -0.743 3.124 399 HD13 LEU 47 HD13 LEU 47 -2.623 -0.637 4.454 400 HD21 LEU 47 HD21 LEU 47 -4.675 -3.722 3.667 401 HD22 LEU 47 HD22 LEU 47 -6.020 -3.234 4.713 402 HD23 LEU 47 HD23 LEU 47 -5.699 -2.341 3.231 403 H ARG 48 H ARG 48 -3.393 0.730 6.752 404 HA ARG 48 HA ARG 48 -6.210 0.646 7.644 405 HB2 ARG 48 HB2 ARG 48 -4.918 1.134 9.670 406 HB3 ARG 48 HB3 ARG 48 -4.157 2.525 8.901 407 HG2 ARG 48 HG2 ARG 48 -6.070 3.830 9.044 408 HG3 ARG 48 HG3 ARG 48 -7.177 2.450 8.959 409 HD2 ARG 48 HD2 ARG 48 -6.655 1.775 11.227 410 HD3 ARG 48 HD3 ARG 48 -5.389 2.984 11.365 411 HE ARG 48 HE ARG 48 -8.264 3.390 11.640 412 HH11 ARG 48 HH11 ARG 48 -9.031 5.441 12.230 413 HH12 ARG 48 HH12 ARG 48 -7.907 6.797 12.115 414 HH21 ARG 48 HH21 ARG 48 -5.170 5.115 11.206 415 HH22 ARG 48 HH22 ARG 48 -5.996 6.650 11.521 416 H ILE 49 H ILE 49 -6.796 0.881 5.590 417 HA ILE 49 HA ILE 49 -5.930 3.177 3.958 418 HB ILE 49 HB ILE 49 -8.291 1.337 3.445 419 HG12 ILE 49 HG12 ILE 49 -5.404 1.119 2.468 420 HG13 ILE 49 HG13 ILE 49 -6.244 0.000 3.550 421 HG21 ILE 49 HG21 ILE 49 -8.313 3.546 2.261 422 HG22 ILE 49 HG22 ILE 49 -6.702 3.185 1.595 423 HG23 ILE 49 HG23 ILE 49 -8.118 2.207 1.142 424 HD11 ILE 49 HD11 ILE 49 -6.245 -1.019 1.422 425 HD12 ILE 49 HD12 ILE 49 -7.893 -0.464 1.705 426 HD13 ILE 49 HD13 ILE 49 -6.813 0.438 0.607 427 H THR 50 H THR 50 -6.748 5.090 4.051 428 HA THR 50 HA THR 50 -9.391 5.667 5.262 429 HB THR 50 HB THR 50 -8.202 7.764 6.216 430 HG1 THR 50 HG1 THR 50 -6.009 6.048 5.887 431 HG21 THR 50 HG21 THR 50 -7.813 5.017 7.439 432 HG22 THR 50 HG22 THR 50 -7.357 6.522 8.265 433 HG23 THR 50 HG23 THR 50 -9.040 6.257 7.815 434 H SER 51 H SER 51 -10.185 7.853 4.612 435 HA SER 51 HA SER 51 -8.840 9.169 2.302 436 HB2 SER 51 HB2 SER 51 -11.638 7.976 2.260 437 HB3 SER 51 HB3 SER 51 -11.147 9.306 1.196 438 HG SER 51 HG SER 51 -10.842 7.368 0.152 439 H LYS 52 H LYS 52 -9.598 11.268 1.827 440 HA LYS 52 HA LYS 52 -11.991 12.157 3.171 441 HB2 LYS 52 HB2 LYS 52 -10.038 12.732 4.735 442 HB3 LYS 52 HB3 LYS 52 -9.567 13.922 3.528 443 HG2 LYS 52 HG2 LYS 52 -10.856 14.927 5.299 444 HG3 LYS 52 HG3 LYS 52 -11.718 15.055 3.766 445 HD2 LYS 52 HD2 LYS 52 -13.252 14.622 5.594 446 HD3 LYS 52 HD3 LYS 52 -13.256 13.228 4.518 447 HE2 LYS 52 HE2 LYS 52 -11.745 12.013 6.058 448 HE3 LYS 52 HE3 LYS 52 -11.624 13.451 7.083 449 HZ1 LYS 52 HZ1 LYS 52 -13.252 12.017 8.056 450 HZ2 LYS 52 HZ2 LYS 52 -14.112 13.234 7.384 451 HZ3 LYS 52 HZ3 LYS 52 -14.016 11.759 6.658 452 H GLY 53 H GLY 53 -13.175 12.842 1.516 453 HA2 GLY 53 HA2 GLY 53 -13.916 13.986 -0.320 454 HA3 GLY 53 HA3 GLY 53 -12.453 14.973 -0.274 455 H LYS 54 H LYS 54 -11.620 14.844 -2.196 456 HA LYS 54 HA LYS 54 -11.559 12.393 -3.837 457 HB2 LYS 54 HB2 LYS 54 -10.863 15.298 -4.208 458 HB3 LYS 54 HB3 LYS 54 -10.588 14.081 -5.490 459 HG2 LYS 54 HG2 LYS 54 -13.036 13.487 -5.348 460 HG3 LYS 54 HG3 LYS 54 -13.265 14.864 -4.265 461 HD2 LYS 54 HD2 LYS 54 -12.260 14.998 -7.137 462 HD3 LYS 54 HD3 LYS 54 -13.901 15.369 -6.585 463 HE2 LYS 54 HE2 LYS 54 -13.003 17.205 -5.157 464 HE3 LYS 54 HE3 LYS 54 -11.372 16.861 -5.749 465 HZ1 LYS 54 HZ1 LYS 54 -12.396 18.675 -6.992 466 HZ2 LYS 54 HZ2 LYS 54 -12.143 17.414 -7.996 467 HZ3 LYS 54 HZ3 LYS 54 -13.650 17.736 -7.448 468 H THR 55 H THR 55 -9.863 12.672 -1.346 469 HA THR 55 HA THR 55 -7.359 11.688 -2.624 470 HB THR 55 HB THR 55 -7.403 13.310 -0.059 471 HG1 THR 55 HG1 THR 55 -6.524 14.952 -1.304 472 HG21 THR 55 HG21 THR 55 -4.950 13.422 -0.490 473 HG22 THR 55 HG22 THR 55 -5.496 11.756 -0.272 474 HG23 THR 55 HG23 THR 55 -5.162 12.367 -1.908 475 H ALA 56 H ALA 56 -6.844 9.717 -2.024 476 HA ALA 56 HA ALA 56 -7.936 8.548 0.491 477 HB1 ALA 56 HB1 ALA 56 -7.486 6.364 -0.467 478 HB2 ALA 56 HB2 ALA 56 -8.550 7.293 -1.534 479 HB3 ALA 56 HB3 ALA 56 -6.826 7.105 -1.934 480 H TYR 57 H TYR 57 -6.503 7.234 1.718 481 HA TYR 57 HA TYR 57 -3.613 7.954 1.664 482 HB2 TYR 57 HB2 TYR 57 -5.493 8.177 4.044 483 HB3 TYR 57 HB3 TYR 57 -3.773 8.520 4.043 484 HD1 TYR 57 HD1 TYR 57 -2.964 10.494 2.571 485 HD2 TYR 57 HD2 TYR 57 -7.086 9.907 3.714 486 HE1 TYR 57 HE1 TYR 57 -3.434 12.905 2.146 487 HE2 TYR 57 HE2 TYR 57 -7.552 12.302 3.260 488 HH TYR 57 HH TYR 57 -5.009 14.569 2.162 489 H ILE 58 H ILE 58 -2.757 5.901 1.374 490 HA ILE 58 HA ILE 58 -3.768 3.615 3.012 491 HB ILE 58 HB ILE 58 -1.418 3.763 1.092 492 HG12 ILE 58 HG12 ILE 58 -2.836 1.988 -0.139 493 HG13 ILE 58 HG13 ILE 58 -4.211 2.593 0.782 494 HG21 ILE 58 HG21 ILE 58 -1.024 2.129 2.922 495 HG22 ILE 58 HG22 ILE 58 -2.601 1.383 2.593 496 HG23 ILE 58 HG23 ILE 58 -1.286 1.317 1.394 497 HD11 ILE 58 HD11 ILE 58 -3.998 4.771 -0.322 498 HD12 ILE 58 HD12 ILE 58 -2.423 4.297 -1.020 499 HD13 ILE 58 HD13 ILE 58 -3.913 3.505 -1.555 500 H LYS 59 H LYS 59 -3.506 4.301 5.121 501 HA LYS 59 HA LYS 59 -0.769 5.046 6.002 502 HB2 LYS 59 HB2 LYS 59 -3.259 4.820 7.719 503 HB3 LYS 59 HB3 LYS 59 -1.722 5.599 8.103 504 HG2 LYS 59 HG2 LYS 59 -2.194 7.108 6.030 505 HG3 LYS 59 HG3 LYS 59 -3.830 6.474 6.098 506 HD2 LYS 59 HD2 LYS 59 -3.989 7.323 8.470 507 HD3 LYS 59 HD3 LYS 59 -2.375 8.058 8.255 508 HE2 LYS 59 HE2 LYS 59 -3.238 9.367 6.322 509 HE3 LYS 59 HE3 LYS 59 -4.832 8.623 6.535 510 HZ1 LYS 59 HZ1 LYS 59 -4.782 10.778 7.611 511 HZ2 LYS 59 HZ2 LYS 59 -4.926 9.615 8.757 512 HZ3 LYS 59 HZ3 LYS 59 -3.489 10.364 8.530 513 H LEU 60 H LEU 60 0.568 3.818 7.111 514 HA LEU 60 HA LEU 60 -0.205 1.019 7.846 515 HB2 LEU 60 HB2 LEU 60 2.265 2.231 6.637 516 HB3 LEU 60 HB3 LEU 60 2.471 0.959 7.834 517 HG LEU 60 HG LEU 60 1.188 -0.621 6.568 518 HD11 LEU 60 HD11 LEU 60 0.815 1.598 4.509 519 HD12 LEU 60 HD12 LEU 60 0.509 -0.126 4.197 520 HD13 LEU 60 HD13 LEU 60 -0.463 0.729 5.392 521 HD21 LEU 60 HD21 LEU 60 3.613 -0.282 6.115 522 HD22 LEU 60 HD22 LEU 60 2.738 -0.906 4.715 523 HD23 LEU 60 HD23 LEU 60 3.200 0.812 4.779 524 H GLU 61 H GLU 61 -0.083 0.447 9.921 525 HA GLU 61 HA GLU 61 1.083 2.358 11.914 526 HB2 GLU 61 HB2 GLU 61 -1.769 1.311 11.822 527 HB3 GLU 61 HB3 GLU 61 -1.028 2.059 13.246 528 HG2 GLU 61 HG2 GLU 61 -0.681 4.156 12.041 529 HG3 GLU 61 HG3 GLU 61 -1.279 3.442 10.541 530 H ASP 62 H ASP 62 1.663 1.464 13.956 531 HA ASP 62 HA ASP 62 2.627 -1.231 13.773 532 HB2 ASP 62 HB2 ASP 62 3.609 0.763 15.015 533 HB3 ASP 62 HB3 ASP 62 2.352 0.488 16.240 534 H LYS 63 H LYS 63 1.988 -3.092 14.673 535 HA LYS 63 HA LYS 63 -0.819 -3.349 15.391 536 HB2 LYS 63 HB2 LYS 63 -0.310 -5.837 15.299 537 HB3 LYS 63 HB3 LYS 63 -0.006 -4.944 13.811 538 HG2 LYS 63 HG2 LYS 63 2.384 -4.831 14.289 539 HG3 LYS 63 HG3 LYS 63 2.160 -5.656 15.837 540 HD2 LYS 63 HD2 LYS 63 1.688 -7.711 14.822 541 HD3 LYS 63 HD3 LYS 63 1.221 -6.962 13.270 542 HE2 LYS 63 HE2 LYS 63 3.561 -6.202 12.937 543 HE3 LYS 63 HE3 LYS 63 4.046 -7.017 14.422 544 HZ1 LYS 63 HZ1 LYS 63 4.433 -8.305 12.351 545 HZ2 LYS 63 HZ2 LYS 63 3.500 -9.128 13.426 546 HZ3 LYS 63 HZ3 LYS 63 2.810 -8.445 12.107 547 H VAL 64 H VAL 64 1.763 -2.705 17.292 548 HA VAL 64 HA VAL 64 0.387 -3.835 19.697 549 HB VAL 64 HB VAL 64 3.333 -3.450 19.077 550 HG11 VAL 64 HG11 VAL 64 2.055 -4.261 21.730 551 HG12 VAL 64 HG12 VAL 64 3.789 -4.385 21.349 552 HG13 VAL 64 HG13 VAL 64 3.025 -2.798 21.422 553 HG21 VAL 64 HG21 VAL 64 2.403 -5.527 18.183 554 HG22 VAL 64 HG22 VAL 64 3.474 -5.883 19.536 555 HG23 VAL 64 HG23 VAL 64 1.712 -5.934 19.769 556 H SER 65 H SER 65 2.333 -1.076 18.450 557 HA SER 65 HA SER 65 1.594 0.503 20.843 558 HB2 SER 65 HB2 SER 65 3.386 1.136 18.478 559 HB3 SER 65 HB3 SER 65 3.140 2.188 19.885 560 HG SER 65 HG SER 65 5.006 0.877 20.101 561 H GLY 66 H GLY 66 0.543 0.241 17.528 562 HA2 GLY 66 HA2 GLY 66 -1.233 1.258 16.430 563 HA3 GLY 66 HA3 GLY 66 -1.627 2.154 17.901 564 H GLU 67 H GLU 67 1.636 2.433 16.791 565 HA GLU 67 HA GLU 67 1.238 5.284 16.219 566 HB2 GLU 67 HB2 GLU 67 3.555 5.528 16.587 567 HB3 GLU 67 HB3 GLU 67 2.904 4.467 17.848 568 HG2 GLU 67 HG2 GLU 67 3.814 2.493 16.685 569 HG3 GLU 67 HG3 GLU 67 4.461 3.522 15.403 570 H LEU 68 H LEU 68 1.992 6.350 14.323 571 HA LEU 68 HA LEU 68 1.532 4.845 11.899 572 HB2 LEU 68 HB2 LEU 68 0.875 7.253 12.292 573 HB3 LEU 68 HB3 LEU 68 2.584 7.676 12.241 574 HG LEU 68 HG LEU 68 2.626 6.658 9.866 575 HD11 LEU 68 HD11 LEU 68 0.484 6.561 8.682 576 HD12 LEU 68 HD12 LEU 68 0.461 5.412 10.018 577 HD13 LEU 68 HD13 LEU 68 -0.399 6.951 10.176 578 HD21 LEU 68 HD21 LEU 68 2.637 9.081 10.274 579 HD22 LEU 68 HD22 LEU 68 1.673 8.679 8.844 580 HD23 LEU 68 HD23 LEU 68 0.862 9.086 10.376 581 H PHE 69 H PHE 69 2.924 3.769 10.660 582 HA PHE 69 HA PHE 69 5.865 4.068 10.969 583 HB2 PHE 69 HB2 PHE 69 5.243 1.823 10.804 584 HB3 PHE 69 HB3 PHE 69 4.051 2.120 9.547 585 HD1 PHE 69 HD1 PHE 69 7.780 2.521 10.064 586 HD2 PHE 69 HD2 PHE 69 4.580 1.494 7.362 587 HE1 PHE 69 HE1 PHE 69 9.430 2.136 8.245 588 HE2 PHE 69 HE2 PHE 69 6.222 1.174 5.538 589 HZ PHE 69 HZ PHE 69 8.645 1.504 5.963 590 H ALA 70 H ALA 70 3.482 4.170 8.272 591 HA ALA 70 HA ALA 70 4.680 6.598 7.159 592 HB1 ALA 70 HB1 ALA 70 6.155 4.774 6.287 593 HB2 ALA 70 HB2 ALA 70 4.725 3.957 5.616 594 HB3 ALA 70 HB3 ALA 70 5.220 5.553 5.004 595 H GLN 71 H GLN 71 3.443 7.327 5.193 596 HA GLN 71 HA GLN 71 0.880 5.990 4.734 597 HB2 GLN 71 HB2 GLN 71 -0.490 7.938 5.003 598 HB3 GLN 71 HB3 GLN 71 0.335 7.561 6.506 599 HG2 GLN 71 HG2 GLN 71 0.600 9.831 6.506 600 HG3 GLN 71 HG3 GLN 71 2.083 9.396 5.675 601 HE21 GLN 71 HE21 GLN 71 1.103 11.703 3.157 602 HE22 GLN 71 HE22 GLN 71 2.407 11.017 4.129 603 H ALA 72 H ALA 72 0.072 6.179 2.715 604 HA ALA 72 HA ALA 72 1.645 7.775 0.729 605 HB1 ALA 72 HB1 ALA 72 0.379 5.040 0.453 606 HB2 ALA 72 HB2 ALA 72 1.190 5.950 -0.838 607 HB3 ALA 72 HB3 ALA 72 2.111 5.415 0.584 608 HA PRO 73 HA PRO 73 -2.544 9.482 0.160 609 HB2 PRO 73 HB2 PRO 73 -1.873 11.915 -0.844 610 HB3 PRO 73 HB3 PRO 73 -1.725 11.519 0.895 611 HG2 PRO 73 HG2 PRO 73 0.441 11.451 -1.212 612 HG3 PRO 73 HG3 PRO 73 0.507 12.201 0.414 613 HD2 PRO 73 HD2 PRO 73 1.506 9.702 -0.090 614 HD3 PRO 73 HD3 PRO 73 0.751 10.109 1.472 615 H VAL 74 H VAL 74 -3.842 9.556 -1.621 616 HA VAL 74 HA VAL 74 -2.706 9.106 -4.356 617 HB VAL 74 HB VAL 74 -5.060 7.560 -3.216 618 HG11 VAL 74 HG11 VAL 74 -4.585 6.021 -5.082 619 HG12 VAL 74 HG12 VAL 74 -4.907 7.656 -5.654 620 HG13 VAL 74 HG13 VAL 74 -3.234 7.053 -5.600 621 HG21 VAL 74 HG21 VAL 74 -3.225 6.847 -1.816 622 HG22 VAL 74 HG22 VAL 74 -3.609 5.589 -2.985 623 HG23 VAL 74 HG23 VAL 74 -2.178 6.611 -3.229 624 H GLU 75 H GLU 75 -3.690 10.423 -5.861 625 HA GLU 75 HA GLU 75 -6.090 11.975 -5.034 626 HB2 GLU 75 HB2 GLU 75 -4.253 12.187 -7.449 627 HB3 GLU 75 HB3 GLU 75 -5.627 13.252 -7.119 628 HG2 GLU 75 HG2 GLU 75 -4.592 13.910 -4.947 629 HG3 GLU 75 HG3 GLU 75 -3.182 12.919 -5.327 630 H GLN 76 H GLN 76 -5.374 9.304 -7.121 631 HA GLN 76 HA GLN 76 -8.138 8.660 -7.382 632 HB2 GLN 76 HB2 GLN 76 -8.466 8.665 -9.716 633 HB3 GLN 76 HB3 GLN 76 -7.969 10.287 -9.290 634 HG2 GLN 76 HG2 GLN 76 -6.255 8.167 -10.655 635 HG3 GLN 76 HG3 GLN 76 -7.010 9.553 -11.413 636 HE21 GLN 76 HE21 GLN 76 -3.463 10.048 -9.444 637 HE22 GLN 76 HE22 GLN 76 -4.390 8.546 -9.246 638 H TYR 77 H TYR 77 -8.428 6.458 -7.917 639 HA TYR 77 HA TYR 77 -5.953 4.852 -8.283 640 HB2 TYR 77 HB2 TYR 77 -6.988 4.580 -6.073 641 HB3 TYR 77 HB3 TYR 77 -8.488 4.069 -6.855 642 HD1 TYR 77 HD1 TYR 77 -4.838 3.222 -6.680 643 HD2 TYR 77 HD2 TYR 77 -8.856 1.801 -7.289 644 HE1 TYR 77 HE1 TYR 77 -3.985 0.887 -6.900 645 HE2 TYR 77 HE2 TYR 77 -8.011 -0.550 -7.395 646 HH TYR 77 HH TYR 77 -4.520 -1.316 -7.175 647 HA PRO 78 HA PRO 78 -5.099 3.122 -9.402 648 HB2 PRO 78 HB2 PRO 78 -4.121 2.684 -11.903 649 HB3 PRO 78 HB3 PRO 78 -5.126 1.494 -11.022 650 HG2 PRO 78 HG2 PRO 78 -6.038 3.520 -13.096 651 HG3 PRO 78 HG3 PRO 78 -6.387 1.761 -13.042 652 HD2 PRO 78 HD2 PRO 78 -8.151 3.591 -12.075 653 HD3 PRO 78 HD3 PRO 78 -7.908 2.024 -11.249 654 H GLY 79 H GLY 79 -3.198 4.290 -9.448 655 HA2 GLY 79 HA2 GLY 79 -2.802 6.684 -11.115 656 HA3 GLY 79 HA3 GLY 79 -3.042 6.972 -9.387 657 H ILE 80 H ILE 80 -0.806 7.906 -9.612 658 HA ILE 80 HA ILE 80 1.413 6.117 -10.143 659 HB ILE 80 HB ILE 80 1.604 8.465 -10.634 660 HG12 ILE 80 HG12 ILE 80 3.537 7.743 -8.389 661 HG13 ILE 80 HG13 ILE 80 3.604 7.053 -10.014 662 HG21 ILE 80 HG21 ILE 80 1.536 9.047 -7.632 663 HG22 ILE 80 HG22 ILE 80 1.743 10.219 -8.947 664 HG23 ILE 80 HG23 ILE 80 0.206 9.390 -8.758 665 HD11 ILE 80 HD11 ILE 80 4.002 9.984 -9.303 666 HD12 ILE 80 HD12 ILE 80 5.246 8.813 -9.762 667 HD13 ILE 80 HD13 ILE 80 4.017 9.308 -10.951 668 H ALA 81 H ALA 81 -0.225 7.063 -7.150 669 HA ALA 81 HA ALA 81 2.009 6.215 -5.468 670 HB1 ALA 81 HB1 ALA 81 -0.748 7.310 -4.828 671 HB2 ALA 81 HB2 ALA 81 0.572 7.086 -3.657 672 HB3 ALA 81 HB3 ALA 81 0.752 8.246 -4.983 673 H VAL 82 H VAL 82 0.101 4.227 -7.037 674 HA VAL 82 HA VAL 82 0.299 2.109 -5.036 675 HB VAL 82 HB VAL 82 -2.399 2.690 -6.262 676 HG11 VAL 82 HG11 VAL 82 -1.496 0.707 -4.104 677 HG12 VAL 82 HG12 VAL 82 -3.172 0.935 -4.624 678 HG13 VAL 82 HG13 VAL 82 -1.981 0.283 -5.754 679 HG21 VAL 82 HG21 VAL 82 -1.624 3.205 -3.380 680 HG22 VAL 82 HG22 VAL 82 -2.119 4.404 -4.596 681 HG23 VAL 82 HG23 VAL 82 -3.274 3.207 -4.031 682 H GLU 83 H GLU 83 0.931 0.316 -6.058 683 HA GLU 83 HA GLU 83 0.180 -0.272 -8.885 684 HB2 GLU 83 HB2 GLU 83 2.981 0.146 -7.786 685 HB3 GLU 83 HB3 GLU 83 2.706 -1.024 -9.078 686 HG2 GLU 83 HG2 GLU 83 1.545 0.750 -10.394 687 HG3 GLU 83 HG3 GLU 83 2.059 1.933 -9.172 688 H THR 84 H THR 84 0.711 -2.446 -9.569 689 HA THR 84 HA THR 84 0.549 -4.521 -7.407 690 HB THR 84 HB THR 84 -0.478 -5.922 -9.183 691 HG1 THR 84 HG1 THR 84 -1.181 -4.902 -11.067 692 HG21 THR 84 HG21 THR 84 -1.923 -3.271 -8.727 693 HG22 THR 84 HG22 THR 84 -2.671 -4.802 -9.240 694 HG23 THR 84 HG23 THR 84 -1.931 -4.680 -7.640 695 H VAL 85 H VAL 85 1.633 -6.562 -7.837 696 HA VAL 85 HA VAL 85 4.146 -6.366 -9.353 697 HB VAL 85 HB VAL 85 4.660 -8.515 -8.355 698 HG11 VAL 85 HG11 VAL 85 5.049 -6.394 -7.093 699 HG12 VAL 85 HG12 VAL 85 3.515 -6.646 -6.241 700 HG13 VAL 85 HG13 VAL 85 4.835 -7.806 -6.047 701 HG21 VAL 85 HG21 VAL 85 2.349 -9.477 -8.340 702 HG22 VAL 85 HG22 VAL 85 3.198 -9.636 -6.807 703 HG23 VAL 85 HG23 VAL 85 1.942 -8.395 -6.997 704 H THR 86 H THR 86 4.678 -8.472 -10.596 705 HA THR 86 HA THR 86 2.624 -8.994 -12.649 706 HB THR 86 HB THR 86 4.444 -10.042 -13.880 707 HG1 THR 86 HG1 THR 86 6.484 -10.166 -12.992 708 HG21 THR 86 HG21 THR 86 4.322 -7.548 -13.944 709 HG22 THR 86 HG22 THR 86 5.457 -7.476 -12.584 710 HG23 THR 86 HG23 THR 86 5.990 -8.147 -14.130 711 H ASP 87 H ASP 87 4.451 -10.779 -10.185 712 HA ASP 87 HA ASP 87 3.590 -13.335 -11.224 713 HB2 ASP 87 HB2 ASP 87 5.836 -12.836 -10.268 714 HB3 ASP 87 HB3 ASP 87 5.079 -12.735 -8.669 715 H SER 88 H SER 88 2.772 -11.601 -8.187 716 HA SER 88 HA SER 88 0.537 -13.566 -7.733 717 HB2 SER 88 HB2 SER 88 2.493 -14.404 -6.548 718 HB3 SER 88 HB3 SER 88 2.644 -12.869 -5.673 719 HG SER 88 HG SER 88 1.432 -14.645 -4.609 720 H SER 89 H SER 89 -1.344 -12.608 -7.332 721 HA SER 89 HA SER 89 -1.562 -9.820 -7.223 722 HB2 SER 89 HB2 SER 89 -3.807 -11.542 -6.234 723 HB3 SER 89 HB3 SER 89 -3.871 -10.100 -7.245 724 HG SER 89 HG SER 89 -2.910 -11.395 -8.936 725 H ARG 90 H ARG 90 -0.783 -11.718 -4.507 726 HA ARG 90 HA ARG 90 -2.146 -9.973 -2.586 727 HB2 ARG 90 HB2 ARG 90 -1.627 -11.444 -0.866 728 HB3 ARG 90 HB3 ARG 90 -2.240 -12.352 -2.239 729 HG2 ARG 90 HG2 ARG 90 0.115 -12.974 -2.832 730 HG3 ARG 90 HG3 ARG 90 0.659 -12.155 -1.349 731 HD2 ARG 90 HD2 ARG 90 -0.734 -13.671 0.021 732 HD3 ARG 90 HD3 ARG 90 -1.383 -14.419 -1.437 733 HE ARG 90 HE ARG 90 0.550 -15.652 -1.724 734 HH11 ARG 90 HH11 ARG 90 2.535 -16.487 -1.212 735 HH12 ARG 90 HH12 ARG 90 3.489 -15.747 0.038 736 HH21 ARG 90 HH21 ARG 90 1.206 -13.323 0.843 737 HH22 ARG 90 HH22 ARG 90 2.783 -14.008 1.131 738 H TYR 91 H TYR 91 0.053 -8.919 -4.326 739 HA TYR 91 HA TYR 91 1.627 -7.611 -2.187 740 HB2 TYR 91 HB2 TYR 91 2.687 -8.899 -4.718 741 HB3 TYR 91 HB3 TYR 91 3.620 -7.845 -3.680 742 HD1 TYR 91 HD1 TYR 91 4.356 -8.566 -1.453 743 HD2 TYR 91 HD2 TYR 91 2.217 -11.226 -4.088 744 HE1 TYR 91 HE1 TYR 91 5.097 -10.510 -0.094 745 HE2 TYR 91 HE2 TYR 91 2.978 -13.174 -2.733 746 HH TYR 91 HH TYR 91 5.118 -12.776 0.125 747 H PHE 92 H PHE 92 2.090 -5.489 -2.526 748 HA PHE 92 HA PHE 92 1.427 -4.181 -5.116 749 HB2 PHE 92 HB2 PHE 92 0.428 -3.229 -2.403 750 HB3 PHE 92 HB3 PHE 92 0.153 -2.436 -3.938 751 HD1 PHE 92 HD1 PHE 92 -1.412 -3.428 -5.621 752 HD2 PHE 92 HD2 PHE 92 -0.811 -5.167 -1.733 753 HE1 PHE 92 HE1 PHE 92 -3.444 -4.841 -5.934 754 HE2 PHE 92 HE2 PHE 92 -2.865 -6.507 -2.005 755 HZ PHE 92 HZ PHE 92 -4.180 -6.372 -4.132 756 H VAL 93 H VAL 93 2.222 -1.968 -5.222 757 HA VAL 93 HA VAL 93 4.349 -1.268 -3.245 758 HB VAL 93 HB VAL 93 4.376 -0.760 -6.235 759 HG11 VAL 93 HG11 VAL 93 6.323 0.333 -4.165 760 HG12 VAL 93 HG12 VAL 93 6.476 0.455 -5.927 761 HG13 VAL 93 HG13 VAL 93 5.157 1.287 -5.109 762 HG21 VAL 93 HG21 VAL 93 5.197 -2.935 -5.638 763 HG22 VAL 93 HG22 VAL 93 6.600 -1.930 -6.017 764 HG23 VAL 93 HG23 VAL 93 6.207 -2.272 -4.330 765 H ILE 94 H ILE 94 4.259 0.851 -2.408 766 HA ILE 94 HA ILE 94 2.268 2.650 -3.648 767 HB ILE 94 HB ILE 94 1.370 3.423 -1.600 768 HG12 ILE 94 HG12 ILE 94 3.218 2.683 -0.028 769 HG13 ILE 94 HG13 ILE 94 1.572 2.505 0.538 770 HG21 ILE 94 HG21 ILE 94 0.111 1.818 -2.854 771 HG22 ILE 94 HG22 ILE 94 0.850 0.460 -2.003 772 HG23 ILE 94 HG23 ILE 94 -0.198 1.601 -1.128 773 HD11 ILE 94 HD11 ILE 94 2.952 0.603 1.206 774 HD12 ILE 94 HD12 ILE 94 1.643 0.077 0.145 775 HD13 ILE 94 HD13 ILE 94 3.295 0.204 -0.485 776 H ARG 95 H ARG 95 2.573 4.821 -3.422 777 HA ARG 95 HA ARG 95 5.402 5.583 -2.861 778 HB2 ARG 95 HB2 ARG 95 4.300 6.238 -5.025 779 HB3 ARG 95 HB3 ARG 95 3.273 7.345 -4.094 780 HG2 ARG 95 HG2 ARG 95 5.375 8.433 -3.199 781 HG3 ARG 95 HG3 ARG 95 6.320 7.387 -4.274 782 HD2 ARG 95 HD2 ARG 95 5.139 8.365 -6.230 783 HD3 ARG 95 HD3 ARG 95 4.186 9.387 -5.134 784 HE ARG 95 HE ARG 95 6.989 9.794 -4.636 785 HH11 ARG 95 HH11 ARG 95 7.982 11.591 -5.190 786 HH12 ARG 95 HH12 ARG 95 7.392 12.612 -6.485 787 HH21 ARG 95 HH21 ARG 95 4.608 10.661 -7.064 788 HH22 ARG 95 HH22 ARG 95 5.489 12.095 -7.518 789 H ILE 96 H ILE 96 5.390 5.426 -0.633 790 HA ILE 96 HA ILE 96 3.628 7.011 1.043 791 HB ILE 96 HB ILE 96 5.151 6.603 2.843 792 HG12 ILE 96 HG12 ILE 96 6.790 4.702 1.140 793 HG13 ILE 96 HG13 ILE 96 7.247 6.403 1.197 794 HG21 ILE 96 HG21 ILE 96 4.380 4.117 1.299 795 HG22 ILE 96 HG22 ILE 96 4.793 4.169 3.020 796 HG23 ILE 96 HG23 ILE 96 3.369 5.030 2.445 797 HD11 ILE 96 HD11 ILE 96 7.449 6.331 3.627 798 HD12 ILE 96 HD12 ILE 96 7.039 4.595 3.615 799 HD13 ILE 96 HD13 ILE 96 8.522 5.164 2.822 800 H GLN 97 H GLN 97 3.966 8.923 2.091 801 HA GLN 97 HA GLN 97 6.213 10.677 1.227 802 HB2 GLN 97 HB2 GLN 97 3.248 11.186 0.869 803 HB3 GLN 97 HB3 GLN 97 4.401 12.517 1.023 804 HG2 GLN 97 HG2 GLN 97 5.384 12.153 -1.004 805 HG3 GLN 97 HG3 GLN 97 5.110 10.415 -0.991 806 HE21 GLN 97 HE21 GLN 97 2.069 10.546 -2.754 807 HE22 GLN 97 HE22 GLN 97 3.190 9.523 -1.865 808 H ASP 98 H ASP 98 6.903 12.050 2.689 809 HA ASP 98 HA ASP 98 6.006 11.637 5.462 810 HB2 ASP 98 HB2 ASP 98 8.377 11.428 4.628 811 HB3 ASP 98 HB3 ASP 98 8.377 13.181 4.457 812 H GLY 99 H GLY 99 4.556 13.510 3.461 813 HA2 GLY 99 HA2 GLY 99 3.162 15.316 3.681 814 HA3 GLY 99 HA3 GLY 99 3.573 15.364 5.393 815 H THR 100 H THR 100 6.313 15.709 3.407 816 HA THR 100 HA THR 100 6.359 18.685 3.752 817 HB THR 100 HB THR 100 7.350 17.400 5.628 818 HG1 THR 100 HG1 THR 100 9.173 18.659 5.765 819 HG21 THR 100 HG21 THR 100 9.535 16.340 5.378 820 HG22 THR 100 HG22 THR 100 8.335 15.523 4.372 821 HG23 THR 100 HG23 THR 100 9.513 16.628 3.624 822 H GLY 101 H GLY 101 6.609 16.386 1.385 823 HA2 GLY 101 HA2 GLY 101 7.009 17.031 -0.880 824 HA3 GLY 101 HA3 GLY 101 8.232 18.188 -0.369 825 H ARG 102 H ARG 102 8.135 14.909 0.894 826 HA ARG 102 HA ARG 102 10.342 13.959 -0.829 827 HB2 ARG 102 HB2 ARG 102 11.650 13.212 0.990 828 HB3 ARG 102 HB3 ARG 102 11.255 14.925 1.242 829 HG2 ARG 102 HG2 ARG 102 9.369 14.175 2.741 830 HG3 ARG 102 HG3 ARG 102 10.020 12.527 2.670 831 HD2 ARG 102 HD2 ARG 102 11.632 14.949 3.516 832 HD3 ARG 102 HD3 ARG 102 10.687 13.989 4.658 833 HE ARG 102 HE ARG 102 13.031 13.003 3.064 834 HH11 ARG 102 HH11 ARG 102 14.302 11.442 3.942 835 HH12 ARG 102 HH12 ARG 102 13.906 10.756 5.488 836 HH21 ARG 102 HH21 ARG 102 11.063 12.608 6.010 837 HH22 ARG 102 HH22 ARG 102 12.158 11.394 6.606 838 H SER 103 H SER 103 10.322 11.750 -1.187 839 HA SER 103 HA SER 103 8.069 10.140 -0.143 840 HB2 SER 103 HB2 SER 103 7.078 9.748 -2.286 841 HB3 SER 103 HB3 SER 103 7.197 11.496 -2.055 842 HG SER 103 HG SER 103 9.256 11.283 -3.284 843 H ALA 104 H ALA 104 8.021 7.926 -0.787 844 HA ALA 104 HA ALA 104 10.310 6.811 -2.259 845 HB1 ALA 104 HB1 ALA 104 10.827 5.158 -0.491 846 HB2 ALA 104 HB2 ALA 104 11.124 6.812 0.078 847 HB3 ALA 104 HB3 ALA 104 9.663 5.943 0.596 848 H PHE 105 H PHE 105 9.837 4.873 -3.268 849 HA PHE 105 HA PHE 105 7.028 3.874 -3.164 850 HB2 PHE 105 HB2 PHE 105 9.338 3.440 -5.079 851 HB3 PHE 105 HB3 PHE 105 7.909 2.429 -5.077 852 HD1 PHE 105 HD1 PHE 105 9.132 5.893 -5.758 853 HD2 PHE 105 HD2 PHE 105 5.791 3.177 -5.952 854 HE1 PHE 105 HE1 PHE 105 7.957 7.431 -7.303 855 HE2 PHE 105 HE2 PHE 105 4.628 4.691 -7.494 856 HZ PHE 105 HZ PHE 105 5.719 6.827 -8.201 857 H ILE 106 H ILE 106 6.629 2.356 -1.662 858 HA ILE 106 HA ILE 106 8.756 0.351 -0.978 859 HB ILE 106 HB ILE 106 7.815 0.090 1.208 860 HG12 ILE 106 HG12 ILE 106 5.875 2.362 0.601 861 HG13 ILE 106 HG13 ILE 106 5.437 0.658 0.729 862 HG21 ILE 106 HG21 ILE 106 8.379 3.014 0.613 863 HG22 ILE 106 HG22 ILE 106 8.616 2.185 2.170 864 HG23 ILE 106 HG23 ILE 106 9.607 1.731 0.783 865 HD11 ILE 106 HD11 ILE 106 6.503 2.359 3.003 866 HD12 ILE 106 HD12 ILE 106 4.866 1.723 2.798 867 HD13 ILE 106 HD13 ILE 106 6.210 0.607 3.082 868 H GLY 107 H GLY 107 8.121 -1.807 -0.582 869 HA2 GLY 107 HA2 GLY 107 5.732 -2.661 -2.141 870 HA3 GLY 107 HA3 GLY 107 7.093 -3.676 -1.672 871 H ILE 108 H ILE 108 4.100 -3.818 -1.179 872 HA ILE 108 HA ILE 108 4.392 -4.674 1.618 873 HB ILE 108 HB ILE 108 2.024 -4.237 2.096 874 HG12 ILE 108 HG12 ILE 108 2.012 -2.417 -0.346 875 HG13 ILE 108 HG13 ILE 108 1.203 -3.984 -0.252 876 HG21 ILE 108 HG21 ILE 108 2.375 -1.892 2.693 877 HG22 ILE 108 HG22 ILE 108 3.834 -2.851 2.937 878 HG23 ILE 108 HG23 ILE 108 3.711 -1.774 1.529 879 HD11 ILE 108 HD11 ILE 108 0.543 -1.554 1.465 880 HD12 ILE 108 HD12 ILE 108 -0.425 -2.249 0.160 881 HD13 ILE 108 HD13 ILE 108 -0.180 -3.165 1.659 882 H GLY 109 H GLY 109 3.535 -6.610 2.150 883 HA2 GLY 109 HA2 GLY 109 2.135 -8.192 0.017 884 HA3 GLY 109 HA3 GLY 109 3.431 -8.873 0.991 885 H PHE 110 H PHE 110 0.478 -9.400 0.598 886 HA PHE 110 HA PHE 110 -0.475 -9.388 3.424 887 HB2 PHE 110 HB2 PHE 110 -1.902 -9.827 0.778 888 HB3 PHE 110 HB3 PHE 110 -2.652 -10.069 2.343 889 HD1 PHE 110 HD1 PHE 110 -3.200 -8.208 3.824 890 HD2 PHE 110 HD2 PHE 110 -1.347 -7.531 -0.013 891 HE1 PHE 110 HE1 PHE 110 -3.786 -5.807 3.964 892 HE2 PHE 110 HE2 PHE 110 -1.964 -5.117 0.134 893 HZ PHE 110 HZ PHE 110 -3.199 -4.270 2.072 894 H THR 111 H THR 111 -1.426 -11.324 4.273 895 HA THR 111 HA THR 111 0.165 -13.700 3.770 896 HB THR 111 HB THR 111 -0.636 -12.872 5.996 897 HG1 THR 111 HG1 THR 111 0.139 -14.932 5.857 898 HG21 THR 111 HG21 THR 111 -3.020 -12.412 5.438 899 HG22 THR 111 HG22 THR 111 -3.295 -14.160 5.260 900 HG23 THR 111 HG23 THR 111 -2.821 -13.486 6.830 901 H ASP 112 H ASP 112 -2.818 -12.538 2.470 902 HA ASP 112 HA ASP 112 -3.262 -15.026 1.005 903 HB2 ASP 112 HB2 ASP 112 -4.475 -15.330 3.193 904 HB3 ASP 112 HB3 ASP 112 -5.440 -13.905 2.813 905 H ARG 113 H ARG 113 -4.561 -14.799 -0.815 906 HA ARG 113 HA ARG 113 -4.461 -12.269 -2.148 907 HB2 ARG 113 HB2 ARG 113 -4.337 -14.590 -3.135 908 HB3 ARG 113 HB3 ARG 113 -6.083 -14.751 -2.880 909 HG2 ARG 113 HG2 ARG 113 -6.499 -12.847 -4.386 910 HG3 ARG 113 HG3 ARG 113 -4.752 -12.552 -4.511 911 HD2 ARG 113 HD2 ARG 113 -4.511 -14.909 -5.441 912 HD3 ARG 113 HD3 ARG 113 -6.267 -15.017 -5.494 913 HE ARG 113 HE ARG 113 -4.495 -13.234 -7.136 914 HH11 ARG 113 HH11 ARG 113 -5.137 -12.535 -9.012 915 HH12 ARG 113 HH12 ARG 113 -6.733 -12.898 -9.639 916 HH21 ARG 113 HH21 ARG 113 -7.732 -14.554 -6.777 917 HH22 ARG 113 HH22 ARG 113 -8.196 -14.005 -8.364 918 H GLY 114 H GLY 114 -7.100 -13.769 -0.294 919 HA2 GLY 114 HA2 GLY 114 -9.218 -12.047 -1.225 920 HA3 GLY 114 HA3 GLY 114 -9.174 -12.961 0.287 921 H ASP 115 H ASP 115 -6.690 -11.619 1.229 922 HA ASP 115 HA ASP 115 -7.979 -9.245 2.433 923 HB2 ASP 115 HB2 ASP 115 -5.237 -10.498 2.840 924 HB3 ASP 115 HB3 ASP 115 -5.820 -9.069 3.693 925 H ALA 116 H ALA 116 -5.365 -9.930 0.131 926 HA ALA 116 HA ALA 116 -4.677 -7.204 -0.469 927 HB1 ALA 116 HB1 ALA 116 -3.238 -9.005 -1.036 928 HB2 ALA 116 HB2 ALA 116 -4.507 -9.856 -1.952 929 HB3 ALA 116 HB3 ALA 116 -3.836 -8.355 -2.583 930 H PHE 117 H PHE 117 -7.171 -9.424 -1.856 931 HA PHE 117 HA PHE 117 -8.162 -7.536 -3.771 932 HB2 PHE 117 HB2 PHE 117 -9.178 -10.063 -2.545 933 HB3 PHE 117 HB3 PHE 117 -10.371 -8.965 -3.208 934 HD1 PHE 117 HD1 PHE 117 -6.896 -9.954 -4.378 935 HD2 PHE 117 HD2 PHE 117 -11.105 -9.669 -5.292 936 HE1 PHE 117 HE1 PHE 117 -6.446 -10.698 -6.695 937 HE2 PHE 117 HE2 PHE 117 -10.647 -10.426 -7.609 938 HZ PHE 117 HZ PHE 117 -8.317 -10.931 -8.319 939 H ASP 118 H ASP 118 -9.076 -7.991 -0.297 940 HA ASP 118 HA ASP 118 -10.996 -5.858 -0.309 941 HB2 ASP 118 HB2 ASP 118 -9.284 -7.035 1.906 942 HB3 ASP 118 HB3 ASP 118 -10.417 -5.723 2.182 943 H PHE 119 H PHE 119 -7.424 -5.712 0.114 944 HA PHE 119 HA PHE 119 -7.227 -2.906 0.601 945 HB2 PHE 119 HB2 PHE 119 -5.332 -4.253 0.938 946 HB3 PHE 119 HB3 PHE 119 -5.353 -4.905 -0.676 947 HD1 PHE 119 HD1 PHE 119 -4.275 -2.115 1.385 948 HD2 PHE 119 HD2 PHE 119 -4.593 -3.570 -2.647 949 HE1 PHE 119 HE1 PHE 119 -2.776 -0.307 0.620 950 HE2 PHE 119 HE2 PHE 119 -3.076 -1.771 -3.418 951 HZ PHE 119 HZ PHE 119 -2.161 -0.125 -1.789 952 H ASN 120 H ASN 120 -7.018 -4.557 -2.628 953 HA ASN 120 HA ASN 120 -7.097 -1.956 -3.903 954 HB2 ASN 120 HB2 ASN 120 -7.040 -3.122 -6.020 955 HB3 ASN 120 HB3 ASN 120 -5.828 -3.743 -4.907 956 HD21 ASN 120 HD21 ASN 120 -8.893 -6.233 -6.059 957 HD22 ASN 120 HD22 ASN 120 -9.225 -4.513 -6.009 958 H VAL 121 H VAL 121 -9.736 -4.143 -3.096 959 HA VAL 121 HA VAL 121 -11.664 -2.757 -4.788 960 HB VAL 121 HB VAL 121 -11.957 -4.688 -2.483 961 HG11 VAL 121 HG11 VAL 121 -14.182 -3.409 -4.135 962 HG12 VAL 121 HG12 VAL 121 -14.377 -4.832 -3.086 963 HG13 VAL 121 HG13 VAL 121 -13.956 -3.277 -2.375 964 HG21 VAL 121 HG21 VAL 121 -11.190 -5.590 -4.697 965 HG22 VAL 121 HG22 VAL 121 -12.790 -6.186 -4.257 966 HG23 VAL 121 HG23 VAL 121 -12.627 -4.891 -5.463 967 H SER 122 H SER 122 -10.607 -2.415 -1.371 968 HA SER 122 HA SER 122 -12.460 -0.447 -0.556 969 HB2 SER 122 HB2 SER 122 -10.898 -1.617 0.937 970 HB3 SER 122 HB3 SER 122 -9.528 -0.784 0.179 971 HG SER 122 HG SER 122 -11.682 0.389 1.623 972 H LEU 123 H LEU 123 -9.391 -0.029 -2.356 973 HA LEU 123 HA LEU 123 -9.547 2.858 -2.456 974 HB2 LEU 123 HB2 LEU 123 -8.014 0.848 -4.152 975 HB3 LEU 123 HB3 LEU 123 -7.799 2.595 -4.238 976 HG LEU 123 HG LEU 123 -7.303 0.946 -1.720 977 HD11 LEU 123 HD11 LEU 123 -4.920 1.280 -2.225 978 HD12 LEU 123 HD12 LEU 123 -5.722 0.363 -3.505 979 HD13 LEU 123 HD13 LEU 123 -5.351 2.081 -3.756 980 HD21 LEU 123 HD21 LEU 123 -6.136 2.947 -0.919 981 HD22 LEU 123 HD22 LEU 123 -6.582 3.831 -2.396 982 HD23 LEU 123 HD23 LEU 123 -7.824 3.319 -1.231 983 H GLN 124 H GLN 124 -10.354 0.385 -4.997 984 HA GLN 124 HA GLN 124 -11.209 2.423 -6.817 985 HB2 GLN 124 HB2 GLN 124 -11.810 0.714 -8.291 986 HB3 GLN 124 HB3 GLN 124 -10.450 0.081 -7.363 987 HG2 GLN 124 HG2 GLN 124 -12.198 -1.060 -5.877 988 HG3 GLN 124 HG3 GLN 124 -13.382 -0.663 -7.121 989 HE21 GLN 124 HE21 GLN 124 -10.414 -3.404 -8.011 990 HE22 GLN 124 HE22 GLN 124 -10.146 -2.221 -6.716 991 H ASP 125 H ASP 125 -13.000 0.784 -4.253 992 HA ASP 125 HA ASP 125 -15.564 1.867 -5.152 993 HB2 ASP 125 HB2 ASP 125 -15.329 -0.387 -4.096 994 HB3 ASP 125 HB3 ASP 125 -14.853 0.404 -2.588 995 H HIS 126 H HIS 126 -12.924 3.287 -3.662 996 HA HIS 126 HA HIS 126 -14.644 5.340 -2.369 997 HB2 HIS 126 HB2 HIS 126 -12.526 4.758 -1.228 998 HB3 HIS 126 HB3 HIS 126 -11.617 5.290 -2.648 999 HD2 HIS 126 HD2 HIS 126 -11.147 7.873 -2.877 1000 HE1 HIS 126 HE1 HIS 126 -13.837 9.343 0.088 1001 HE2 HIS 126 HE2 HIS 126 -12.059 10.004 -1.588 1002 H PHE 127 H PHE 127 -12.551 4.897 -5.231 1003 HA PHE 127 HA PHE 127 -13.123 7.649 -6.079 1004 HB2 PHE 127 HB2 PHE 127 -11.314 5.495 -7.186 1005 HB3 PHE 127 HB3 PHE 127 -11.494 7.089 -7.904 1006 HD1 PHE 127 HD1 PHE 127 -9.684 5.219 -5.468 1007 HD2 PHE 127 HD2 PHE 127 -11.165 9.167 -6.324 1008 HE1 PHE 127 HE1 PHE 127 -7.908 6.176 -4.040 1009 HE2 PHE 127 HE2 PHE 127 -9.396 10.138 -4.876 1010 HZ PHE 127 HZ PHE 127 -7.752 8.656 -3.758 1011 H LYS 128 H LYS 128 -14.883 4.829 -6.645 1012 HA LYS 128 HA LYS 128 -15.436 4.916 -9.331 1013 HB2 LYS 128 HB2 LYS 128 -17.343 3.666 -9.041 1014 HB3 LYS 128 HB3 LYS 128 -16.252 3.181 -7.761 1015 HG2 LYS 128 HG2 LYS 128 -18.628 5.088 -7.406 1016 HG3 LYS 128 HG3 LYS 128 -18.658 3.348 -7.124 1017 HD2 LYS 128 HD2 LYS 128 -16.868 3.614 -5.414 1018 HD3 LYS 128 HD3 LYS 128 -16.933 5.365 -5.630 1019 HE2 LYS 128 HE2 LYS 128 -18.209 4.883 -3.712 1020 HE3 LYS 128 HE3 LYS 128 -19.345 5.324 -4.999 1021 HZ1 LYS 128 HZ1 LYS 128 -20.019 3.323 -3.698 1022 HZ2 LYS 128 HZ2 LYS 128 -19.846 2.967 -5.281 1023 HZ3 LYS 128 HZ3 LYS 128 -18.693 2.515 -4.215 1024 H TRP 129 H TRP 129 -16.697 7.250 -7.054 1025 HA TRP 129 HA TRP 129 -18.568 8.430 -8.996 1026 HB2 TRP 129 HB2 TRP 129 -19.100 9.999 -7.260 1027 HB3 TRP 129 HB3 TRP 129 -19.114 8.369 -6.610 1028 HD1 TRP 129 HD1 TRP 129 -17.013 7.685 -5.012 1029 HE1 TRP 129 HE1 TRP 129 -15.397 9.034 -3.609 1030 HE3 TRP 129 HE3 TRP 129 -18.039 12.354 -6.873 1031 HZ2 TRP 129 HZ2 TRP 129 -14.881 11.845 -3.046 1032 HZ3 TRP 129 HZ3 TRP 129 -17.010 14.360 -5.829 1033 HH2 TRP 129 HH2 TRP 129 -15.459 14.123 -3.906 1034 H VAL 130 H VAL 130 -15.234 8.921 -8.074 1035 HA VAL 130 HA VAL 130 -14.973 11.597 -9.268 1036 HB VAL 130 HB VAL 130 -12.781 9.678 -8.375 1037 HG11 VAL 130 HG11 VAL 130 -11.456 11.755 -8.083 1038 HG12 VAL 130 HG12 VAL 130 -11.944 11.535 -9.762 1039 HG13 VAL 130 HG13 VAL 130 -12.806 12.707 -8.739 1040 HG21 VAL 130 HG21 VAL 130 -14.197 10.066 -6.436 1041 HG22 VAL 130 HG22 VAL 130 -12.741 11.040 -6.262 1042 HG23 VAL 130 HG23 VAL 130 -14.258 11.809 -6.776 1043 H LYS 131 H LYS 131 -14.500 8.241 -10.201 1044 HA LYS 131 HA LYS 131 -13.224 8.917 -12.785 1045 HB2 LYS 131 HB2 LYS 131 -13.711 6.300 -11.303 1046 HB3 LYS 131 HB3 LYS 131 -12.990 6.373 -12.898 1047 HG2 LYS 131 HG2 LYS 131 -11.833 7.654 -10.385 1048 HG3 LYS 131 HG3 LYS 131 -11.301 6.143 -11.109 1049 HD2 LYS 131 HD2 LYS 131 -11.103 8.894 -12.416 1050 HD3 LYS 131 HD3 LYS 131 -9.787 8.015 -11.648 1051 HE2 LYS 131 HE2 LYS 131 -9.826 6.267 -13.297 1052 HE3 LYS 131 HE3 LYS 131 -11.343 6.856 -13.992 1053 HZ1 LYS 131 HZ1 LYS 131 -10.261 8.803 -14.788 1054 HZ2 LYS 131 HZ2 LYS 131 -8.832 8.430 -14.053 1055 HZ3 LYS 131 HZ3 LYS 131 -9.389 7.525 -15.298 1056 H GLN 132 H GLN 132 -15.994 9.663 -12.311 1057 HA GLN 132 HA GLN 132 -17.515 8.008 -14.199 1058 HB2 GLN 132 HB2 GLN 132 -18.195 10.622 -12.820 1059 HB3 GLN 132 HB3 GLN 132 -19.235 9.777 -13.983 1060 HG2 GLN 132 HG2 GLN 132 -19.308 7.790 -12.511 1061 HG3 GLN 132 HG3 GLN 132 -18.273 8.611 -11.341 1062 HE21 GLN 132 HE21 GLN 132 -20.903 10.784 -10.157 1063 HE22 GLN 132 HE22 GLN 132 -19.149 10.644 -10.313 1064 H GLU 133 H GLU 133 -16.317 8.078 -15.999 1065 HA GLU 133 HA GLU 133 -16.082 10.603 -17.593 1066 HB2 GLU 133 HB2 GLU 133 -13.860 8.579 -17.087 1067 HB3 GLU 133 HB3 GLU 133 -13.804 9.886 -18.272 1068 HG2 GLU 133 HG2 GLU 133 -14.091 11.550 -16.417 1069 HG3 GLU 133 HG3 GLU 133 -14.014 10.228 -15.249 Start of MODEL 3 1 H1 GLY -4 H1 GLY -4 -10.546 33.148 17.853 2 H2 GLY -4 H2 GLY -4 -9.237 34.133 17.917 3 H3 GLY -4 H3 GLY -4 -9.237 32.718 18.741 4 HA2 GLY -4 HA2 GLY -4 -9.295 31.448 16.701 5 HA3 GLY -4 HA3 GLY -4 -9.311 32.977 15.803 6 H SER -3 H SER -3 -7.371 30.839 15.611 7 HA SER -3 HA SER -3 -4.857 32.262 16.375 8 HB2 SER -3 HB2 SER -3 -5.394 29.283 16.644 9 HB3 SER -3 HB3 SER -3 -3.829 30.081 16.894 10 HG SER -3 HG SER -3 -4.983 29.743 18.865 11 HA PRO -2 HA PRO -2 -3.919 31.599 12.105 12 HB2 PRO -2 HB2 PRO -2 -1.232 32.022 11.992 13 HB3 PRO -2 HB3 PRO -2 -2.388 33.309 12.446 14 HG2 PRO -2 HG2 PRO -2 -0.792 31.511 14.310 15 HG3 PRO -2 HG3 PRO -2 -0.900 33.301 14.334 16 HD2 PRO -2 HD2 PRO -2 -2.469 31.762 15.931 17 HD3 PRO -2 HD3 PRO -2 -3.107 33.252 15.172 18 H ASN -1 H ASN -1 -2.818 29.303 14.399 19 HA ASN -1 HA ASN -1 -1.001 27.724 12.961 20 HB2 ASN -1 HB2 ASN -1 -3.051 26.894 15.065 21 HB3 ASN -1 HB3 ASN -1 -1.648 25.941 14.591 22 HD21 ASN -1 HD21 ASN -1 -0.992 28.152 17.657 23 HD22 ASN -1 HD22 ASN -1 -2.411 27.204 17.240 24 H SER 0 H SER 0 -4.521 27.762 12.617 25 HA SER 0 HA SER 0 -4.853 25.283 11.228 26 HB2 SER 0 HB2 SER 0 -6.992 26.275 10.484 27 HB3 SER 0 HB3 SER 0 -6.722 26.457 12.227 28 HG SER 0 HG SER 0 -7.455 28.412 11.264 29 H MET 1 H MET 1 -3.467 28.295 10.149 30 HA MET 1 HA MET 1 -3.850 27.831 7.295 31 HB2 MET 1 HB2 MET 1 -1.918 29.689 8.735 32 HB3 MET 1 HB3 MET 1 -2.324 29.722 7.021 33 HG2 MET 1 HG2 MET 1 -4.672 30.261 7.555 34 HG3 MET 1 HG3 MET 1 -4.310 30.189 9.278 35 HE1 MET 1 HE1 MET 1 -3.990 32.200 5.959 36 HE2 MET 1 HE2 MET 1 -2.930 33.554 6.404 37 HE3 MET 1 HE3 MET 1 -2.258 31.919 6.259 38 H ALA 2 H ALA 2 -1.974 26.159 9.484 39 HA ALA 2 HA ALA 2 -0.041 25.273 7.388 40 HB1 ALA 2 HB1 ALA 2 1.728 25.234 9.105 41 HB2 ALA 2 HB2 ALA 2 1.100 26.877 8.877 42 HB3 ALA 2 HB3 ALA 2 0.608 25.926 10.298 43 H THR 3 H THR 3 -1.715 24.505 10.467 44 HA THR 3 HA THR 3 -1.684 21.605 9.738 45 HB THR 3 HB THR 3 -1.138 22.715 12.518 46 HG1 THR 3 HG1 THR 3 0.922 21.899 12.197 47 HG21 THR 3 HG21 THR 3 -2.287 20.531 12.566 48 HG22 THR 3 HG22 THR 3 -1.124 19.872 11.392 49 HG23 THR 3 HG23 THR 3 -0.592 20.334 13.027 50 H GLU 4 H GLU 4 -3.759 21.274 9.280 51 HA GLU 4 HA GLU 4 -5.781 21.712 11.405 52 HB2 GLU 4 HB2 GLU 4 -7.407 22.599 9.803 53 HB3 GLU 4 HB3 GLU 4 -6.015 23.655 10.000 54 HG2 GLU 4 HG2 GLU 4 -5.049 22.925 7.892 55 HG3 GLU 4 HG3 GLU 4 -6.310 21.703 7.681 56 H LEU 5 H LEU 5 -4.310 19.352 10.190 57 HA LEU 5 HA LEU 5 -6.345 17.775 8.867 58 HB2 LEU 5 HB2 LEU 5 -3.704 17.790 8.674 59 HB3 LEU 5 HB3 LEU 5 -3.783 16.624 9.989 60 HG LEU 5 HG LEU 5 -5.106 16.467 7.262 61 HD11 LEU 5 HD11 LEU 5 -2.854 14.813 8.475 62 HD12 LEU 5 HD12 LEU 5 -3.545 14.610 6.846 63 HD13 LEU 5 HD13 LEU 5 -2.669 16.092 7.253 64 HD21 LEU 5 HD21 LEU 5 -5.183 14.418 9.521 65 HD22 LEU 5 HD22 LEU 5 -6.571 15.262 8.786 66 HD23 LEU 5 HD23 LEU 5 -5.667 14.088 7.842 67 H GLU 6 H GLU 6 -8.079 17.530 10.169 68 HA GLU 6 HA GLU 6 -7.824 15.724 12.525 69 HB2 GLU 6 HB2 GLU 6 -8.018 18.201 13.139 70 HB3 GLU 6 HB3 GLU 6 -9.663 18.143 12.509 71 HG2 GLU 6 HG2 GLU 6 -10.185 16.327 14.174 72 HG3 GLU 6 HG3 GLU 6 -8.517 16.388 14.736 73 H TYR 7 H TYR 7 -8.283 14.626 10.187 74 HA TYR 7 HA TYR 7 -11.066 13.713 10.134 75 HB2 TYR 7 HB2 TYR 7 -11.353 14.289 7.775 76 HB3 TYR 7 HB3 TYR 7 -11.162 15.731 8.744 77 HD1 TYR 7 HD1 TYR 7 -9.480 17.340 8.221 78 HD2 TYR 7 HD2 TYR 7 -9.327 13.430 6.382 79 HE1 TYR 7 HE1 TYR 7 -7.739 18.139 6.634 80 HE2 TYR 7 HE2 TYR 7 -7.667 14.241 4.769 81 HH TYR 7 HH TYR 7 -6.417 17.622 4.837 82 H GLU 8 H GLU 8 -11.271 11.718 9.063 83 HA GLU 8 HA GLU 8 -9.645 10.769 7.020 84 HB2 GLU 8 HB2 GLU 8 -8.543 10.198 9.714 85 HB3 GLU 8 HB3 GLU 8 -8.993 8.697 8.914 86 HG2 GLU 8 HG2 GLU 8 -7.559 9.139 7.042 87 HG3 GLU 8 HG3 GLU 8 -7.238 10.780 7.566 88 H SER 9 H SER 9 -11.192 9.639 5.953 89 HA SER 9 HA SER 9 -13.186 8.025 7.484 90 HB2 SER 9 HB2 SER 9 -13.029 9.024 4.644 91 HB3 SER 9 HB3 SER 9 -14.105 7.683 5.090 92 HG SER 9 HG SER 9 -15.212 8.974 6.472 93 H VAL 10 H VAL 10 -12.363 6.121 8.059 94 HA VAL 10 HA VAL 10 -10.359 4.610 6.627 95 HB VAL 10 HB VAL 10 -12.368 3.676 8.721 96 HG11 VAL 10 HG11 VAL 10 -9.737 2.429 7.801 97 HG12 VAL 10 HG12 VAL 10 -10.670 1.928 9.229 98 HG13 VAL 10 HG13 VAL 10 -11.369 1.726 7.629 99 HG21 VAL 10 HG21 VAL 10 -10.937 5.529 9.568 100 HG22 VAL 10 HG22 VAL 10 -10.535 3.997 10.338 101 HG23 VAL 10 HG23 VAL 10 -9.488 4.635 9.058 102 H LEU 11 H LEU 11 -10.468 2.766 5.418 103 HA LEU 11 HA LEU 11 -13.023 2.215 3.937 104 HB2 LEU 11 HB2 LEU 11 -10.223 2.677 2.826 105 HB3 LEU 11 HB3 LEU 11 -11.588 2.093 1.889 106 HG LEU 11 HG LEU 11 -11.441 4.840 3.182 107 HD11 LEU 11 HD11 LEU 11 -11.269 5.563 0.779 108 HD12 LEU 11 HD12 LEU 11 -9.858 4.672 1.361 109 HD13 LEU 11 HD13 LEU 11 -11.056 3.866 0.322 110 HD21 LEU 11 HD21 LEU 11 -13.473 3.626 1.251 111 HD22 LEU 11 HD22 LEU 11 -13.780 4.077 2.947 112 HD23 LEU 11 HD23 LEU 11 -13.414 5.327 1.758 113 H CYS 12 H CYS 12 -9.770 1.012 4.835 114 HA CYS 12 HA CYS 12 -10.858 -1.691 5.149 115 HB2 CYS 12 HB2 CYS 12 -10.122 -1.580 2.740 116 HB3 CYS 12 HB3 CYS 12 -8.479 -1.215 3.315 117 HG CYS 12 HG CYS 12 -8.653 -3.716 2.530 118 H VAL 13 H VAL 13 -9.907 -2.710 6.782 119 HA VAL 13 HA VAL 13 -7.195 -1.907 7.697 120 HB VAL 13 HB VAL 13 -9.601 -2.360 9.492 121 HG11 VAL 13 HG11 VAL 13 -7.642 -3.435 10.534 122 HG12 VAL 13 HG12 VAL 13 -6.679 -1.961 10.277 123 HG13 VAL 13 HG13 VAL 13 -8.062 -1.950 11.387 124 HG21 VAL 13 HG21 VAL 13 -9.430 -0.070 8.555 125 HG22 VAL 13 HG22 VAL 13 -9.099 -0.075 10.292 126 HG23 VAL 13 HG23 VAL 13 -7.756 0.046 9.132 127 H LYS 14 H LYS 14 -5.868 -3.544 7.789 128 HA LYS 14 HA LYS 14 -6.862 -6.316 8.196 129 HB2 LYS 14 HB2 LYS 14 -4.680 -5.546 6.225 130 HB3 LYS 14 HB3 LYS 14 -5.129 -7.182 6.655 131 HG2 LYS 14 HG2 LYS 14 -6.990 -5.193 5.281 132 HG3 LYS 14 HG3 LYS 14 -6.026 -6.425 4.469 133 HD2 LYS 14 HD2 LYS 14 -7.223 -8.203 5.733 134 HD3 LYS 14 HD3 LYS 14 -8.259 -6.960 6.473 135 HE2 LYS 14 HE2 LYS 14 -9.055 -6.275 4.248 136 HE3 LYS 14 HE3 LYS 14 -7.985 -7.459 3.486 137 HZ1 LYS 14 HZ1 LYS 14 -10.206 -8.354 3.675 138 HZ2 LYS 14 HZ2 LYS 14 -9.211 -9.221 4.653 139 HZ3 LYS 14 HZ3 LYS 14 -10.241 -8.117 5.301 140 HA PRO 15 HA PRO 15 -3.963 -5.939 11.489 141 HB2 PRO 15 HB2 PRO 15 -3.931 -8.465 12.503 142 HB3 PRO 15 HB3 PRO 15 -5.375 -7.402 12.585 143 HG2 PRO 15 HG2 PRO 15 -4.759 -9.564 10.536 144 HG3 PRO 15 HG3 PRO 15 -6.276 -9.331 11.472 145 HD2 PRO 15 HD2 PRO 15 -5.997 -8.406 8.935 146 HD3 PRO 15 HD3 PRO 15 -6.896 -7.475 10.174 147 H ASP 16 H ASP 16 -3.157 -8.029 8.820 148 HA ASP 16 HA ASP 16 -0.297 -8.135 9.696 149 HB2 ASP 16 HB2 ASP 16 -1.999 -10.360 8.523 150 HB3 ASP 16 HB3 ASP 16 -0.238 -10.372 8.506 151 H VAL 17 H VAL 17 0.626 -6.701 8.468 152 HA VAL 17 HA VAL 17 0.799 -7.303 5.586 153 HB VAL 17 HB VAL 17 -0.827 -5.449 5.752 154 HG11 VAL 17 HG11 VAL 17 1.484 -3.775 6.819 155 HG12 VAL 17 HG12 VAL 17 -0.108 -3.180 6.325 156 HG13 VAL 17 HG13 VAL 17 0.033 -4.253 7.724 157 HG21 VAL 17 HG21 VAL 17 1.786 -4.607 4.448 158 HG22 VAL 17 HG22 VAL 17 0.592 -5.735 3.751 159 HG23 VAL 17 HG23 VAL 17 0.153 -4.047 4.044 160 H SER 18 H SER 18 2.801 -7.079 4.748 161 HA SER 18 HA SER 18 5.014 -6.457 6.680 162 HB2 SER 18 HB2 SER 18 4.874 -8.599 4.531 163 HB3 SER 18 HB3 SER 18 6.229 -8.297 5.639 164 HG SER 18 HG SER 18 4.807 -10.015 6.322 165 H VAL 19 H VAL 19 6.483 -5.008 6.065 166 HA VAL 19 HA VAL 19 6.439 -3.932 3.299 167 HB VAL 19 HB VAL 19 7.606 -2.839 5.858 168 HG11 VAL 19 HG11 VAL 19 9.151 -2.143 4.105 169 HG12 VAL 19 HG12 VAL 19 7.808 -1.720 3.019 170 HG13 VAL 19 HG13 VAL 19 8.114 -0.777 4.498 171 HG21 VAL 19 HG21 VAL 19 5.090 -2.648 5.393 172 HG22 VAL 19 HG22 VAL 19 5.959 -1.126 5.615 173 HG23 VAL 19 HG23 VAL 19 5.521 -1.659 3.984 174 H TYR 20 H TYR 20 7.921 -4.056 1.913 175 HA TYR 20 HA TYR 20 10.650 -4.944 2.693 176 HB2 TYR 20 HB2 TYR 20 9.628 -5.575 -0.040 177 HB3 TYR 20 HB3 TYR 20 10.856 -6.373 0.931 178 HD1 TYR 20 HD1 TYR 20 10.093 -7.894 2.847 179 HD2 TYR 20 HD2 TYR 20 7.392 -6.321 -0.103 180 HE1 TYR 20 HE1 TYR 20 8.410 -9.619 3.483 181 HE2 TYR 20 HE2 TYR 20 5.732 -8.086 0.475 182 HH TYR 20 HH TYR 20 6.345 -10.521 3.030 183 H ARG 21 H ARG 21 12.087 -3.486 2.231 184 HA ARG 21 HA ARG 21 11.731 -1.259 0.333 185 HB2 ARG 21 HB2 ARG 21 14.186 -2.443 1.698 186 HB3 ARG 21 HB3 ARG 21 14.263 -1.103 0.545 187 HG2 ARG 21 HG2 ARG 21 12.735 0.240 1.938 188 HG3 ARG 21 HG3 ARG 21 12.640 -1.058 3.137 189 HD2 ARG 21 HD2 ARG 21 15.243 0.286 2.298 190 HD3 ARG 21 HD3 ARG 21 14.238 0.843 3.649 191 HE ARG 21 HE ARG 21 14.783 -1.961 3.973 192 HH11 ARG 21 HH11 ARG 21 15.936 -2.641 5.567 193 HH12 ARG 21 HH12 ARG 21 17.221 -1.671 6.289 194 HH21 ARG 21 HH21 ARG 21 16.527 1.071 4.291 195 HH22 ARG 21 HH22 ARG 21 17.524 0.435 5.572 196 H ILE 22 H ILE 22 12.159 -1.202 -1.770 197 HA ILE 22 HA ILE 22 12.692 -3.809 -3.100 198 HB ILE 22 HB ILE 22 11.376 -3.000 -4.990 199 HG12 ILE 22 HG12 ILE 22 10.683 -0.597 -3.246 200 HG13 ILE 22 HG13 ILE 22 11.635 -0.571 -4.736 201 HG21 ILE 22 HG21 ILE 22 9.760 -2.854 -2.424 202 HG22 ILE 22 HG22 ILE 22 9.254 -3.457 -4.021 203 HG23 ILE 22 HG23 ILE 22 10.438 -4.358 -3.074 204 HD11 ILE 22 HD11 ILE 22 9.428 0.128 -5.312 205 HD12 ILE 22 HD12 ILE 22 9.619 -1.523 -5.943 206 HD13 ILE 22 HD13 ILE 22 8.684 -1.235 -4.460 207 HA PRO 23 HA PRO 23 16.234 -2.104 -5.205 208 HB2 PRO 23 HB2 PRO 23 16.368 -3.701 -7.432 209 HB3 PRO 23 HB3 PRO 23 16.738 -4.297 -5.785 210 HG2 PRO 23 HG2 PRO 23 14.101 -4.515 -7.290 211 HG3 PRO 23 HG3 PRO 23 15.027 -5.826 -6.477 212 HD2 PRO 23 HD2 PRO 23 12.971 -4.575 -5.256 213 HD3 PRO 23 HD3 PRO 23 14.436 -5.027 -4.336 214 HA PRO 24 HA PRO 24 14.704 0.659 -8.479 215 HB2 PRO 24 HB2 PRO 24 16.878 0.919 -10.134 216 HB3 PRO 24 HB3 PRO 24 16.755 1.704 -8.532 217 HG2 PRO 24 HG2 PRO 24 18.165 -0.890 -9.227 218 HG3 PRO 24 HG3 PRO 24 18.782 0.482 -8.255 219 HD2 PRO 24 HD2 PRO 24 17.719 -1.733 -7.095 220 HD3 PRO 24 HD3 PRO 24 17.447 -0.110 -6.400 221 H ARG 25 H ARG 25 13.224 -0.111 -9.820 222 HA ARG 25 HA ARG 25 13.727 -2.269 -11.800 223 HB2 ARG 25 HB2 ARG 25 12.337 -2.509 -9.150 224 HB3 ARG 25 HB3 ARG 25 11.442 -3.179 -10.499 225 HG2 ARG 25 HG2 ARG 25 14.277 -3.980 -9.747 226 HG3 ARG 25 HG3 ARG 25 12.783 -4.814 -9.290 227 HD2 ARG 25 HD2 ARG 25 12.240 -4.988 -11.770 228 HD3 ARG 25 HD3 ARG 25 13.905 -4.467 -12.087 229 HE ARG 25 HE ARG 25 13.759 -6.649 -10.155 230 HH11 ARG 25 HH11 ARG 25 14.412 -8.658 -10.600 231 HH12 ARG 25 HH12 ARG 25 14.778 -9.137 -12.247 232 HH21 ARG 25 HH21 ARG 25 13.883 -6.117 -13.632 233 HH22 ARG 25 HH22 ARG 25 14.441 -7.738 -13.932 234 H ALA 26 H ALA 26 11.800 -2.842 -13.026 235 HA ALA 26 HA ALA 26 10.268 -0.497 -13.864 236 HB1 ALA 26 HB1 ALA 26 9.405 -1.953 -15.605 237 HB2 ALA 26 HB2 ALA 26 11.175 -2.020 -15.536 238 HB3 ALA 26 HB3 ALA 26 10.215 -3.361 -14.869 239 H SER 27 H SER 27 8.410 0.030 -13.228 240 HA SER 27 HA SER 27 7.511 -0.970 -10.783 241 HB2 SER 27 HB2 SER 27 6.015 1.022 -10.812 242 HB3 SER 27 HB3 SER 27 7.711 1.360 -11.224 243 HG SER 27 HG SER 27 6.195 2.378 -12.663 244 H ASN 28 H ASN 28 6.131 -1.687 -13.835 245 HA ASN 28 HA ASN 28 4.159 -3.399 -12.422 246 HB2 ASN 28 HB2 ASN 28 2.411 -2.836 -14.157 247 HB3 ASN 28 HB3 ASN 28 2.784 -1.584 -12.997 248 HD21 ASN 28 HD21 ASN 28 3.585 0.777 -15.452 249 HD22 ASN 28 HD22 ASN 28 3.153 0.430 -13.770 250 H ARG 29 H ARG 29 6.792 -3.656 -13.880 251 HA ARG 29 HA ARG 29 6.079 -5.934 -15.715 252 HB2 ARG 29 HB2 ARG 29 8.237 -3.885 -16.279 253 HB3 ARG 29 HB3 ARG 29 7.766 -5.263 -17.275 254 HG2 ARG 29 HG2 ARG 29 5.467 -4.205 -17.518 255 HG3 ARG 29 HG3 ARG 29 6.123 -2.764 -16.691 256 HD2 ARG 29 HD2 ARG 29 7.931 -2.651 -18.388 257 HD3 ARG 29 HD3 ARG 29 7.192 -4.032 -19.228 258 HE ARG 29 HE ARG 29 5.223 -1.981 -18.862 259 HH11 ARG 29 HH11 ARG 29 4.546 -0.676 -20.527 260 HH12 ARG 29 HH12 ARG 29 5.544 -0.470 -21.937 261 HH21 ARG 29 HH21 ARG 29 8.061 -2.531 -20.844 262 HH22 ARG 29 HH22 ARG 29 7.485 -1.492 -22.119 263 H GLY 30 H GLY 30 8.395 -4.538 -13.439 264 HA2 GLY 30 HA2 GLY 30 10.013 -7.046 -13.530 265 HA3 GLY 30 HA3 GLY 30 10.616 -5.417 -13.146 266 H TYR 31 H TYR 31 8.170 -4.977 -11.332 267 HA TYR 31 HA TYR 31 9.003 -6.260 -8.872 268 HB2 TYR 31 HB2 TYR 31 6.350 -5.026 -9.723 269 HB3 TYR 31 HB3 TYR 31 6.793 -5.465 -8.092 270 HD1 TYR 31 HD1 TYR 31 9.802 -4.022 -9.071 271 HD2 TYR 31 HD2 TYR 31 5.650 -3.002 -8.441 272 HE1 TYR 31 HE1 TYR 31 10.409 -1.627 -8.743 273 HE2 TYR 31 HE2 TYR 31 6.284 -0.637 -8.062 274 HH TYR 31 HH TYR 31 9.675 0.496 -8.319 275 H ARG 32 H ARG 32 8.923 -8.516 -8.798 276 HA ARG 32 HA ARG 32 6.385 -9.863 -9.717 277 HB2 ARG 32 HB2 ARG 32 7.551 -11.828 -10.333 278 HB3 ARG 32 HB3 ARG 32 8.208 -10.462 -11.207 279 HG2 ARG 32 HG2 ARG 32 9.700 -11.014 -8.701 280 HG3 ARG 32 HG3 ARG 32 9.623 -12.423 -9.771 281 HD2 ARG 32 HD2 ARG 32 10.440 -11.073 -11.654 282 HD3 ARG 32 HD3 ARG 32 10.397 -9.635 -10.631 283 HE ARG 32 HE ARG 32 12.461 -10.176 -9.774 284 HH11 ARG 32 HH11 ARG 32 14.204 -11.150 -9.353 285 HH12 ARG 32 HH12 ARG 32 14.479 -12.840 -9.776 286 HH21 ARG 32 HH21 ARG 32 11.329 -13.192 -11.184 287 HH22 ARG 32 HH22 ARG 32 12.837 -13.982 -10.810 288 H ALA 33 H ALA 33 6.922 -8.790 -7.121 289 HA ALA 33 HA ALA 33 7.085 -9.175 -4.910 290 HB1 ALA 33 HB1 ALA 33 4.976 -10.303 -5.522 291 HB2 ALA 33 HB2 ALA 33 5.833 -11.844 -5.606 292 HB3 ALA 33 HB3 ALA 33 5.744 -10.975 -4.052 293 H SER 34 H SER 34 8.192 -12.209 -6.516 294 HA SER 34 HA SER 34 10.029 -13.034 -4.533 295 HB2 SER 34 HB2 SER 34 10.112 -13.554 -7.525 296 HB3 SER 34 HB3 SER 34 10.917 -14.517 -6.275 297 HG SER 34 HG SER 34 8.895 -15.112 -5.465 298 H ASP 35 H ASP 35 10.371 -10.319 -6.521 299 HA ASP 35 HA ASP 35 13.303 -10.310 -6.652 300 HB2 ASP 35 HB2 ASP 35 11.368 -9.132 -8.177 301 HB3 ASP 35 HB3 ASP 35 11.692 -7.814 -7.070 302 H TRP 36 H TRP 36 10.998 -9.682 -4.208 303 HA TRP 36 HA TRP 36 12.530 -7.537 -2.875 304 HB2 TRP 36 HB2 TRP 36 9.801 -8.648 -2.201 305 HB3 TRP 36 HB3 TRP 36 10.496 -7.125 -1.691 306 HD1 TRP 36 HD1 TRP 36 11.259 -6.601 -5.048 307 HE1 TRP 36 HE1 TRP 36 9.342 -5.522 -6.395 308 HE3 TRP 36 HE3 TRP 36 7.341 -7.668 -1.931 309 HZ2 TRP 36 HZ2 TRP 36 6.591 -4.939 -6.018 310 HZ3 TRP 36 HZ3 TRP 36 5.086 -6.692 -2.378 311 HH2 TRP 36 HH2 TRP 36 4.710 -5.318 -4.404 312 H LYS 37 H LYS 37 12.228 -7.638 -0.435 313 HA LYS 37 HA LYS 37 13.698 -9.905 0.626 314 HB2 LYS 37 HB2 LYS 37 12.808 -7.250 1.729 315 HB3 LYS 37 HB3 LYS 37 13.514 -8.483 2.761 316 HG2 LYS 37 HG2 LYS 37 15.522 -8.633 1.346 317 HG3 LYS 37 HG3 LYS 37 14.838 -7.417 0.251 318 HD2 LYS 37 HD2 LYS 37 16.361 -6.315 1.689 319 HD3 LYS 37 HD3 LYS 37 14.708 -5.836 2.148 320 HE2 LYS 37 HE2 LYS 37 14.803 -7.438 4.042 321 HE3 LYS 37 HE3 LYS 37 16.461 -7.864 3.597 322 HZ1 LYS 37 HZ1 LYS 37 16.408 -6.192 5.355 323 HZ2 LYS 37 HZ2 LYS 37 17.066 -5.525 4.016 324 HZ3 LYS 37 HZ3 LYS 37 15.524 -5.164 4.448 325 H LEU 38 H LEU 38 11.400 -11.036 -0.152 326 HA LEU 38 HA LEU 38 9.141 -10.952 1.466 327 HB2 LEU 38 HB2 LEU 38 10.217 -13.376 -0.014 328 HB3 LEU 38 HB3 LEU 38 8.574 -13.193 0.593 329 HG LEU 38 HG LEU 38 9.888 -11.562 -1.604 330 HD11 LEU 38 HD11 LEU 38 7.537 -13.520 -1.554 331 HD12 LEU 38 HD12 LEU 38 8.098 -12.639 -2.979 332 HD13 LEU 38 HD13 LEU 38 9.153 -13.843 -2.223 333 HD21 LEU 38 HD21 LEU 38 7.577 -10.560 -1.900 334 HD22 LEU 38 HD22 LEU 38 7.141 -11.259 -0.325 335 HD23 LEU 38 HD23 LEU 38 8.417 -10.027 -0.444 336 H ASP 39 H ASP 39 12.001 -12.927 2.172 337 HA ASP 39 HA ASP 39 10.638 -14.137 4.517 338 HB2 ASP 39 HB2 ASP 39 11.894 -15.520 2.850 339 HB3 ASP 39 HB3 ASP 39 13.380 -14.741 3.381 340 H GLN 40 H GLN 40 12.153 -11.301 4.017 341 HA GLN 40 HA GLN 40 12.969 -10.969 6.828 342 HB2 GLN 40 HB2 GLN 40 15.095 -9.741 5.987 343 HB3 GLN 40 HB3 GLN 40 15.117 -11.471 6.198 344 HG2 GLN 40 HG2 GLN 40 14.580 -10.222 3.485 345 HG3 GLN 40 HG3 GLN 40 16.214 -10.405 4.097 346 HE21 GLN 40 HE21 GLN 40 15.068 -11.669 1.690 347 HE22 GLN 40 HE22 GLN 40 15.218 -13.393 1.981 348 HA PRO 41 HA PRO 41 10.572 -7.408 4.875 349 HB2 PRO 41 HB2 PRO 41 8.735 -7.109 6.942 350 HB3 PRO 41 HB3 PRO 41 8.482 -8.093 5.479 351 HG2 PRO 41 HG2 PRO 41 9.469 -9.022 8.193 352 HG3 PRO 41 HG3 PRO 41 8.213 -9.773 7.157 353 HD2 PRO 41 HD2 PRO 41 10.738 -10.731 7.198 354 HD3 PRO 41 HD3 PRO 41 9.845 -10.625 5.651 355 H ASP 42 H ASP 42 11.052 -5.378 5.290 356 HA ASP 42 HA ASP 42 13.059 -4.700 7.286 357 HB2 ASP 42 HB2 ASP 42 11.438 -3.011 5.332 358 HB3 ASP 42 HB3 ASP 42 12.800 -2.424 6.293 359 H TRP 43 H TRP 43 9.579 -4.489 7.077 360 HA TRP 43 HA TRP 43 9.378 -3.982 9.951 361 HB2 TRP 43 HB2 TRP 43 9.459 -1.682 9.208 362 HB3 TRP 43 HB3 TRP 43 8.316 -1.992 7.916 363 HD1 TRP 43 HD1 TRP 43 8.479 -1.118 11.579 364 HE1 TRP 43 HE1 TRP 43 6.129 -0.510 12.417 365 HE3 TRP 43 HE3 TRP 43 5.756 -2.825 7.611 366 HZ2 TRP 43 HZ2 TRP 43 3.427 -0.508 11.355 367 HZ3 TRP 43 HZ3 TRP 43 3.296 -2.371 7.493 368 HH2 TRP 43 HH2 TRP 43 2.129 -1.262 9.369 369 H THR 44 H THR 44 7.279 -4.584 10.789 370 HA THR 44 HA THR 44 5.238 -5.487 8.852 371 HB THR 44 HB THR 44 4.680 -7.469 10.169 372 HG1 THR 44 HG1 THR 44 7.199 -7.083 11.411 373 HG21 THR 44 HG21 THR 44 6.391 -8.956 9.372 374 HG22 THR 44 HG22 THR 44 6.078 -7.699 8.169 375 HG23 THR 44 HG23 THR 44 7.541 -7.608 9.173 376 H GLY 45 H GLY 45 3.130 -5.346 9.534 377 HA2 GLY 45 HA2 GLY 45 2.275 -4.767 12.200 378 HA3 GLY 45 HA3 GLY 45 2.540 -3.247 11.358 379 H ARG 46 H ARG 46 0.479 -2.581 11.262 380 HA ARG 46 HA ARG 46 -1.626 -4.300 10.014 381 HB2 ARG 46 HB2 ARG 46 -2.020 -1.862 11.787 382 HB3 ARG 46 HB3 ARG 46 -3.248 -2.993 11.213 383 HG2 ARG 46 HG2 ARG 46 -2.062 -4.811 12.561 384 HG3 ARG 46 HG3 ARG 46 -1.030 -3.535 13.230 385 HD2 ARG 46 HD2 ARG 46 -3.091 -2.345 14.019 386 HD3 ARG 46 HD3 ARG 46 -4.073 -3.699 13.422 387 HE ARG 46 HE ARG 46 -2.135 -4.791 15.167 388 HH11 ARG 46 HH11 ARG 46 -2.285 -4.927 17.407 389 HH12 ARG 46 HH12 ARG 46 -3.762 -4.418 18.172 390 HH21 ARG 46 HH21 ARG 46 -5.034 -2.854 15.402 391 HH22 ARG 46 HH22 ARG 46 -5.229 -3.185 17.101 392 H LEU 47 H LEU 47 -3.007 -3.465 8.551 393 HA LEU 47 HA LEU 47 -2.095 -1.176 6.886 394 HB2 LEU 47 HB2 LEU 47 -2.503 -3.362 5.804 395 HB3 LEU 47 HB3 LEU 47 -4.121 -3.406 6.499 396 HG LEU 47 HG LEU 47 -4.773 -1.430 5.124 397 HD11 LEU 47 HD11 LEU 47 -2.018 -1.816 3.861 398 HD12 LEU 47 HD12 LEU 47 -3.319 -0.804 3.204 399 HD13 LEU 47 HD13 LEU 47 -2.569 -0.374 4.743 400 HD21 LEU 47 HD21 LEU 47 -5.205 -3.727 4.393 401 HD22 LEU 47 HD22 LEU 47 -4.864 -2.685 3.014 402 HD23 LEU 47 HD23 LEU 47 -3.601 -3.782 3.626 403 H ARG 48 H ARG 48 -3.281 0.650 6.658 404 HA ARG 48 HA ARG 48 -6.135 0.805 7.491 405 HB2 ARG 48 HB2 ARG 48 -4.900 1.528 9.437 406 HB3 ARG 48 HB3 ARG 48 -3.820 2.528 8.472 407 HG2 ARG 48 HG2 ARG 48 -5.595 4.154 8.030 408 HG3 ARG 48 HG3 ARG 48 -6.793 3.118 8.855 409 HD2 ARG 48 HD2 ARG 48 -5.604 3.272 10.929 410 HD3 ARG 48 HD3 ARG 48 -4.214 4.071 10.163 411 HE ARG 48 HE ARG 48 -6.146 5.917 9.722 412 HH11 ARG 48 HH11 ARG 48 -6.576 7.563 11.006 413 HH12 ARG 48 HH12 ARG 48 -6.475 7.441 12.760 414 HH21 ARG 48 HH21 ARG 48 -4.921 4.368 12.631 415 HH22 ARG 48 HH22 ARG 48 -5.544 5.634 13.654 416 H ILE 49 H ILE 49 -6.795 0.894 5.440 417 HA ILE 49 HA ILE 49 -5.798 3.044 3.646 418 HB ILE 49 HB ILE 49 -8.033 1.065 3.127 419 HG12 ILE 49 HG12 ILE 49 -5.064 0.977 2.389 420 HG13 ILE 49 HG13 ILE 49 -5.933 -0.140 3.452 421 HG21 ILE 49 HG21 ILE 49 -6.456 2.882 1.243 422 HG22 ILE 49 HG22 ILE 49 -7.763 1.771 0.775 423 HG23 ILE 49 HG23 ILE 49 -8.126 3.166 1.782 424 HD11 ILE 49 HD11 ILE 49 -5.768 -1.306 1.487 425 HD12 ILE 49 HD12 ILE 49 -7.412 -0.696 1.455 426 HD13 ILE 49 HD13 ILE 49 -6.156 0.088 0.457 427 H THR 50 H THR 50 -6.806 4.872 3.373 428 HA THR 50 HA THR 50 -9.297 5.560 4.819 429 HB THR 50 HB THR 50 -7.616 7.638 5.490 430 HG1 THR 50 HG1 THR 50 -5.836 6.037 4.812 431 HG21 THR 50 HG21 THR 50 -8.147 5.101 7.078 432 HG22 THR 50 HG22 THR 50 -7.526 6.609 7.762 433 HG23 THR 50 HG23 THR 50 -9.144 6.584 7.056 434 H SER 51 H SER 51 -10.043 7.870 4.268 435 HA SER 51 HA SER 51 -8.685 9.167 2.008 436 HB2 SER 51 HB2 SER 51 -10.656 9.133 0.593 437 HB3 SER 51 HB3 SER 51 -10.161 7.473 0.957 438 HG SER 51 HG SER 51 -12.425 7.785 1.177 439 H LYS 52 H LYS 52 -9.435 11.233 1.532 440 HA LYS 52 HA LYS 52 -11.878 12.077 2.734 441 HB2 LYS 52 HB2 LYS 52 -10.117 12.667 4.459 442 HB3 LYS 52 HB3 LYS 52 -9.498 13.854 3.316 443 HG2 LYS 52 HG2 LYS 52 -11.035 14.740 5.055 444 HG3 LYS 52 HG3 LYS 52 -11.525 15.109 3.403 445 HD2 LYS 52 HD2 LYS 52 -13.431 14.584 4.849 446 HD3 LYS 52 HD3 LYS 52 -13.296 13.402 3.547 447 HE2 LYS 52 HE2 LYS 52 -12.313 11.761 5.045 448 HE3 LYS 52 HE3 LYS 52 -12.265 12.933 6.373 449 HZ1 LYS 52 HZ1 LYS 52 -14.234 11.356 6.337 450 HZ2 LYS 52 HZ2 LYS 52 -14.650 12.949 6.443 451 HZ3 LYS 52 HZ3 LYS 52 -14.790 12.123 5.036 452 H GLY 53 H GLY 53 -12.991 12.845 1.072 453 HA2 GLY 53 HA2 GLY 53 -13.651 14.061 -0.750 454 HA3 GLY 53 HA3 GLY 53 -12.174 15.023 -0.623 455 H LYS 54 H LYS 54 -11.284 14.936 -2.523 456 HA LYS 54 HA LYS 54 -11.145 12.498 -4.187 457 HB2 LYS 54 HB2 LYS 54 -10.495 15.418 -4.523 458 HB3 LYS 54 HB3 LYS 54 -10.137 14.212 -5.796 459 HG2 LYS 54 HG2 LYS 54 -12.569 13.548 -5.753 460 HG3 LYS 54 HG3 LYS 54 -12.879 14.908 -4.667 461 HD2 LYS 54 HD2 LYS 54 -11.783 15.096 -7.501 462 HD3 LYS 54 HD3 LYS 54 -13.452 15.414 -6.999 463 HE2 LYS 54 HE2 LYS 54 -12.656 17.264 -5.532 464 HE3 LYS 54 HE3 LYS 54 -10.998 16.975 -6.075 465 HZ1 LYS 54 HZ1 LYS 54 -12.038 18.764 -7.339 466 HZ2 LYS 54 HZ2 LYS 54 -11.715 17.519 -8.341 467 HZ3 LYS 54 HZ3 LYS 54 -13.247 17.791 -7.838 468 H THR 55 H THR 55 -9.613 12.645 -1.640 469 HA THR 55 HA THR 55 -7.043 11.723 -2.809 470 HB THR 55 HB THR 55 -7.164 13.217 -0.170 471 HG1 THR 55 HG1 THR 55 -7.558 14.713 -1.756 472 HG21 THR 55 HG21 THR 55 -4.704 13.362 -0.534 473 HG22 THR 55 HG22 THR 55 -5.253 11.686 -0.409 474 HG23 THR 55 HG23 THR 55 -4.871 12.378 -2.005 475 H ALA 56 H ALA 56 -6.526 9.744 -2.191 476 HA ALA 56 HA ALA 56 -7.792 8.526 0.227 477 HB1 ALA 56 HB1 ALA 56 -6.565 7.126 -2.162 478 HB2 ALA 56 HB2 ALA 56 -7.277 6.352 -0.734 479 HB3 ALA 56 HB3 ALA 56 -8.310 7.293 -1.821 480 H TYR 57 H TYR 57 -6.383 7.155 1.490 481 HA TYR 57 HA TYR 57 -3.506 7.932 1.558 482 HB2 TYR 57 HB2 TYR 57 -5.456 8.054 3.898 483 HB3 TYR 57 HB3 TYR 57 -3.744 8.431 3.941 484 HD1 TYR 57 HD1 TYR 57 -2.946 10.422 2.437 485 HD2 TYR 57 HD2 TYR 57 -7.056 9.806 3.632 486 HE1 TYR 57 HE1 TYR 57 -3.446 12.823 2.004 487 HE2 TYR 57 HE2 TYR 57 -7.549 12.185 3.147 488 HH TYR 57 HH TYR 57 -5.042 14.472 2.024 489 H ILE 58 H ILE 58 -2.537 5.937 1.315 490 HA ILE 58 HA ILE 58 -3.550 3.590 2.892 491 HB ILE 58 HB ILE 58 -1.225 3.781 0.941 492 HG12 ILE 58 HG12 ILE 58 -2.620 2.022 -0.314 493 HG13 ILE 58 HG13 ILE 58 -3.999 2.560 0.641 494 HG21 ILE 58 HG21 ILE 58 -2.358 1.359 2.407 495 HG22 ILE 58 HG22 ILE 58 -1.030 1.356 1.220 496 HG23 ILE 58 HG23 ILE 58 -0.801 2.139 2.765 497 HD11 ILE 58 HD11 ILE 58 -3.760 3.549 -1.674 498 HD12 ILE 58 HD12 ILE 58 -3.872 4.772 -0.405 499 HD13 ILE 58 HD13 ILE 58 -2.290 4.371 -1.131 500 H LYS 59 H LYS 59 -3.177 3.875 4.972 501 HA LYS 59 HA LYS 59 -0.450 4.734 5.830 502 HB2 LYS 59 HB2 LYS 59 -3.048 4.817 7.410 503 HB3 LYS 59 HB3 LYS 59 -1.448 5.353 7.946 504 HG2 LYS 59 HG2 LYS 59 -1.480 6.870 5.818 505 HG3 LYS 59 HG3 LYS 59 -3.213 6.551 5.775 506 HD2 LYS 59 HD2 LYS 59 -3.489 7.548 8.004 507 HD3 LYS 59 HD3 LYS 59 -1.726 7.750 8.153 508 HE2 LYS 59 HE2 LYS 59 -1.758 9.188 6.088 509 HE3 LYS 59 HE3 LYS 59 -3.526 9.072 6.076 510 HZ1 LYS 59 HZ1 LYS 59 -1.930 10.228 8.297 511 HZ2 LYS 59 HZ2 LYS 59 -2.735 11.096 7.173 512 HZ3 LYS 59 HZ3 LYS 59 -3.579 10.155 8.217 513 H LEU 60 H LEU 60 0.733 3.597 7.113 514 HA LEU 60 HA LEU 60 -0.059 0.799 7.855 515 HB2 LEU 60 HB2 LEU 60 2.401 2.036 6.660 516 HB3 LEU 60 HB3 LEU 60 2.659 0.827 7.904 517 HG LEU 60 HG LEU 60 1.471 -0.859 6.709 518 HD11 LEU 60 HD11 LEU 60 0.892 1.247 4.578 519 HD12 LEU 60 HD12 LEU 60 0.707 -0.506 4.338 520 HD13 LEU 60 HD13 LEU 60 -0.295 0.320 5.527 521 HD21 LEU 60 HD21 LEU 60 3.859 -0.348 6.169 522 HD22 LEU 60 HD22 LEU 60 2.993 -1.118 4.834 523 HD23 LEU 60 HD23 LEU 60 3.320 0.630 4.793 524 H GLU 61 H GLU 61 0.042 0.225 9.963 525 HA GLU 61 HA GLU 61 1.259 2.133 11.913 526 HB2 GLU 61 HB2 GLU 61 -1.557 1.018 12.150 527 HB3 GLU 61 HB3 GLU 61 -0.697 1.982 13.358 528 HG2 GLU 61 HG2 GLU 61 -0.476 3.795 11.547 529 HG3 GLU 61 HG3 GLU 61 -1.669 2.882 10.622 530 H ASP 62 H ASP 62 1.903 1.312 13.918 531 HA ASP 62 HA ASP 62 2.987 -1.337 13.806 532 HB2 ASP 62 HB2 ASP 62 3.913 0.705 14.992 533 HB3 ASP 62 HB3 ASP 62 2.635 0.470 16.205 534 H LYS 63 H LYS 63 2.361 -3.199 14.642 535 HA LYS 63 HA LYS 63 -0.401 -3.498 15.378 536 HB2 LYS 63 HB2 LYS 63 0.244 -6.016 15.413 537 HB3 LYS 63 HB3 LYS 63 0.496 -5.170 13.885 538 HG2 LYS 63 HG2 LYS 63 2.850 -4.890 14.318 539 HG3 LYS 63 HG3 LYS 63 2.702 -5.555 15.949 540 HD2 LYS 63 HD2 LYS 63 2.351 -7.753 15.138 541 HD3 LYS 63 HD3 LYS 63 1.972 -7.177 13.490 542 HE2 LYS 63 HE2 LYS 63 4.274 -6.286 13.268 543 HE3 LYS 63 HE3 LYS 63 4.684 -6.892 14.872 544 HZ1 LYS 63 HZ1 LYS 63 5.329 -8.334 12.930 545 HZ2 LYS 63 HZ2 LYS 63 4.470 -9.127 14.092 546 HZ3 LYS 63 HZ3 LYS 63 3.756 -8.679 12.689 547 H VAL 64 H VAL 64 2.113 -2.791 17.362 548 HA VAL 64 HA VAL 64 0.662 -3.925 19.724 549 HB VAL 64 HB VAL 64 3.615 -3.350 19.301 550 HG11 VAL 64 HG11 VAL 64 3.071 -2.772 21.621 551 HG12 VAL 64 HG12 VAL 64 2.189 -4.307 21.825 552 HG13 VAL 64 HG13 VAL 64 3.952 -4.298 21.588 553 HG21 VAL 64 HG21 VAL 64 3.888 -5.783 19.741 554 HG22 VAL 64 HG22 VAL 64 2.119 -5.956 19.816 555 HG23 VAL 64 HG23 VAL 64 2.917 -5.475 18.303 556 H SER 65 H SER 65 2.517 -1.094 18.499 557 HA SER 65 HA SER 65 1.647 0.476 20.852 558 HB2 SER 65 HB2 SER 65 3.464 1.158 18.520 559 HB3 SER 65 HB3 SER 65 3.135 2.221 19.901 560 HG SER 65 HG SER 65 5.053 1.002 20.186 561 H GLY 66 H GLY 66 0.635 0.087 17.547 562 HA2 GLY 66 HA2 GLY 66 -1.154 0.998 16.404 563 HA3 GLY 66 HA3 GLY 66 -1.604 1.918 17.845 564 H GLU 67 H GLU 67 1.657 2.304 16.744 565 HA GLU 67 HA GLU 67 1.123 5.131 16.147 566 HB2 GLU 67 HB2 GLU 67 3.399 5.517 16.596 567 HB3 GLU 67 HB3 GLU 67 2.781 4.414 17.836 568 HG2 GLU 67 HG2 GLU 67 3.857 2.506 16.705 569 HG3 GLU 67 HG3 GLU 67 4.463 3.573 15.436 570 H LEU 68 H LEU 68 1.935 6.243 14.307 571 HA LEU 68 HA LEU 68 1.523 4.795 11.858 572 HB2 LEU 68 HB2 LEU 68 0.833 7.158 12.279 573 HB3 LEU 68 HB3 LEU 68 2.531 7.624 12.335 574 HG LEU 68 HG LEU 68 2.752 6.821 9.927 575 HD11 LEU 68 HD11 LEU 68 0.672 6.631 8.605 576 HD12 LEU 68 HD12 LEU 68 0.762 5.348 9.810 577 HD13 LEU 68 HD13 LEU 68 -0.296 6.740 10.097 578 HD21 LEU 68 HD21 LEU 68 2.479 9.200 10.489 579 HD22 LEU 68 HD22 LEU 68 1.634 8.807 8.984 580 HD23 LEU 68 HD23 LEU 68 0.711 9.013 10.490 581 H PHE 69 H PHE 69 2.917 3.682 10.673 582 HA PHE 69 HA PHE 69 5.853 3.992 10.974 583 HB2 PHE 69 HB2 PHE 69 5.098 1.735 10.899 584 HB3 PHE 69 HB3 PHE 69 4.075 2.029 9.501 585 HD1 PHE 69 HD1 PHE 69 7.693 2.133 10.537 586 HD2 PHE 69 HD2 PHE 69 4.876 1.528 7.324 587 HE1 PHE 69 HE1 PHE 69 9.556 1.537 9.008 588 HE2 PHE 69 HE2 PHE 69 6.746 1.005 5.790 589 HZ PHE 69 HZ PHE 69 9.086 0.983 6.627 590 H ALA 70 H ALA 70 3.414 4.118 8.327 591 HA ALA 70 HA ALA 70 4.797 6.345 7.028 592 HB1 ALA 70 HB1 ALA 70 4.612 3.633 5.631 593 HB2 ALA 70 HB2 ALA 70 5.255 5.146 4.952 594 HB3 ALA 70 HB3 ALA 70 6.108 4.349 6.275 595 H GLN 71 H GLN 71 3.653 7.104 5.097 596 HA GLN 71 HA GLN 71 0.848 6.227 4.757 597 HB2 GLN 71 HB2 GLN 71 0.143 8.646 4.834 598 HB3 GLN 71 HB3 GLN 71 0.532 7.911 6.392 599 HG2 GLN 71 HG2 GLN 71 2.485 9.156 6.683 600 HG3 GLN 71 HG3 GLN 71 2.712 9.421 4.967 601 HE21 GLN 71 HE21 GLN 71 1.484 12.666 5.309 602 HE22 GLN 71 HE22 GLN 71 2.743 11.573 4.708 603 H ALA 72 H ALA 72 0.203 6.263 2.669 604 HA ALA 72 HA ALA 72 1.767 7.833 0.643 605 HB1 ALA 72 HB1 ALA 72 0.507 5.082 0.428 606 HB2 ALA 72 HB2 ALA 72 1.208 5.998 -0.920 607 HB3 ALA 72 HB3 ALA 72 2.232 5.476 0.425 608 HA PRO 73 HA PRO 73 -2.406 9.622 0.118 609 HB2 PRO 73 HB2 PRO 73 -0.748 11.786 -1.125 610 HB3 PRO 73 HB3 PRO 73 -2.107 11.922 0.029 611 HG2 PRO 73 HG2 PRO 73 0.465 12.279 0.838 612 HG3 PRO 73 HG3 PRO 73 -0.695 11.372 1.869 613 HD2 PRO 73 HD2 PRO 73 1.363 10.255 -0.061 614 HD3 PRO 73 HD3 PRO 73 1.047 9.793 1.640 615 H VAL 74 H VAL 74 -3.648 9.536 -1.717 616 HA VAL 74 HA VAL 74 -2.373 9.213 -4.400 617 HB VAL 74 HB VAL 74 -4.862 7.655 -3.697 618 HG11 VAL 74 HG11 VAL 74 -4.082 6.158 -5.432 619 HG12 VAL 74 HG12 VAL 74 -4.084 7.822 -6.024 620 HG13 VAL 74 HG13 VAL 74 -2.552 7.049 -5.574 621 HG21 VAL 74 HG21 VAL 74 -3.409 6.904 -1.906 622 HG22 VAL 74 HG22 VAL 74 -3.576 5.652 -3.134 623 HG23 VAL 74 HG23 VAL 74 -2.082 6.615 -3.051 624 H GLU 75 H GLU 75 -3.321 10.520 -5.955 625 HA GLU 75 HA GLU 75 -5.720 12.086 -5.218 626 HB2 GLU 75 HB2 GLU 75 -3.943 12.127 -7.686 627 HB3 GLU 75 HB3 GLU 75 -5.297 13.225 -7.386 628 HG2 GLU 75 HG2 GLU 75 -4.190 13.998 -5.282 629 HG3 GLU 75 HG3 GLU 75 -2.797 12.983 -5.659 630 H GLN 76 H GLN 76 -5.044 9.305 -7.234 631 HA GLN 76 HA GLN 76 -7.761 8.570 -7.291 632 HB2 GLN 76 HB2 GLN 76 -7.998 8.430 -9.847 633 HB3 GLN 76 HB3 GLN 76 -8.366 9.917 -9.016 634 HG2 GLN 76 HG2 GLN 76 -7.282 10.524 -11.006 635 HG3 GLN 76 HG3 GLN 76 -6.146 10.866 -9.721 636 HE21 GLN 76 HE21 GLN 76 -3.733 8.577 -11.040 637 HE22 GLN 76 HE22 GLN 76 -4.127 9.636 -9.689 638 H TYR 77 H TYR 77 -8.119 6.433 -8.098 639 HA TYR 77 HA TYR 77 -5.623 4.832 -8.324 640 HB2 TYR 77 HB2 TYR 77 -6.796 4.607 -6.178 641 HB3 TYR 77 HB3 TYR 77 -8.253 4.099 -7.042 642 HD1 TYR 77 HD1 TYR 77 -8.646 1.815 -7.371 643 HD2 TYR 77 HD2 TYR 77 -4.624 3.201 -6.666 644 HE1 TYR 77 HE1 TYR 77 -7.841 -0.540 -7.356 645 HE2 TYR 77 HE2 TYR 77 -3.809 0.842 -6.756 646 HH TYR 77 HH TYR 77 -6.026 -1.919 -7.253 647 HA PRO 78 HA PRO 78 -4.706 3.046 -9.298 648 HB2 PRO 78 HB2 PRO 78 -3.590 2.443 -11.702 649 HB3 PRO 78 HB3 PRO 78 -4.659 1.315 -10.811 650 HG2 PRO 78 HG2 PRO 78 -5.423 3.211 -13.061 651 HG3 PRO 78 HG3 PRO 78 -5.795 1.463 -12.914 652 HD2 PRO 78 HD2 PRO 78 -7.591 3.368 -12.175 653 HD3 PRO 78 HD3 PRO 78 -7.421 1.853 -11.242 654 H GLY 79 H GLY 79 -2.810 4.246 -9.281 655 HA2 GLY 79 HA2 GLY 79 -2.255 6.459 -11.091 656 HA3 GLY 79 HA3 GLY 79 -2.860 6.981 -9.518 657 H ILE 80 H ILE 80 -0.620 8.024 -9.802 658 HA ILE 80 HA ILE 80 1.772 6.675 -9.938 659 HB ILE 80 HB ILE 80 1.543 9.057 -10.250 660 HG12 ILE 80 HG12 ILE 80 3.495 9.957 -9.059 661 HG13 ILE 80 HG13 ILE 80 3.491 8.587 -7.951 662 HG21 ILE 80 HG21 ILE 80 1.304 10.678 -8.441 663 HG22 ILE 80 HG22 ILE 80 -0.090 9.603 -8.442 664 HG23 ILE 80 HG23 ILE 80 1.198 9.390 -7.234 665 HD11 ILE 80 HD11 ILE 80 4.036 7.060 -9.811 666 HD12 ILE 80 HD12 ILE 80 3.937 8.417 -10.961 667 HD13 ILE 80 HD13 ILE 80 5.202 8.384 -9.715 668 H ALA 81 H ALA 81 -0.067 7.139 -6.951 669 HA ALA 81 HA ALA 81 2.231 6.292 -5.309 670 HB1 ALA 81 HB1 ALA 81 0.840 7.044 -3.438 671 HB2 ALA 81 HB2 ALA 81 0.978 8.290 -4.690 672 HB3 ALA 81 HB3 ALA 81 -0.510 7.334 -4.554 673 H VAL 82 H VAL 82 0.213 4.409 -7.005 674 HA VAL 82 HA VAL 82 0.516 2.210 -5.069 675 HB VAL 82 HB VAL 82 -2.200 2.746 -6.264 676 HG11 VAL 82 HG11 VAL 82 -1.763 0.361 -5.813 677 HG12 VAL 82 HG12 VAL 82 -1.161 0.744 -4.198 678 HG13 VAL 82 HG13 VAL 82 -2.879 0.963 -4.581 679 HG21 VAL 82 HG21 VAL 82 -1.416 3.243 -3.379 680 HG22 VAL 82 HG22 VAL 82 -1.930 4.453 -4.575 681 HG23 VAL 82 HG23 VAL 82 -3.066 3.227 -4.030 682 H GLU 83 H GLU 83 1.179 0.462 -6.067 683 HA GLU 83 HA GLU 83 0.491 -0.160 -8.885 684 HB2 GLU 83 HB2 GLU 83 3.222 0.443 -7.752 685 HB3 GLU 83 HB3 GLU 83 3.115 -0.824 -8.958 686 HG2 GLU 83 HG2 GLU 83 1.956 1.932 -9.422 687 HG3 GLU 83 HG3 GLU 83 3.629 1.514 -9.776 688 H THR 84 H THR 84 1.401 -2.286 -9.546 689 HA THR 84 HA THR 84 0.839 -4.391 -7.442 690 HB THR 84 HB THR 84 -0.408 -5.586 -9.081 691 HG1 THR 84 HG1 THR 84 -0.702 -4.795 -11.173 692 HG21 THR 84 HG21 THR 84 -2.302 -4.149 -9.500 693 HG22 THR 84 HG22 THR 84 -1.591 -3.639 -7.960 694 HG23 THR 84 HG23 THR 84 -1.298 -2.682 -9.419 695 H VAL 85 H VAL 85 1.732 -6.494 -7.831 696 HA VAL 85 HA VAL 85 4.305 -6.511 -9.293 697 HB VAL 85 HB VAL 85 4.686 -8.682 -8.351 698 HG11 VAL 85 HG11 VAL 85 5.202 -6.668 -7.034 699 HG12 VAL 85 HG12 VAL 85 3.635 -6.793 -6.219 700 HG13 VAL 85 HG13 VAL 85 4.846 -8.065 -6.011 701 HG21 VAL 85 HG21 VAL 85 2.361 -9.565 -8.392 702 HG22 VAL 85 HG22 VAL 85 3.167 -9.788 -6.842 703 HG23 VAL 85 HG23 VAL 85 1.962 -8.499 -7.037 704 H THR 86 H THR 86 4.766 -8.596 -10.556 705 HA THR 86 HA THR 86 2.739 -8.958 -12.668 706 HB THR 86 HB THR 86 4.478 -10.182 -13.841 707 HG1 THR 86 HG1 THR 86 6.454 -10.532 -12.891 708 HG21 THR 86 HG21 THR 86 6.243 -8.481 -14.008 709 HG22 THR 86 HG22 THR 86 4.638 -7.703 -13.928 710 HG23 THR 86 HG23 THR 86 5.702 -7.730 -12.509 711 H ASP 87 H ASP 87 4.249 -10.893 -10.120 712 HA ASP 87 HA ASP 87 3.275 -13.360 -11.267 713 HB2 ASP 87 HB2 ASP 87 5.543 -13.030 -10.334 714 HB3 ASP 87 HB3 ASP 87 4.834 -12.892 -8.719 715 H SER 88 H SER 88 2.525 -11.647 -8.200 716 HA SER 88 HA SER 88 0.168 -13.479 -7.851 717 HB2 SER 88 HB2 SER 88 1.989 -14.535 -6.640 718 HB3 SER 88 HB3 SER 88 2.256 -13.052 -5.709 719 HG SER 88 HG SER 88 0.930 -14.546 -4.590 720 H SER 89 H SER 89 -1.631 -12.545 -7.267 721 HA SER 89 HA SER 89 -1.826 -9.758 -7.014 722 HB2 SER 89 HB2 SER 89 -3.984 -11.769 -6.307 723 HB3 SER 89 HB3 SER 89 -4.197 -10.098 -6.862 724 HG SER 89 HG SER 89 -4.472 -11.581 -8.582 725 H ARG 90 H ARG 90 -0.646 -11.496 -4.511 726 HA ARG 90 HA ARG 90 -2.042 -9.918 -2.435 727 HB2 ARG 90 HB2 ARG 90 -1.518 -11.429 -0.801 728 HB3 ARG 90 HB3 ARG 90 -2.013 -12.388 -2.173 729 HG2 ARG 90 HG2 ARG 90 0.337 -12.912 -2.692 730 HG3 ARG 90 HG3 ARG 90 0.869 -11.870 -1.357 731 HD2 ARG 90 HD2 ARG 90 -0.393 -13.335 0.238 732 HD3 ARG 90 HD3 ARG 90 -0.707 -14.450 -1.109 733 HE ARG 90 HE ARG 90 2.093 -13.866 -0.983 734 HH11 ARG 90 HH11 ARG 90 3.550 -15.298 -0.348 735 HH12 ARG 90 HH12 ARG 90 3.128 -16.598 0.741 736 HH21 ARG 90 HH21 ARG 90 -0.114 -15.572 1.181 737 HH22 ARG 90 HH22 ARG 90 1.085 -16.772 1.530 738 H TYR 91 H TYR 91 0.103 -8.847 -4.322 739 HA TYR 91 HA TYR 91 1.779 -7.634 -2.215 740 HB2 TYR 91 HB2 TYR 91 2.772 -8.901 -4.778 741 HB3 TYR 91 HB3 TYR 91 3.745 -7.964 -3.666 742 HD1 TYR 91 HD1 TYR 91 4.273 -8.854 -1.389 743 HD2 TYR 91 HD2 TYR 91 2.291 -11.232 -4.387 744 HE1 TYR 91 HE1 TYR 91 4.849 -10.922 -0.125 745 HE2 TYR 91 HE2 TYR 91 2.960 -13.309 -3.179 746 HH TYR 91 HH TYR 91 4.785 -13.203 -0.100 747 H PHE 92 H PHE 92 2.047 -5.516 -2.484 748 HA PHE 92 HA PHE 92 1.496 -4.193 -5.098 749 HB2 PHE 92 HB2 PHE 92 0.249 -3.495 -2.406 750 HB3 PHE 92 HB3 PHE 92 0.179 -2.474 -3.829 751 HD1 PHE 92 HD1 PHE 92 -1.033 -5.642 -2.327 752 HD2 PHE 92 HD2 PHE 92 -1.265 -3.005 -5.724 753 HE1 PHE 92 HE1 PHE 92 -3.049 -6.839 -3.137 754 HE2 PHE 92 HE2 PHE 92 -3.331 -4.164 -6.483 755 HZ PHE 92 HZ PHE 92 -4.211 -6.103 -5.194 756 H VAL 93 H VAL 93 2.281 -1.945 -5.125 757 HA VAL 93 HA VAL 93 4.410 -1.340 -3.108 758 HB VAL 93 HB VAL 93 4.538 -0.856 -6.106 759 HG11 VAL 93 HG11 VAL 93 5.496 1.075 -4.890 760 HG12 VAL 93 HG12 VAL 93 6.554 -0.024 -3.979 761 HG13 VAL 93 HG13 VAL 93 6.734 0.149 -5.732 762 HG21 VAL 93 HG21 VAL 93 6.146 -2.604 -4.199 763 HG22 VAL 93 HG22 VAL 93 5.160 -3.115 -5.586 764 HG23 VAL 93 HG23 VAL 93 6.671 -2.229 -5.830 765 H ILE 94 H ILE 94 4.363 0.760 -2.278 766 HA ILE 94 HA ILE 94 2.467 2.630 -3.577 767 HB ILE 94 HB ILE 94 1.565 3.427 -1.530 768 HG12 ILE 94 HG12 ILE 94 3.388 2.594 0.037 769 HG13 ILE 94 HG13 ILE 94 1.730 2.521 0.597 770 HG21 ILE 94 HG21 ILE 94 0.973 0.483 -1.976 771 HG22 ILE 94 HG22 ILE 94 -0.067 1.655 -1.129 772 HG23 ILE 94 HG23 ILE 94 0.302 1.866 -2.846 773 HD11 ILE 94 HD11 ILE 94 1.654 0.098 0.226 774 HD12 ILE 94 HD12 ILE 94 3.310 0.117 -0.414 775 HD13 ILE 94 HD13 ILE 94 3.000 0.548 1.276 776 H ARG 95 H ARG 95 2.799 4.780 -3.357 777 HA ARG 95 HA ARG 95 5.636 5.483 -2.764 778 HB2 ARG 95 HB2 ARG 95 4.525 6.128 -4.955 779 HB3 ARG 95 HB3 ARG 95 3.615 7.339 -4.037 780 HG2 ARG 95 HG2 ARG 95 5.762 8.310 -3.226 781 HG3 ARG 95 HG3 ARG 95 6.654 7.103 -4.174 782 HD2 ARG 95 HD2 ARG 95 5.587 7.991 -6.243 783 HD3 ARG 95 HD3 ARG 95 4.778 9.239 -5.276 784 HE ARG 95 HE ARG 95 7.421 9.588 -4.597 785 HH11 ARG 95 HH11 ARG 95 8.875 10.841 -5.481 786 HH12 ARG 95 HH12 ARG 95 8.803 11.294 -7.172 787 HH21 ARG 95 HH21 ARG 95 5.879 9.557 -7.746 788 HH22 ARG 95 HH22 ARG 95 7.119 10.570 -8.438 789 H ILE 96 H ILE 96 5.678 5.456 -0.549 790 HA ILE 96 HA ILE 96 3.806 7.053 1.005 791 HB ILE 96 HB ILE 96 5.035 6.509 2.969 792 HG12 ILE 96 HG12 ILE 96 6.874 4.539 2.461 793 HG13 ILE 96 HG13 ILE 96 7.191 5.593 1.096 794 HG21 ILE 96 HG21 ILE 96 4.533 4.115 1.193 795 HG22 ILE 96 HG22 ILE 96 4.678 4.072 2.954 796 HG23 ILE 96 HG23 ILE 96 3.355 4.964 2.229 797 HD11 ILE 96 HD11 ILE 96 7.245 6.347 4.049 798 HD12 ILE 96 HD12 ILE 96 8.645 6.125 2.983 799 HD13 ILE 96 HD13 ILE 96 7.542 7.491 2.712 800 H GLN 97 H GLN 97 4.087 8.977 2.020 801 HA GLN 97 HA GLN 97 6.297 10.762 1.101 802 HB2 GLN 97 HB2 GLN 97 3.317 11.111 0.661 803 HB3 GLN 97 HB3 GLN 97 4.445 12.467 0.623 804 HG2 GLN 97 HG2 GLN 97 5.459 11.815 -1.333 805 HG3 GLN 97 HG3 GLN 97 5.068 10.106 -1.142 806 HE21 GLN 97 HE21 GLN 97 2.040 10.296 -2.925 807 HE22 GLN 97 HE22 GLN 97 3.157 9.288 -2.005 808 H ASP 98 H ASP 98 6.754 12.421 2.372 809 HA ASP 98 HA ASP 98 5.707 12.334 5.148 810 HB2 ASP 98 HB2 ASP 98 8.172 12.270 4.520 811 HB3 ASP 98 HB3 ASP 98 7.997 13.964 4.060 812 H GLY 99 H GLY 99 4.681 13.915 2.496 813 HA2 GLY 99 HA2 GLY 99 3.028 15.538 2.298 814 HA3 GLY 99 HA3 GLY 99 3.197 15.933 4.009 815 H THR 100 H THR 100 6.142 15.987 2.290 816 HA THR 100 HA THR 100 6.112 18.943 1.873 817 HB THR 100 HB THR 100 6.776 18.389 4.184 818 HG1 THR 100 HG1 THR 100 8.789 19.471 2.528 819 HG21 THR 100 HG21 THR 100 9.229 17.068 2.960 820 HG22 THR 100 HG22 THR 100 8.916 17.360 4.683 821 HG23 THR 100 HG23 THR 100 7.902 16.223 3.786 822 H GLY 101 H GLY 101 6.370 16.425 0.075 823 HA2 GLY 101 HA2 GLY 101 7.299 16.288 -2.068 824 HA3 GLY 101 HA3 GLY 101 8.507 17.502 -1.657 825 H ARG 102 H ARG 102 8.642 15.316 0.821 826 HA ARG 102 HA ARG 102 10.851 13.653 -0.206 827 HB2 ARG 102 HB2 ARG 102 9.296 13.614 2.411 828 HB3 ARG 102 HB3 ARG 102 10.686 12.590 2.055 829 HG2 ARG 102 HG2 ARG 102 12.160 14.473 1.959 830 HG3 ARG 102 HG3 ARG 102 10.802 15.618 2.074 831 HD2 ARG 102 HD2 ARG 102 10.232 14.747 4.307 832 HD3 ARG 102 HD3 ARG 102 11.609 13.635 4.244 833 HE ARG 102 HE ARG 102 12.919 15.918 3.885 834 HH11 ARG 102 HH11 ARG 102 13.669 17.399 5.332 835 HH12 ARG 102 HH12 ARG 102 12.821 17.677 6.823 836 HH21 ARG 102 HH21 ARG 102 10.298 15.415 6.245 837 HH22 ARG 102 HH22 ARG 102 11.004 16.588 7.321 838 H SER 103 H SER 103 10.562 11.689 -0.970 839 HA SER 103 HA SER 103 8.280 10.119 -0.139 840 HB2 SER 103 HB2 SER 103 7.373 9.586 -2.326 841 HB3 SER 103 HB3 SER 103 7.389 11.342 -2.126 842 HG SER 103 HG SER 103 9.402 11.340 -3.297 843 H ALA 104 H ALA 104 8.267 7.885 -0.716 844 HA ALA 104 HA ALA 104 10.586 6.729 -2.115 845 HB1 ALA 104 HB1 ALA 104 9.823 5.917 0.728 846 HB2 ALA 104 HB2 ALA 104 11.020 5.102 -0.302 847 HB3 ALA 104 HB3 ALA 104 11.316 6.760 0.255 848 H PHE 105 H PHE 105 10.139 4.728 -3.052 849 HA PHE 105 HA PHE 105 7.308 3.782 -2.976 850 HB2 PHE 105 HB2 PHE 105 9.616 3.198 -4.844 851 HB3 PHE 105 HB3 PHE 105 8.170 2.209 -4.778 852 HD1 PHE 105 HD1 PHE 105 9.563 5.368 -5.997 853 HD2 PHE 105 HD2 PHE 105 5.928 3.144 -5.358 854 HE1 PHE 105 HE1 PHE 105 8.385 6.797 -7.655 855 HE2 PHE 105 HE2 PHE 105 4.764 4.535 -7.043 856 HZ PHE 105 HZ PHE 105 5.996 6.361 -8.204 857 H ILE 106 H ILE 106 6.814 2.283 -1.550 858 HA ILE 106 HA ILE 106 8.882 0.278 -0.714 859 HB ILE 106 HB ILE 106 7.950 0.092 1.436 860 HG12 ILE 106 HG12 ILE 106 5.873 2.212 0.743 861 HG13 ILE 106 HG13 ILE 106 5.546 0.486 0.916 862 HG21 ILE 106 HG21 ILE 106 8.248 3.062 0.848 863 HG22 ILE 106 HG22 ILE 106 8.621 2.222 2.371 864 HG23 ILE 106 HG23 ILE 106 9.605 1.917 0.935 865 HD11 ILE 106 HD11 ILE 106 6.470 2.313 3.153 866 HD12 ILE 106 HD12 ILE 106 4.876 1.573 2.938 867 HD13 ILE 106 HD13 ILE 106 6.284 0.550 3.275 868 H GLY 107 H GLY 107 8.294 -1.875 -0.519 869 HA2 GLY 107 HA2 GLY 107 5.881 -2.683 -2.071 870 HA3 GLY 107 HA3 GLY 107 7.256 -3.710 -1.659 871 H ILE 108 H ILE 108 4.260 -3.867 -1.157 872 HA ILE 108 HA ILE 108 4.533 -4.734 1.649 873 HB ILE 108 HB ILE 108 2.164 -4.299 2.074 874 HG12 ILE 108 HG12 ILE 108 2.198 -2.418 -0.322 875 HG13 ILE 108 HG13 ILE 108 1.423 -4.002 -0.322 876 HG21 ILE 108 HG21 ILE 108 3.877 -1.842 1.558 877 HG22 ILE 108 HG22 ILE 108 2.512 -1.951 2.690 878 HG23 ILE 108 HG23 ILE 108 3.958 -2.922 2.966 879 HD11 ILE 108 HD11 ILE 108 -0.260 -2.336 0.109 880 HD12 ILE 108 HD12 ILE 108 -0.032 -3.302 1.579 881 HD13 ILE 108 HD13 ILE 108 0.646 -1.666 1.473 882 H GLY 109 H GLY 109 3.840 -6.664 2.146 883 HA2 GLY 109 HA2 GLY 109 2.433 -8.341 0.096 884 HA3 GLY 109 HA3 GLY 109 3.684 -8.959 1.175 885 H PHE 110 H PHE 110 0.794 -9.583 0.719 886 HA PHE 110 HA PHE 110 -0.353 -9.232 3.460 887 HB2 PHE 110 HB2 PHE 110 -1.516 -9.882 0.742 888 HB3 PHE 110 HB3 PHE 110 -2.446 -10.017 2.218 889 HD1 PHE 110 HD1 PHE 110 -3.715 -8.208 2.952 890 HD2 PHE 110 HD2 PHE 110 -0.407 -7.493 0.270 891 HE1 PHE 110 HE1 PHE 110 -4.358 -5.828 2.774 892 HE2 PHE 110 HE2 PHE 110 -1.023 -5.106 0.142 893 HZ PHE 110 HZ PHE 110 -2.975 -4.261 1.406 894 H THR 111 H THR 111 -1.667 -11.074 4.250 895 HA THR 111 HA THR 111 -0.139 -13.532 4.315 896 HB THR 111 HB THR 111 -1.399 -12.659 6.222 897 HG1 THR 111 HG1 THR 111 -2.159 -14.666 6.860 898 HG21 THR 111 HG21 THR 111 -3.500 -11.915 5.080 899 HG22 THR 111 HG22 THR 111 -3.932 -13.621 4.821 900 HG23 THR 111 HG23 THR 111 -3.790 -12.973 6.465 901 H ASP 112 H ASP 112 -3.041 -12.509 2.487 902 HA ASP 112 HA ASP 112 -2.701 -14.760 0.670 903 HB2 ASP 112 HB2 ASP 112 -4.089 -15.658 2.618 904 HB3 ASP 112 HB3 ASP 112 -5.335 -14.491 2.179 905 H ARG 113 H ARG 113 -3.943 -14.566 -1.261 906 HA ARG 113 HA ARG 113 -4.399 -11.946 -2.340 907 HB2 ARG 113 HB2 ARG 113 -5.407 -14.730 -3.130 908 HB3 ARG 113 HB3 ARG 113 -5.697 -13.270 -4.099 909 HG2 ARG 113 HG2 ARG 113 -3.330 -12.843 -4.265 910 HG3 ARG 113 HG3 ARG 113 -2.950 -14.267 -3.279 911 HD2 ARG 113 HD2 ARG 113 -4.576 -14.499 -5.821 912 HD3 ARG 113 HD3 ARG 113 -2.812 -14.450 -5.900 913 HE ARG 113 HE ARG 113 -4.506 -16.627 -4.849 914 HH11 ARG 113 HH11 ARG 113 -3.587 -18.587 -4.413 915 HH12 ARG 113 HH12 ARG 113 -1.858 -18.761 -4.402 916 HH21 ARG 113 HH21 ARG 113 -1.171 -15.486 -5.152 917 HH22 ARG 113 HH22 ARG 113 -0.541 -17.070 -4.814 918 H GLY 114 H GLY 114 -6.601 -14.275 -0.862 919 HA2 GLY 114 HA2 GLY 114 -9.010 -12.876 -1.368 920 HA3 GLY 114 HA3 GLY 114 -8.744 -14.102 -0.113 921 H ASP 115 H ASP 115 -6.511 -11.868 0.703 922 HA ASP 115 HA ASP 115 -8.351 -10.006 2.164 923 HB2 ASP 115 HB2 ASP 115 -5.663 -11.165 2.973 924 HB3 ASP 115 HB3 ASP 115 -6.290 -9.669 3.659 925 H ALA 116 H ALA 116 -5.368 -10.312 0.204 926 HA ALA 116 HA ALA 116 -4.815 -7.512 0.087 927 HB1 ALA 116 HB1 ALA 116 -3.374 -9.582 -0.454 928 HB2 ALA 116 HB2 ALA 116 -4.173 -9.555 -2.039 929 HB3 ALA 116 HB3 ALA 116 -3.209 -8.157 -1.482 930 H PHE 117 H PHE 117 -7.070 -9.517 -1.821 931 HA PHE 117 HA PHE 117 -7.664 -7.567 -3.827 932 HB2 PHE 117 HB2 PHE 117 -8.949 -10.020 -2.779 933 HB3 PHE 117 HB3 PHE 117 -10.087 -8.824 -3.352 934 HD1 PHE 117 HD1 PHE 117 -7.091 -10.811 -4.401 935 HD2 PHE 117 HD2 PHE 117 -10.407 -8.363 -5.669 936 HE1 PHE 117 HE1 PHE 117 -6.665 -11.456 -6.759 937 HE2 PHE 117 HE2 PHE 117 -9.964 -8.994 -8.030 938 HZ PHE 117 HZ PHE 117 -8.095 -10.542 -8.578 939 H ASP 118 H ASP 118 -8.648 -7.635 -0.402 940 HA ASP 118 HA ASP 118 -10.698 -5.597 -0.727 941 HB2 ASP 118 HB2 ASP 118 -9.178 -6.626 1.702 942 HB3 ASP 118 HB3 ASP 118 -10.415 -5.381 1.790 943 H PHE 119 H PHE 119 -7.189 -5.449 -0.351 944 HA PHE 119 HA PHE 119 -6.981 -2.616 0.223 945 HB2 PHE 119 HB2 PHE 119 -5.116 -3.999 0.629 946 HB3 PHE 119 HB3 PHE 119 -5.120 -4.670 -0.983 947 HD1 PHE 119 HD1 PHE 119 -4.476 -3.285 -2.984 948 HD2 PHE 119 HD2 PHE 119 -3.785 -2.036 1.081 949 HE1 PHE 119 HE1 PHE 119 -2.922 -1.534 -3.780 950 HE2 PHE 119 HE2 PHE 119 -2.260 -0.286 0.289 951 HZ PHE 119 HZ PHE 119 -1.804 -0.016 -2.143 952 H ASN 120 H ASN 120 -7.107 -4.487 -2.787 953 HA ASN 120 HA ASN 120 -6.922 -2.151 -4.499 954 HB2 ASN 120 HB2 ASN 120 -5.979 -4.198 -5.275 955 HB3 ASN 120 HB3 ASN 120 -7.382 -5.144 -4.798 956 HD21 ASN 120 HD21 ASN 120 -8.722 -5.070 -7.995 957 HD22 ASN 120 HD22 ASN 120 -8.673 -5.810 -6.405 958 H VAL 121 H VAL 121 -9.661 -4.124 -3.334 959 HA VAL 121 HA VAL 121 -11.579 -2.773 -5.054 960 HB VAL 121 HB VAL 121 -11.905 -4.705 -2.745 961 HG11 VAL 121 HG11 VAL 121 -14.073 -3.526 -4.541 962 HG12 VAL 121 HG12 VAL 121 -14.276 -4.941 -3.483 963 HG13 VAL 121 HG13 VAL 121 -13.953 -3.360 -2.773 964 HG21 VAL 121 HG21 VAL 121 -10.973 -5.587 -4.915 965 HG22 VAL 121 HG22 VAL 121 -12.563 -6.257 -4.537 966 HG23 VAL 121 HG23 VAL 121 -12.406 -4.970 -5.753 967 H SER 122 H SER 122 -10.634 -2.328 -1.596 968 HA SER 122 HA SER 122 -12.720 -0.424 -1.070 969 HB2 SER 122 HB2 SER 122 -11.425 0.192 0.894 970 HB3 SER 122 HB3 SER 122 -11.540 -1.567 0.722 971 HG SER 122 HG SER 122 -9.485 -1.684 0.123 972 H LEU 123 H LEU 123 -9.467 0.020 -2.437 973 HA LEU 123 HA LEU 123 -9.561 2.906 -2.512 974 HB2 LEU 123 HB2 LEU 123 -7.997 0.811 -4.060 975 HB3 LEU 123 HB3 LEU 123 -7.794 2.539 -4.343 976 HG LEU 123 HG LEU 123 -7.329 1.217 -1.637 977 HD11 LEU 123 HD11 LEU 123 -5.323 2.102 -3.758 978 HD12 LEU 123 HD12 LEU 123 -4.940 1.445 -2.147 979 HD13 LEU 123 HD13 LEU 123 -5.724 0.421 -3.350 980 HD21 LEU 123 HD21 LEU 123 -6.626 3.991 -2.705 981 HD22 LEU 123 HD22 LEU 123 -7.824 3.625 -1.441 982 HD23 LEU 123 HD23 LEU 123 -6.117 3.325 -1.140 983 H GLN 124 H GLN 124 -10.312 0.474 -5.102 984 HA GLN 124 HA GLN 124 -11.130 2.541 -6.916 985 HB2 GLN 124 HB2 GLN 124 -11.675 0.862 -8.432 986 HB3 GLN 124 HB3 GLN 124 -10.344 0.200 -7.478 987 HG2 GLN 124 HG2 GLN 124 -12.081 -0.990 -6.084 988 HG3 GLN 124 HG3 GLN 124 -13.289 -0.516 -7.280 989 HE21 GLN 124 HE21 GLN 124 -10.416 -3.310 -8.285 990 HE22 GLN 124 HE22 GLN 124 -10.112 -2.206 -6.945 991 H ASP 125 H ASP 125 -12.946 0.858 -4.390 992 HA ASP 125 HA ASP 125 -15.507 1.910 -5.308 993 HB2 ASP 125 HB2 ASP 125 -15.271 -0.312 -4.209 994 HB3 ASP 125 HB3 ASP 125 -14.793 0.505 -2.715 995 H HIS 126 H HIS 126 -12.883 3.332 -3.731 996 HA HIS 126 HA HIS 126 -14.634 5.464 -2.620 997 HB2 HIS 126 HB2 HIS 126 -12.640 4.893 -1.294 998 HB3 HIS 126 HB3 HIS 126 -11.597 5.277 -2.669 999 HD2 HIS 126 HD2 HIS 126 -11.074 7.838 -3.147 1000 HE1 HIS 126 HE1 HIS 126 -13.647 9.595 -0.236 1001 HE2 HIS 126 HE2 HIS 126 -11.879 10.079 -1.981 1002 H PHE 127 H PHE 127 -12.350 4.873 -5.302 1003 HA PHE 127 HA PHE 127 -12.832 7.581 -6.321 1004 HB2 PHE 127 HB2 PHE 127 -10.995 5.337 -7.178 1005 HB3 PHE 127 HB3 PHE 127 -11.123 6.859 -8.045 1006 HD1 PHE 127 HD1 PHE 127 -10.952 9.066 -6.530 1007 HD2 PHE 127 HD2 PHE 127 -9.312 5.219 -5.511 1008 HE1 PHE 127 HE1 PHE 127 -9.232 10.170 -5.121 1009 HE2 PHE 127 HE2 PHE 127 -7.538 6.316 -4.186 1010 HZ PHE 127 HZ PHE 127 -7.500 8.801 -3.982 1011 H LYS 128 H LYS 128 -14.655 4.787 -6.852 1012 HA LYS 128 HA LYS 128 -15.024 4.772 -9.563 1013 HB2 LYS 128 HB2 LYS 128 -17.022 3.637 -9.363 1014 HB3 LYS 128 HB3 LYS 128 -16.023 3.138 -8.016 1015 HG2 LYS 128 HG2 LYS 128 -18.323 5.153 -7.840 1016 HG3 LYS 128 HG3 LYS 128 -18.437 3.427 -7.498 1017 HD2 LYS 128 HD2 LYS 128 -16.677 3.712 -5.729 1018 HD3 LYS 128 HD3 LYS 128 -16.742 5.457 -5.990 1019 HE2 LYS 128 HE2 LYS 128 -18.090 5.033 -4.119 1020 HE3 LYS 128 HE3 LYS 128 -19.182 5.407 -5.464 1021 HZ1 LYS 128 HZ1 LYS 128 -18.531 2.643 -4.519 1022 HZ2 LYS 128 HZ2 LYS 128 -19.895 3.455 -4.125 1023 HZ3 LYS 128 HZ3 LYS 128 -19.624 3.022 -5.674 1024 H TRP 129 H TRP 129 -16.336 7.277 -7.510 1025 HA TRP 129 HA TRP 129 -17.985 8.439 -9.663 1026 HB2 TRP 129 HB2 TRP 129 -18.549 10.136 -8.061 1027 HB3 TRP 129 HB3 TRP 129 -18.715 8.548 -7.330 1028 HD1 TRP 129 HD1 TRP 129 -16.754 7.832 -5.553 1029 HE1 TRP 129 HE1 TRP 129 -15.260 9.194 -4.024 1030 HE3 TRP 129 HE3 TRP 129 -17.441 12.450 -7.677 1031 HZ2 TRP 129 HZ2 TRP 129 -14.669 12.003 -3.556 1032 HZ3 TRP 129 HZ3 TRP 129 -16.450 14.466 -6.616 1033 HH2 TRP 129 HH2 TRP 129 -15.095 14.260 -4.546 1034 H VAL 130 H VAL 130 -14.695 8.716 -8.634 1035 HA VAL 130 HA VAL 130 -14.178 11.261 -10.059 1036 HB VAL 130 HB VAL 130 -12.241 9.371 -8.667 1037 HG11 VAL 130 HG11 VAL 130 -11.089 10.845 -10.263 1038 HG12 VAL 130 HG12 VAL 130 -11.919 12.263 -9.577 1039 HG13 VAL 130 HG13 VAL 130 -10.743 11.346 -8.609 1040 HG21 VAL 130 HG21 VAL 130 -13.794 10.243 -6.999 1041 HG22 VAL 130 HG22 VAL 130 -12.260 11.093 -6.837 1042 HG23 VAL 130 HG23 VAL 130 -13.626 11.889 -7.644 1043 H LYS 131 H LYS 131 -13.914 7.789 -10.541 1044 HA LYS 131 HA LYS 131 -12.359 8.022 -13.034 1045 HB2 LYS 131 HB2 LYS 131 -13.203 5.724 -11.236 1046 HB3 LYS 131 HB3 LYS 131 -12.581 5.407 -12.853 1047 HG2 LYS 131 HG2 LYS 131 -11.035 7.118 -10.877 1048 HG3 LYS 131 HG3 LYS 131 -10.882 5.357 -10.937 1049 HD2 LYS 131 HD2 LYS 131 -10.046 5.373 -13.182 1050 HD3 LYS 131 HD3 LYS 131 -10.500 7.063 -13.429 1051 HE2 LYS 131 HE2 LYS 131 -8.889 7.725 -11.637 1052 HE3 LYS 131 HE3 LYS 131 -8.319 6.048 -11.569 1053 HZ1 LYS 131 HZ1 LYS 131 -6.997 7.529 -13.042 1054 HZ2 LYS 131 HZ2 LYS 131 -7.624 6.256 -13.877 1055 HZ3 LYS 131 HZ3 LYS 131 -8.304 7.744 -14.019 1056 H GLN 132 H GLN 132 -14.687 9.331 -13.160 1057 HA GLN 132 HA GLN 132 -16.400 7.735 -14.953 1058 HB2 GLN 132 HB2 GLN 132 -16.764 10.469 -13.693 1059 HB3 GLN 132 HB3 GLN 132 -17.912 9.782 -14.842 1060 HG2 GLN 132 HG2 GLN 132 -17.190 8.544 -12.152 1061 HG3 GLN 132 HG3 GLN 132 -18.645 9.472 -12.489 1062 HE21 GLN 132 HE21 GLN 132 -18.884 5.575 -13.088 1063 HE22 GLN 132 HE22 GLN 132 -17.758 6.374 -11.988 1064 H GLU 133 H GLU 133 -13.682 8.788 -15.476 1065 HA GLU 133 HA GLU 133 -13.967 10.598 -17.714 1066 HB2 GLU 133 HB2 GLU 133 -11.556 10.460 -17.937 1067 HB3 GLU 133 HB3 GLU 133 -12.003 10.727 -16.254 1068 HG2 GLU 133 HG2 GLU 133 -11.653 8.295 -15.786 1069 HG3 GLU 133 HG3 GLU 133 -11.153 8.054 -17.463 Start of MODEL 4 1 H1 GLY -4 H1 GLY -4 -8.716 39.540 16.086 2 H2 GLY -4 H2 GLY -4 -7.873 38.401 16.910 3 H3 GLY -4 H3 GLY -4 -9.495 38.513 17.099 4 HA2 GLY -4 HA2 GLY -4 -9.876 37.862 14.816 5 HA3 GLY -4 HA3 GLY -4 -8.120 37.746 14.605 6 H SER -3 H SER -3 -9.545 35.567 13.965 7 HA SER -3 HA SER -3 -10.082 33.703 16.047 8 HB2 SER -3 HB2 SER -3 -9.385 33.158 13.138 9 HB3 SER -3 HB3 SER -3 -10.206 32.046 14.245 10 HG SER -3 HG SER -3 -11.920 33.577 14.400 11 HA PRO -2 HA PRO -2 -5.999 32.210 16.991 12 HB2 PRO -2 HB2 PRO -2 -6.507 29.855 18.257 13 HB3 PRO -2 HB3 PRO -2 -7.014 31.435 18.926 14 HG2 PRO -2 HG2 PRO -2 -8.683 29.491 17.294 15 HG3 PRO -2 HG3 PRO -2 -9.100 30.255 18.862 16 HD2 PRO -2 HD2 PRO -2 -9.952 31.286 16.486 17 HD3 PRO -2 HD3 PRO -2 -9.489 32.345 17.851 18 H ASN -1 H ASN -1 -7.869 30.662 14.598 19 HA ASN -1 HA ASN -1 -5.500 29.272 13.502 20 HB2 ASN -1 HB2 ASN -1 -6.679 27.247 13.048 21 HB3 ASN -1 HB3 ASN -1 -6.926 27.590 14.753 22 HD21 ASN -1 HD21 ASN -1 -10.460 28.026 14.362 23 HD22 ASN -1 HD22 ASN -1 -9.095 28.257 15.444 24 H SER 0 H SER 0 -5.858 28.654 11.169 25 HA SER 0 HA SER 0 -6.650 31.037 9.734 26 HB2 SER 0 HB2 SER 0 -5.682 29.859 7.806 27 HB3 SER 0 HB3 SER 0 -4.617 29.786 9.219 28 HG SER 0 HG SER 0 -4.745 27.755 8.301 29 H MET 1 H MET 1 -8.524 28.331 10.585 30 HA MET 1 HA MET 1 -10.246 27.175 9.753 31 HB2 MET 1 HB2 MET 1 -11.045 29.802 8.458 32 HB3 MET 1 HB3 MET 1 -12.091 28.397 8.710 33 HG2 MET 1 HG2 MET 1 -11.702 28.551 11.157 34 HG3 MET 1 HG3 MET 1 -10.739 30.010 10.903 35 HE1 MET 1 HE1 MET 1 -12.194 31.224 12.706 36 HE2 MET 1 HE2 MET 1 -13.964 31.365 12.642 37 HE3 MET 1 HE3 MET 1 -13.209 29.780 12.923 38 H ALA 2 H ALA 2 -7.795 27.098 8.235 39 HA ALA 2 HA ALA 2 -8.845 25.754 5.795 40 HB1 ALA 2 HB1 ALA 2 -6.517 27.730 5.853 41 HB2 ALA 2 HB2 ALA 2 -7.037 26.769 4.452 42 HB3 ALA 2 HB3 ALA 2 -8.110 28.015 5.117 43 H THR 3 H THR 3 -6.132 26.157 8.105 44 HA THR 3 HA THR 3 -4.929 23.589 7.264 45 HB THR 3 HB THR 3 -3.925 25.435 9.434 46 HG1 THR 3 HG1 THR 3 -2.577 26.268 7.804 47 HG21 THR 3 HG21 THR 3 -2.925 23.152 9.356 48 HG22 THR 3 HG22 THR 3 -2.570 23.363 7.631 49 HG23 THR 3 HG23 THR 3 -1.751 24.374 8.847 50 H GLU 4 H GLU 4 -6.816 22.438 7.873 51 HA GLU 4 HA GLU 4 -7.039 21.781 10.781 52 HB2 GLU 4 HB2 GLU 4 -9.469 21.764 10.564 53 HB3 GLU 4 HB3 GLU 4 -8.764 23.344 10.241 54 HG2 GLU 4 HG2 GLU 4 -9.040 23.012 7.806 55 HG3 GLU 4 HG3 GLU 4 -9.706 21.402 8.084 56 H LEU 5 H LEU 5 -5.489 20.339 8.966 57 HA LEU 5 HA LEU 5 -6.886 18.033 7.974 58 HB2 LEU 5 HB2 LEU 5 -4.684 19.303 7.199 59 HB3 LEU 5 HB3 LEU 5 -3.885 18.123 8.222 60 HG LEU 5 HG LEU 5 -5.709 17.648 5.837 61 HD11 LEU 5 HD11 LEU 5 -2.763 17.018 6.267 62 HD12 LEU 5 HD12 LEU 5 -3.700 16.709 4.787 63 HD13 LEU 5 HD13 LEU 5 -3.413 18.374 5.319 64 HD21 LEU 5 HD21 LEU 5 -5.170 15.229 6.005 65 HD22 LEU 5 HD22 LEU 5 -4.378 15.524 7.570 66 HD23 LEU 5 HD23 LEU 5 -6.130 15.783 7.375 67 H GLU 6 H GLU 6 -7.861 17.742 10.174 68 HA GLU 6 HA GLU 6 -6.433 15.552 11.635 69 HB2 GLU 6 HB2 GLU 6 -6.527 17.759 12.878 70 HB3 GLU 6 HB3 GLU 6 -8.282 17.587 12.937 71 HG2 GLU 6 HG2 GLU 6 -7.981 15.414 14.169 72 HG3 GLU 6 HG3 GLU 6 -6.234 15.605 14.051 73 H TYR 7 H TYR 7 -7.628 14.592 9.638 74 HA TYR 7 HA TYR 7 -10.200 13.438 10.425 75 HB2 TYR 7 HB2 TYR 7 -11.257 14.121 8.310 76 HB3 TYR 7 HB3 TYR 7 -10.936 15.469 9.375 77 HD1 TYR 7 HD1 TYR 7 -10.004 17.419 8.476 78 HD2 TYR 7 HD2 TYR 7 -9.377 13.671 6.409 79 HE1 TYR 7 HE1 TYR 7 -8.987 18.628 6.566 80 HE2 TYR 7 HE2 TYR 7 -8.317 14.873 4.548 81 HH TYR 7 HH TYR 7 -8.048 18.459 4.475 82 H GLU 8 H GLU 8 -10.729 11.593 9.229 83 HA GLU 8 HA GLU 8 -9.333 10.577 7.006 84 HB2 GLU 8 HB2 GLU 8 -8.116 8.705 8.113 85 HB3 GLU 8 HB3 GLU 8 -7.415 10.285 8.406 86 HG2 GLU 8 HG2 GLU 8 -8.576 10.270 10.684 87 HG3 GLU 8 HG3 GLU 8 -9.021 8.592 10.343 88 H SER 9 H SER 9 -10.998 9.580 6.097 89 HA SER 9 HA SER 9 -12.985 8.080 7.716 90 HB2 SER 9 HB2 SER 9 -12.918 9.051 4.854 91 HB3 SER 9 HB3 SER 9 -14.078 7.825 5.391 92 HG SER 9 HG SER 9 -14.914 9.255 6.886 93 H VAL 10 H VAL 10 -12.392 6.107 8.196 94 HA VAL 10 HA VAL 10 -10.480 4.457 6.921 95 HB VAL 10 HB VAL 10 -12.803 3.677 8.716 96 HG11 VAL 10 HG11 VAL 10 -11.412 1.697 9.299 97 HG12 VAL 10 HG12 VAL 10 -11.977 1.641 7.635 98 HG13 VAL 10 HG13 VAL 10 -10.290 2.113 7.981 99 HG21 VAL 10 HG21 VAL 10 -11.216 5.291 9.758 100 HG22 VAL 10 HG22 VAL 10 -11.091 3.695 10.497 101 HG23 VAL 10 HG23 VAL 10 -9.860 4.223 9.328 102 H LEU 11 H LEU 11 -10.488 2.748 5.554 103 HA LEU 11 HA LEU 11 -12.933 2.136 3.931 104 HB2 LEU 11 HB2 LEU 11 -10.094 2.662 2.948 105 HB3 LEU 11 HB3 LEU 11 -11.380 1.990 1.959 106 HG LEU 11 HG LEU 11 -11.371 4.786 3.165 107 HD11 LEU 11 HD11 LEU 11 -10.949 3.755 0.330 108 HD12 LEU 11 HD12 LEU 11 -11.173 5.457 0.760 109 HD13 LEU 11 HD13 LEU 11 -9.756 4.579 1.360 110 HD21 LEU 11 HD21 LEU 11 -13.337 3.447 1.247 111 HD22 LEU 11 HD22 LEU 11 -13.688 3.964 2.914 112 HD23 LEU 11 HD23 LEU 11 -13.330 5.170 1.681 113 H CYS 12 H CYS 12 -9.711 1.065 5.044 114 HA CYS 12 HA CYS 12 -10.693 -1.689 5.356 115 HB2 CYS 12 HB2 CYS 12 -9.748 -1.633 3.028 116 HB3 CYS 12 HB3 CYS 12 -8.220 -1.040 3.708 117 HG CYS 12 HG CYS 12 -9.742 -3.965 4.054 118 H VAL 13 H VAL 13 -9.650 -2.728 6.992 119 HA VAL 13 HA VAL 13 -7.160 -1.649 8.123 120 HB VAL 13 HB VAL 13 -9.535 -2.235 9.923 121 HG11 VAL 13 HG11 VAL 13 -6.704 -1.279 10.568 122 HG12 VAL 13 HG12 VAL 13 -8.034 -1.429 11.736 123 HG13 VAL 13 HG13 VAL 13 -7.381 -2.875 10.967 124 HG21 VAL 13 HG21 VAL 13 -9.836 -0.064 8.894 125 HG22 VAL 13 HG22 VAL 13 -9.362 0.159 10.580 126 HG23 VAL 13 HG23 VAL 13 -8.166 0.400 9.282 127 H LYS 14 H LYS 14 -5.790 -3.295 8.337 128 HA LYS 14 HA LYS 14 -6.855 -6.022 8.808 129 HB2 LYS 14 HB2 LYS 14 -6.286 -5.190 6.326 130 HB3 LYS 14 HB3 LYS 14 -4.670 -5.738 6.768 131 HG2 LYS 14 HG2 LYS 14 -5.446 -7.968 7.171 132 HG3 LYS 14 HG3 LYS 14 -7.147 -7.480 7.166 133 HD2 LYS 14 HD2 LYS 14 -5.304 -7.268 4.760 134 HD3 LYS 14 HD3 LYS 14 -6.369 -8.637 5.084 135 HE2 LYS 14 HE2 LYS 14 -7.323 -5.772 4.654 136 HE3 LYS 14 HE3 LYS 14 -7.245 -7.003 3.395 137 HZ1 LYS 14 HZ1 LYS 14 -8.896 -7.232 5.847 138 HZ2 LYS 14 HZ2 LYS 14 -9.455 -6.862 4.355 139 HZ3 LYS 14 HZ3 LYS 14 -8.796 -8.355 4.649 140 HA PRO 15 HA PRO 15 -3.837 -5.772 11.920 141 HB2 PRO 15 HB2 PRO 15 -3.798 -8.323 12.914 142 HB3 PRO 15 HB3 PRO 15 -5.194 -7.211 13.091 143 HG2 PRO 15 HG2 PRO 15 -4.776 -9.358 10.972 144 HG3 PRO 15 HG3 PRO 15 -6.222 -9.100 12.010 145 HD2 PRO 15 HD2 PRO 15 -6.120 -8.139 9.500 146 HD3 PRO 15 HD3 PRO 15 -6.828 -7.153 10.816 147 H ASP 16 H ASP 16 -3.123 -7.904 9.253 148 HA ASP 16 HA ASP 16 -0.240 -8.013 10.058 149 HB2 ASP 16 HB2 ASP 16 -1.976 -10.247 8.952 150 HB3 ASP 16 HB3 ASP 16 -0.215 -10.267 8.917 151 H VAL 17 H VAL 17 0.697 -6.650 8.777 152 HA VAL 17 HA VAL 17 0.816 -7.343 5.918 153 HB VAL 17 HB VAL 17 -0.793 -5.428 6.098 154 HG11 VAL 17 HG11 VAL 17 1.647 -3.770 6.852 155 HG12 VAL 17 HG12 VAL 17 0.020 -3.170 6.490 156 HG13 VAL 17 HG13 VAL 17 0.296 -4.161 7.932 157 HG21 VAL 17 HG21 VAL 17 0.112 -4.183 4.239 158 HG22 VAL 17 HG22 VAL 17 1.750 -4.774 4.565 159 HG23 VAL 17 HG23 VAL 17 0.477 -5.901 4.028 160 H SER 18 H SER 18 2.816 -6.993 4.991 161 HA SER 18 HA SER 18 5.057 -6.344 6.884 162 HB2 SER 18 HB2 SER 18 4.979 -8.546 4.795 163 HB3 SER 18 HB3 SER 18 6.319 -8.167 5.899 164 HG SER 18 HG SER 18 4.970 -9.928 6.618 165 H VAL 19 H VAL 19 6.605 -5.020 6.154 166 HA VAL 19 HA VAL 19 6.402 -3.978 3.372 167 HB VAL 19 HB VAL 19 7.621 -2.787 5.871 168 HG11 VAL 19 HG11 VAL 19 8.010 -0.745 4.441 169 HG12 VAL 19 HG12 VAL 19 9.068 -2.090 4.033 170 HG13 VAL 19 HG13 VAL 19 7.665 -1.737 3.001 171 HG21 VAL 19 HG21 VAL 19 5.079 -2.676 5.507 172 HG22 VAL 19 HG22 VAL 19 5.919 -1.129 5.676 173 HG23 VAL 19 HG23 VAL 19 5.427 -1.693 4.072 174 H TYR 20 H TYR 20 7.904 -4.196 1.939 175 HA TYR 20 HA TYR 20 10.694 -4.796 2.766 176 HB2 TYR 20 HB2 TYR 20 10.040 -5.951 0.158 177 HB3 TYR 20 HB3 TYR 20 10.930 -6.624 1.502 178 HD1 TYR 20 HD1 TYR 20 9.751 -7.967 3.254 179 HD2 TYR 20 HD2 TYR 20 7.691 -6.394 -0.186 180 HE1 TYR 20 HE1 TYR 20 7.849 -9.512 3.694 181 HE2 TYR 20 HE2 TYR 20 5.781 -7.944 0.255 182 HH TYR 20 HH TYR 20 5.811 -10.265 2.986 183 H ARG 21 H ARG 21 11.877 -3.115 2.192 184 HA ARG 21 HA ARG 21 11.222 -1.241 0.048 185 HB2 ARG 21 HB2 ARG 21 13.807 -1.802 1.556 186 HB3 ARG 21 HB3 ARG 21 13.658 -0.574 0.290 187 HG2 ARG 21 HG2 ARG 21 11.849 0.551 1.548 188 HG3 ARG 21 HG3 ARG 21 11.997 -0.631 2.857 189 HD2 ARG 21 HD2 ARG 21 14.259 1.169 1.890 190 HD3 ARG 21 HD3 ARG 21 13.185 1.559 3.248 191 HE ARG 21 HE ARG 21 14.203 -0.995 3.822 192 HH11 ARG 21 HH11 ARG 21 15.686 -1.421 5.166 193 HH12 ARG 21 HH12 ARG 21 16.981 -0.285 5.560 194 HH21 ARG 21 HH21 ARG 21 15.685 2.172 3.478 195 HH22 ARG 21 HH22 ARG 21 16.956 1.757 4.599 196 H ILE 22 H ILE 22 11.664 -1.295 -2.025 197 HA ILE 22 HA ILE 22 12.319 -3.941 -3.108 198 HB ILE 22 HB ILE 22 11.218 -3.172 -5.157 199 HG12 ILE 22 HG12 ILE 22 10.723 -0.543 -3.697 200 HG13 ILE 22 HG13 ILE 22 11.768 -0.782 -5.103 201 HG21 ILE 22 HG21 ILE 22 9.480 -2.593 -2.735 202 HG22 ILE 22 HG22 ILE 22 8.992 -3.268 -4.306 203 HG23 ILE 22 HG23 ILE 22 9.994 -4.222 -3.213 204 HD11 ILE 22 HD11 ILE 22 9.699 0.115 -5.902 205 HD12 ILE 22 HD12 ILE 22 9.739 -1.601 -6.379 206 HD13 ILE 22 HD13 ILE 22 8.747 -1.073 -5.002 207 HA PRO 23 HA PRO 23 16.168 -2.850 -5.120 208 HB2 PRO 23 HB2 PRO 23 16.075 -4.380 -7.408 209 HB3 PRO 23 HB3 PRO 23 16.330 -5.074 -5.778 210 HG2 PRO 23 HG2 PRO 23 13.684 -4.784 -7.266 211 HG3 PRO 23 HG3 PRO 23 14.387 -6.279 -6.559 212 HD2 PRO 23 HD2 PRO 23 12.598 -4.838 -5.193 213 HD3 PRO 23 HD3 PRO 23 14.040 -5.455 -4.338 214 HA PRO 24 HA PRO 24 15.230 0.258 -8.281 215 HB2 PRO 24 HB2 PRO 24 17.507 0.286 -9.812 216 HB3 PRO 24 HB3 PRO 24 17.411 0.979 -8.164 217 HG2 PRO 24 HG2 PRO 24 18.452 -1.755 -8.973 218 HG3 PRO 24 HG3 PRO 24 19.214 -0.555 -7.883 219 HD2 PRO 24 HD2 PRO 24 17.768 -2.646 -6.925 220 HD3 PRO 24 HD3 PRO 24 17.702 -1.043 -6.135 221 H ARG 25 H ARG 25 13.736 -0.172 -9.747 222 HA ARG 25 HA ARG 25 14.025 -2.276 -11.824 223 HB2 ARG 25 HB2 ARG 25 12.259 -2.305 -9.356 224 HB3 ARG 25 HB3 ARG 25 11.620 -3.029 -10.828 225 HG2 ARG 25 HG2 ARG 25 14.181 -3.869 -9.438 226 HG3 ARG 25 HG3 ARG 25 12.602 -4.651 -9.287 227 HD2 ARG 25 HD2 ARG 25 12.547 -5.183 -11.645 228 HD3 ARG 25 HD3 ARG 25 14.068 -4.357 -11.941 229 HE ARG 25 HE ARG 25 13.702 -6.962 -10.566 230 HH11 ARG 25 HH11 ARG 25 15.380 -8.072 -9.810 231 HH12 ARG 25 HH12 ARG 25 17.017 -7.522 -10.080 232 HH21 ARG 25 HH21 ARG 25 16.062 -4.390 -11.130 233 HH22 ARG 25 HH22 ARG 25 17.389 -5.461 -10.791 234 H ALA 26 H ALA 26 12.362 -2.439 -13.287 235 HA ALA 26 HA ALA 26 10.580 -0.107 -13.714 236 HB1 ALA 26 HB1 ALA 26 11.063 -2.644 -15.325 237 HB2 ALA 26 HB2 ALA 26 9.876 -1.385 -15.735 238 HB3 ALA 26 HB3 ALA 26 11.615 -1.002 -15.729 239 H SER 27 H SER 27 8.532 -0.174 -13.141 240 HA SER 27 HA SER 27 7.601 -1.978 -11.171 241 HB2 SER 27 HB2 SER 27 5.506 -0.648 -11.281 242 HB3 SER 27 HB3 SER 27 6.979 0.332 -11.134 243 HG SER 27 HG SER 27 5.801 1.291 -12.720 244 H ASN 28 H ASN 28 6.056 -1.330 -14.285 245 HA ASN 28 HA ASN 28 4.352 -3.651 -14.060 246 HB2 ASN 28 HB2 ASN 28 4.749 -1.491 -16.167 247 HB3 ASN 28 HB3 ASN 28 3.636 -2.833 -16.408 248 HD21 ASN 28 HD21 ASN 28 2.644 -0.074 -13.502 249 HD22 ASN 28 HD22 ASN 28 4.333 -0.232 -13.954 250 H ARG 29 H ARG 29 7.495 -3.565 -14.930 251 HA ARG 29 HA ARG 29 7.337 -5.963 -16.739 252 HB2 ARG 29 HB2 ARG 29 9.604 -3.971 -16.501 253 HB3 ARG 29 HB3 ARG 29 9.458 -5.318 -17.632 254 HG2 ARG 29 HG2 ARG 29 7.364 -4.198 -18.561 255 HG3 ARG 29 HG3 ARG 29 7.754 -2.785 -17.549 256 HD2 ARG 29 HD2 ARG 29 9.985 -2.654 -18.610 257 HD3 ARG 29 HD3 ARG 29 9.586 -4.033 -19.636 258 HE ARG 29 HE ARG 29 8.631 -1.251 -19.889 259 HH11 ARG 29 HH11 ARG 29 7.524 -0.637 -21.707 260 HH12 ARG 29 HH12 ARG 29 6.921 -1.840 -22.809 261 HH21 ARG 29 HH21 ARG 29 8.089 -4.526 -21.027 262 HH22 ARG 29 HH22 ARG 29 7.228 -3.982 -22.441 263 H GLY 30 H GLY 30 8.786 -4.682 -13.762 264 HA2 GLY 30 HA2 GLY 30 10.142 -7.307 -13.312 265 HA3 GLY 30 HA3 GLY 30 10.974 -5.751 -13.181 266 H TYR 31 H TYR 31 8.018 -5.121 -11.685 267 HA TYR 31 HA TYR 31 8.899 -6.048 -9.014 268 HB2 TYR 31 HB2 TYR 31 6.292 -4.836 -10.009 269 HB3 TYR 31 HB3 TYR 31 6.642 -5.248 -8.355 270 HD1 TYR 31 HD1 TYR 31 9.696 -3.841 -9.470 271 HD2 TYR 31 HD2 TYR 31 5.609 -2.821 -8.517 272 HE1 TYR 31 HE1 TYR 31 10.336 -1.460 -9.202 273 HE2 TYR 31 HE2 TYR 31 6.275 -0.452 -8.200 274 HH TYR 31 HH TYR 31 9.634 0.677 -8.761 275 H ARG 32 H ARG 32 8.966 -8.354 -9.104 276 HA ARG 32 HA ARG 32 6.396 -9.710 -9.910 277 HB2 ARG 32 HB2 ARG 32 7.540 -11.702 -10.498 278 HB3 ARG 32 HB3 ARG 32 8.113 -10.355 -11.455 279 HG2 ARG 32 HG2 ARG 32 9.673 -11.182 -9.000 280 HG3 ARG 32 HG3 ARG 32 9.749 -12.200 -10.438 281 HD2 ARG 32 HD2 ARG 32 10.267 -9.227 -10.492 282 HD3 ARG 32 HD3 ARG 32 11.544 -10.447 -10.251 283 HE ARG 32 HE ARG 32 10.027 -11.033 -12.618 284 HH11 ARG 32 HH11 ARG 32 10.835 -10.638 -14.651 285 HH12 ARG 32 HH12 ARG 32 12.208 -9.594 -14.855 286 HH21 ARG 32 HH21 ARG 32 12.578 -8.890 -11.504 287 HH22 ARG 32 HH22 ARG 32 13.179 -8.639 -13.130 288 H ALA 33 H ALA 33 7.011 -8.632 -7.309 289 HA ALA 33 HA ALA 33 7.076 -9.045 -5.104 290 HB1 ALA 33 HB1 ALA 33 4.924 -10.105 -5.728 291 HB2 ALA 33 HB2 ALA 33 5.727 -11.674 -5.799 292 HB3 ALA 33 HB3 ALA 33 5.665 -10.791 -4.256 293 H SER 34 H SER 34 8.092 -12.114 -6.695 294 HA SER 34 HA SER 34 9.855 -12.995 -4.674 295 HB2 SER 34 HB2 SER 34 9.921 -13.575 -7.654 296 HB3 SER 34 HB3 SER 34 10.717 -14.530 -6.386 297 HG SER 34 HG SER 34 8.677 -15.410 -6.979 298 H ASP 35 H ASP 35 10.375 -10.358 -6.770 299 HA ASP 35 HA ASP 35 13.309 -10.473 -6.766 300 HB2 ASP 35 HB2 ASP 35 11.340 -9.096 -8.249 301 HB3 ASP 35 HB3 ASP 35 12.061 -7.844 -7.269 302 H TRP 36 H TRP 36 10.897 -9.616 -4.457 303 HA TRP 36 HA TRP 36 12.500 -7.558 -3.096 304 HB2 TRP 36 HB2 TRP 36 9.748 -8.604 -2.411 305 HB3 TRP 36 HB3 TRP 36 10.485 -7.104 -1.893 306 HD1 TRP 36 HD1 TRP 36 11.251 -6.645 -5.272 307 HE1 TRP 36 HE1 TRP 36 9.381 -5.486 -6.618 308 HE3 TRP 36 HE3 TRP 36 7.295 -7.524 -2.134 309 HZ2 TRP 36 HZ2 TRP 36 6.664 -4.806 -6.255 310 HZ3 TRP 36 HZ3 TRP 36 5.060 -6.527 -2.639 311 HH2 TRP 36 HH2 TRP 36 4.749 -5.153 -4.673 312 H LYS 37 H LYS 37 12.359 -7.666 -0.682 313 HA LYS 37 HA LYS 37 13.614 -10.140 0.282 314 HB2 LYS 37 HB2 LYS 37 13.034 -7.557 1.761 315 HB3 LYS 37 HB3 LYS 37 14.049 -8.892 2.308 316 HG2 LYS 37 HG2 LYS 37 15.487 -8.473 0.209 317 HG3 LYS 37 HG3 LYS 37 14.617 -6.936 0.064 318 HD2 LYS 37 HD2 LYS 37 16.319 -7.935 2.377 319 HD3 LYS 37 HD3 LYS 37 16.678 -6.563 1.328 320 HE2 LYS 37 HE2 LYS 37 14.299 -6.742 3.244 321 HE3 LYS 37 HE3 LYS 37 15.834 -5.991 3.663 322 HZ1 LYS 37 HZ1 LYS 37 14.118 -4.397 2.866 323 HZ2 LYS 37 HZ2 LYS 37 15.500 -4.328 1.985 324 HZ3 LYS 37 HZ3 LYS 37 14.171 -5.065 1.376 325 H LEU 38 H LEU 38 11.320 -11.080 -0.282 326 HA LEU 38 HA LEU 38 9.058 -10.630 1.287 327 HB2 LEU 38 HB2 LEU 38 9.962 -13.223 -0.022 328 HB3 LEU 38 HB3 LEU 38 8.323 -12.896 0.542 329 HG LEU 38 HG LEU 38 9.776 -11.475 -1.713 330 HD11 LEU 38 HD11 LEU 38 7.300 -13.266 -1.627 331 HD12 LEU 38 HD12 LEU 38 7.960 -12.500 -3.079 332 HD13 LEU 38 HD13 LEU 38 8.906 -13.735 -2.234 333 HD21 LEU 38 HD21 LEU 38 8.399 -9.789 -0.669 334 HD22 LEU 38 HD22 LEU 38 7.525 -10.352 -2.095 335 HD23 LEU 38 HD23 LEU 38 7.051 -10.928 -0.484 336 H ASP 39 H ASP 39 11.815 -12.508 2.307 337 HA ASP 39 HA ASP 39 10.288 -13.534 4.668 338 HB2 ASP 39 HB2 ASP 39 11.363 -15.183 3.074 339 HB3 ASP 39 HB3 ASP 39 12.928 -14.570 3.604 340 H GLN 40 H GLN 40 12.100 -10.955 3.886 341 HA GLN 40 HA GLN 40 13.185 -10.595 6.646 342 HB2 GLN 40 HB2 GLN 40 14.677 -10.106 4.028 343 HB3 GLN 40 HB3 GLN 40 15.087 -9.312 5.545 344 HG2 GLN 40 HG2 GLN 40 16.534 -11.052 5.468 345 HG3 GLN 40 HG3 GLN 40 15.270 -11.522 6.621 346 HE21 GLN 40 HE21 GLN 40 15.140 -13.539 2.989 347 HE22 GLN 40 HE22 GLN 40 15.327 -11.793 2.971 348 HA PRO 41 HA PRO 41 10.682 -7.192 5.161 349 HB2 PRO 41 HB2 PRO 41 9.454 -7.174 7.924 350 HB3 PRO 41 HB3 PRO 41 8.620 -6.999 6.361 351 HG2 PRO 41 HG2 PRO 41 8.543 -9.366 7.717 352 HG3 PRO 41 HG3 PRO 41 8.753 -9.351 5.936 353 HD2 PRO 41 HD2 PRO 41 10.899 -9.626 8.068 354 HD3 PRO 41 HD3 PRO 41 10.631 -10.614 6.603 355 H ASP 42 H ASP 42 10.937 -4.988 5.450 356 HA ASP 42 HA ASP 42 13.071 -3.993 7.214 357 HB2 ASP 42 HB2 ASP 42 11.074 -2.659 5.338 358 HB3 ASP 42 HB3 ASP 42 12.286 -1.776 6.271 359 H TRP 43 H TRP 43 9.574 -4.254 7.256 360 HA TRP 43 HA TRP 43 9.393 -3.727 10.109 361 HB2 TRP 43 HB2 TRP 43 9.342 -1.427 9.343 362 HB3 TRP 43 HB3 TRP 43 8.210 -1.816 8.063 363 HD1 TRP 43 HD1 TRP 43 8.345 -0.952 11.746 364 HE1 TRP 43 HE1 TRP 43 5.975 -0.393 12.560 365 HE3 TRP 43 HE3 TRP 43 5.707 -2.665 7.730 366 HZ2 TRP 43 HZ2 TRP 43 3.289 -0.404 11.448 367 HZ3 TRP 43 HZ3 TRP 43 3.243 -2.260 7.579 368 HH2 TRP 43 HH2 TRP 43 2.031 -1.172 9.442 369 H THR 44 H THR 44 7.329 -4.400 10.960 370 HA THR 44 HA THR 44 5.289 -5.377 9.063 371 HB THR 44 HB THR 44 4.755 -7.324 10.446 372 HG1 THR 44 HG1 THR 44 7.286 -6.892 11.647 373 HG21 THR 44 HG21 THR 44 6.450 -8.823 9.652 374 HG22 THR 44 HG22 THR 44 6.161 -7.577 8.429 375 HG23 THR 44 HG23 THR 44 7.615 -7.490 9.446 376 H GLY 45 H GLY 45 3.186 -5.250 9.782 377 HA2 GLY 45 HA2 GLY 45 2.353 -4.639 12.435 378 HA3 GLY 45 HA3 GLY 45 2.608 -3.118 11.589 379 H ARG 46 H ARG 46 0.547 -2.440 11.437 380 HA ARG 46 HA ARG 46 -1.541 -4.214 10.246 381 HB2 ARG 46 HB2 ARG 46 -1.954 -1.678 11.868 382 HB3 ARG 46 HB3 ARG 46 -3.176 -2.835 11.336 383 HG2 ARG 46 HG2 ARG 46 -2.008 -4.581 12.795 384 HG3 ARG 46 HG3 ARG 46 -0.996 -3.270 13.420 385 HD2 ARG 46 HD2 ARG 46 -3.060 -2.053 14.126 386 HD3 ARG 46 HD3 ARG 46 -4.045 -3.413 13.548 387 HE ARG 46 HE ARG 46 -2.198 -4.513 15.358 388 HH11 ARG 46 HH11 ARG 46 -2.355 -4.557 17.605 389 HH12 ARG 46 HH12 ARG 46 -3.796 -3.928 18.347 390 HH21 ARG 46 HH21 ARG 46 -4.973 -2.393 15.520 391 HH22 ARG 46 HH22 ARG 46 -5.184 -2.645 17.230 392 H LEU 47 H LEU 47 -2.741 -3.588 8.603 393 HA LEU 47 HA LEU 47 -2.017 -1.248 6.927 394 HB2 LEU 47 HB2 LEU 47 -2.480 -3.438 5.842 395 HB3 LEU 47 HB3 LEU 47 -4.035 -3.515 6.669 396 HG LEU 47 HG LEU 47 -4.767 -1.448 5.398 397 HD11 LEU 47 HD11 LEU 47 -2.200 -1.987 3.834 398 HD12 LEU 47 HD12 LEU 47 -3.500 -0.884 3.343 399 HD13 LEU 47 HD13 LEU 47 -2.551 -0.529 4.789 400 HD21 LEU 47 HD21 LEU 47 -5.191 -2.673 3.332 401 HD22 LEU 47 HD22 LEU 47 -3.928 -3.852 3.775 402 HD23 LEU 47 HD23 LEU 47 -5.414 -3.710 4.735 403 H ARG 48 H ARG 48 -3.220 0.616 6.957 404 HA ARG 48 HA ARG 48 -6.070 0.501 7.731 405 HB2 ARG 48 HB2 ARG 48 -4.930 1.008 9.818 406 HB3 ARG 48 HB3 ARG 48 -4.089 2.377 9.090 407 HG2 ARG 48 HG2 ARG 48 -5.958 3.725 9.107 408 HG3 ARG 48 HG3 ARG 48 -7.091 2.389 8.870 409 HD2 ARG 48 HD2 ARG 48 -6.860 1.662 11.172 410 HD3 ARG 48 HD3 ARG 48 -5.582 2.831 11.477 411 HE ARG 48 HE ARG 48 -8.457 3.334 11.402 412 HH11 ARG 48 HH11 ARG 48 -9.219 5.425 11.855 413 HH12 ARG 48 HH12 ARG 48 -8.034 6.734 11.892 414 HH21 ARG 48 HH21 ARG 48 -5.271 4.946 11.316 415 HH22 ARG 48 HH22 ARG 48 -6.073 6.508 11.569 416 H ILE 49 H ILE 49 -6.633 0.787 5.689 417 HA ILE 49 HA ILE 49 -5.675 3.092 4.101 418 HB ILE 49 HB ILE 49 -7.999 1.281 3.415 419 HG12 ILE 49 HG12 ILE 49 -5.061 0.942 2.655 420 HG13 ILE 49 HG13 ILE 49 -6.021 -0.138 3.673 421 HG21 ILE 49 HG21 ILE 49 -7.628 2.142 1.140 422 HG22 ILE 49 HG22 ILE 49 -7.849 3.493 2.237 423 HG23 ILE 49 HG23 ILE 49 -6.217 3.071 1.695 424 HD11 ILE 49 HD11 ILE 49 -6.193 0.248 0.696 425 HD12 ILE 49 HD12 ILE 49 -6.096 -1.241 1.660 426 HD13 ILE 49 HD13 ILE 49 -7.604 -0.339 1.610 427 H THR 50 H THR 50 -6.523 4.981 4.187 428 HA THR 50 HA THR 50 -9.257 5.502 5.216 429 HB THR 50 HB THR 50 -8.155 7.631 6.224 430 HG1 THR 50 HG1 THR 50 -5.939 5.911 6.132 431 HG21 THR 50 HG21 THR 50 -9.149 6.086 7.725 432 HG22 THR 50 HG22 THR 50 -7.850 4.888 7.487 433 HG23 THR 50 HG23 THR 50 -7.527 6.404 8.349 434 H SER 51 H SER 51 -9.871 7.910 4.599 435 HA SER 51 HA SER 51 -8.483 9.064 2.288 436 HB2 SER 51 HB2 SER 51 -9.875 7.216 1.300 437 HB3 SER 51 HB3 SER 51 -11.318 7.974 2.005 438 HG SER 51 HG SER 51 -10.956 8.604 -0.172 439 H LYS 52 H LYS 52 -9.344 11.146 1.743 440 HA LYS 52 HA LYS 52 -11.933 11.800 2.775 441 HB2 LYS 52 HB2 LYS 52 -9.858 12.783 4.368 442 HB3 LYS 52 HB3 LYS 52 -10.286 14.161 3.351 443 HG2 LYS 52 HG2 LYS 52 -11.595 14.301 5.310 444 HG3 LYS 52 HG3 LYS 52 -12.712 13.758 4.044 445 HD2 LYS 52 HD2 LYS 52 -12.610 11.467 4.895 446 HD3 LYS 52 HD3 LYS 52 -11.248 11.891 5.950 447 HE2 LYS 52 HE2 LYS 52 -12.965 11.749 7.396 448 HE3 LYS 52 HE3 LYS 52 -12.816 13.502 7.114 449 HZ1 LYS 52 HZ1 LYS 52 -14.705 13.242 5.506 450 HZ2 LYS 52 HZ2 LYS 52 -14.809 11.650 5.928 451 HZ3 LYS 52 HZ3 LYS 52 -15.144 12.811 7.023 452 H GLY 53 H GLY 53 -12.996 12.535 1.193 453 HA2 GLY 53 HA2 GLY 53 -13.759 13.852 -0.555 454 HA3 GLY 53 HA3 GLY 53 -12.254 14.776 -0.506 455 H LYS 54 H LYS 54 -10.972 14.507 -2.149 456 HA LYS 54 HA LYS 54 -11.080 12.064 -3.878 457 HB2 LYS 54 HB2 LYS 54 -10.381 14.956 -4.361 458 HB3 LYS 54 HB3 LYS 54 -10.022 13.679 -5.554 459 HG2 LYS 54 HG2 LYS 54 -12.451 13.062 -5.571 460 HG3 LYS 54 HG3 LYS 54 -12.782 14.440 -4.514 461 HD2 LYS 54 HD2 LYS 54 -11.590 14.589 -7.314 462 HD3 LYS 54 HD3 LYS 54 -13.279 14.902 -6.885 463 HE2 LYS 54 HE2 LYS 54 -12.554 16.775 -5.408 464 HE3 LYS 54 HE3 LYS 54 -10.873 16.492 -5.882 465 HZ1 LYS 54 HZ1 LYS 54 -11.504 17.005 -8.180 466 HZ2 LYS 54 HZ2 LYS 54 -13.057 17.271 -7.743 467 HZ3 LYS 54 HZ3 LYS 54 -11.876 18.259 -7.207 468 H THR 55 H THR 55 -9.429 12.694 -1.298 469 HA THR 55 HA THR 55 -6.857 11.690 -2.449 470 HB THR 55 HB THR 55 -7.103 13.324 0.077 471 HG1 THR 55 HG1 THR 55 -6.307 15.023 -1.165 472 HG21 THR 55 HG21 THR 55 -4.769 12.540 -1.745 473 HG22 THR 55 HG22 THR 55 -4.641 13.573 -0.299 474 HG23 THR 55 HG23 THR 55 -5.091 11.868 -0.133 475 H ALA 56 H ALA 56 -6.714 9.597 -2.034 476 HA ALA 56 HA ALA 56 -7.757 8.448 0.492 477 HB1 ALA 56 HB1 ALA 56 -8.303 7.250 -1.543 478 HB2 ALA 56 HB2 ALA 56 -6.571 7.071 -1.918 479 HB3 ALA 56 HB3 ALA 56 -7.258 6.286 -0.483 480 H TYR 57 H TYR 57 -6.359 7.095 1.769 481 HA TYR 57 HA TYR 57 -3.489 7.907 1.885 482 HB2 TYR 57 HB2 TYR 57 -5.543 8.050 4.129 483 HB3 TYR 57 HB3 TYR 57 -3.825 8.383 4.283 484 HD1 TYR 57 HD1 TYR 57 -2.910 10.325 2.726 485 HD2 TYR 57 HD2 TYR 57 -7.044 9.879 3.919 486 HE1 TYR 57 HE1 TYR 57 -3.308 12.746 2.299 487 HE2 TYR 57 HE2 TYR 57 -7.436 12.277 3.442 488 HH TYR 57 HH TYR 57 -4.830 14.462 2.327 489 H ILE 58 H ILE 58 -2.635 5.830 1.498 490 HA ILE 58 HA ILE 58 -3.616 3.521 3.117 491 HB ILE 58 HB ILE 58 -1.246 3.686 1.218 492 HG12 ILE 58 HG12 ILE 58 -2.618 1.943 -0.061 493 HG13 ILE 58 HG13 ILE 58 -4.013 2.438 0.893 494 HG21 ILE 58 HG21 ILE 58 -1.123 1.236 1.507 495 HG22 ILE 58 HG22 ILE 58 -0.862 2.042 3.037 496 HG23 ILE 58 HG23 ILE 58 -2.440 1.301 2.702 497 HD11 ILE 58 HD11 ILE 58 -3.923 4.669 -0.132 498 HD12 ILE 58 HD12 ILE 58 -2.346 4.280 -0.882 499 HD13 ILE 58 HD13 ILE 58 -3.824 3.445 -1.397 500 H LYS 59 H LYS 59 -3.376 4.229 5.232 501 HA LYS 59 HA LYS 59 -0.645 4.954 6.135 502 HB2 LYS 59 HB2 LYS 59 -3.145 4.717 7.837 503 HB3 LYS 59 HB3 LYS 59 -1.613 5.495 8.232 504 HG2 LYS 59 HG2 LYS 59 -2.081 7.003 6.145 505 HG3 LYS 59 HG3 LYS 59 -3.723 6.380 6.238 506 HD2 LYS 59 HD2 LYS 59 -3.830 7.243 8.619 507 HD3 LYS 59 HD3 LYS 59 -2.223 7.978 8.351 508 HE2 LYS 59 HE2 LYS 59 -3.153 9.231 6.400 509 HE3 LYS 59 HE3 LYS 59 -4.745 8.524 6.720 510 HZ1 LYS 59 HZ1 LYS 59 -3.264 10.286 8.602 511 HZ2 LYS 59 HZ2 LYS 59 -4.560 10.730 7.705 512 HZ3 LYS 59 HZ3 LYS 59 -4.731 9.620 8.894 513 H LEU 60 H LEU 60 0.692 3.731 7.237 514 HA LEU 60 HA LEU 60 -0.050 0.918 7.967 515 HB2 LEU 60 HB2 LEU 60 2.405 2.205 6.802 516 HB3 LEU 60 HB3 LEU 60 2.646 0.951 8.007 517 HG LEU 60 HG LEU 60 1.464 -0.689 6.739 518 HD11 LEU 60 HD11 LEU 60 0.717 -0.241 4.381 519 HD12 LEU 60 HD12 LEU 60 -0.281 0.567 5.587 520 HD13 LEU 60 HD13 LEU 60 0.933 1.500 4.681 521 HD21 LEU 60 HD21 LEU 60 3.855 -0.222 6.241 522 HD22 LEU 60 HD22 LEU 60 2.995 -0.865 4.836 523 HD23 LEU 60 HD23 LEU 60 3.365 0.871 4.932 524 H GLU 61 H GLU 61 0.025 0.354 10.056 525 HA GLU 61 HA GLU 61 1.062 2.342 12.045 526 HB2 GLU 61 HB2 GLU 61 -1.693 1.072 11.955 527 HB3 GLU 61 HB3 GLU 61 -1.021 1.920 13.357 528 HG2 GLU 61 HG2 GLU 61 -0.806 3.994 12.051 529 HG3 GLU 61 HG3 GLU 61 -1.409 3.177 10.605 530 H ASP 62 H ASP 62 1.735 1.569 14.051 531 HA ASP 62 HA ASP 62 2.894 -1.048 14.015 532 HB2 ASP 62 HB2 ASP 62 3.761 1.039 15.156 533 HB3 ASP 62 HB3 ASP 62 2.474 0.811 16.363 534 H LYS 63 H LYS 63 2.322 -2.900 14.898 535 HA LYS 63 HA LYS 63 -0.437 -3.266 15.601 536 HB2 LYS 63 HB2 LYS 63 0.287 -5.762 15.713 537 HB3 LYS 63 HB3 LYS 63 0.513 -4.944 14.166 538 HG2 LYS 63 HG2 LYS 63 2.857 -4.583 14.590 539 HG3 LYS 63 HG3 LYS 63 2.731 -5.208 16.240 540 HD2 LYS 63 HD2 LYS 63 2.454 -7.435 15.491 541 HD3 LYS 63 HD3 LYS 63 2.041 -6.922 13.832 542 HE2 LYS 63 HE2 LYS 63 4.316 -5.965 13.562 543 HE3 LYS 63 HE3 LYS 63 4.758 -6.523 15.174 544 HZ1 LYS 63 HZ1 LYS 63 5.420 -7.994 13.257 545 HZ2 LYS 63 HZ2 LYS 63 4.595 -8.781 14.446 546 HZ3 LYS 63 HZ3 LYS 63 3.855 -8.383 13.041 547 H VAL 64 H VAL 64 2.026 -2.444 17.607 548 HA VAL 64 HA VAL 64 0.566 -3.555 19.973 549 HB VAL 64 HB VAL 64 3.509 -2.917 19.583 550 HG11 VAL 64 HG11 VAL 64 3.834 -3.826 21.888 551 HG12 VAL 64 HG12 VAL 64 2.910 -2.325 21.889 552 HG13 VAL 64 HG13 VAL 64 2.069 -3.881 22.097 553 HG21 VAL 64 HG21 VAL 64 3.839 -5.336 20.064 554 HG22 VAL 64 HG22 VAL 64 2.074 -5.555 20.111 555 HG23 VAL 64 HG23 VAL 64 2.887 -5.074 18.604 556 H SER 65 H SER 65 2.358 -0.706 18.701 557 HA SER 65 HA SER 65 1.431 0.886 21.021 558 HB2 SER 65 HB2 SER 65 3.303 1.549 18.726 559 HB3 SER 65 HB3 SER 65 2.933 2.626 20.086 560 HG SER 65 HG SER 65 4.851 1.418 20.429 561 H GLY 66 H GLY 66 0.497 0.435 17.713 562 HA2 GLY 66 HA2 GLY 66 -1.259 1.324 16.498 563 HA3 GLY 66 HA3 GLY 66 -1.747 2.278 17.903 564 H GLU 67 H GLU 67 1.542 2.658 16.920 565 HA GLU 67 HA GLU 67 1.036 5.456 16.201 566 HB2 GLU 67 HB2 GLU 67 3.302 5.843 16.682 567 HB3 GLU 67 HB3 GLU 67 2.667 4.765 17.936 568 HG2 GLU 67 HG2 GLU 67 3.755 2.836 16.855 569 HG3 GLU 67 HG3 GLU 67 4.383 3.879 15.576 570 H LEU 68 H LEU 68 1.943 6.492 14.329 571 HA LEU 68 HA LEU 68 1.528 4.921 11.944 572 HB2 LEU 68 HB2 LEU 68 0.879 7.344 12.257 573 HB3 LEU 68 HB3 LEU 68 2.592 7.757 12.222 574 HG LEU 68 HG LEU 68 2.675 6.675 9.883 575 HD11 LEU 68 HD11 LEU 68 0.518 5.412 10.039 576 HD12 LEU 68 HD12 LEU 68 -0.357 6.949 10.137 577 HD13 LEU 68 HD13 LEU 68 0.553 6.519 8.670 578 HD21 LEU 68 HD21 LEU 68 2.656 9.112 10.216 579 HD22 LEU 68 HD22 LEU 68 1.727 8.654 8.781 580 HD23 LEU 68 HD23 LEU 68 0.881 9.102 10.282 581 H PHE 69 H PHE 69 2.936 3.799 10.772 582 HA PHE 69 HA PHE 69 5.871 4.075 11.129 583 HB2 PHE 69 HB2 PHE 69 5.116 1.830 11.032 584 HB3 PHE 69 HB3 PHE 69 4.076 2.135 9.650 585 HD1 PHE 69 HD1 PHE 69 7.715 2.217 10.622 586 HD2 PHE 69 HD2 PHE 69 4.830 1.621 7.469 587 HE1 PHE 69 HE1 PHE 69 9.542 1.586 9.062 588 HE2 PHE 69 HE2 PHE 69 6.662 1.041 5.907 589 HZ PHE 69 HZ PHE 69 9.018 1.000 6.701 590 H ALA 70 H ALA 70 3.511 4.168 8.422 591 HA ALA 70 HA ALA 70 4.840 6.448 7.157 592 HB1 ALA 70 HB1 ALA 70 6.208 4.490 6.406 593 HB2 ALA 70 HB2 ALA 70 4.733 3.709 5.793 594 HB3 ALA 70 HB3 ALA 70 5.313 5.225 5.073 595 H GLN 71 H GLN 71 3.588 7.205 5.234 596 HA GLN 71 HA GLN 71 1.002 5.909 4.794 597 HB2 GLN 71 HB2 GLN 71 -0.357 7.841 5.092 598 HB3 GLN 71 HB3 GLN 71 0.517 7.508 6.573 599 HG2 GLN 71 HG2 GLN 71 0.785 9.773 6.519 600 HG3 GLN 71 HG3 GLN 71 2.232 9.326 5.632 601 HE21 GLN 71 HE21 GLN 71 1.102 11.674 3.203 602 HE22 GLN 71 HE22 GLN 71 2.445 11.068 4.170 603 H ALA 72 H ALA 72 0.254 6.004 2.764 604 HA ALA 72 HA ALA 72 1.774 7.632 0.768 605 HB1 ALA 72 HB1 ALA 72 0.445 4.931 0.483 606 HB2 ALA 72 HB2 ALA 72 1.180 5.865 -0.835 607 HB3 ALA 72 HB3 ALA 72 2.182 5.289 0.508 608 HA PRO 73 HA PRO 73 -2.367 9.471 0.281 609 HB2 PRO 73 HB2 PRO 73 -1.634 11.917 -0.617 610 HB3 PRO 73 HB3 PRO 73 -1.469 11.444 1.103 611 HG2 PRO 73 HG2 PRO 73 0.670 11.432 -1.040 612 HG3 PRO 73 HG3 PRO 73 0.774 12.080 0.624 613 HD2 PRO 73 HD2 PRO 73 1.675 9.573 -0.084 614 HD3 PRO 73 HD3 PRO 73 1.040 9.937 1.541 615 H VAL 74 H VAL 74 -3.646 9.453 -1.483 616 HA VAL 74 HA VAL 74 -2.460 9.072 -4.211 617 HB VAL 74 HB VAL 74 -4.865 7.518 -3.236 618 HG11 VAL 74 HG11 VAL 74 -2.757 6.929 -5.350 619 HG12 VAL 74 HG12 VAL 74 -4.191 5.947 -4.988 620 HG13 VAL 74 HG13 VAL 74 -4.386 7.577 -5.634 621 HG21 VAL 74 HG21 VAL 74 -3.219 6.860 -1.595 622 HG22 VAL 74 HG22 VAL 74 -3.478 5.569 -2.760 623 HG23 VAL 74 HG23 VAL 74 -2.010 6.565 -2.862 624 H GLU 75 H GLU 75 -3.328 10.528 -5.640 625 HA GLU 75 HA GLU 75 -5.829 11.951 -4.947 626 HB2 GLU 75 HB2 GLU 75 -3.845 12.299 -7.222 627 HB3 GLU 75 HB3 GLU 75 -5.266 13.316 -6.950 628 HG2 GLU 75 HG2 GLU 75 -4.399 13.915 -4.688 629 HG3 GLU 75 HG3 GLU 75 -2.938 12.979 -5.011 630 H GLN 76 H GLN 76 -4.997 9.279 -6.905 631 HA GLN 76 HA GLN 76 -7.722 8.736 -7.597 632 HB2 GLN 76 HB2 GLN 76 -7.620 8.731 -9.967 633 HB3 GLN 76 HB3 GLN 76 -7.185 10.336 -9.439 634 HG2 GLN 76 HG2 GLN 76 -5.273 8.207 -10.494 635 HG3 GLN 76 HG3 GLN 76 -5.863 9.608 -11.360 636 HE21 GLN 76 HE21 GLN 76 -2.737 10.054 -8.765 637 HE22 GLN 76 HE22 GLN 76 -3.697 8.559 -8.743 638 H TYR 77 H TYR 77 -8.001 6.515 -7.930 639 HA TYR 77 HA TYR 77 -5.561 4.846 -8.264 640 HB2 TYR 77 HB2 TYR 77 -6.335 4.731 -5.948 641 HB3 TYR 77 HB3 TYR 77 -7.928 4.220 -6.515 642 HD1 TYR 77 HD1 TYR 77 -4.322 3.281 -6.877 643 HD2 TYR 77 HD2 TYR 77 -8.403 1.927 -6.656 644 HE1 TYR 77 HE1 TYR 77 -3.551 0.928 -7.111 645 HE2 TYR 77 HE2 TYR 77 -7.623 -0.440 -6.809 646 HH TYR 77 HH TYR 77 -4.162 -1.280 -7.180 647 HA PRO 78 HA PRO 78 -4.851 2.930 -9.410 648 HB2 PRO 78 HB2 PRO 78 -4.965 2.924 -12.413 649 HB3 PRO 78 HB3 PRO 78 -4.158 1.772 -11.302 650 HG2 PRO 78 HG2 PRO 78 -6.517 1.104 -12.434 651 HG3 PRO 78 HG3 PRO 78 -6.263 0.792 -10.683 652 HD2 PRO 78 HD2 PRO 78 -7.683 3.145 -11.977 653 HD3 PRO 78 HD3 PRO 78 -8.240 2.099 -10.638 654 H GLY 79 H GLY 79 -2.931 4.071 -9.569 655 HA2 GLY 79 HA2 GLY 79 -2.387 6.332 -11.244 656 HA3 GLY 79 HA3 GLY 79 -2.992 6.874 -9.682 657 H ILE 80 H ILE 80 -0.851 7.902 -9.554 658 HA ILE 80 HA ILE 80 1.562 6.514 -9.835 659 HB ILE 80 HB ILE 80 1.332 8.897 -10.101 660 HG12 ILE 80 HG12 ILE 80 3.317 9.751 -8.941 661 HG13 ILE 80 HG13 ILE 80 3.325 8.362 -7.857 662 HG21 ILE 80 HG21 ILE 80 1.136 10.490 -8.277 663 HG22 ILE 80 HG22 ILE 80 -0.254 9.409 -8.231 664 HG23 ILE 80 HG23 ILE 80 1.081 9.197 -7.074 665 HD11 ILE 80 HD11 ILE 80 3.824 6.864 -9.750 666 HD12 ILE 80 HD12 ILE 80 3.697 8.236 -10.880 667 HD13 ILE 80 HD13 ILE 80 4.995 8.188 -9.668 668 H ALA 81 H ALA 81 -0.225 7.022 -6.804 669 HA ALA 81 HA ALA 81 2.099 6.146 -5.210 670 HB1 ALA 81 HB1 ALA 81 0.770 6.996 -3.324 671 HB2 ALA 81 HB2 ALA 81 0.942 8.194 -4.616 672 HB3 ALA 81 HB3 ALA 81 -0.583 7.311 -4.433 673 H VAL 82 H VAL 82 0.059 4.264 -6.775 674 HA VAL 82 HA VAL 82 0.370 2.076 -4.844 675 HB VAL 82 HB VAL 82 -2.383 2.687 -5.918 676 HG11 VAL 82 HG11 VAL 82 -3.111 0.878 -4.359 677 HG12 VAL 82 HG12 VAL 82 -1.944 0.264 -5.530 678 HG13 VAL 82 HG13 VAL 82 -1.422 0.622 -3.880 679 HG21 VAL 82 HG21 VAL 82 -1.498 3.083 -3.054 680 HG22 VAL 82 HG22 VAL 82 -2.012 4.336 -4.206 681 HG23 VAL 82 HG23 VAL 82 -3.168 3.128 -3.659 682 H GLU 83 H GLU 83 1.082 0.397 -5.965 683 HA GLU 83 HA GLU 83 0.122 -0.177 -8.720 684 HB2 GLU 83 HB2 GLU 83 2.883 0.595 -7.850 685 HB3 GLU 83 HB3 GLU 83 2.810 -0.796 -8.919 686 HG2 GLU 83 HG2 GLU 83 1.374 1.798 -9.527 687 HG3 GLU 83 HG3 GLU 83 3.042 1.476 -10.008 688 H THR 84 H THR 84 0.784 -2.259 -9.542 689 HA THR 84 HA THR 84 0.651 -4.392 -7.423 690 HB THR 84 HB THR 84 -0.556 -5.741 -8.967 691 HG1 THR 84 HG1 THR 84 0.234 -5.297 -10.941 692 HG21 THR 84 HG21 THR 84 -2.600 -4.466 -9.308 693 HG22 THR 84 HG22 THR 84 -1.882 -4.003 -7.762 694 HG23 THR 84 HG23 THR 84 -1.721 -2.923 -9.164 695 H VAL 85 H VAL 85 1.655 -6.475 -7.961 696 HA VAL 85 HA VAL 85 4.219 -6.242 -9.384 697 HB VAL 85 HB VAL 85 4.621 -8.500 -8.537 698 HG11 VAL 85 HG11 VAL 85 4.796 -7.920 -6.188 699 HG12 VAL 85 HG12 VAL 85 5.127 -6.494 -7.176 700 HG13 VAL 85 HG13 VAL 85 3.565 -6.663 -6.354 701 HG21 VAL 85 HG21 VAL 85 2.273 -9.340 -8.592 702 HG22 VAL 85 HG22 VAL 85 3.121 -9.628 -7.069 703 HG23 VAL 85 HG23 VAL 85 1.915 -8.331 -7.178 704 H THR 86 H THR 86 4.731 -8.314 -10.714 705 HA THR 86 HA THR 86 2.768 -8.551 -12.906 706 HB THR 86 HB THR 86 4.574 -9.584 -14.144 707 HG1 THR 86 HG1 THR 86 6.543 -9.959 -13.192 708 HG21 THR 86 HG21 THR 86 6.283 -7.814 -14.127 709 HG22 THR 86 HG22 THR 86 4.657 -7.096 -13.984 710 HG23 THR 86 HG23 THR 86 5.706 -7.235 -12.561 711 H ASP 87 H ASP 87 4.389 -10.640 -10.528 712 HA ASP 87 HA ASP 87 3.277 -13.017 -11.784 713 HB2 ASP 87 HB2 ASP 87 5.610 -12.821 -11.041 714 HB3 ASP 87 HB3 ASP 87 5.057 -12.769 -9.360 715 H SER 88 H SER 88 2.736 -11.502 -8.562 716 HA SER 88 HA SER 88 0.487 -13.451 -8.109 717 HB2 SER 88 HB2 SER 88 2.499 -14.346 -7.055 718 HB3 SER 88 HB3 SER 88 2.683 -12.853 -6.113 719 HG SER 88 HG SER 88 1.515 -14.676 -5.086 720 H SER 89 H SER 89 -1.352 -12.373 -7.772 721 HA SER 89 HA SER 89 -1.390 -9.601 -7.435 722 HB2 SER 89 HB2 SER 89 -3.819 -11.200 -6.726 723 HB3 SER 89 HB3 SER 89 -3.693 -9.704 -7.646 724 HG SER 89 HG SER 89 -2.745 -10.952 -9.357 725 H ARG 90 H ARG 90 -0.721 -11.629 -4.859 726 HA ARG 90 HA ARG 90 -2.103 -9.977 -2.862 727 HB2 ARG 90 HB2 ARG 90 -1.686 -11.555 -1.219 728 HB3 ARG 90 HB3 ARG 90 -2.270 -12.386 -2.653 729 HG2 ARG 90 HG2 ARG 90 0.085 -13.049 -3.188 730 HG3 ARG 90 HG3 ARG 90 0.605 -12.290 -1.664 731 HD2 ARG 90 HD2 ARG 90 -0.888 -13.800 -0.388 732 HD3 ARG 90 HD3 ARG 90 -1.469 -14.510 -1.891 733 HE ARG 90 HE ARG 90 0.498 -15.718 -2.152 734 HH11 ARG 90 HH11 ARG 90 2.304 -16.752 -1.416 735 HH12 ARG 90 HH12 ARG 90 3.089 -16.210 0.036 736 HH21 ARG 90 HH21 ARG 90 0.935 -13.613 0.648 737 HH22 ARG 90 HH22 ARG 90 2.389 -14.449 1.117 738 H TYR 91 H TYR 91 0.115 -8.887 -4.505 739 HA TYR 91 HA TYR 91 1.682 -7.718 -2.287 740 HB2 TYR 91 HB2 TYR 91 2.785 -8.910 -4.853 741 HB3 TYR 91 HB3 TYR 91 3.708 -7.952 -3.716 742 HD1 TYR 91 HD1 TYR 91 2.285 -11.268 -4.414 743 HD2 TYR 91 HD2 TYR 91 4.240 -8.816 -1.452 744 HE1 TYR 91 HE1 TYR 91 2.933 -13.307 -3.159 745 HE2 TYR 91 HE2 TYR 91 4.829 -10.867 -0.155 746 HH TYR 91 HH TYR 91 4.083 -14.151 -1.361 747 H PHE 92 H PHE 92 2.164 -5.582 -2.543 748 HA PHE 92 HA PHE 92 1.526 -4.187 -5.099 749 HB2 PHE 92 HB2 PHE 92 0.537 -3.357 -2.339 750 HB3 PHE 92 HB3 PHE 92 0.318 -2.445 -3.819 751 HD1 PHE 92 HD1 PHE 92 -0.945 -5.128 -1.754 752 HD2 PHE 92 HD2 PHE 92 -1.126 -3.387 -5.679 753 HE1 PHE 92 HE1 PHE 92 -3.069 -6.318 -2.173 754 HE2 PHE 92 HE2 PHE 92 -3.222 -4.665 -6.141 755 HZ PHE 92 HZ PHE 92 -4.181 -6.130 -4.414 756 H VAL 93 H VAL 93 2.391 -1.993 -5.184 757 HA VAL 93 HA VAL 93 4.483 -1.367 -3.142 758 HB VAL 93 HB VAL 93 4.602 -0.684 -6.100 759 HG11 VAL 93 HG11 VAL 93 6.766 0.304 -5.647 760 HG12 VAL 93 HG12 VAL 93 5.568 1.100 -4.628 761 HG13 VAL 93 HG13 VAL 93 6.657 -0.110 -3.923 762 HG21 VAL 93 HG21 VAL 93 5.226 -2.986 -5.782 763 HG22 VAL 93 HG22 VAL 93 6.729 -2.075 -5.960 764 HG23 VAL 93 HG23 VAL 93 6.213 -2.594 -4.354 765 H ILE 94 H ILE 94 4.303 0.666 -2.199 766 HA ILE 94 HA ILE 94 2.362 2.536 -3.452 767 HB ILE 94 HB ILE 94 1.487 3.278 -1.391 768 HG12 ILE 94 HG12 ILE 94 3.372 2.463 0.132 769 HG13 ILE 94 HG13 ILE 94 1.726 2.375 0.727 770 HG21 ILE 94 HG21 ILE 94 -0.083 1.442 -0.969 771 HG22 ILE 94 HG22 ILE 94 0.239 1.687 -2.689 772 HG23 ILE 94 HG23 ILE 94 0.975 0.318 -1.856 773 HD11 ILE 94 HD11 ILE 94 3.034 0.405 1.368 774 HD12 ILE 94 HD12 ILE 94 1.656 -0.043 0.361 775 HD13 ILE 94 HD13 ILE 94 3.287 -0.018 -0.336 776 H ARG 95 H ARG 95 2.672 4.699 -3.180 777 HA ARG 95 HA ARG 95 5.521 5.415 -2.668 778 HB2 ARG 95 HB2 ARG 95 4.307 6.059 -4.823 779 HB3 ARG 95 HB3 ARG 95 3.466 7.286 -3.869 780 HG2 ARG 95 HG2 ARG 95 5.725 8.169 -3.142 781 HG3 ARG 95 HG3 ARG 95 6.482 6.956 -4.183 782 HD2 ARG 95 HD2 ARG 95 6.529 8.879 -5.481 783 HD3 ARG 95 HD3 ARG 95 5.137 7.993 -6.123 784 HE ARG 95 HE ARG 95 4.123 9.720 -4.136 785 HH11 ARG 95 HH11 ARG 95 3.505 11.875 -4.414 786 HH12 ARG 95 HH12 ARG 95 3.783 12.631 -5.954 787 HH21 ARG 95 HH21 ARG 95 5.683 10.099 -7.250 788 HH22 ARG 95 HH22 ARG 95 5.048 11.704 -7.477 789 H ILE 96 H ILE 96 5.573 5.335 -0.440 790 HA ILE 96 HA ILE 96 3.753 6.969 1.149 791 HB ILE 96 HB ILE 96 4.970 6.424 3.082 792 HG12 ILE 96 HG12 ILE 96 6.813 4.469 2.657 793 HG13 ILE 96 HG13 ILE 96 7.115 5.425 1.219 794 HG21 ILE 96 HG21 ILE 96 4.477 4.000 1.350 795 HG22 ILE 96 HG22 ILE 96 4.605 4.002 3.117 796 HG23 ILE 96 HG23 ILE 96 3.291 4.875 2.354 797 HD11 ILE 96 HD11 ILE 96 7.203 6.394 4.115 798 HD12 ILE 96 HD12 ILE 96 8.597 6.051 3.077 799 HD13 ILE 96 HD13 ILE 96 7.536 7.419 2.695 800 H GLN 97 H GLN 97 4.063 8.910 2.114 801 HA GLN 97 HA GLN 97 6.319 10.621 1.160 802 HB2 GLN 97 HB2 GLN 97 3.359 11.020 0.632 803 HB3 GLN 97 HB3 GLN 97 4.527 12.341 0.551 804 HG2 GLN 97 HG2 GLN 97 5.608 11.513 -1.326 805 HG3 GLN 97 HG3 GLN 97 5.081 9.856 -1.078 806 HE21 GLN 97 HE21 GLN 97 2.064 10.192 -2.886 807 HE22 GLN 97 HE22 GLN 97 3.082 9.144 -1.909 808 H ASP 98 H ASP 98 6.686 12.449 2.305 809 HA ASP 98 HA ASP 98 5.742 12.377 5.121 810 HB2 ASP 98 HB2 ASP 98 8.186 12.326 4.405 811 HB3 ASP 98 HB3 ASP 98 7.973 14.010 3.924 812 H GLY 99 H GLY 99 4.600 13.888 2.479 813 HA2 GLY 99 HA2 GLY 99 2.949 15.515 2.296 814 HA3 GLY 99 HA3 GLY 99 3.167 15.937 3.994 815 H THR 100 H THR 100 6.094 15.983 2.294 816 HA THR 100 HA THR 100 6.022 18.938 1.825 817 HB THR 100 HB THR 100 6.897 18.215 4.062 818 HG1 THR 100 HG1 THR 100 8.596 19.651 3.998 819 HG21 THR 100 HG21 THR 100 9.096 17.283 4.286 820 HG22 THR 100 HG22 THR 100 8.161 16.191 3.254 821 HG23 THR 100 HG23 THR 100 9.357 17.291 2.530 822 H GLY 101 H GLY 101 6.233 16.282 0.081 823 HA2 GLY 101 HA2 GLY 101 6.941 16.161 -2.165 824 HA3 GLY 101 HA3 GLY 101 8.168 17.392 -1.882 825 H ARG 102 H ARG 102 8.498 15.273 0.638 826 HA ARG 102 HA ARG 102 10.652 13.606 -0.461 827 HB2 ARG 102 HB2 ARG 102 9.150 13.583 2.189 828 HB3 ARG 102 HB3 ARG 102 10.488 12.499 1.803 829 HG2 ARG 102 HG2 ARG 102 12.026 14.317 1.618 830 HG3 ARG 102 HG3 ARG 102 10.722 15.517 1.789 831 HD2 ARG 102 HD2 ARG 102 10.235 14.690 4.058 832 HD3 ARG 102 HD3 ARG 102 11.553 13.514 3.934 833 HE ARG 102 HE ARG 102 12.958 15.716 3.493 834 HH11 ARG 102 HH11 ARG 102 13.846 17.182 4.872 835 HH12 ARG 102 HH12 ARG 102 13.078 17.538 6.390 836 HH21 ARG 102 HH21 ARG 102 10.415 15.405 5.970 837 HH22 ARG 102 HH22 ARG 102 11.227 16.559 6.987 838 H SER 103 H SER 103 10.385 11.670 -1.240 839 HA SER 103 HA SER 103 8.016 10.094 -0.551 840 HB2 SER 103 HB2 SER 103 7.513 9.502 -2.895 841 HB3 SER 103 HB3 SER 103 7.371 11.248 -2.631 842 HG SER 103 HG SER 103 8.519 10.838 -4.542 843 H ALA 104 H ALA 104 8.126 7.858 -0.808 844 HA ALA 104 HA ALA 104 10.496 6.626 -2.058 845 HB1 ALA 104 HB1 ALA 104 9.629 6.015 0.804 846 HB2 ALA 104 HB2 ALA 104 10.864 5.133 -0.119 847 HB3 ALA 104 HB3 ALA 104 11.136 6.830 0.326 848 H PHE 105 H PHE 105 10.052 4.663 -2.999 849 HA PHE 105 HA PHE 105 7.239 3.677 -2.929 850 HB2 PHE 105 HB2 PHE 105 9.559 3.181 -4.805 851 HB3 PHE 105 HB3 PHE 105 8.147 2.150 -4.766 852 HD1 PHE 105 HD1 PHE 105 9.478 5.272 -6.041 853 HD2 PHE 105 HD2 PHE 105 5.831 3.146 -5.180 854 HE1 PHE 105 HE1 PHE 105 8.245 6.713 -7.646 855 HE2 PHE 105 HE2 PHE 105 4.613 4.538 -6.817 856 HZ PHE 105 HZ PHE 105 5.819 6.334 -8.056 857 H ILE 106 H ILE 106 6.752 2.175 -1.511 858 HA ILE 106 HA ILE 106 8.822 0.176 -0.673 859 HB ILE 106 HB ILE 106 7.887 0.007 1.482 860 HG12 ILE 106 HG12 ILE 106 5.854 2.169 0.791 861 HG13 ILE 106 HG13 ILE 106 5.491 0.451 0.964 862 HG21 ILE 106 HG21 ILE 106 8.232 2.969 0.880 863 HG22 ILE 106 HG22 ILE 106 8.606 2.128 2.402 864 HG23 ILE 106 HG23 ILE 106 9.572 1.804 0.957 865 HD11 ILE 106 HD11 ILE 106 4.844 1.568 2.986 866 HD12 ILE 106 HD12 ILE 106 6.207 0.493 3.324 867 HD13 ILE 106 HD13 ILE 106 6.463 2.246 3.209 868 H GLY 107 H GLY 107 8.247 -1.983 -0.516 869 HA2 GLY 107 HA2 GLY 107 5.830 -2.774 -2.050 870 HA3 GLY 107 HA3 GLY 107 7.208 -3.795 -1.652 871 H ILE 108 H ILE 108 4.199 -3.969 -1.123 872 HA ILE 108 HA ILE 108 4.545 -4.989 1.619 873 HB ILE 108 HB ILE 108 2.217 -4.508 2.206 874 HG12 ILE 108 HG12 ILE 108 2.161 -2.568 -0.143 875 HG13 ILE 108 HG13 ILE 108 1.321 -4.119 -0.105 876 HG21 ILE 108 HG21 ILE 108 4.109 -3.193 3.019 877 HG22 ILE 108 HG22 ILE 108 3.894 -2.028 1.694 878 HG23 ILE 108 HG23 ILE 108 2.635 -2.230 2.933 879 HD11 ILE 108 HD11 ILE 108 0.762 -1.769 1.761 880 HD12 ILE 108 HD12 ILE 108 -0.255 -2.366 0.442 881 HD13 ILE 108 HD13 ILE 108 0.006 -3.369 1.880 882 H GLY 109 H GLY 109 3.576 -6.875 2.136 883 HA2 GLY 109 HA2 GLY 109 2.222 -8.397 -0.068 884 HA3 GLY 109 HA3 GLY 109 3.404 -9.119 1.014 885 H PHE 110 H PHE 110 0.611 -9.772 0.417 886 HA PHE 110 HA PHE 110 -0.670 -9.591 3.116 887 HB2 PHE 110 HB2 PHE 110 -1.809 -9.846 0.318 888 HB3 PHE 110 HB3 PHE 110 -2.762 -10.138 1.758 889 HD1 PHE 110 HD1 PHE 110 -0.621 -7.478 0.154 890 HD2 PHE 110 HD2 PHE 110 -3.905 -8.381 2.806 891 HE1 PHE 110 HE1 PHE 110 -1.089 -5.058 0.417 892 HE2 PHE 110 HE2 PHE 110 -4.417 -5.956 2.988 893 HZ PHE 110 HZ PHE 110 -3.020 -4.305 1.748 894 H THR 111 H THR 111 -1.863 -11.426 3.849 895 HA THR 111 HA THR 111 -0.387 -13.902 3.546 896 HB THR 111 HB THR 111 -1.325 -12.998 5.666 897 HG1 THR 111 HG1 THR 111 -1.861 -15.024 6.439 898 HG21 THR 111 HG21 THR 111 -3.625 -13.420 6.302 899 HG22 THR 111 HG22 THR 111 -3.616 -12.371 4.879 900 HG23 THR 111 HG23 THR 111 -4.001 -14.098 4.706 901 H ASP 112 H ASP 112 -3.249 -12.631 2.020 902 HA ASP 112 HA ASP 112 -3.613 -15.096 0.492 903 HB2 ASP 112 HB2 ASP 112 -4.988 -15.385 2.593 904 HB3 ASP 112 HB3 ASP 112 -5.912 -13.956 2.134 905 H ARG 113 H ARG 113 -4.729 -14.817 -1.449 906 HA ARG 113 HA ARG 113 -4.534 -12.241 -2.684 907 HB2 ARG 113 HB2 ARG 113 -4.308 -14.497 -3.774 908 HB3 ARG 113 HB3 ARG 113 -6.063 -14.702 -3.646 909 HG2 ARG 113 HG2 ARG 113 -6.417 -12.727 -5.084 910 HG3 ARG 113 HG3 ARG 113 -4.673 -12.401 -5.081 911 HD2 ARG 113 HD2 ARG 113 -4.300 -14.643 -6.160 912 HD3 ARG 113 HD3 ARG 113 -6.045 -14.859 -6.269 913 HE ARG 113 HE ARG 113 -4.336 -12.955 -7.805 914 HH11 ARG 113 HH11 ARG 113 -5.059 -11.999 -9.537 915 HH12 ARG 113 HH12 ARG 113 -6.711 -12.202 -10.084 916 HH21 ARG 113 HH21 ARG 113 -7.624 -14.118 -7.360 917 HH22 ARG 113 HH22 ARG 113 -8.158 -13.348 -8.828 918 H GLY 114 H GLY 114 -7.320 -13.839 -1.145 919 HA2 GLY 114 HA2 GLY 114 -9.343 -12.021 -2.139 920 HA3 GLY 114 HA3 GLY 114 -9.447 -13.071 -0.721 921 H ASP 115 H ASP 115 -7.012 -11.842 0.514 922 HA ASP 115 HA ASP 115 -8.323 -9.487 1.747 923 HB2 ASP 115 HB2 ASP 115 -6.009 -11.289 2.458 924 HB3 ASP 115 HB3 ASP 115 -6.093 -9.677 3.144 925 H ALA 116 H ALA 116 -5.524 -10.168 -0.351 926 HA ALA 116 HA ALA 116 -4.701 -7.403 -0.596 927 HB1 ALA 116 HB1 ALA 116 -3.725 -8.307 -2.742 928 HB2 ALA 116 HB2 ALA 116 -3.280 -9.193 -1.268 929 HB3 ALA 116 HB3 ALA 116 -4.499 -9.854 -2.388 930 H PHE 117 H PHE 117 -7.166 -9.400 -2.323 931 HA PHE 117 HA PHE 117 -8.070 -7.283 -4.029 932 HB2 PHE 117 HB2 PHE 117 -9.162 -9.906 -3.143 933 HB3 PHE 117 HB3 PHE 117 -10.329 -8.706 -3.661 934 HD1 PHE 117 HD1 PHE 117 -6.896 -9.769 -4.886 935 HD2 PHE 117 HD2 PHE 117 -11.014 -8.933 -5.865 936 HE1 PHE 117 HE1 PHE 117 -6.422 -10.225 -7.273 937 HE2 PHE 117 HE2 PHE 117 -10.535 -9.396 -8.255 938 HZ PHE 117 HZ PHE 117 -8.238 -10.037 -8.965 939 H ASP 118 H ASP 118 -8.946 -8.000 -0.610 940 HA ASP 118 HA ASP 118 -10.909 -5.947 -0.425 941 HB2 ASP 118 HB2 ASP 118 -10.436 -7.811 1.224 942 HB3 ASP 118 HB3 ASP 118 -9.051 -6.883 1.794 943 H PHE 119 H PHE 119 -7.342 -5.726 -0.094 944 HA PHE 119 HA PHE 119 -7.178 -2.919 0.526 945 HB2 PHE 119 HB2 PHE 119 -5.292 -4.266 0.868 946 HB3 PHE 119 HB3 PHE 119 -5.280 -4.884 -0.761 947 HD1 PHE 119 HD1 PHE 119 -4.135 -2.207 1.400 948 HD2 PHE 119 HD2 PHE 119 -4.574 -3.441 -2.701 949 HE1 PHE 119 HE1 PHE 119 -2.622 -0.399 0.700 950 HE2 PHE 119 HE2 PHE 119 -3.025 -1.647 -3.403 951 HZ PHE 119 HZ PHE 119 -2.041 -0.107 -1.706 952 H ASN 120 H ASN 120 -7.095 -4.544 -2.716 953 HA ASN 120 HA ASN 120 -7.045 -1.906 -3.962 954 HB2 ASN 120 HB2 ASN 120 -6.912 -2.992 -6.083 955 HB3 ASN 120 HB3 ASN 120 -5.753 -3.664 -4.949 956 HD21 ASN 120 HD21 ASN 120 -8.768 -6.096 -6.322 957 HD22 ASN 120 HD22 ASN 120 -9.123 -4.385 -6.180 958 H VAL 121 H VAL 121 -9.713 -4.088 -3.262 959 HA VAL 121 HA VAL 121 -11.573 -2.698 -5.033 960 HB VAL 121 HB VAL 121 -11.969 -4.710 -2.810 961 HG11 VAL 121 HG11 VAL 121 -14.089 -3.459 -4.614 962 HG12 VAL 121 HG12 VAL 121 -14.325 -4.910 -3.614 963 HG13 VAL 121 HG13 VAL 121 -14.012 -3.359 -2.839 964 HG21 VAL 121 HG21 VAL 121 -12.626 -6.188 -4.679 965 HG22 VAL 121 HG22 VAL 121 -12.370 -4.866 -5.841 966 HG23 VAL 121 HG23 VAL 121 -11.002 -5.561 -4.951 967 H SER 122 H SER 122 -10.826 -2.510 -1.500 968 HA SER 122 HA SER 122 -12.858 -0.583 -0.925 969 HB2 SER 122 HB2 SER 122 -11.623 -0.140 1.120 970 HB3 SER 122 HB3 SER 122 -11.737 -1.886 0.812 971 HG SER 122 HG SER 122 -9.673 -1.986 0.335 972 H LEU 123 H LEU 123 -9.552 -0.150 -2.153 973 HA LEU 123 HA LEU 123 -9.610 2.740 -2.170 974 HB2 LEU 123 HB2 LEU 123 -8.024 0.641 -3.688 975 HB3 LEU 123 HB3 LEU 123 -7.815 2.363 -3.995 976 HG LEU 123 HG LEU 123 -7.416 1.121 -1.245 977 HD11 LEU 123 HD11 LEU 123 -5.006 1.287 -1.727 978 HD12 LEU 123 HD12 LEU 123 -5.799 0.196 -2.863 979 HD13 LEU 123 HD13 LEU 123 -5.363 1.837 -3.384 980 HD21 LEU 123 HD21 LEU 123 -7.857 3.556 -1.190 981 HD22 LEU 123 HD22 LEU 123 -6.171 3.217 -0.810 982 HD23 LEU 123 HD23 LEU 123 -6.602 3.820 -2.423 983 H GLN 124 H GLN 124 -10.214 0.399 -4.907 984 HA GLN 124 HA GLN 124 -10.874 2.566 -6.650 985 HB2 GLN 124 HB2 GLN 124 -11.261 0.991 -8.315 986 HB3 GLN 124 HB3 GLN 124 -10.035 0.266 -7.273 987 HG2 GLN 124 HG2 GLN 124 -11.946 -0.976 -6.128 988 HG3 GLN 124 HG3 GLN 124 -12.985 -0.442 -7.449 989 HE21 GLN 124 HE21 GLN 124 -9.961 -3.139 -8.285 990 HE22 GLN 124 HE22 GLN 124 -9.815 -2.065 -6.878 991 H ASP 125 H ASP 125 -12.942 0.824 -4.398 992 HA ASP 125 HA ASP 125 -15.409 1.858 -5.556 993 HB2 ASP 125 HB2 ASP 125 -15.262 -0.331 -4.380 994 HB3 ASP 125 HB3 ASP 125 -14.906 0.524 -2.873 995 H HIS 126 H HIS 126 -12.933 3.309 -3.755 996 HA HIS 126 HA HIS 126 -14.761 5.458 -2.835 997 HB2 HIS 126 HB2 HIS 126 -12.839 4.741 -1.372 998 HB3 HIS 126 HB3 HIS 126 -11.729 5.339 -2.611 999 HD2 HIS 126 HD2 HIS 126 -11.686 8.044 -3.032 1000 HE1 HIS 126 HE1 HIS 126 -13.996 9.137 0.384 1001 HE2 HIS 126 HE2 HIS 126 -12.582 10.027 -1.542 1002 H PHE 127 H PHE 127 -12.563 4.685 -5.468 1003 HA PHE 127 HA PHE 127 -12.762 7.454 -6.520 1004 HB2 PHE 127 HB2 PHE 127 -10.946 5.125 -7.171 1005 HB3 PHE 127 HB3 PHE 127 -10.972 6.614 -8.100 1006 HD1 PHE 127 HD1 PHE 127 -10.706 8.870 -6.781 1007 HD2 PHE 127 HD2 PHE 127 -9.512 5.022 -5.274 1008 HE1 PHE 127 HE1 PHE 127 -9.044 9.964 -5.295 1009 HE2 PHE 127 HE2 PHE 127 -7.814 6.096 -3.836 1010 HZ PHE 127 HZ PHE 127 -7.584 8.584 -3.835 1011 H LYS 128 H LYS 128 -14.593 4.653 -7.112 1012 HA LYS 128 HA LYS 128 -14.810 4.640 -9.856 1013 HB2 LYS 128 HB2 LYS 128 -16.820 3.517 -9.756 1014 HB3 LYS 128 HB3 LYS 128 -15.894 3.009 -8.359 1015 HG2 LYS 128 HG2 LYS 128 -18.171 5.061 -8.285 1016 HG3 LYS 128 HG3 LYS 128 -18.345 3.332 -7.985 1017 HD2 LYS 128 HD2 LYS 128 -16.689 3.538 -6.111 1018 HD3 LYS 128 HD3 LYS 128 -16.691 5.291 -6.345 1019 HE2 LYS 128 HE2 LYS 128 -18.167 4.901 -4.576 1020 HE3 LYS 128 HE3 LYS 128 -19.174 5.278 -5.985 1021 HZ1 LYS 128 HZ1 LYS 128 -18.595 2.516 -4.995 1022 HZ2 LYS 128 HZ2 LYS 128 -19.977 3.335 -4.681 1023 HZ3 LYS 128 HZ3 LYS 128 -19.621 2.895 -6.212 1024 H TRP 129 H TRP 129 -16.186 7.148 -7.858 1025 HA TRP 129 HA TRP 129 -17.726 8.345 -10.063 1026 HB2 TRP 129 HB2 TRP 129 -18.303 10.054 -8.485 1027 HB3 TRP 129 HB3 TRP 129 -18.527 8.472 -7.758 1028 HD1 TRP 129 HD1 TRP 129 -16.593 7.707 -5.949 1029 HE1 TRP 129 HE1 TRP 129 -15.121 9.039 -4.382 1030 HE3 TRP 129 HE3 TRP 129 -17.182 12.355 -8.042 1031 HZ2 TRP 129 HZ2 TRP 129 -14.639 11.854 -3.786 1032 HZ3 TRP 129 HZ3 TRP 129 -16.287 14.360 -6.885 1033 HH2 TRP 129 HH2 TRP 129 -15.058 14.129 -4.743 1034 H VAL 130 H VAL 130 -14.455 8.520 -8.995 1035 HA VAL 130 HA VAL 130 -13.858 11.037 -10.449 1036 HB VAL 130 HB VAL 130 -11.997 9.136 -8.974 1037 HG11 VAL 130 HG11 VAL 130 -11.546 11.961 -10.023 1038 HG12 VAL 130 HG12 VAL 130 -10.415 11.041 -9.006 1039 HG13 VAL 130 HG13 VAL 130 -10.781 10.478 -10.637 1040 HG21 VAL 130 HG21 VAL 130 -13.539 10.164 -7.372 1041 HG22 VAL 130 HG22 VAL 130 -11.959 10.931 -7.224 1042 HG23 VAL 130 HG23 VAL 130 -13.266 11.766 -8.088 1043 H LYS 131 H LYS 131 -13.548 7.534 -10.756 1044 HA LYS 131 HA LYS 131 -12.137 7.640 -13.348 1045 HB2 LYS 131 HB2 LYS 131 -13.014 5.372 -11.511 1046 HB3 LYS 131 HB3 LYS 131 -12.235 5.098 -13.068 1047 HG2 LYS 131 HG2 LYS 131 -10.951 6.744 -10.851 1048 HG3 LYS 131 HG3 LYS 131 -10.715 5.007 -11.066 1049 HD2 LYS 131 HD2 LYS 131 -9.775 5.343 -13.304 1050 HD3 LYS 131 HD3 LYS 131 -10.039 7.099 -13.196 1051 HE2 LYS 131 HE2 LYS 131 -8.563 7.281 -11.298 1052 HE3 LYS 131 HE3 LYS 131 -8.385 5.520 -11.212 1053 HZ1 LYS 131 HZ1 LYS 131 -7.349 5.637 -13.465 1054 HZ2 LYS 131 HZ2 LYS 131 -7.356 7.268 -13.384 1055 HZ3 LYS 131 HZ3 LYS 131 -6.464 6.381 -12.320 1056 H GLN 132 H GLN 132 -14.417 8.943 -13.546 1057 HA GLN 132 HA GLN 132 -16.440 7.205 -14.820 1058 HB2 GLN 132 HB2 GLN 132 -16.393 10.169 -14.198 1059 HB3 GLN 132 HB3 GLN 132 -17.637 9.410 -15.199 1060 HG2 GLN 132 HG2 GLN 132 -17.008 8.549 -12.350 1061 HG3 GLN 132 HG3 GLN 132 -18.276 9.694 -12.774 1062 HE21 GLN 132 HE21 GLN 132 -19.096 5.760 -13.018 1063 HE22 GLN 132 HE22 GLN 132 -17.641 6.381 -12.239 1064 H GLU 133 H GLU 133 -15.569 6.445 -16.572 1065 HA GLU 133 HA GLU 133 -14.049 7.894 -18.580 1066 HB2 GLU 133 HB2 GLU 133 -15.390 5.164 -18.677 1067 HB3 GLU 133 HB3 GLU 133 -14.324 5.822 -19.923 1068 HG2 GLU 133 HG2 GLU 133 -12.488 6.006 -18.233 1069 HG3 GLU 133 HG3 GLU 133 -13.535 5.244 -17.035 Start of MODEL 5 1 H1 GLY -4 H1 GLY -4 2.923 27.224 19.761 2 H2 GLY -4 H2 GLY -4 1.351 26.997 19.356 3 H3 GLY -4 H3 GLY -4 2.220 28.190 18.644 4 HA2 GLY -4 HA2 GLY -4 2.707 25.298 18.335 5 HA3 GLY -4 HA3 GLY -4 1.947 26.343 17.120 6 H SER -3 H SER -3 3.897 25.149 16.011 7 HA SER -3 HA SER -3 6.058 27.121 15.680 8 HB2 SER -3 HB2 SER -3 7.861 25.596 16.099 9 HB3 SER -3 HB3 SER -3 6.816 25.520 17.512 10 HG SER -3 HG SER -3 6.024 23.571 16.833 11 HA PRO -2 HA PRO -2 6.048 25.664 11.431 12 HB2 PRO -2 HB2 PRO -2 8.967 24.952 11.761 13 HB3 PRO -2 HB3 PRO -2 8.160 25.798 10.402 14 HG2 PRO -2 HG2 PRO -2 9.494 27.246 12.238 15 HG3 PRO -2 HG3 PRO -2 7.855 27.784 11.735 16 HD2 PRO -2 HD2 PRO -2 8.648 26.200 14.193 17 HD3 PRO -2 HD3 PRO -2 7.571 27.628 14.079 18 H ASN -1 H ASN -1 7.099 23.483 13.947 19 HA ASN -1 HA ASN -1 7.087 21.050 12.335 20 HB2 ASN -1 HB2 ASN -1 6.875 21.334 15.364 21 HB3 ASN -1 HB3 ASN -1 7.352 19.908 14.459 22 HD21 ASN -1 HD21 ASN -1 10.115 22.745 15.353 23 HD22 ASN -1 HD22 ASN -1 8.416 22.946 15.792 24 H SER 0 H SER 0 4.715 22.730 14.452 25 HA SER 0 HA SER 0 2.671 20.651 13.942 26 HB2 SER 0 HB2 SER 0 1.260 21.947 15.442 27 HB3 SER 0 HB3 SER 0 2.799 21.492 16.186 28 HG SER 0 HG SER 0 2.074 23.699 16.527 29 H MET 1 H MET 1 3.543 23.842 12.781 30 HA MET 1 HA MET 1 1.107 24.276 11.238 31 HB2 MET 1 HB2 MET 1 3.830 25.613 11.142 32 HB3 MET 1 HB3 MET 1 2.405 26.166 10.255 33 HG2 MET 1 HG2 MET 1 1.200 26.619 12.296 34 HG3 MET 1 HG3 MET 1 2.487 25.925 13.281 35 HE1 MET 1 HE1 MET 1 1.262 28.736 13.921 36 HE2 MET 1 HE2 MET 1 2.599 28.002 14.838 37 HE3 MET 1 HE3 MET 1 2.731 29.678 14.260 38 H ALA 2 H ALA 2 2.077 21.726 10.742 39 HA ALA 2 HA ALA 2 2.430 21.699 7.819 40 HB1 ALA 2 HB1 ALA 2 4.447 20.370 9.693 41 HB2 ALA 2 HB2 ALA 2 4.389 20.188 7.927 42 HB3 ALA 2 HB3 ALA 2 4.761 21.768 8.642 43 H THR 3 H THR 3 2.156 19.768 10.835 44 HA THR 3 HA THR 3 0.130 18.014 9.506 45 HB THR 3 HB THR 3 2.233 17.065 11.488 46 HG1 THR 3 HG1 THR 3 3.075 15.968 9.730 47 HG21 THR 3 HG21 THR 3 0.137 15.555 9.848 48 HG22 THR 3 HG22 THR 3 1.386 14.812 10.873 49 HG23 THR 3 HG23 THR 3 0.109 15.783 11.612 50 H GLU 4 H GLU 4 -1.689 18.737 10.379 51 HA GLU 4 HA GLU 4 -1.965 18.949 13.342 52 HB2 GLU 4 HB2 GLU 4 -3.066 21.110 13.090 53 HB3 GLU 4 HB3 GLU 4 -1.480 21.183 12.332 54 HG2 GLU 4 HG2 GLU 4 -2.522 20.829 10.095 55 HG3 GLU 4 HG3 GLU 4 -4.114 20.743 10.838 56 H LEU 5 H LEU 5 -3.047 17.200 10.986 57 HA LEU 5 HA LEU 5 -5.794 17.907 10.766 58 HB2 LEU 5 HB2 LEU 5 -6.083 16.251 9.226 59 HB3 LEU 5 HB3 LEU 5 -4.467 16.874 8.949 60 HG LEU 5 HG LEU 5 -5.164 14.280 10.394 61 HD11 LEU 5 HD11 LEU 5 -4.370 13.168 8.353 62 HD12 LEU 5 HD12 LEU 5 -5.767 14.203 8.039 63 HD13 LEU 5 HD13 LEU 5 -4.141 14.756 7.575 64 HD21 LEU 5 HD21 LEU 5 -2.483 15.395 9.471 65 HD22 LEU 5 HD22 LEU 5 -2.994 15.080 11.150 66 HD23 LEU 5 HD23 LEU 5 -2.745 13.730 10.044 67 H GLU 6 H GLU 6 -7.664 16.952 11.305 68 HA GLU 6 HA GLU 6 -7.702 14.766 13.324 69 HB2 GLU 6 HB2 GLU 6 -7.827 17.111 14.354 70 HB3 GLU 6 HB3 GLU 6 -9.420 17.256 13.611 71 HG2 GLU 6 HG2 GLU 6 -10.143 15.205 14.888 72 HG3 GLU 6 HG3 GLU 6 -8.524 15.081 15.568 73 H TYR 7 H TYR 7 -8.018 14.206 10.734 74 HA TYR 7 HA TYR 7 -10.829 13.408 10.493 75 HB2 TYR 7 HB2 TYR 7 -11.094 14.216 8.249 76 HB3 TYR 7 HB3 TYR 7 -10.731 15.568 9.291 77 HD1 TYR 7 HD1 TYR 7 -9.194 13.231 6.748 78 HD2 TYR 7 HD2 TYR 7 -8.936 17.050 8.758 79 HE1 TYR 7 HE1 TYR 7 -7.496 13.955 5.131 80 HE2 TYR 7 HE2 TYR 7 -7.172 17.755 7.143 81 HH TYR 7 HH TYR 7 -6.073 15.623 4.476 82 H GLU 8 H GLU 8 -11.082 11.477 9.409 83 HA GLU 8 HA GLU 8 -9.547 10.579 7.257 84 HB2 GLU 8 HB2 GLU 8 -8.426 9.833 9.914 85 HB3 GLU 8 HB3 GLU 8 -8.922 8.391 9.044 86 HG2 GLU 8 HG2 GLU 8 -7.456 8.853 7.210 87 HG3 GLU 8 HG3 GLU 8 -7.119 10.474 7.769 88 H SER 9 H SER 9 -11.192 9.595 6.158 89 HA SER 9 HA SER 9 -13.288 8.080 7.647 90 HB2 SER 9 HB2 SER 9 -13.067 9.107 4.821 91 HB3 SER 9 HB3 SER 9 -14.245 7.859 5.286 92 HG SER 9 HG SER 9 -15.312 9.712 5.619 93 H VAL 10 H VAL 10 -12.712 6.092 8.123 94 HA VAL 10 HA VAL 10 -10.713 4.543 6.728 95 HB VAL 10 HB VAL 10 -12.777 3.491 8.710 96 HG11 VAL 10 HG11 VAL 10 -9.938 2.622 8.010 97 HG12 VAL 10 HG12 VAL 10 -10.887 1.987 9.372 98 HG13 VAL 10 HG13 VAL 10 -11.440 1.708 7.728 99 HG21 VAL 10 HG21 VAL 10 -11.826 5.417 9.810 100 HG22 VAL 10 HG22 VAL 10 -11.026 3.998 10.470 101 HG23 VAL 10 HG23 VAL 10 -10.193 5.004 9.263 102 H LEU 11 H LEU 11 -10.824 2.652 5.607 103 HA LEU 11 HA LEU 11 -13.342 2.099 4.074 104 HB2 LEU 11 HB2 LEU 11 -10.536 2.557 2.969 105 HB3 LEU 11 HB3 LEU 11 -11.905 1.983 2.028 106 HG LEU 11 HG LEU 11 -11.783 4.717 3.376 107 HD11 LEU 11 HD11 LEU 11 -11.496 5.557 1.054 108 HD12 LEU 11 HD12 LEU 11 -10.121 4.595 1.613 109 HD13 LEU 11 HD13 LEU 11 -11.304 3.886 0.491 110 HD21 LEU 11 HD21 LEU 11 -13.719 3.558 1.318 111 HD22 LEU 11 HD22 LEU 11 -14.104 3.938 3.013 112 HD23 LEU 11 HD23 LEU 11 -13.698 5.239 1.892 113 H CYS 12 H CYS 12 -10.085 1.011 5.055 114 HA CYS 12 HA CYS 12 -11.075 -1.729 5.435 115 HB2 CYS 12 HB2 CYS 12 -10.238 -1.489 3.017 116 HB3 CYS 12 HB3 CYS 12 -8.621 -1.259 3.711 117 HG CYS 12 HG CYS 12 -8.975 -3.717 2.789 118 H VAL 13 H VAL 13 -9.939 -2.838 6.917 119 HA VAL 13 HA VAL 13 -7.351 -1.833 7.940 120 HB VAL 13 HB VAL 13 -9.698 -2.439 9.782 121 HG11 VAL 13 HG11 VAL 13 -8.165 -1.825 11.620 122 HG12 VAL 13 HG12 VAL 13 -7.578 -3.253 10.770 123 HG13 VAL 13 HG13 VAL 13 -6.824 -1.670 10.468 124 HG21 VAL 13 HG21 VAL 13 -9.855 -0.168 8.846 125 HG22 VAL 13 HG22 VAL 13 -9.399 -0.094 10.549 126 HG23 VAL 13 HG23 VAL 13 -8.167 0.152 9.290 127 H LYS 14 H LYS 14 -5.946 -3.488 8.027 128 HA LYS 14 HA LYS 14 -6.959 -6.262 8.382 129 HB2 LYS 14 HB2 LYS 14 -5.100 -5.303 6.259 130 HB3 LYS 14 HB3 LYS 14 -4.619 -6.764 7.083 131 HG2 LYS 14 HG2 LYS 14 -5.825 -7.281 5.063 132 HG3 LYS 14 HG3 LYS 14 -6.701 -7.886 6.477 133 HD2 LYS 14 HD2 LYS 14 -8.317 -6.111 6.337 134 HD3 LYS 14 HD3 LYS 14 -7.318 -5.218 5.180 135 HE2 LYS 14 HE2 LYS 14 -9.053 -6.115 3.896 136 HE3 LYS 14 HE3 LYS 14 -7.664 -7.142 3.544 137 HZ1 LYS 14 HZ1 LYS 14 -9.780 -8.338 3.949 138 HZ2 LYS 14 HZ2 LYS 14 -8.603 -8.834 4.983 139 HZ3 LYS 14 HZ3 LYS 14 -9.798 -7.827 5.504 140 HA PRO 15 HA PRO 15 -4.204 -6.268 11.838 141 HB2 PRO 15 HB2 PRO 15 -4.073 -8.940 12.380 142 HB3 PRO 15 HB3 PRO 15 -5.547 -7.955 12.668 143 HG2 PRO 15 HG2 PRO 15 -4.901 -9.682 10.243 144 HG3 PRO 15 HG3 PRO 15 -6.414 -9.670 11.217 145 HD2 PRO 15 HD2 PRO 15 -6.193 -8.310 8.907 146 HD3 PRO 15 HD3 PRO 15 -7.080 -7.615 10.301 147 H ASP 16 H ASP 16 -3.334 -7.949 8.870 148 HA ASP 16 HA ASP 16 -0.487 -8.157 9.791 149 HB2 ASP 16 HB2 ASP 16 -2.192 -10.251 8.403 150 HB3 ASP 16 HB3 ASP 16 -0.430 -10.288 8.414 151 H VAL 17 H VAL 17 0.561 -6.718 8.691 152 HA VAL 17 HA VAL 17 0.761 -7.128 5.781 153 HB VAL 17 HB VAL 17 -0.802 -5.243 6.003 154 HG11 VAL 17 HG11 VAL 17 1.509 -3.719 7.272 155 HG12 VAL 17 HG12 VAL 17 -0.034 -3.030 6.740 156 HG13 VAL 17 HG13 VAL 17 -0.002 -4.198 8.069 157 HG21 VAL 17 HG21 VAL 17 0.683 -5.437 4.037 158 HG22 VAL 17 HG22 VAL 17 0.253 -3.764 4.419 159 HG23 VAL 17 HG23 VAL 17 1.865 -4.367 4.838 160 H SER 18 H SER 18 2.769 -6.874 4.963 161 HA SER 18 HA SER 18 5.006 -6.309 6.892 162 HB2 SER 18 HB2 SER 18 4.888 -8.445 4.734 163 HB3 SER 18 HB3 SER 18 6.225 -8.142 5.864 164 HG SER 18 HG SER 18 4.815 -9.888 6.503 165 H VAL 19 H VAL 19 6.558 -4.939 6.198 166 HA VAL 19 HA VAL 19 6.393 -3.858 3.427 167 HB VAL 19 HB VAL 19 7.649 -2.732 5.932 168 HG11 VAL 19 HG11 VAL 19 7.686 -1.623 3.081 169 HG12 VAL 19 HG12 VAL 19 8.055 -0.672 4.540 170 HG13 VAL 19 HG13 VAL 19 9.090 -2.023 4.097 171 HG21 VAL 19 HG21 VAL 19 5.095 -2.591 5.560 172 HG22 VAL 19 HG22 VAL 19 5.961 -1.072 5.808 173 HG23 VAL 19 HG23 VAL 19 5.472 -1.549 4.174 174 H TYR 20 H TYR 20 7.863 -3.989 1.993 175 HA TYR 20 HA TYR 20 10.638 -4.714 2.755 176 HB2 TYR 20 HB2 TYR 20 9.791 -5.661 0.088 177 HB3 TYR 20 HB3 TYR 20 10.882 -6.371 1.259 178 HD1 TYR 20 HD1 TYR 20 9.990 -7.885 3.038 179 HD2 TYR 20 HD2 TYR 20 7.452 -6.201 0.001 180 HE1 TYR 20 HE1 TYR 20 8.230 -9.559 3.590 181 HE2 TYR 20 HE2 TYR 20 5.683 -7.874 0.554 182 HH TYR 20 HH TYR 20 6.131 -10.341 3.116 183 H ARG 21 H ARG 21 11.947 -3.165 2.157 184 HA ARG 21 HA ARG 21 11.415 -1.149 0.098 185 HB2 ARG 21 HB2 ARG 21 13.967 -2.097 1.464 186 HB3 ARG 21 HB3 ARG 21 13.948 -0.848 0.209 187 HG2 ARG 21 HG2 ARG 21 12.396 0.526 1.535 188 HG3 ARG 21 HG3 ARG 21 12.372 -0.683 2.827 189 HD2 ARG 21 HD2 ARG 21 14.912 0.668 1.835 190 HD3 ARG 21 HD3 ARG 21 13.913 1.321 3.147 191 HE ARG 21 HE ARG 21 14.464 -1.384 3.804 192 HH11 ARG 21 HH11 ARG 21 15.748 -1.911 5.359 193 HH12 ARG 21 HH12 ARG 21 17.133 -0.920 5.820 194 HH21 ARG 21 HH21 ARG 21 16.357 1.562 3.533 195 HH22 ARG 21 HH22 ARG 21 17.450 1.051 4.791 196 H ILE 22 H ILE 22 11.728 -1.220 -2.018 197 HA ILE 22 HA ILE 22 12.085 -3.930 -3.137 198 HB ILE 22 HB ILE 22 10.848 -3.167 -5.079 199 HG12 ILE 22 HG12 ILE 22 10.570 -0.478 -3.673 200 HG13 ILE 22 HG13 ILE 22 11.495 -0.796 -5.143 201 HG21 ILE 22 HG21 ILE 22 9.377 -2.461 -2.519 202 HG22 ILE 22 HG22 ILE 22 8.694 -3.126 -4.019 203 HG23 ILE 22 HG23 ILE 22 9.757 -4.118 -3.022 204 HD11 ILE 22 HD11 ILE 22 9.336 -1.566 -6.243 205 HD12 ILE 22 HD12 ILE 22 8.483 -0.941 -4.813 206 HD13 ILE 22 HD13 ILE 22 9.420 0.162 -5.831 207 HA PRO 23 HA PRO 23 15.741 -2.852 -5.554 208 HB2 PRO 23 HB2 PRO 23 15.543 -4.640 -7.616 209 HB3 PRO 23 HB3 PRO 23 15.942 -5.149 -5.947 210 HG2 PRO 23 HG2 PRO 23 13.218 -5.151 -7.298 211 HG3 PRO 23 HG3 PRO 23 14.023 -6.501 -6.434 212 HD2 PRO 23 HD2 PRO 23 12.216 -4.897 -5.206 213 HD3 PRO 23 HD3 PRO 23 13.652 -5.499 -4.325 214 HA PRO 24 HA PRO 24 14.254 -0.192 -8.921 215 HB2 PRO 24 HB2 PRO 24 16.059 -0.634 -10.964 216 HB3 PRO 24 HB3 PRO 24 16.397 0.374 -9.524 217 HG2 PRO 24 HG2 PRO 24 17.112 -2.545 -9.959 218 HG3 PRO 24 HG3 PRO 24 18.176 -1.218 -9.387 219 HD2 PRO 24 HD2 PRO 24 17.023 -2.898 -7.632 220 HD3 PRO 24 HD3 PRO 24 17.098 -1.152 -7.266 221 H ARG 25 H ARG 25 13.018 -0.324 -10.796 222 HA ARG 25 HA ARG 25 11.501 -2.713 -11.092 223 HB2 ARG 25 HB2 ARG 25 10.750 -0.313 -11.414 224 HB3 ARG 25 HB3 ARG 25 11.584 -0.314 -12.975 225 HG2 ARG 25 HG2 ARG 25 10.083 -2.155 -13.740 226 HG3 ARG 25 HG3 ARG 25 9.289 -2.142 -12.160 227 HD2 ARG 25 HD2 ARG 25 9.419 0.289 -13.975 228 HD3 ARG 25 HD3 ARG 25 8.175 -0.948 -14.129 229 HE ARG 25 HE ARG 25 8.642 0.608 -11.591 230 HH11 ARG 25 HH11 ARG 25 6.871 0.899 -10.261 231 HH12 ARG 25 HH12 ARG 25 5.270 0.532 -10.931 232 HH21 ARG 25 HH21 ARG 25 6.226 -0.609 -13.893 233 HH22 ARG 25 HH22 ARG 25 4.952 -0.301 -12.705 234 H ALA 26 H ALA 26 11.126 -4.074 -12.832 235 HA ALA 26 HA ALA 26 13.205 -4.911 -14.632 236 HB1 ALA 26 HB1 ALA 26 10.174 -5.160 -14.723 237 HB2 ALA 26 HB2 ALA 26 11.293 -6.127 -15.698 238 HB3 ALA 26 HB3 ALA 26 11.278 -6.303 -13.931 239 H SER 27 H SER 27 12.410 -4.976 -17.077 240 HA SER 27 HA SER 27 13.007 -2.301 -18.041 241 HB2 SER 27 HB2 SER 27 12.628 -4.899 -19.576 242 HB3 SER 27 HB3 SER 27 13.299 -3.388 -20.224 243 HG SER 27 HG SER 27 14.946 -4.844 -19.549 244 H ASN 28 H ASN 28 11.064 -1.325 -17.350 245 HA ASN 28 HA ASN 28 9.000 -0.569 -17.336 246 HB2 ASN 28 HB2 ASN 28 7.936 0.157 -19.316 247 HB3 ASN 28 HB3 ASN 28 9.672 0.399 -19.460 248 HD21 ASN 28 HD21 ASN 28 7.819 -2.317 -21.946 249 HD22 ASN 28 HD22 ASN 28 7.136 -1.999 -20.346 250 H ARG 29 H ARG 29 9.356 -3.441 -16.859 251 HA ARG 29 HA ARG 29 6.662 -4.525 -17.571 252 HB2 ARG 29 HB2 ARG 29 8.772 -6.106 -16.085 253 HB3 ARG 29 HB3 ARG 29 7.407 -6.675 -17.013 254 HG2 ARG 29 HG2 ARG 29 9.930 -5.378 -18.120 255 HG3 ARG 29 HG3 ARG 29 9.482 -7.085 -18.233 256 HD2 ARG 29 HD2 ARG 29 7.534 -6.527 -19.596 257 HD3 ARG 29 HD3 ARG 29 7.829 -4.808 -19.362 258 HE ARG 29 HE ARG 29 9.743 -4.839 -20.720 259 HH11 ARG 29 HH11 ARG 29 10.736 -5.476 -22.591 260 HH12 ARG 29 HH12 ARG 29 10.438 -7.056 -23.255 261 HH21 ARG 29 HH21 ARG 29 8.194 -7.990 -20.832 262 HH22 ARG 29 HH22 ARG 29 9.028 -8.448 -22.293 263 H GLY 30 H GLY 30 8.627 -4.056 -14.577 264 HA2 GLY 30 HA2 GLY 30 7.107 -2.847 -12.848 265 HA3 GLY 30 HA3 GLY 30 6.108 -4.285 -13.062 266 H TYR 31 H TYR 31 6.327 -4.973 -11.062 267 HA TYR 31 HA TYR 31 8.926 -6.098 -10.116 268 HB2 TYR 31 HB2 TYR 31 6.518 -5.367 -8.437 269 HB3 TYR 31 HB3 TYR 31 8.166 -5.674 -7.903 270 HD1 TYR 31 HD1 TYR 31 9.895 -3.972 -9.424 271 HD2 TYR 31 HD2 TYR 31 5.829 -3.170 -8.214 272 HE1 TYR 31 HE1 TYR 31 10.393 -1.549 -9.334 273 HE2 TYR 31 HE2 TYR 31 6.287 -0.741 -8.300 274 HH TYR 31 HH TYR 31 9.525 0.586 -9.061 275 H ARG 32 H ARG 32 8.730 -8.134 -8.890 276 HA ARG 32 HA ARG 32 6.416 -9.830 -9.762 277 HB2 ARG 32 HB2 ARG 32 8.032 -11.648 -10.282 278 HB3 ARG 32 HB3 ARG 32 8.063 -10.290 -11.384 279 HG2 ARG 32 HG2 ARG 32 10.071 -10.484 -9.111 280 HG3 ARG 32 HG3 ARG 32 10.286 -11.398 -10.607 281 HD2 ARG 32 HD2 ARG 32 10.122 -9.270 -11.921 282 HD3 ARG 32 HD3 ARG 32 10.055 -8.373 -10.414 283 HE ARG 32 HE ARG 32 12.328 -8.699 -10.035 284 HH11 ARG 32 HH11 ARG 32 14.307 -9.059 -10.531 285 HH12 ARG 32 HH12 ARG 32 14.771 -9.994 -11.952 286 HH21 ARG 32 HH21 ARG 32 11.491 -10.649 -12.843 287 HH22 ARG 32 HH22 ARG 32 13.170 -10.891 -13.239 288 H ALA 33 H ALA 33 7.035 -8.692 -7.154 289 HA ALA 33 HA ALA 33 7.088 -9.133 -4.954 290 HB1 ALA 33 HB1 ALA 33 5.656 -10.948 -4.229 291 HB2 ALA 33 HB2 ALA 33 4.972 -10.139 -5.659 292 HB3 ALA 33 HB3 ALA 33 5.752 -11.710 -5.838 293 H SER 34 H SER 34 8.153 -12.185 -6.509 294 HA SER 34 HA SER 34 9.662 -13.180 -4.344 295 HB2 SER 34 HB2 SER 34 9.955 -13.726 -7.315 296 HB3 SER 34 HB3 SER 34 10.629 -14.722 -6.011 297 HG SER 34 HG SER 34 8.601 -15.515 -6.773 298 H ASP 35 H ASP 35 10.484 -10.580 -6.398 299 HA ASP 35 HA ASP 35 13.400 -10.845 -5.999 300 HB2 ASP 35 HB2 ASP 35 12.150 -10.102 -8.136 301 HB3 ASP 35 HB3 ASP 35 11.910 -8.560 -7.321 302 H TRP 36 H TRP 36 10.824 -9.738 -4.123 303 HA TRP 36 HA TRP 36 12.306 -7.572 -2.765 304 HB2 TRP 36 HB2 TRP 36 9.551 -8.682 -2.188 305 HB3 TRP 36 HB3 TRP 36 10.248 -7.191 -1.603 306 HD1 TRP 36 HD1 TRP 36 11.063 -6.763 -5.036 307 HE1 TRP 36 HE1 TRP 36 9.229 -5.493 -6.346 308 HE3 TRP 36 HE3 TRP 36 7.138 -7.473 -1.839 309 HZ2 TRP 36 HZ2 TRP 36 6.493 -4.776 -5.970 310 HZ3 TRP 36 HZ3 TRP 36 4.934 -6.400 -2.297 311 HH2 TRP 36 HH2 TRP 36 4.606 -5.073 -4.362 312 H LYS 37 H LYS 37 12.066 -7.716 -0.319 313 HA LYS 37 HA LYS 37 13.444 -10.133 0.593 314 HB2 LYS 37 HB2 LYS 37 12.734 -7.551 2.024 315 HB3 LYS 37 HB3 LYS 37 13.670 -8.874 2.718 316 HG2 LYS 37 HG2 LYS 37 15.309 -8.667 0.822 317 HG3 LYS 37 HG3 LYS 37 14.482 -7.161 0.359 318 HD2 LYS 37 HD2 LYS 37 15.959 -7.811 2.930 319 HD3 LYS 37 HD3 LYS 37 16.386 -6.600 1.705 320 HE2 LYS 37 HE2 LYS 37 14.242 -5.380 2.277 321 HE3 LYS 37 HE3 LYS 37 13.966 -6.558 3.569 322 HZ1 LYS 37 HZ1 LYS 37 16.365 -4.807 3.401 323 HZ2 LYS 37 HZ2 LYS 37 15.060 -4.478 4.323 324 HZ3 LYS 37 HZ3 LYS 37 15.980 -5.799 4.648 325 H LEU 38 H LEU 38 11.205 -11.188 -0.020 326 HA LEU 38 HA LEU 38 9.022 -11.105 1.778 327 HB2 LEU 38 HB2 LEU 38 9.931 -13.485 0.123 328 HB3 LEU 38 HB3 LEU 38 8.318 -13.215 0.780 329 HG LEU 38 HG LEU 38 9.696 -11.607 -1.395 330 HD11 LEU 38 HD11 LEU 38 7.221 -13.401 -1.366 331 HD12 LEU 38 HD12 LEU 38 7.812 -12.505 -2.771 332 HD13 LEU 38 HD13 LEU 38 8.797 -13.806 -2.081 333 HD21 LEU 38 HD21 LEU 38 7.476 -10.428 -1.621 334 HD22 LEU 38 HD22 LEU 38 7.002 -11.153 -0.069 335 HD23 LEU 38 HD23 LEU 38 8.365 -10.017 -0.153 336 H ASP 39 H ASP 39 12.069 -12.581 2.382 337 HA ASP 39 HA ASP 39 10.979 -14.245 4.619 338 HB2 ASP 39 HB2 ASP 39 13.627 -14.318 3.142 339 HB3 ASP 39 HB3 ASP 39 13.288 -15.251 4.598 340 H GLN 40 H GLN 40 12.256 -11.176 4.128 341 HA GLN 40 HA GLN 40 12.767 -10.833 6.986 342 HB2 GLN 40 HB2 GLN 40 14.969 -9.681 6.612 343 HB3 GLN 40 HB3 GLN 40 14.962 -11.428 6.625 344 HG2 GLN 40 HG2 GLN 40 15.063 -9.774 4.080 345 HG3 GLN 40 HG3 GLN 40 16.481 -10.301 4.952 346 HE21 GLN 40 HE21 GLN 40 15.377 -12.774 2.194 347 HE22 GLN 40 HE22 GLN 40 15.277 -11.021 2.167 348 HA PRO 41 HA PRO 41 10.499 -7.264 5.111 349 HB2 PRO 41 HB2 PRO 41 9.412 -7.354 7.920 350 HB3 PRO 41 HB3 PRO 41 8.543 -7.001 6.407 351 HG2 PRO 41 HG2 PRO 41 8.329 -9.442 7.584 352 HG3 PRO 41 HG3 PRO 41 8.500 -9.317 5.807 353 HD2 PRO 41 HD2 PRO 41 10.626 -9.966 7.858 354 HD3 PRO 41 HD3 PRO 41 10.306 -10.737 6.276 355 H ASP 42 H ASP 42 10.878 -5.100 5.455 356 HA ASP 42 HA ASP 42 13.034 -4.230 7.267 357 HB2 ASP 42 HB2 ASP 42 11.107 -2.740 5.433 358 HB3 ASP 42 HB3 ASP 42 12.381 -1.966 6.382 359 H TRP 43 H TRP 43 9.526 -4.353 7.245 360 HA TRP 43 HA TRP 43 9.355 -3.878 10.123 361 HB2 TRP 43 HB2 TRP 43 9.380 -1.570 9.386 362 HB3 TRP 43 HB3 TRP 43 8.229 -1.902 8.108 363 HD1 TRP 43 HD1 TRP 43 8.413 -1.062 11.790 364 HE1 TRP 43 HE1 TRP 43 6.063 -0.456 12.630 365 HE3 TRP 43 HE3 TRP 43 5.703 -2.687 7.788 366 HZ2 TRP 43 HZ2 TRP 43 3.359 -0.442 11.564 367 HZ3 TRP 43 HZ3 TRP 43 3.250 -2.232 7.663 368 HH2 TRP 43 HH2 TRP 43 2.068 -1.164 9.562 369 H THR 44 H THR 44 7.264 -4.478 10.974 370 HA THR 44 HA THR 44 5.211 -5.455 9.086 371 HB THR 44 HB THR 44 4.698 -7.405 10.519 372 HG1 THR 44 HG1 THR 44 7.303 -7.016 11.557 373 HG21 THR 44 HG21 THR 44 7.503 -7.559 9.363 374 HG22 THR 44 HG22 THR 44 6.370 -8.903 9.656 375 HG23 THR 44 HG23 THR 44 5.990 -7.678 8.438 376 H GLY 45 H GLY 45 3.102 -5.298 9.813 377 HA2 GLY 45 HA2 GLY 45 2.309 -4.726 12.482 378 HA3 GLY 45 HA3 GLY 45 2.572 -3.195 11.655 379 H ARG 46 H ARG 46 0.588 -2.457 11.483 380 HA ARG 46 HA ARG 46 -1.689 -4.154 10.517 381 HB2 ARG 46 HB2 ARG 46 -1.784 -1.548 12.080 382 HB3 ARG 46 HB3 ARG 46 -3.082 -2.709 11.843 383 HG2 ARG 46 HG2 ARG 46 -0.548 -3.187 13.505 384 HG3 ARG 46 HG3 ARG 46 -2.131 -2.715 14.136 385 HD2 ARG 46 HD2 ARG 46 -3.058 -4.854 13.094 386 HD3 ARG 46 HD3 ARG 46 -1.368 -5.309 12.775 387 HE ARG 46 HE ARG 46 -2.082 -4.578 15.559 388 HH11 ARG 46 HH11 ARG 46 -1.439 -5.982 17.144 389 HH12 ARG 46 HH12 ARG 46 -1.394 -7.687 16.796 390 HH21 ARG 46 HH21 ARG 46 -1.686 -7.321 13.393 391 HH22 ARG 46 HH22 ARG 46 -1.429 -8.415 14.728 392 H LEU 47 H LEU 47 -2.977 -3.488 8.923 393 HA LEU 47 HA LEU 47 -2.093 -1.203 7.215 394 HB2 LEU 47 HB2 LEU 47 -2.391 -3.396 6.112 395 HB3 LEU 47 HB3 LEU 47 -4.012 -3.514 6.784 396 HG LEU 47 HG LEU 47 -4.705 -1.510 5.408 397 HD11 LEU 47 HD11 LEU 47 -1.941 -1.882 4.168 398 HD12 LEU 47 HD12 LEU 47 -3.251 -0.889 3.496 399 HD13 LEU 47 HD13 LEU 47 -2.519 -0.441 5.039 400 HD21 LEU 47 HD21 LEU 47 -5.191 -3.745 4.634 401 HD22 LEU 47 HD22 LEU 47 -4.729 -2.736 3.269 402 HD23 LEU 47 HD23 LEU 47 -3.556 -3.896 3.948 403 H ARG 48 H ARG 48 -3.276 0.628 7.104 404 HA ARG 48 HA ARG 48 -6.209 0.360 7.416 405 HB2 ARG 48 HB2 ARG 48 -5.477 1.581 9.404 406 HB3 ARG 48 HB3 ARG 48 -4.616 2.762 8.413 407 HG2 ARG 48 HG2 ARG 48 -6.667 3.576 7.420 408 HG3 ARG 48 HG3 ARG 48 -7.585 2.195 8.022 409 HD2 ARG 48 HD2 ARG 48 -8.214 4.082 9.303 410 HD3 ARG 48 HD3 ARG 48 -7.300 3.009 10.344 411 HE ARG 48 HE ARG 48 -6.447 5.686 9.288 412 HH11 ARG 48 HH11 ARG 48 -4.971 6.748 10.352 413 HH12 ARG 48 HH12 ARG 48 -3.902 5.920 11.528 414 HH21 ARG 48 HH21 ARG 48 -5.690 2.990 11.398 415 HH22 ARG 48 HH22 ARG 48 -4.436 3.887 12.220 416 H ILE 49 H ILE 49 -7.320 1.063 5.774 417 HA ILE 49 HA ILE 49 -6.077 2.872 3.751 418 HB ILE 49 HB ILE 49 -8.363 0.958 3.221 419 HG12 ILE 49 HG12 ILE 49 -5.425 0.686 2.424 420 HG13 ILE 49 HG13 ILE 49 -6.302 -0.340 3.564 421 HG21 ILE 49 HG21 ILE 49 -6.695 2.757 1.400 422 HG22 ILE 49 HG22 ILE 49 -7.987 1.663 0.853 423 HG23 ILE 49 HG23 ILE 49 -8.388 3.031 1.885 424 HD11 ILE 49 HD11 ILE 49 -7.928 -0.822 1.579 425 HD12 ILE 49 HD12 ILE 49 -6.582 -0.241 0.571 426 HD13 ILE 49 HD13 ILE 49 -6.363 -1.622 1.672 427 H THR 50 H THR 50 -7.069 4.701 3.437 428 HA THR 50 HA THR 50 -9.537 5.454 4.886 429 HB THR 50 HB THR 50 -7.710 7.459 5.551 430 HG1 THR 50 HG1 THR 50 -6.024 5.835 4.953 431 HG21 THR 50 HG21 THR 50 -8.553 5.013 7.137 432 HG22 THR 50 HG22 THR 50 -7.787 6.444 7.838 433 HG23 THR 50 HG23 THR 50 -9.380 6.593 7.084 434 H SER 51 H SER 51 -10.162 7.803 4.388 435 HA SER 51 HA SER 51 -8.702 9.125 2.230 436 HB2 SER 51 HB2 SER 51 -10.226 7.470 1.063 437 HB3 SER 51 HB3 SER 51 -11.608 8.300 1.805 438 HG SER 51 HG SER 51 -11.096 9.038 -0.322 439 H LYS 52 H LYS 52 -9.387 11.244 1.820 440 HA LYS 52 HA LYS 52 -11.820 12.120 3.092 441 HB2 LYS 52 HB2 LYS 52 -9.957 12.613 4.736 442 HB3 LYS 52 HB3 LYS 52 -9.361 13.812 3.590 443 HG2 LYS 52 HG2 LYS 52 -10.759 14.716 5.419 444 HG3 LYS 52 HG3 LYS 52 -11.359 15.120 3.810 445 HD2 LYS 52 HD2 LYS 52 -13.157 14.637 5.393 446 HD3 LYS 52 HD3 LYS 52 -13.170 13.468 4.073 447 HE2 LYS 52 HE2 LYS 52 -12.204 11.753 5.445 448 HE3 LYS 52 HE3 LYS 52 -11.844 12.894 6.750 449 HZ1 LYS 52 HZ1 LYS 52 -13.941 11.489 6.995 450 HZ2 LYS 52 HZ2 LYS 52 -14.162 13.109 7.222 451 HZ3 LYS 52 HZ3 LYS 52 -14.613 12.375 5.831 452 H GLY 53 H GLY 53 -12.961 12.890 1.511 453 HA2 GLY 53 HA2 GLY 53 -13.721 14.144 -0.260 454 HA3 GLY 53 HA3 GLY 53 -12.205 15.050 -0.255 455 H LYS 54 H LYS 54 -10.982 14.758 -1.910 456 HA LYS 54 HA LYS 54 -11.164 12.346 -3.669 457 HB2 LYS 54 HB2 LYS 54 -10.423 15.241 -4.104 458 HB3 LYS 54 HB3 LYS 54 -10.150 13.988 -5.342 459 HG2 LYS 54 HG2 LYS 54 -12.588 13.470 -5.333 460 HG3 LYS 54 HG3 LYS 54 -12.848 14.779 -4.165 461 HD2 LYS 54 HD2 LYS 54 -11.895 16.407 -5.802 462 HD3 LYS 54 HD3 LYS 54 -11.714 15.087 -6.982 463 HE2 LYS 54 HE2 LYS 54 -14.159 14.662 -6.871 464 HE3 LYS 54 HE3 LYS 54 -14.334 15.964 -5.686 465 HZ1 LYS 54 HZ1 LYS 54 -13.545 17.528 -7.386 466 HZ2 LYS 54 HZ2 LYS 54 -13.379 16.328 -8.482 467 HZ3 LYS 54 HZ3 LYS 54 -14.860 16.736 -7.935 468 H THR 55 H THR 55 -9.456 12.829 -1.134 469 HA THR 55 HA THR 55 -6.920 11.820 -2.368 470 HB THR 55 HB THR 55 -7.077 13.389 0.215 471 HG1 THR 55 HG1 THR 55 -7.531 14.810 -1.434 472 HG21 THR 55 HG21 THR 55 -4.615 13.570 -0.183 473 HG22 THR 55 HG22 THR 55 -5.126 11.882 -0.022 474 HG23 THR 55 HG23 THR 55 -4.789 12.551 -1.633 475 H ALA 56 H ALA 56 -6.878 9.712 -2.025 476 HA ALA 56 HA ALA 56 -7.915 8.521 0.478 477 HB1 ALA 56 HB1 ALA 56 -8.389 7.335 -1.585 478 HB2 ALA 56 HB2 ALA 56 -6.638 7.187 -1.907 479 HB3 ALA 56 HB3 ALA 56 -7.359 6.379 -0.504 480 H TYR 57 H TYR 57 -6.528 7.164 1.753 481 HA TYR 57 HA TYR 57 -3.626 7.812 1.768 482 HB2 TYR 57 HB2 TYR 57 -5.428 7.948 4.216 483 HB3 TYR 57 HB3 TYR 57 -3.703 8.260 4.145 484 HD1 TYR 57 HD1 TYR 57 -2.900 10.285 2.754 485 HD2 TYR 57 HD2 TYR 57 -7.009 9.715 3.951 486 HE1 TYR 57 HE1 TYR 57 -3.332 12.722 2.455 487 HE2 TYR 57 HE2 TYR 57 -7.444 12.132 3.600 488 HH TYR 57 HH TYR 57 -4.877 14.410 2.579 489 H ILE 58 H ILE 58 -2.654 5.842 1.628 490 HA ILE 58 HA ILE 58 -3.759 3.523 3.192 491 HB ILE 58 HB ILE 58 -1.420 3.628 1.256 492 HG12 ILE 58 HG12 ILE 58 -2.852 1.934 -0.025 493 HG13 ILE 58 HG13 ILE 58 -4.229 2.521 0.904 494 HG21 ILE 58 HG21 ILE 58 -1.076 1.983 3.079 495 HG22 ILE 58 HG22 ILE 58 -2.673 1.281 2.740 496 HG23 ILE 58 HG23 ILE 58 -1.354 1.180 1.547 497 HD11 ILE 58 HD11 ILE 58 -4.028 4.715 -0.150 498 HD12 ILE 58 HD12 ILE 58 -2.423 4.297 -0.811 499 HD13 ILE 58 HD13 ILE 58 -3.879 3.500 -1.421 500 H LYS 59 H LYS 59 -3.286 3.666 5.287 501 HA LYS 59 HA LYS 59 -0.601 4.742 6.084 502 HB2 LYS 59 HB2 LYS 59 -3.188 4.866 7.673 503 HB3 LYS 59 HB3 LYS 59 -1.592 5.442 8.180 504 HG2 LYS 59 HG2 LYS 59 -1.661 6.847 5.952 505 HG3 LYS 59 HG3 LYS 59 -3.399 6.536 6.001 506 HD2 LYS 59 HD2 LYS 59 -3.514 7.585 8.249 507 HD3 LYS 59 HD3 LYS 59 -1.759 7.858 8.211 508 HE2 LYS 59 HE2 LYS 59 -2.058 9.219 6.113 509 HE3 LYS 59 HE3 LYS 59 -3.814 9.023 6.283 510 HZ1 LYS 59 HZ1 LYS 59 -3.064 11.113 7.240 511 HZ2 LYS 59 HZ2 LYS 59 -3.678 10.146 8.418 512 HZ3 LYS 59 HZ3 LYS 59 -2.044 10.352 8.260 513 H LEU 60 H LEU 60 0.721 3.598 7.146 514 HA LEU 60 HA LEU 60 -0.013 0.848 8.074 515 HB2 LEU 60 HB2 LEU 60 2.386 2.097 6.780 516 HB3 LEU 60 HB3 LEU 60 2.694 0.903 8.032 517 HG LEU 60 HG LEU 60 1.447 -0.798 6.899 518 HD11 LEU 60 HD11 LEU 60 -0.348 0.440 5.777 519 HD12 LEU 60 HD12 LEU 60 0.832 1.279 4.746 520 HD13 LEU 60 HD13 LEU 60 0.569 -0.472 4.579 521 HD21 LEU 60 HD21 LEU 60 3.230 0.638 4.884 522 HD22 LEU 60 HD22 LEU 60 3.825 -0.291 6.272 523 HD23 LEU 60 HD23 LEU 60 2.907 -1.110 5.002 524 H GLU 61 H GLU 61 0.024 0.365 10.161 525 HA GLU 61 HA GLU 61 1.239 2.308 12.065 526 HB2 GLU 61 HB2 GLU 61 -1.660 1.414 11.961 527 HB3 GLU 61 HB3 GLU 61 -0.885 1.997 13.454 528 HG2 GLU 61 HG2 GLU 61 -0.173 4.064 12.133 529 HG3 GLU 61 HG3 GLU 61 -1.255 3.512 10.845 530 H ASP 62 H ASP 62 1.771 1.614 14.140 531 HA ASP 62 HA ASP 62 2.996 -0.914 14.176 532 HB2 ASP 62 HB2 ASP 62 3.748 1.084 15.397 533 HB3 ASP 62 HB3 ASP 62 2.375 0.856 16.512 534 H LYS 63 H LYS 63 2.642 -2.775 15.153 535 HA LYS 63 HA LYS 63 -0.088 -3.533 15.578 536 HB2 LYS 63 HB2 LYS 63 1.122 -5.879 15.973 537 HB3 LYS 63 HB3 LYS 63 1.095 -5.163 14.362 538 HG2 LYS 63 HG2 LYS 63 3.324 -4.321 14.582 539 HG3 LYS 63 HG3 LYS 63 3.384 -4.724 16.312 540 HD2 LYS 63 HD2 LYS 63 3.325 -7.128 15.741 541 HD3 LYS 63 HD3 LYS 63 3.263 -6.710 14.003 542 HE2 LYS 63 HE2 LYS 63 5.407 -5.392 14.334 543 HE3 LYS 63 HE3 LYS 63 5.473 -6.002 15.991 544 HZ1 LYS 63 HZ1 LYS 63 5.711 -7.573 13.486 545 HZ2 LYS 63 HZ2 LYS 63 6.826 -7.404 14.649 546 HZ3 LYS 63 HZ3 LYS 63 5.491 -8.296 14.954 547 H VAL 64 H VAL 64 2.042 -2.367 17.816 548 HA VAL 64 HA VAL 64 0.464 -3.614 20.027 549 HB VAL 64 HB VAL 64 3.350 -2.659 19.982 550 HG11 VAL 64 HG11 VAL 64 3.515 -3.675 22.258 551 HG12 VAL 64 HG12 VAL 64 2.408 -2.305 22.228 552 HG13 VAL 64 HG13 VAL 64 1.760 -3.963 22.241 553 HG21 VAL 64 HG21 VAL 64 3.907 -5.057 20.386 554 HG22 VAL 64 HG22 VAL 64 2.191 -5.472 20.170 555 HG23 VAL 64 HG23 VAL 64 3.138 -4.799 18.822 556 H SER 65 H SER 65 1.979 -0.603 18.852 557 HA SER 65 HA SER 65 0.485 0.912 20.969 558 HB2 SER 65 HB2 SER 65 3.140 1.413 19.611 559 HB3 SER 65 HB3 SER 65 2.326 2.608 20.639 560 HG SER 65 HG SER 65 3.835 1.310 21.810 561 H GLY 66 H GLY 66 0.468 0.457 17.596 562 HA2 GLY 66 HA2 GLY 66 -0.914 1.427 16.010 563 HA3 GLY 66 HA3 GLY 66 -1.571 2.499 17.249 564 H GLU 67 H GLU 67 1.846 2.600 16.938 565 HA GLU 67 HA GLU 67 2.001 5.348 16.284 566 HB2 GLU 67 HB2 GLU 67 4.147 3.217 15.981 567 HB3 GLU 67 HB3 GLU 67 4.396 4.967 16.150 568 HG2 GLU 67 HG2 GLU 67 3.211 4.707 18.437 569 HG3 GLU 67 HG3 GLU 67 3.388 2.962 18.171 570 H LEU 68 H LEU 68 2.290 6.422 14.322 571 HA LEU 68 HA LEU 68 1.721 5.005 11.867 572 HB2 LEU 68 HB2 LEU 68 0.981 7.328 12.358 573 HB3 LEU 68 HB3 LEU 68 2.662 7.859 12.302 574 HG LEU 68 HG LEU 68 2.769 7.119 9.889 575 HD11 LEU 68 HD11 LEU 68 0.627 6.759 8.691 576 HD12 LEU 68 HD12 LEU 68 0.936 5.469 9.843 577 HD13 LEU 68 HD13 LEU 68 -0.240 6.734 10.245 578 HD21 LEU 68 HD21 LEU 68 2.311 9.461 10.492 579 HD22 LEU 68 HD22 LEU 68 1.421 9.003 9.031 580 HD23 LEU 68 HD23 LEU 68 0.571 9.111 10.588 581 H PHE 69 H PHE 69 3.095 3.722 10.858 582 HA PHE 69 HA PHE 69 6.020 4.085 10.946 583 HB2 PHE 69 HB2 PHE 69 5.233 1.831 10.968 584 HB3 PHE 69 HB3 PHE 69 4.166 2.097 9.597 585 HD1 PHE 69 HD1 PHE 69 4.902 1.632 7.379 586 HD2 PHE 69 HD2 PHE 69 7.804 2.096 10.539 587 HE1 PHE 69 HE1 PHE 69 6.723 1.091 5.793 588 HE2 PHE 69 HE2 PHE 69 9.617 1.473 8.958 589 HZ PHE 69 HZ PHE 69 9.080 0.987 6.576 590 H ALA 70 H ALA 70 3.460 4.179 8.427 591 HA ALA 70 HA ALA 70 4.774 6.374 7.028 592 HB1 ALA 70 HB1 ALA 70 4.528 3.655 5.654 593 HB2 ALA 70 HB2 ALA 70 5.149 5.167 4.951 594 HB3 ALA 70 HB3 ALA 70 6.053 4.365 6.233 595 H GLN 71 H GLN 71 3.521 7.129 5.177 596 HA GLN 71 HA GLN 71 0.719 6.202 4.956 597 HB2 GLN 71 HB2 GLN 71 -0.012 8.624 5.034 598 HB3 GLN 71 HB3 GLN 71 0.419 7.897 6.583 599 HG2 GLN 71 HG2 GLN 71 2.405 9.136 6.794 600 HG3 GLN 71 HG3 GLN 71 2.532 9.434 5.073 601 HE21 GLN 71 HE21 GLN 71 1.376 12.676 5.623 602 HE22 GLN 71 HE22 GLN 71 2.639 11.608 4.992 603 H ALA 72 H ALA 72 0.016 6.199 2.883 604 HA ALA 72 HA ALA 72 1.519 7.775 0.816 605 HB1 ALA 72 HB1 ALA 72 0.217 5.046 0.630 606 HB2 ALA 72 HB2 ALA 72 0.884 5.961 -0.737 607 HB3 ALA 72 HB3 ALA 72 1.948 5.427 0.571 608 HA PRO 73 HA PRO 73 -2.578 9.768 0.340 609 HB2 PRO 73 HB2 PRO 73 -0.652 11.700 -0.925 610 HB3 PRO 73 HB3 PRO 73 -2.102 12.034 0.069 611 HG2 PRO 73 HG2 PRO 73 0.395 12.229 1.116 612 HG3 PRO 73 HG3 PRO 73 -0.941 11.508 2.071 613 HD2 PRO 73 HD2 PRO 73 1.252 10.092 0.549 614 HD3 PRO 73 HD3 PRO 73 0.585 9.741 2.166 615 H VAL 74 H VAL 74 -3.772 9.546 -1.476 616 HA VAL 74 HA VAL 74 -2.502 9.174 -4.154 617 HB VAL 74 HB VAL 74 -4.949 7.598 -3.316 618 HG11 VAL 74 HG11 VAL 74 -2.831 7.082 -5.430 619 HG12 VAL 74 HG12 VAL 74 -4.269 6.088 -5.115 620 HG13 VAL 74 HG13 VAL 74 -4.459 7.743 -5.693 621 HG21 VAL 74 HG21 VAL 74 -3.583 5.608 -2.892 622 HG22 VAL 74 HG22 VAL 74 -2.106 6.599 -2.944 623 HG23 VAL 74 HG23 VAL 74 -3.328 6.855 -1.678 624 H GLU 75 H GLU 75 -3.488 10.419 -5.742 625 HA GLU 75 HA GLU 75 -5.874 12.008 -4.966 626 HB2 GLU 75 HB2 GLU 75 -4.043 12.139 -7.388 627 HB3 GLU 75 HB3 GLU 75 -5.398 13.230 -7.074 628 HG2 GLU 75 HG2 GLU 75 -4.339 13.914 -4.918 629 HG3 GLU 75 HG3 GLU 75 -2.942 12.904 -5.298 630 H GLN 76 H GLN 76 -5.205 9.264 -6.990 631 HA GLN 76 HA GLN 76 -7.911 8.581 -7.157 632 HB2 GLN 76 HB2 GLN 76 -8.076 8.479 -9.740 633 HB3 GLN 76 HB3 GLN 76 -8.509 9.920 -8.867 634 HG2 GLN 76 HG2 GLN 76 -7.410 10.639 -10.800 635 HG3 GLN 76 HG3 GLN 76 -6.309 10.967 -9.483 636 HE21 GLN 76 HE21 GLN 76 -3.829 8.699 -10.773 637 HE22 GLN 76 HE22 GLN 76 -4.353 9.508 -9.301 638 H TYR 77 H TYR 77 -8.285 6.476 -8.074 639 HA TYR 77 HA TYR 77 -5.812 4.853 -8.393 640 HB2 TYR 77 HB2 TYR 77 -6.802 4.640 -6.145 641 HB3 TYR 77 HB3 TYR 77 -8.314 4.103 -6.891 642 HD1 TYR 77 HD1 TYR 77 -8.690 1.818 -7.211 643 HD2 TYR 77 HD2 TYR 77 -4.657 3.282 -6.807 644 HE1 TYR 77 HE1 TYR 77 -7.843 -0.520 -7.276 645 HE2 TYR 77 HE2 TYR 77 -3.804 0.947 -6.968 646 HH TYR 77 HH TYR 77 -5.980 -1.868 -7.341 647 HA PRO 78 HA PRO 78 -5.013 3.074 -9.540 648 HB2 PRO 78 HB2 PRO 78 -4.110 2.702 -12.088 649 HB3 PRO 78 HB3 PRO 78 -5.078 1.491 -11.195 650 HG2 PRO 78 HG2 PRO 78 -6.074 3.555 -13.191 651 HG3 PRO 78 HG3 PRO 78 -6.413 1.794 -13.161 652 HD2 PRO 78 HD2 PRO 78 -8.156 3.575 -12.093 653 HD3 PRO 78 HD3 PRO 78 -7.850 2.009 -11.289 654 H GLY 79 H GLY 79 -3.105 4.212 -9.581 655 HA2 GLY 79 HA2 GLY 79 -2.630 6.614 -11.172 656 HA3 GLY 79 HA3 GLY 79 -3.000 6.924 -9.467 657 H ILE 80 H ILE 80 -0.750 7.853 -9.536 658 HA ILE 80 HA ILE 80 1.494 6.087 -9.973 659 HB ILE 80 HB ILE 80 1.676 8.429 -10.462 660 HG12 ILE 80 HG12 ILE 80 3.536 7.739 -8.146 661 HG13 ILE 80 HG13 ILE 80 3.676 7.060 -9.771 662 HG21 ILE 80 HG21 ILE 80 0.191 9.337 -8.639 663 HG22 ILE 80 HG22 ILE 80 1.498 9.040 -7.473 664 HG23 ILE 80 HG23 ILE 80 1.713 10.199 -8.796 665 HD11 ILE 80 HD11 ILE 80 4.083 9.324 -10.682 666 HD12 ILE 80 HD12 ILE 80 3.983 9.996 -9.035 667 HD13 ILE 80 HD13 ILE 80 5.271 8.854 -9.445 668 H ALA 81 H ALA 81 -0.176 7.080 -6.989 669 HA ALA 81 HA ALA 81 2.046 6.187 -5.314 670 HB1 ALA 81 HB1 ALA 81 -0.670 7.341 -4.609 671 HB2 ALA 81 HB2 ALA 81 0.691 7.119 -3.491 672 HB3 ALA 81 HB3 ALA 81 0.831 8.260 -4.839 673 H VAL 82 H VAL 82 0.126 4.238 -6.860 674 HA VAL 82 HA VAL 82 0.277 2.127 -4.845 675 HB VAL 82 HB VAL 82 -2.379 2.716 -6.156 676 HG11 VAL 82 HG11 VAL 82 -1.984 0.308 -5.640 677 HG12 VAL 82 HG12 VAL 82 -1.534 0.730 -3.981 678 HG13 VAL 82 HG13 VAL 82 -3.201 0.959 -4.540 679 HG21 VAL 82 HG21 VAL 82 -2.133 4.424 -4.472 680 HG22 VAL 82 HG22 VAL 82 -3.312 3.232 -3.943 681 HG23 VAL 82 HG23 VAL 82 -1.680 3.216 -3.248 682 H GLU 83 H GLU 83 0.887 0.307 -5.832 683 HA GLU 83 HA GLU 83 0.436 -0.190 -8.731 684 HB2 GLU 83 HB2 GLU 83 2.926 0.723 -7.422 685 HB3 GLU 83 HB3 GLU 83 3.166 -0.800 -8.262 686 HG2 GLU 83 HG2 GLU 83 1.760 1.516 -9.622 687 HG3 GLU 83 HG3 GLU 83 3.524 1.414 -9.534 688 H THR 84 H THR 84 1.241 -2.326 -9.430 689 HA THR 84 HA THR 84 0.799 -4.460 -7.331 690 HB THR 84 HB THR 84 -0.347 -5.731 -9.050 691 HG1 THR 84 HG1 THR 84 -0.852 -4.776 -11.026 692 HG21 THR 84 HG21 THR 84 -1.708 -4.203 -7.673 693 HG22 THR 84 HG22 THR 84 -1.507 -2.909 -8.877 694 HG23 THR 84 HG23 THR 84 -2.393 -4.399 -9.286 695 H VAL 85 H VAL 85 1.670 -6.554 -7.810 696 HA VAL 85 HA VAL 85 4.217 -6.579 -9.310 697 HB VAL 85 HB VAL 85 4.596 -8.714 -8.255 698 HG11 VAL 85 HG11 VAL 85 5.167 -6.611 -7.048 699 HG12 VAL 85 HG12 VAL 85 3.616 -6.695 -6.189 700 HG13 VAL 85 HG13 VAL 85 4.831 -7.951 -5.947 701 HG21 VAL 85 HG21 VAL 85 1.892 -8.374 -6.877 702 HG22 VAL 85 HG22 VAL 85 2.240 -9.544 -8.163 703 HG23 VAL 85 HG23 VAL 85 3.072 -9.671 -6.625 704 H THR 86 H THR 86 4.578 -8.588 -10.670 705 HA THR 86 HA THR 86 2.293 -9.130 -12.454 706 HB THR 86 HB THR 86 3.988 -10.108 -13.917 707 HG1 THR 86 HG1 THR 86 6.145 -10.087 -13.270 708 HG21 THR 86 HG21 THR 86 5.005 -7.508 -12.701 709 HG22 THR 86 HG22 THR 86 5.322 -8.112 -14.341 710 HG23 THR 86 HG23 THR 86 3.677 -7.622 -13.870 711 H ASP 87 H ASP 87 4.273 -10.893 -10.135 712 HA ASP 87 HA ASP 87 3.518 -13.463 -11.288 713 HB2 ASP 87 HB2 ASP 87 5.828 -12.832 -10.558 714 HB3 ASP 87 HB3 ASP 87 5.256 -12.902 -8.884 715 H SER 88 H SER 88 2.869 -11.837 -8.165 716 HA SER 88 HA SER 88 0.853 -13.985 -7.552 717 HB2 SER 88 HB2 SER 88 2.940 -14.583 -6.441 718 HB3 SER 88 HB3 SER 88 2.960 -13.018 -5.605 719 HG SER 88 HG SER 88 1.973 -14.916 -4.475 720 H SER 89 H SER 89 -1.067 -13.225 -7.076 721 HA SER 89 HA SER 89 -1.464 -10.402 -6.918 722 HB2 SER 89 HB2 SER 89 -3.540 -12.596 -6.729 723 HB3 SER 89 HB3 SER 89 -3.807 -10.890 -7.150 724 HG SER 89 HG SER 89 -3.663 -12.230 -9.013 725 H ARG 90 H ARG 90 -0.160 -11.335 -4.488 726 HA ARG 90 HA ARG 90 -2.067 -10.169 -2.528 727 HB2 ARG 90 HB2 ARG 90 -1.533 -11.527 -0.789 728 HB3 ARG 90 HB3 ARG 90 -1.841 -12.596 -2.151 729 HG2 ARG 90 HG2 ARG 90 0.515 -13.047 -2.446 730 HG3 ARG 90 HG3 ARG 90 0.951 -11.792 -1.267 731 HD2 ARG 90 HD2 ARG 90 -0.439 -13.141 0.439 732 HD3 ARG 90 HD3 ARG 90 -0.334 -14.477 -0.727 733 HE ARG 90 HE ARG 90 2.276 -13.432 -0.365 734 HH11 ARG 90 HH11 ARG 90 3.792 -14.167 0.983 735 HH12 ARG 90 HH12 ARG 90 3.367 -15.165 2.353 736 HH21 ARG 90 HH21 ARG 90 -0.013 -15.053 1.757 737 HH22 ARG 90 HH22 ARG 90 1.256 -15.652 2.776 738 H TYR 91 H TYR 91 0.133 -8.916 -4.232 739 HA TYR 91 HA TYR 91 1.642 -7.623 -2.027 740 HB2 TYR 91 HB2 TYR 91 2.771 -8.809 -4.577 741 HB3 TYR 91 HB3 TYR 91 3.668 -7.843 -3.438 742 HD1 TYR 91 HD1 TYR 91 2.461 -11.173 -4.245 743 HD2 TYR 91 HD2 TYR 91 4.110 -8.729 -1.110 744 HE1 TYR 91 HE1 TYR 91 3.223 -13.217 -3.065 745 HE2 TYR 91 HE2 TYR 91 4.756 -10.790 0.146 746 HH TYR 91 HH TYR 91 4.400 -14.053 -1.297 747 H PHE 92 H PHE 92 2.008 -5.487 -2.306 748 HA PHE 92 HA PHE 92 1.401 -4.179 -4.913 749 HB2 PHE 92 HB2 PHE 92 0.309 -3.316 -2.205 750 HB3 PHE 92 HB3 PHE 92 0.144 -2.417 -3.701 751 HD1 PHE 92 HD1 PHE 92 -1.242 -3.344 -5.595 752 HD2 PHE 92 HD2 PHE 92 -1.153 -5.149 -1.696 753 HE1 PHE 92 HE1 PHE 92 -3.288 -4.651 -6.151 754 HE2 PHE 92 HE2 PHE 92 -3.235 -6.361 -2.201 755 HZ PHE 92 HZ PHE 92 -4.292 -6.157 -4.469 756 H VAL 93 H VAL 93 2.236 -2.018 -5.060 757 HA VAL 93 HA VAL 93 4.349 -1.286 -3.068 758 HB VAL 93 HB VAL 93 4.322 -0.732 -6.052 759 HG11 VAL 93 HG11 VAL 93 6.335 0.266 -3.996 760 HG12 VAL 93 HG12 VAL 93 6.439 0.450 -5.757 761 HG13 VAL 93 HG13 VAL 93 5.157 1.270 -4.870 762 HG21 VAL 93 HG21 VAL 93 6.543 -1.922 -5.913 763 HG22 VAL 93 HG22 VAL 93 6.176 -2.321 -4.232 764 HG23 VAL 93 HG23 VAL 93 5.145 -2.937 -5.546 765 H ILE 94 H ILE 94 4.243 0.839 -2.243 766 HA ILE 94 HA ILE 94 2.246 2.626 -3.486 767 HB ILE 94 HB ILE 94 1.393 3.447 -1.422 768 HG12 ILE 94 HG12 ILE 94 3.257 2.649 0.108 769 HG13 ILE 94 HG13 ILE 94 1.616 2.551 0.712 770 HG21 ILE 94 HG21 ILE 94 -0.211 1.664 -0.924 771 HG22 ILE 94 HG22 ILE 94 0.072 1.872 -2.656 772 HG23 ILE 94 HG23 ILE 94 0.796 0.498 -1.815 773 HD11 ILE 94 HD11 ILE 94 3.229 0.172 -0.309 774 HD12 ILE 94 HD12 ILE 94 2.925 0.606 1.381 775 HD13 ILE 94 HD13 ILE 94 1.580 0.118 0.346 776 H ARG 95 H ARG 95 2.564 4.805 -3.264 777 HA ARG 95 HA ARG 95 5.393 5.571 -2.682 778 HB2 ARG 95 HB2 ARG 95 4.318 6.250 -4.852 779 HB3 ARG 95 HB3 ARG 95 3.257 7.321 -3.922 780 HG2 ARG 95 HG2 ARG 95 5.300 8.455 -2.989 781 HG3 ARG 95 HG3 ARG 95 6.302 7.439 -4.044 782 HD2 ARG 95 HD2 ARG 95 5.137 8.377 -6.026 783 HD3 ARG 95 HD3 ARG 95 4.122 9.366 -4.957 784 HE ARG 95 HE ARG 95 6.893 9.886 -4.395 785 HH11 ARG 95 HH11 ARG 95 7.837 11.708 -4.953 786 HH12 ARG 95 HH12 ARG 95 7.245 12.689 -6.278 787 HH21 ARG 95 HH21 ARG 95 4.540 10.641 -6.886 788 HH22 ARG 95 HH22 ARG 95 5.388 12.094 -7.346 789 H ILE 96 H ILE 96 5.482 5.556 -0.482 790 HA ILE 96 HA ILE 96 3.544 7.065 1.109 791 HB ILE 96 HB ILE 96 4.782 6.549 3.059 792 HG12 ILE 96 HG12 ILE 96 6.701 4.673 2.609 793 HG13 ILE 96 HG13 ILE 96 6.974 5.672 1.194 794 HG21 ILE 96 HG21 ILE 96 4.384 4.150 1.266 795 HG22 ILE 96 HG22 ILE 96 4.522 4.095 3.026 796 HG23 ILE 96 HG23 ILE 96 3.170 4.947 2.304 797 HD11 ILE 96 HD11 ILE 96 7.004 6.568 4.111 798 HD12 ILE 96 HD12 ILE 96 8.413 6.333 3.062 799 HD13 ILE 96 HD13 ILE 96 7.277 7.652 2.721 800 H GLN 97 H GLN 97 3.829 9.016 2.154 801 HA GLN 97 HA GLN 97 6.008 10.792 1.143 802 HB2 GLN 97 HB2 GLN 97 3.019 11.280 0.988 803 HB3 GLN 97 HB3 GLN 97 4.217 12.548 0.787 804 HG2 GLN 97 HG2 GLN 97 4.834 11.898 -1.307 805 HG3 GLN 97 HG3 GLN 97 4.584 10.181 -1.004 806 HE21 GLN 97 HE21 GLN 97 1.286 10.120 -2.251 807 HE22 GLN 97 HE22 GLN 97 2.658 9.225 -1.601 808 H ASP 98 H ASP 98 6.577 12.443 2.395 809 HA ASP 98 HA ASP 98 5.759 12.271 5.244 810 HB2 ASP 98 HB2 ASP 98 8.138 11.981 4.444 811 HB3 ASP 98 HB3 ASP 98 8.134 13.695 4.038 812 H GLY 99 H GLY 99 4.356 13.879 2.993 813 HA2 GLY 99 HA2 GLY 99 2.861 15.638 3.055 814 HA3 GLY 99 HA3 GLY 99 3.364 15.980 4.711 815 H THR 100 H THR 100 6.038 16.018 2.670 816 HA THR 100 HA THR 100 5.966 18.990 2.288 817 HB THR 100 HB THR 100 7.087 18.227 4.371 818 HG1 THR 100 HG1 THR 100 8.846 19.560 4.111 819 HG21 THR 100 HG21 THR 100 9.237 17.108 2.523 820 HG22 THR 100 HG22 THR 100 9.303 17.228 4.292 821 HG23 THR 100 HG23 THR 100 8.134 16.142 3.536 822 H GLY 101 H GLY 101 6.063 16.278 0.518 823 HA2 GLY 101 HA2 GLY 101 6.470 16.182 -1.821 824 HA3 GLY 101 HA3 GLY 101 7.675 17.462 -1.690 825 H ARG 102 H ARG 102 8.400 15.537 0.818 826 HA ARG 102 HA ARG 102 10.466 13.863 -0.405 827 HB2 ARG 102 HB2 ARG 102 10.980 14.981 1.660 828 HB3 ARG 102 HB3 ARG 102 9.453 14.477 2.390 829 HG2 ARG 102 HG2 ARG 102 10.213 12.122 2.374 830 HG3 ARG 102 HG3 ARG 102 11.784 12.658 1.718 831 HD2 ARG 102 HD2 ARG 102 12.038 14.138 3.739 832 HD3 ARG 102 HD3 ARG 102 10.494 13.524 4.338 833 HE ARG 102 HE ARG 102 12.676 11.581 3.771 834 HH11 ARG 102 HH11 ARG 102 13.471 10.337 5.403 835 HH12 ARG 102 HH12 ARG 102 12.935 10.589 7.038 836 HH21 ARG 102 HH21 ARG 102 10.734 13.122 6.315 837 HH22 ARG 102 HH22 ARG 102 11.488 12.138 7.536 838 H SER 103 H SER 103 10.170 11.851 -0.901 839 HA SER 103 HA SER 103 7.937 10.209 0.101 840 HB2 SER 103 HB2 SER 103 6.951 9.778 -2.057 841 HB3 SER 103 HB3 SER 103 6.964 11.520 -1.760 842 HG SER 103 HG SER 103 9.004 11.509 -3.006 843 H ALA 104 H ALA 104 7.944 7.989 -0.591 844 HA ALA 104 HA ALA 104 10.280 6.935 -2.042 845 HB1 ALA 104 HB1 ALA 104 11.043 6.959 0.316 846 HB2 ALA 104 HB2 ALA 104 9.591 6.051 0.799 847 HB3 ALA 104 HB3 ALA 104 10.803 5.299 -0.260 848 H PHE 105 H PHE 105 9.907 4.906 -2.977 849 HA PHE 105 HA PHE 105 7.097 3.902 -2.939 850 HB2 PHE 105 HB2 PHE 105 9.413 3.465 -4.836 851 HB3 PHE 105 HB3 PHE 105 7.989 2.446 -4.826 852 HD1 PHE 105 HD1 PHE 105 9.216 5.880 -5.584 853 HD2 PHE 105 HD2 PHE 105 5.835 3.207 -5.646 854 HE1 PHE 105 HE1 PHE 105 8.025 7.407 -7.129 855 HE2 PHE 105 HE2 PHE 105 4.654 4.716 -7.195 856 HZ PHE 105 HZ PHE 105 5.759 6.819 -7.964 857 H ILE 106 H ILE 106 6.655 2.389 -1.499 858 HA ILE 106 HA ILE 106 8.757 0.390 -0.735 859 HB ILE 106 HB ILE 106 7.870 0.187 1.436 860 HG12 ILE 106 HG12 ILE 106 5.765 2.294 0.793 861 HG13 ILE 106 HG13 ILE 106 5.454 0.565 0.959 862 HG21 ILE 106 HG21 ILE 106 8.545 2.306 2.373 863 HG22 ILE 106 HG22 ILE 106 9.500 2.029 0.911 864 HG23 ILE 106 HG23 ILE 106 8.129 3.163 0.870 865 HD11 ILE 106 HD11 ILE 106 6.402 2.387 3.192 866 HD12 ILE 106 HD12 ILE 106 4.811 1.631 3.002 867 HD13 ILE 106 HD13 ILE 106 6.235 0.621 3.306 868 H GLY 107 H GLY 107 8.157 -1.775 -0.458 869 HA2 GLY 107 HA2 GLY 107 5.734 -2.614 -1.971 870 HA3 GLY 107 HA3 GLY 107 7.120 -3.620 -1.561 871 H ILE 108 H ILE 108 4.129 -3.786 -0.990 872 HA ILE 108 HA ILE 108 4.473 -4.643 1.806 873 HB ILE 108 HB ILE 108 2.138 -4.184 2.328 874 HG12 ILE 108 HG12 ILE 108 2.049 -2.376 -0.122 875 HG13 ILE 108 HG13 ILE 108 1.259 -3.950 -0.018 876 HG21 ILE 108 HG21 ILE 108 2.505 -1.821 2.865 877 HG22 ILE 108 HG22 ILE 108 3.964 -2.785 3.099 878 HG23 ILE 108 HG23 ILE 108 3.816 -1.737 1.670 879 HD11 ILE 108 HD11 ILE 108 0.603 -1.537 1.729 880 HD12 ILE 108 HD12 ILE 108 -0.383 -2.240 0.440 881 HD13 ILE 108 HD13 ILE 108 -0.088 -3.156 1.931 882 H GLY 109 H GLY 109 3.744 -6.567 2.350 883 HA2 GLY 109 HA2 GLY 109 2.352 -8.253 0.294 884 HA3 GLY 109 HA3 GLY 109 3.556 -8.868 1.425 885 H PHE 110 H PHE 110 0.666 -9.451 0.860 886 HA PHE 110 HA PHE 110 -0.615 -8.939 3.496 887 HB2 PHE 110 HB2 PHE 110 -1.641 -9.764 0.765 888 HB3 PHE 110 HB3 PHE 110 -2.621 -9.918 2.205 889 HD1 PHE 110 HD1 PHE 110 -4.030 -8.180 2.799 890 HD2 PHE 110 HD2 PHE 110 -0.499 -7.282 0.483 891 HE1 PHE 110 HE1 PHE 110 -4.702 -5.799 2.686 892 HE2 PHE 110 HE2 PHE 110 -1.110 -4.888 0.496 893 HZ PHE 110 HZ PHE 110 -3.220 -4.147 1.555 894 H THR 111 H THR 111 -1.868 -10.662 4.479 895 HA THR 111 HA THR 111 -0.322 -13.073 4.872 896 HB THR 111 HB THR 111 -1.639 -11.936 6.616 897 HG1 THR 111 HG1 THR 111 -2.369 -13.844 7.544 898 HG21 THR 111 HG21 THR 111 -3.729 -11.432 5.352 899 HG22 THR 111 HG22 THR 111 -4.108 -13.169 5.326 900 HG23 THR 111 HG23 THR 111 -4.026 -12.292 6.866 901 H ASP 112 H ASP 112 -2.983 -12.259 2.714 902 HA ASP 112 HA ASP 112 -2.770 -14.808 1.366 903 HB2 ASP 112 HB2 ASP 112 -4.340 -15.306 3.303 904 HB3 ASP 112 HB3 ASP 112 -5.439 -14.088 2.657 905 H ARG 113 H ARG 113 -3.910 -14.837 -0.654 906 HA ARG 113 HA ARG 113 -4.076 -12.422 -2.155 907 HB2 ARG 113 HB2 ARG 113 -3.856 -14.826 -2.997 908 HB3 ARG 113 HB3 ARG 113 -5.576 -15.032 -2.634 909 HG2 ARG 113 HG2 ARG 113 -5.956 -12.966 -4.177 910 HG3 ARG 113 HG3 ARG 113 -4.254 -13.151 -4.621 911 HD2 ARG 113 HD2 ARG 113 -5.604 -14.266 -6.294 912 HD3 ARG 113 HD3 ARG 113 -4.754 -15.492 -5.350 913 HE ARG 113 HE ARG 113 -6.766 -16.321 -4.592 914 HH11 ARG 113 HH11 ARG 113 -8.954 -16.565 -4.443 915 HH12 ARG 113 HH12 ARG 113 -10.013 -15.306 -5.002 916 HH21 ARG 113 HH21 ARG 113 -7.519 -13.174 -5.979 917 HH22 ARG 113 HH22 ARG 113 -9.229 -13.444 -5.844 918 H GLY 114 H GLY 114 -6.653 -14.197 -0.415 919 HA2 GLY 114 HA2 GLY 114 -8.878 -12.683 -1.325 920 HA3 GLY 114 HA3 GLY 114 -8.776 -13.570 0.199 921 H ASP 115 H ASP 115 -6.516 -11.892 1.216 922 HA ASP 115 HA ASP 115 -8.086 -9.621 2.254 923 HB2 ASP 115 HB2 ASP 115 -5.323 -10.731 2.881 924 HB3 ASP 115 HB3 ASP 115 -5.954 -9.242 3.578 925 H ALA 116 H ALA 116 -5.242 -10.127 0.130 926 HA ALA 116 HA ALA 116 -4.787 -7.347 -0.481 927 HB1 ALA 116 HB1 ALA 116 -3.133 -8.982 -0.985 928 HB2 ALA 116 HB2 ALA 116 -4.278 -9.974 -1.923 929 HB3 ALA 116 HB3 ALA 116 -3.747 -8.420 -2.558 930 H PHE 117 H PHE 117 -7.040 -9.766 -1.807 931 HA PHE 117 HA PHE 117 -8.196 -7.990 -3.759 932 HB2 PHE 117 HB2 PHE 117 -8.689 -10.741 -2.816 933 HB3 PHE 117 HB3 PHE 117 -10.129 -9.898 -3.316 934 HD1 PHE 117 HD1 PHE 117 -6.640 -10.674 -4.478 935 HD2 PHE 117 HD2 PHE 117 -10.653 -9.558 -5.591 936 HE1 PHE 117 HE1 PHE 117 -6.071 -11.008 -6.876 937 HE2 PHE 117 HE2 PHE 117 -10.083 -9.901 -7.988 938 HZ PHE 117 HZ PHE 117 -7.793 -10.632 -8.631 939 H ASP 118 H ASP 118 -8.368 -7.590 -0.471 940 HA ASP 118 HA ASP 118 -10.916 -6.046 -0.758 941 HB2 ASP 118 HB2 ASP 118 -9.187 -6.612 1.676 942 HB3 ASP 118 HB3 ASP 118 -10.585 -5.548 1.675 943 H PHE 119 H PHE 119 -7.392 -5.663 -0.411 944 HA PHE 119 HA PHE 119 -7.277 -2.898 0.180 945 HB2 PHE 119 HB2 PHE 119 -5.374 -4.328 0.411 946 HB3 PHE 119 HB3 PHE 119 -5.393 -4.769 -1.282 947 HD1 PHE 119 HD1 PHE 119 -4.563 -3.272 -3.042 948 HD2 PHE 119 HD2 PHE 119 -4.352 -2.198 1.122 949 HE1 PHE 119 HE1 PHE 119 -2.972 -1.462 -3.585 950 HE2 PHE 119 HE2 PHE 119 -2.781 -0.390 0.585 951 HZ PHE 119 HZ PHE 119 -2.070 -0.001 -1.774 952 H ASN 120 H ASN 120 -7.128 -4.466 -3.011 953 HA ASN 120 HA ASN 120 -7.072 -2.022 -4.524 954 HB2 ASN 120 HB2 ASN 120 -7.437 -3.552 -6.449 955 HB3 ASN 120 HB3 ASN 120 -6.173 -4.150 -5.379 956 HD21 ASN 120 HD21 ASN 120 -8.358 -7.031 -6.270 957 HD22 ASN 120 HD22 ASN 120 -7.341 -5.920 -7.190 958 H VAL 121 H VAL 121 -9.763 -4.086 -3.469 959 HA VAL 121 HA VAL 121 -11.775 -2.696 -5.022 960 HB VAL 121 HB VAL 121 -11.919 -4.699 -2.752 961 HG11 VAL 121 HG11 VAL 121 -14.242 -3.463 -4.306 962 HG12 VAL 121 HG12 VAL 121 -14.348 -4.911 -3.281 963 HG13 VAL 121 HG13 VAL 121 -13.966 -3.352 -2.552 964 HG21 VAL 121 HG21 VAL 121 -12.754 -6.169 -4.544 965 HG22 VAL 121 HG22 VAL 121 -12.633 -4.841 -5.720 966 HG23 VAL 121 HG23 VAL 121 -11.172 -5.520 -4.974 967 H SER 122 H SER 122 -10.665 -2.393 -1.631 968 HA SER 122 HA SER 122 -12.630 -0.463 -0.849 969 HB2 SER 122 HB2 SER 122 -9.828 -0.898 0.252 970 HB3 SER 122 HB3 SER 122 -11.142 -0.013 1.051 971 HG SER 122 HG SER 122 -10.970 -2.768 0.424 972 H LEU 123 H LEU 123 -9.550 -0.064 -2.553 973 HA LEU 123 HA LEU 123 -9.605 2.860 -2.445 974 HB2 LEU 123 HB2 LEU 123 -8.043 0.851 -4.111 975 HB3 LEU 123 HB3 LEU 123 -7.845 2.595 -4.264 976 HG LEU 123 HG LEU 123 -7.388 1.094 -1.648 977 HD11 LEU 123 HD11 LEU 123 -5.395 2.028 -3.752 978 HD12 LEU 123 HD12 LEU 123 -4.987 1.349 -2.155 979 HD13 LEU 123 HD13 LEU 123 -5.797 0.342 -3.359 980 HD21 LEU 123 HD21 LEU 123 -6.602 3.903 -2.546 981 HD22 LEU 123 HD22 LEU 123 -7.858 3.510 -1.349 982 HD23 LEU 123 HD23 LEU 123 -6.175 3.134 -1.002 983 H GLN 124 H GLN 124 -10.345 0.480 -5.090 984 HA GLN 124 HA GLN 124 -11.133 2.562 -6.870 985 HB2 GLN 124 HB2 GLN 124 -11.691 0.901 -8.407 986 HB3 GLN 124 HB3 GLN 124 -10.390 0.206 -7.437 987 HG2 GLN 124 HG2 GLN 124 -12.203 -0.939 -6.066 988 HG3 GLN 124 HG3 GLN 124 -13.354 -0.449 -7.308 989 HE21 GLN 124 HE21 GLN 124 -10.519 -3.324 -8.199 990 HE22 GLN 124 HE22 GLN 124 -10.224 -2.185 -6.878 991 H ASP 125 H ASP 125 -13.032 0.916 -4.388 992 HA ASP 125 HA ASP 125 -15.550 2.023 -5.385 993 HB2 ASP 125 HB2 ASP 125 -15.417 -0.234 -4.350 994 HB3 ASP 125 HB3 ASP 125 -14.913 0.506 -2.827 995 H HIS 126 H HIS 126 -12.965 3.385 -3.679 996 HA HIS 126 HA HIS 126 -14.797 5.504 -2.654 997 HB2 HIS 126 HB2 HIS 126 -12.815 4.917 -1.242 998 HB3 HIS 126 HB3 HIS 126 -11.757 5.463 -2.552 999 HD2 HIS 126 HD2 HIS 126 -11.707 8.144 -3.063 1000 HE1 HIS 126 HE1 HIS 126 -14.167 9.393 0.190 1001 HE2 HIS 126 HE2 HIS 126 -12.677 10.200 -1.702 1002 H PHE 127 H PHE 127 -12.418 4.875 -5.225 1003 HA PHE 127 HA PHE 127 -12.790 7.599 -6.227 1004 HB2 PHE 127 HB2 PHE 127 -10.952 5.327 -7.011 1005 HB3 PHE 127 HB3 PHE 127 -10.987 6.867 -7.851 1006 HD1 PHE 127 HD1 PHE 127 -10.916 9.031 -6.195 1007 HD2 PHE 127 HD2 PHE 127 -9.309 5.137 -5.316 1008 HE1 PHE 127 HE1 PHE 127 -9.177 10.071 -4.772 1009 HE2 PHE 127 HE2 PHE 127 -7.521 6.174 -3.961 1010 HZ PHE 127 HZ PHE 127 -7.448 8.653 -3.700 1011 H LYS 128 H LYS 128 -14.678 4.911 -6.875 1012 HA LYS 128 HA LYS 128 -14.861 4.926 -9.625 1013 HB2 LYS 128 HB2 LYS 128 -16.915 3.854 -9.553 1014 HB3 LYS 128 HB3 LYS 128 -15.995 3.271 -8.187 1015 HG2 LYS 128 HG2 LYS 128 -18.013 5.526 -7.785 1016 HG3 LYS 128 HG3 LYS 128 -18.572 3.877 -8.027 1017 HD2 LYS 128 HD2 LYS 128 -17.322 3.070 -6.141 1018 HD3 LYS 128 HD3 LYS 128 -16.608 4.675 -5.844 1019 HE2 LYS 128 HE2 LYS 128 -18.689 5.616 -5.226 1020 HE3 LYS 128 HE3 LYS 128 -19.611 4.281 -5.947 1021 HZ1 LYS 128 HZ1 LYS 128 -19.534 4.036 -3.530 1022 HZ2 LYS 128 HZ2 LYS 128 -18.677 2.805 -4.225 1023 HZ3 LYS 128 HZ3 LYS 128 -17.883 4.032 -3.551 1024 H TRP 129 H TRP 129 -16.037 7.478 -7.626 1025 HA TRP 129 HA TRP 129 -17.550 8.766 -9.842 1026 HB2 TRP 129 HB2 TRP 129 -18.263 10.359 -8.229 1027 HB3 TRP 129 HB3 TRP 129 -18.531 8.739 -7.606 1028 HD1 TRP 129 HD1 TRP 129 -16.673 7.894 -5.710 1029 HE1 TRP 129 HE1 TRP 129 -15.372 9.177 -3.946 1030 HE3 TRP 129 HE3 TRP 129 -17.416 12.656 -7.468 1031 HZ2 TRP 129 HZ2 TRP 129 -14.944 11.945 -3.197 1032 HZ3 TRP 129 HZ3 TRP 129 -16.626 14.603 -6.146 1033 HH2 TRP 129 HH2 TRP 129 -15.385 14.265 -4.017 1034 H VAL 130 H VAL 130 -14.364 8.827 -8.582 1035 HA VAL 130 HA VAL 130 -13.776 11.599 -9.500 1036 HB VAL 130 HB VAL 130 -11.950 9.638 -8.079 1037 HG11 VAL 130 HG11 VAL 130 -11.810 12.670 -8.391 1038 HG12 VAL 130 HG12 VAL 130 -10.700 11.677 -7.420 1039 HG13 VAL 130 HG13 VAL 130 -10.735 11.487 -9.171 1040 HG21 VAL 130 HG21 VAL 130 -13.820 10.046 -6.582 1041 HG22 VAL 130 HG22 VAL 130 -12.440 10.977 -6.009 1042 HG23 VAL 130 HG23 VAL 130 -13.746 11.795 -6.895 1043 H LYS 131 H LYS 131 -12.967 8.214 -10.240 1044 HA LYS 131 HA LYS 131 -10.924 9.001 -12.189 1045 HB2 LYS 131 HB2 LYS 131 -10.559 7.252 -10.459 1046 HB3 LYS 131 HB3 LYS 131 -11.793 6.249 -11.209 1047 HG2 LYS 131 HG2 LYS 131 -9.437 5.595 -11.714 1048 HG3 LYS 131 HG3 LYS 131 -10.403 5.856 -13.144 1049 HD2 LYS 131 HD2 LYS 131 -9.369 8.129 -13.412 1050 HD3 LYS 131 HD3 LYS 131 -8.385 7.816 -11.961 1051 HE2 LYS 131 HE2 LYS 131 -7.427 5.821 -13.101 1052 HE3 LYS 131 HE3 LYS 131 -8.434 6.185 -14.524 1053 HZ1 LYS 131 HZ1 LYS 131 -6.157 7.077 -14.750 1054 HZ2 LYS 131 HZ2 LYS 131 -7.272 8.286 -14.755 1055 HZ3 LYS 131 HZ3 LYS 131 -6.369 8.009 -13.411 1056 H GLN 132 H GLN 132 -13.669 9.632 -12.770 1057 HA GLN 132 HA GLN 132 -14.474 7.868 -14.975 1058 HB2 GLN 132 HB2 GLN 132 -15.799 10.381 -13.906 1059 HB3 GLN 132 HB3 GLN 132 -16.404 9.327 -15.201 1060 HG2 GLN 132 HG2 GLN 132 -16.356 7.400 -13.553 1061 HG3 GLN 132 HG3 GLN 132 -15.961 8.560 -12.283 1062 HE21 GLN 132 HE21 GLN 132 -19.581 8.061 -12.010 1063 HE22 GLN 132 HE22 GLN 132 -18.064 7.220 -11.649 1064 H GLU 133 H GLU 133 -12.960 8.054 -16.453 1065 HA GLU 133 HA GLU 133 -12.555 10.635 -17.934 1066 HB2 GLU 133 HB2 GLU 133 -10.489 8.473 -17.372 1067 HB3 GLU 133 HB3 GLU 133 -10.270 9.853 -18.450 1068 HG2 GLU 133 HG2 GLU 133 -10.688 11.388 -16.495 1069 HG3 GLU 133 HG3 GLU 133 -10.710 9.975 -15.436 Start of MODEL 6 1 H1 GLY -4 H1 GLY -4 2.298 8.595 25.479 2 H2 GLY -4 H2 GLY -4 2.088 9.864 24.464 3 H3 GLY -4 H3 GLY -4 2.527 10.125 26.019 4 HA2 GLY -4 HA2 GLY -4 4.651 9.056 25.674 5 HA3 GLY -4 HA3 GLY -4 4.175 8.751 23.994 6 H SER -3 H SER -3 6.455 10.230 24.980 7 HA SER -3 HA SER -3 7.698 12.046 24.677 8 HB2 SER -3 HB2 SER -3 5.638 12.923 22.633 9 HB3 SER -3 HB3 SER -3 7.214 13.672 22.882 10 HG SER -3 HG SER -3 6.723 10.960 22.147 11 HA PRO -2 HA PRO -2 6.257 15.138 27.479 12 HB2 PRO -2 HB2 PRO -2 8.242 16.987 27.437 13 HB3 PRO -2 HB3 PRO -2 8.515 15.311 28.003 14 HG2 PRO -2 HG2 PRO -2 9.075 16.450 25.239 15 HG3 PRO -2 HG3 PRO -2 10.187 15.518 26.294 16 HD2 PRO -2 HD2 PRO -2 8.741 14.325 24.321 17 HD3 PRO -2 HD3 PRO -2 9.051 13.502 25.878 18 H ASN -1 H ASN -1 6.560 15.971 24.121 19 HA ASN -1 HA ASN -1 5.656 18.729 24.327 20 HB2 ASN -1 HB2 ASN -1 5.890 16.864 21.927 21 HB3 ASN -1 HB3 ASN -1 5.599 18.597 21.845 22 HD21 ASN -1 HD21 ASN -1 9.377 17.418 21.950 23 HD22 ASN -1 HD22 ASN -1 8.031 16.390 21.485 24 H SER 0 H SER 0 3.674 19.618 23.595 25 HA SER 0 HA SER 0 1.301 17.995 24.162 26 HB2 SER 0 HB2 SER 0 0.134 20.174 23.916 27 HB3 SER 0 HB3 SER 0 1.453 20.210 25.100 28 HG SER 0 HG SER 0 1.492 22.034 23.688 29 H MET 1 H MET 1 3.048 18.828 21.332 30 HA MET 1 HA MET 1 0.954 17.727 19.573 31 HB2 MET 1 HB2 MET 1 1.052 20.447 19.878 32 HB3 MET 1 HB3 MET 1 2.236 20.267 18.597 33 HG2 MET 1 HG2 MET 1 -0.628 19.238 18.608 34 HG3 MET 1 HG3 MET 1 -0.089 20.718 17.834 35 HE1 MET 1 HE1 MET 1 1.937 19.450 14.732 36 HE2 MET 1 HE2 MET 1 1.344 20.861 15.634 37 HE3 MET 1 HE3 MET 1 2.637 19.844 16.314 38 H ALA 2 H ALA 2 1.768 16.887 17.646 39 HA ALA 2 HA ALA 2 4.560 17.279 16.857 40 HB1 ALA 2 HB1 ALA 2 5.063 14.855 16.720 41 HB2 ALA 2 HB2 ALA 2 4.790 15.370 18.394 42 HB3 ALA 2 HB3 ALA 2 3.521 14.482 17.523 43 H THR 3 H THR 3 1.660 15.256 16.202 44 HA THR 3 HA THR 3 1.054 16.628 13.734 45 HB THR 3 HB THR 3 1.895 13.694 13.641 46 HG1 THR 3 HG1 THR 3 3.312 15.679 13.216 47 HG21 THR 3 HG21 THR 3 -0.174 13.848 12.345 48 HG22 THR 3 HG22 THR 3 0.402 15.327 11.538 49 HG23 THR 3 HG23 THR 3 1.196 13.764 11.237 50 H GLU 4 H GLU 4 -1.144 16.653 13.582 51 HA GLU 4 HA GLU 4 -2.790 14.442 14.279 52 HB2 GLU 4 HB2 GLU 4 -4.237 15.462 15.887 53 HB3 GLU 4 HB3 GLU 4 -2.605 15.456 16.539 54 HG2 GLU 4 HG2 GLU 4 -2.382 17.878 15.938 55 HG3 GLU 4 HG3 GLU 4 -4.033 17.857 15.306 56 H LEU 5 H LEU 5 -4.772 14.617 13.346 57 HA LEU 5 HA LEU 5 -5.631 17.043 11.942 58 HB2 LEU 5 HB2 LEU 5 -6.137 15.809 9.898 59 HB3 LEU 5 HB3 LEU 5 -4.430 16.087 10.189 60 HG LEU 5 HG LEU 5 -5.601 13.442 11.020 61 HD11 LEU 5 HD11 LEU 5 -4.829 14.174 8.171 62 HD12 LEU 5 HD12 LEU 5 -5.209 12.534 8.768 63 HD13 LEU 5 HD13 LEU 5 -6.460 13.777 8.760 64 HD21 LEU 5 HD21 LEU 5 -3.204 13.928 11.503 65 HD22 LEU 5 HD22 LEU 5 -3.375 12.610 10.343 66 HD23 LEU 5 HD23 LEU 5 -2.928 14.241 9.784 67 H GLU 6 H GLU 6 -7.806 17.287 11.840 68 HA GLU 6 HA GLU 6 -9.312 15.613 13.700 69 HB2 GLU 6 HB2 GLU 6 -9.067 18.191 13.653 70 HB3 GLU 6 HB3 GLU 6 -10.314 18.157 12.409 71 HG2 GLU 6 HG2 GLU 6 -11.828 16.971 14.048 72 HG3 GLU 6 HG3 GLU 6 -10.528 17.003 15.233 73 H TYR 7 H TYR 7 -8.852 14.326 11.144 74 HA TYR 7 HA TYR 7 -11.560 13.592 10.361 75 HB2 TYR 7 HB2 TYR 7 -11.360 14.209 8.053 76 HB3 TYR 7 HB3 TYR 7 -11.102 15.652 9.000 77 HD1 TYR 7 HD1 TYR 7 -9.466 13.097 6.837 78 HD2 TYR 7 HD2 TYR 7 -8.920 16.800 8.990 79 HE1 TYR 7 HE1 TYR 7 -7.477 13.578 5.473 80 HE2 TYR 7 HE2 TYR 7 -6.832 17.223 7.691 81 HH TYR 7 HH TYR 7 -5.759 15.046 5.051 82 H GLU 8 H GLU 8 -11.588 11.563 9.305 83 HA GLU 8 HA GLU 8 -9.727 10.634 7.492 84 HB2 GLU 8 HB2 GLU 8 -9.005 9.932 10.312 85 HB3 GLU 8 HB3 GLU 8 -9.228 8.499 9.316 86 HG2 GLU 8 HG2 GLU 8 -7.517 9.115 7.794 87 HG3 GLU 8 HG3 GLU 8 -7.414 10.749 8.400 88 H SER 9 H SER 9 -11.199 9.567 6.227 89 HA SER 9 HA SER 9 -13.330 7.913 7.511 90 HB2 SER 9 HB2 SER 9 -12.956 9.068 4.756 91 HB3 SER 9 HB3 SER 9 -14.102 7.744 5.075 92 HG SER 9 HG SER 9 -15.311 9.473 5.458 93 H VAL 10 H VAL 10 -12.538 5.995 8.069 94 HA VAL 10 HA VAL 10 -10.475 4.512 6.781 95 HB VAL 10 HB VAL 10 -12.686 3.546 8.626 96 HG11 VAL 10 HG11 VAL 10 -11.112 1.689 9.177 97 HG12 VAL 10 HG12 VAL 10 -11.712 1.584 7.528 98 HG13 VAL 10 HG13 VAL 10 -10.064 2.196 7.833 99 HG21 VAL 10 HG21 VAL 10 -10.938 3.710 10.368 100 HG22 VAL 10 HG22 VAL 10 -9.786 4.334 9.168 101 HG23 VAL 10 HG23 VAL 10 -11.213 5.288 9.631 102 H LEU 11 H LEU 11 -10.421 2.741 5.457 103 HA LEU 11 HA LEU 11 -12.826 2.155 3.754 104 HB2 LEU 11 HB2 LEU 11 -9.968 2.758 2.892 105 HB3 LEU 11 HB3 LEU 11 -11.174 2.046 1.837 106 HG LEU 11 HG LEU 11 -11.335 4.828 3.063 107 HD11 LEU 11 HD11 LEU 11 -11.055 5.517 0.670 108 HD12 LEU 11 HD12 LEU 11 -9.638 4.688 1.324 109 HD13 LEU 11 HD13 LEU 11 -10.754 3.824 0.241 110 HD21 LEU 11 HD21 LEU 11 -13.235 5.146 1.485 111 HD22 LEU 11 HD22 LEU 11 -13.171 3.420 1.066 112 HD23 LEU 11 HD23 LEU 11 -13.606 3.938 2.713 113 H CYS 12 H CYS 12 -9.619 1.000 4.861 114 HA CYS 12 HA CYS 12 -10.670 -1.740 5.047 115 HB2 CYS 12 HB2 CYS 12 -9.760 -1.596 2.715 116 HB3 CYS 12 HB3 CYS 12 -8.188 -1.116 3.398 117 HG CYS 12 HG CYS 12 -8.085 -3.619 2.629 118 H VAL 13 H VAL 13 -9.838 -2.734 6.775 119 HA VAL 13 HA VAL 13 -7.208 -1.876 7.882 120 HB VAL 13 HB VAL 13 -9.745 -2.391 9.460 121 HG11 VAL 13 HG11 VAL 13 -6.881 -2.089 10.486 122 HG12 VAL 13 HG12 VAL 13 -8.340 -2.035 11.497 123 HG13 VAL 13 HG13 VAL 13 -7.917 -3.527 10.658 124 HG21 VAL 13 HG21 VAL 13 -9.393 -0.063 8.592 125 HG22 VAL 13 HG22 VAL 13 -9.326 -0.150 10.359 126 HG23 VAL 13 HG23 VAL 13 -7.820 -0.044 9.421 127 H LYS 14 H LYS 14 -5.840 -3.464 8.036 128 HA LYS 14 HA LYS 14 -6.805 -6.258 8.429 129 HB2 LYS 14 HB2 LYS 14 -4.516 -5.510 6.593 130 HB3 LYS 14 HB3 LYS 14 -4.978 -7.140 7.038 131 HG2 LYS 14 HG2 LYS 14 -6.800 -5.200 5.544 132 HG3 LYS 14 HG3 LYS 14 -5.784 -6.424 4.786 133 HD2 LYS 14 HD2 LYS 14 -6.998 -8.218 5.921 134 HD3 LYS 14 HD3 LYS 14 -8.020 -7.035 6.764 135 HE2 LYS 14 HE2 LYS 14 -8.908 -6.220 4.641 136 HE3 LYS 14 HE3 LYS 14 -7.856 -7.328 3.748 137 HZ1 LYS 14 HZ1 LYS 14 -9.973 -8.181 5.652 138 HZ2 LYS 14 HZ2 LYS 14 -10.093 -8.248 4.018 139 HZ3 LYS 14 HZ3 LYS 14 -8.992 -9.190 4.798 140 HA PRO 15 HA PRO 15 -4.224 -5.830 12.010 141 HB2 PRO 15 HB2 PRO 15 -4.222 -8.838 12.064 142 HB3 PRO 15 HB3 PRO 15 -4.622 -7.687 13.374 143 HG2 PRO 15 HG2 PRO 15 -6.579 -9.007 12.044 144 HG3 PRO 15 HG3 PRO 15 -6.776 -7.264 12.441 145 HD2 PRO 15 HD2 PRO 15 -5.930 -8.517 9.818 146 HD3 PRO 15 HD3 PRO 15 -7.115 -7.215 10.147 147 H ASP 16 H ASP 16 -3.215 -7.967 9.404 148 HA ASP 16 HA ASP 16 -0.355 -7.696 10.237 149 HB2 ASP 16 HB2 ASP 16 -1.296 -9.903 10.866 150 HB3 ASP 16 HB3 ASP 16 -1.675 -10.202 9.166 151 H VAL 17 H VAL 17 0.773 -6.705 8.804 152 HA VAL 17 HA VAL 17 0.788 -7.498 5.987 153 HB VAL 17 HB VAL 17 -0.867 -5.617 6.151 154 HG11 VAL 17 HG11 VAL 17 -0.114 -3.321 6.428 155 HG12 VAL 17 HG12 VAL 17 0.251 -4.244 7.893 156 HG13 VAL 17 HG13 VAL 17 1.545 -3.852 6.744 157 HG21 VAL 17 HG21 VAL 17 1.604 -4.993 4.498 158 HG22 VAL 17 HG22 VAL 17 0.296 -6.117 4.047 159 HG23 VAL 17 HG23 VAL 17 -0.043 -4.393 4.221 160 H SER 18 H SER 18 2.787 -7.115 5.008 161 HA SER 18 HA SER 18 5.018 -6.402 6.892 162 HB2 SER 18 HB2 SER 18 4.912 -8.606 4.810 163 HB3 SER 18 HB3 SER 18 6.290 -8.216 5.861 164 HG SER 18 HG SER 18 4.956 -9.968 6.638 165 H VAL 19 H VAL 19 6.534 -5.036 6.212 166 HA VAL 19 HA VAL 19 6.414 -3.949 3.453 167 HB VAL 19 HB VAL 19 7.598 -2.843 5.999 168 HG11 VAL 19 HG11 VAL 19 7.765 -1.705 3.166 169 HG12 VAL 19 HG12 VAL 19 8.080 -0.773 4.650 170 HG13 VAL 19 HG13 VAL 19 9.123 -2.125 4.232 171 HG21 VAL 19 HG21 VAL 19 5.073 -2.672 5.538 172 HG22 VAL 19 HG22 VAL 19 5.935 -1.149 5.786 173 HG23 VAL 19 HG23 VAL 19 5.500 -1.657 4.146 174 H TYR 20 H TYR 20 7.905 -4.044 2.038 175 HA TYR 20 HA TYR 20 10.670 -4.802 2.818 176 HB2 TYR 20 HB2 TYR 20 9.697 -5.675 0.135 177 HB3 TYR 20 HB3 TYR 20 10.934 -6.360 1.183 178 HD1 TYR 20 HD1 TYR 20 7.390 -6.346 0.253 179 HD2 TYR 20 HD2 TYR 20 10.294 -7.930 2.996 180 HE1 TYR 20 HE1 TYR 20 5.745 -8.059 0.987 181 HE2 TYR 20 HE2 TYR 20 8.653 -9.653 3.749 182 HH TYR 20 HH TYR 20 5.345 -9.853 2.410 183 H ARG 21 H ARG 21 11.996 -3.207 2.284 184 HA ARG 21 HA ARG 21 11.426 -1.125 0.339 185 HB2 ARG 21 HB2 ARG 21 12.989 -0.992 2.322 186 HB3 ARG 21 HB3 ARG 21 14.132 -2.008 1.432 187 HG2 ARG 21 HG2 ARG 21 14.253 -0.273 -0.365 188 HG3 ARG 21 HG3 ARG 21 13.013 0.672 0.481 189 HD2 ARG 21 HD2 ARG 21 15.099 1.664 1.042 190 HD3 ARG 21 HD3 ARG 21 14.521 0.787 2.475 191 HE ARG 21 HE ARG 21 16.277 -0.854 0.853 192 HH11 ARG 21 HH11 ARG 21 18.336 -1.346 1.540 193 HH12 ARG 21 HH12 ARG 21 19.087 -0.392 2.785 194 HH21 ARG 21 HH21 ARG 21 16.435 1.741 3.204 195 HH22 ARG 21 HH22 ARG 21 18.046 1.308 3.709 196 H ILE 22 H ILE 22 11.399 -1.334 -1.787 197 HA ILE 22 HA ILE 22 12.054 -3.908 -2.939 198 HB ILE 22 HB ILE 22 10.901 -3.059 -4.958 199 HG12 ILE 22 HG12 ILE 22 10.567 -0.478 -3.365 200 HG13 ILE 22 HG13 ILE 22 11.476 -0.689 -4.864 201 HG21 ILE 22 HG21 ILE 22 8.711 -3.163 -4.028 202 HG22 ILE 22 HG22 ILE 22 9.745 -4.182 -3.027 203 HG23 ILE 22 HG23 ILE 22 9.278 -2.574 -2.445 204 HD11 ILE 22 HD11 ILE 22 9.402 0.304 -5.459 205 HD12 ILE 22 HD12 ILE 22 9.294 -1.400 -5.962 206 HD13 ILE 22 HD13 ILE 22 8.479 -0.848 -4.480 207 HA PRO 23 HA PRO 23 15.570 -2.661 -5.582 208 HB2 PRO 23 HB2 PRO 23 15.260 -4.425 -7.649 209 HB3 PRO 23 HB3 PRO 23 15.885 -4.920 -6.046 210 HG2 PRO 23 HG2 PRO 23 13.043 -5.141 -7.093 211 HG3 PRO 23 HG3 PRO 23 14.038 -6.406 -6.299 212 HD2 PRO 23 HD2 PRO 23 12.219 -4.908 -4.932 213 HD3 PRO 23 HD3 PRO 23 13.749 -5.437 -4.176 214 HA PRO 24 HA PRO 24 13.625 0.212 -8.249 215 HB2 PRO 24 HB2 PRO 24 15.258 0.453 -10.458 216 HB3 PRO 24 HB3 PRO 24 15.670 1.060 -8.825 217 HG2 PRO 24 HG2 PRO 24 16.480 -1.581 -10.087 218 HG3 PRO 24 HG3 PRO 24 17.527 -0.386 -9.253 219 HD2 PRO 24 HD2 PRO 24 16.592 -2.556 -7.949 220 HD3 PRO 24 HD3 PRO 24 16.645 -0.971 -7.125 221 H ARG 25 H ARG 25 12.201 0.519 -9.877 222 HA ARG 25 HA ARG 25 10.916 -1.720 -11.178 223 HB2 ARG 25 HB2 ARG 25 9.822 0.362 -10.381 224 HB3 ARG 25 HB3 ARG 25 10.715 1.271 -11.611 225 HG2 ARG 25 HG2 ARG 25 8.397 1.067 -12.174 226 HG3 ARG 25 HG3 ARG 25 9.374 0.261 -13.387 227 HD2 ARG 25 HD2 ARG 25 8.614 -1.883 -12.751 228 HD3 ARG 25 HD3 ARG 25 8.217 -1.357 -11.121 229 HE ARG 25 HE ARG 25 6.182 -0.434 -11.793 230 HH11 ARG 25 HH11 ARG 25 4.458 -0.369 -12.858 231 HH12 ARG 25 HH12 ARG 25 4.333 -0.902 -14.538 232 HH21 ARG 25 HH21 ARG 25 7.688 -1.762 -14.728 233 HH22 ARG 25 HH22 ARG 25 6.152 -1.704 -15.549 234 H ALA 26 H ALA 26 10.671 -2.129 -13.321 235 HA ALA 26 HA ALA 26 11.962 -0.457 -15.333 236 HB1 ALA 26 HB1 ALA 26 13.673 -2.097 -14.854 237 HB2 ALA 26 HB2 ALA 26 12.522 -3.425 -15.072 238 HB3 ALA 26 HB3 ALA 26 12.992 -2.414 -16.470 239 H SER 27 H SER 27 11.128 -1.004 -17.489 240 HA SER 27 HA SER 27 8.239 -0.855 -17.261 241 HB2 SER 27 HB2 SER 27 8.408 -0.099 -19.618 242 HB3 SER 27 HB3 SER 27 9.496 0.780 -18.525 243 HG SER 27 HG SER 27 10.651 0.214 -20.355 244 H ASN 28 H ASN 28 10.511 -2.920 -19.002 245 HA ASN 28 HA ASN 28 8.367 -4.718 -19.972 246 HB2 ASN 28 HB2 ASN 28 11.338 -4.420 -20.575 247 HB3 ASN 28 HB3 ASN 28 10.391 -5.785 -21.154 248 HD21 ASN 28 HD21 ASN 28 9.625 -2.115 -22.831 249 HD22 ASN 28 HD22 ASN 28 10.310 -2.141 -21.214 250 H ARG 29 H ARG 29 9.808 -4.434 -17.118 251 HA ARG 29 HA ARG 29 9.830 -7.383 -16.544 252 HB2 ARG 29 HB2 ARG 29 11.190 -5.259 -14.871 253 HB3 ARG 29 HB3 ARG 29 11.237 -7.012 -14.683 254 HG2 ARG 29 HG2 ARG 29 12.375 -7.136 -16.961 255 HG3 ARG 29 HG3 ARG 29 12.466 -5.353 -16.931 256 HD2 ARG 29 HD2 ARG 29 13.613 -5.497 -14.716 257 HD3 ARG 29 HD3 ARG 29 13.568 -7.265 -14.843 258 HE ARG 29 HE ARG 29 14.848 -5.894 -17.116 259 HH11 ARG 29 HH11 ARG 29 16.997 -6.226 -17.537 260 HH12 ARG 29 HH12 ARG 29 18.012 -6.981 -16.344 261 HH21 ARG 29 HH21 ARG 29 15.525 -7.402 -14.024 262 HH22 ARG 29 HH22 ARG 29 17.209 -7.629 -14.408 263 H GLY 30 H GLY 30 9.237 -4.285 -14.717 264 HA2 GLY 30 HA2 GLY 30 7.567 -3.767 -13.286 265 HA3 GLY 30 HA3 GLY 30 6.663 -5.224 -13.728 266 H TYR 31 H TYR 31 6.763 -4.513 -11.171 267 HA TYR 31 HA TYR 31 8.764 -5.901 -9.628 268 HB2 TYR 31 HB2 TYR 31 5.936 -5.110 -8.878 269 HB3 TYR 31 HB3 TYR 31 7.261 -5.495 -7.783 270 HD1 TYR 31 HD1 TYR 31 5.420 -2.961 -8.085 271 HD2 TYR 31 HD2 TYR 31 9.445 -3.832 -9.406 272 HE1 TYR 31 HE1 TYR 31 6.012 -0.566 -7.882 273 HE2 TYR 31 HE2 TYR 31 10.097 -1.500 -8.880 274 HH TYR 31 HH TYR 31 7.675 1.000 -7.989 275 H ARG 32 H ARG 32 8.541 -7.939 -8.638 276 HA ARG 32 HA ARG 32 6.388 -9.774 -9.630 277 HB2 ARG 32 HB2 ARG 32 8.121 -11.486 -10.193 278 HB3 ARG 32 HB3 ARG 32 8.023 -10.123 -11.279 279 HG2 ARG 32 HG2 ARG 32 10.089 -10.163 -9.061 280 HG3 ARG 32 HG3 ARG 32 10.346 -11.065 -10.561 281 HD2 ARG 32 HD2 ARG 32 10.039 -9.023 -11.897 282 HD3 ARG 32 HD3 ARG 32 9.798 -8.085 -10.422 283 HE ARG 32 HE ARG 32 12.319 -9.430 -10.248 284 HH11 ARG 32 HH11 ARG 32 14.111 -8.360 -10.318 285 HH12 ARG 32 HH12 ARG 32 14.247 -6.765 -11.055 286 HH21 ARG 32 HH21 ARG 32 10.878 -6.650 -11.871 287 HH22 ARG 32 HH22 ARG 32 12.409 -5.803 -11.885 288 H ALA 33 H ALA 33 7.045 -8.650 -6.990 289 HA ALA 33 HA ALA 33 7.111 -9.166 -4.810 290 HB1 ALA 33 HB1 ALA 33 5.799 -11.723 -5.781 291 HB2 ALA 33 HB2 ALA 33 5.661 -10.995 -4.159 292 HB3 ALA 33 HB3 ALA 33 5.010 -10.160 -5.589 293 H SER 34 H SER 34 8.288 -12.117 -6.497 294 HA SER 34 HA SER 34 9.782 -13.138 -4.309 295 HB2 SER 34 HB2 SER 34 10.090 -13.651 -7.287 296 HB3 SER 34 HB3 SER 34 10.781 -14.646 -5.989 297 HG SER 34 HG SER 34 8.769 -15.471 -6.764 298 H ASP 35 H ASP 35 10.598 -10.553 -6.437 299 HA ASP 35 HA ASP 35 13.497 -10.730 -5.962 300 HB2 ASP 35 HB2 ASP 35 11.834 -9.420 -7.846 301 HB3 ASP 35 HB3 ASP 35 12.518 -8.128 -6.898 302 H TRP 36 H TRP 36 10.836 -9.699 -4.060 303 HA TRP 36 HA TRP 36 12.299 -7.613 -2.597 304 HB2 TRP 36 HB2 TRP 36 9.559 -8.770 -2.054 305 HB3 TRP 36 HB3 TRP 36 10.233 -7.276 -1.455 306 HD1 TRP 36 HD1 TRP 36 11.050 -6.821 -4.898 307 HE1 TRP 36 HE1 TRP 36 9.204 -5.556 -6.197 308 HE3 TRP 36 HE3 TRP 36 7.136 -7.548 -1.682 309 HZ2 TRP 36 HZ2 TRP 36 6.493 -4.799 -5.783 310 HZ3 TRP 36 HZ3 TRP 36 4.919 -6.485 -2.151 311 HH2 TRP 36 HH2 TRP 36 4.606 -5.128 -4.185 312 H LYS 37 H LYS 37 12.051 -7.808 -0.170 313 HA LYS 37 HA LYS 37 13.532 -10.186 0.668 314 HB2 LYS 37 HB2 LYS 37 12.804 -7.614 2.114 315 HB3 LYS 37 HB3 LYS 37 13.763 -8.917 2.813 316 HG2 LYS 37 HG2 LYS 37 15.348 -8.725 0.845 317 HG3 LYS 37 HG3 LYS 37 14.508 -7.217 0.422 318 HD2 LYS 37 HD2 LYS 37 16.108 -7.881 2.913 319 HD3 LYS 37 HD3 LYS 37 16.460 -6.656 1.681 320 HE2 LYS 37 HE2 LYS 37 14.363 -5.440 2.382 321 HE3 LYS 37 HE3 LYS 37 14.137 -6.641 3.663 322 HZ1 LYS 37 HZ1 LYS 37 16.210 -5.921 4.658 323 HZ2 LYS 37 HZ2 LYS 37 16.530 -4.892 3.421 324 HZ3 LYS 37 HZ3 LYS 37 15.274 -4.595 4.417 325 H LEU 38 H LEU 38 11.336 -11.325 0.109 326 HA LEU 38 HA LEU 38 9.173 -11.282 1.908 327 HB2 LEU 38 HB2 LEU 38 10.123 -13.623 0.219 328 HB3 LEU 38 HB3 LEU 38 8.506 -13.408 0.888 329 HG LEU 38 HG LEU 38 9.831 -11.702 -1.249 330 HD11 LEU 38 HD11 LEU 38 7.401 -13.560 -1.270 331 HD12 LEU 38 HD12 LEU 38 7.978 -12.612 -2.649 332 HD13 LEU 38 HD13 LEU 38 8.988 -13.911 -1.992 333 HD21 LEU 38 HD21 LEU 38 8.472 -10.181 0.026 334 HD22 LEU 38 HD22 LEU 38 7.559 -10.600 -1.425 335 HD23 LEU 38 HD23 LEU 38 7.154 -11.367 0.133 336 H ASP 39 H ASP 39 12.227 -12.662 2.619 337 HA ASP 39 HA ASP 39 11.062 -14.241 4.881 338 HB2 ASP 39 HB2 ASP 39 12.384 -15.485 3.148 339 HB3 ASP 39 HB3 ASP 39 13.800 -14.555 3.623 340 H GLN 40 H GLN 40 12.362 -11.265 4.281 341 HA GLN 40 HA GLN 40 12.963 -10.818 7.099 342 HB2 GLN 40 HB2 GLN 40 15.137 -9.678 6.662 343 HB3 GLN 40 HB3 GLN 40 15.146 -11.425 6.680 344 HG2 GLN 40 HG2 GLN 40 15.196 -9.764 4.140 345 HG3 GLN 40 HG3 GLN 40 16.625 -10.309 4.979 346 HE21 GLN 40 HE21 GLN 40 15.360 -12.774 2.249 347 HE22 GLN 40 HE22 GLN 40 15.203 -11.024 2.236 348 HA PRO 41 HA PRO 41 10.702 -7.302 5.013 349 HB2 PRO 41 HB2 PRO 41 8.901 -6.930 7.111 350 HB3 PRO 41 HB3 PRO 41 8.613 -7.961 5.688 351 HG2 PRO 41 HG2 PRO 41 9.654 -8.791 8.409 352 HG3 PRO 41 HG3 PRO 41 8.374 -9.573 7.425 353 HD2 PRO 41 HD2 PRO 41 10.883 -10.545 7.456 354 HD3 PRO 41 HD3 PRO 41 9.971 -10.487 5.919 355 H ASP 42 H ASP 42 10.981 -5.190 5.465 356 HA ASP 42 HA ASP 42 13.055 -4.393 7.370 357 HB2 ASP 42 HB2 ASP 42 11.209 -2.845 5.499 358 HB3 ASP 42 HB3 ASP 42 12.479 -2.102 6.479 359 H TRP 43 H TRP 43 9.554 -4.388 7.264 360 HA TRP 43 HA TRP 43 9.355 -3.919 10.150 361 HB2 TRP 43 HB2 TRP 43 9.410 -1.613 9.426 362 HB3 TRP 43 HB3 TRP 43 8.292 -1.931 8.115 363 HD1 TRP 43 HD1 TRP 43 8.379 -1.060 11.784 364 HE1 TRP 43 HE1 TRP 43 6.007 -0.463 12.568 365 HE3 TRP 43 HE3 TRP 43 5.755 -2.780 7.758 366 HZ2 TRP 43 HZ2 TRP 43 3.334 -0.457 11.438 367 HZ3 TRP 43 HZ3 TRP 43 3.300 -2.349 7.581 368 HH2 TRP 43 HH2 TRP 43 2.084 -1.224 9.423 369 H THR 44 H THR 44 7.280 -4.569 10.987 370 HA THR 44 HA THR 44 5.224 -5.398 9.045 371 HB THR 44 HB THR 44 4.661 -7.419 10.176 372 HG1 THR 44 HG1 THR 44 7.025 -7.103 11.705 373 HG21 THR 44 HG21 THR 44 6.414 -8.875 9.486 374 HG22 THR 44 HG22 THR 44 6.290 -7.533 8.339 375 HG23 THR 44 HG23 THR 44 7.614 -7.555 9.524 376 H GLY 45 H GLY 45 3.128 -5.348 9.788 377 HA2 GLY 45 HA2 GLY 45 2.277 -4.668 12.434 378 HA3 GLY 45 HA3 GLY 45 2.576 -3.176 11.554 379 H ARG 46 H ARG 46 0.529 -2.463 11.383 380 HA ARG 46 HA ARG 46 -1.629 -4.182 10.243 381 HB2 ARG 46 HB2 ARG 46 -1.844 -1.538 11.728 382 HB3 ARG 46 HB3 ARG 46 -3.171 -2.595 11.235 383 HG2 ARG 46 HG2 ARG 46 -2.263 -4.360 12.780 384 HG3 ARG 46 HG3 ARG 46 -1.064 -3.196 13.361 385 HD2 ARG 46 HD2 ARG 46 -4.098 -2.808 13.484 386 HD3 ARG 46 HD3 ARG 46 -3.106 -3.406 14.805 387 HE ARG 46 HE ARG 46 -2.065 -1.286 15.068 388 HH11 ARG 46 HH11 ARG 46 -2.344 0.903 15.249 389 HH12 ARG 46 HH12 ARG 46 -3.294 1.733 14.012 390 HH21 ARG 46 HH21 ARG 46 -4.424 -0.961 12.423 391 HH22 ARG 46 HH22 ARG 46 -4.295 0.795 12.560 392 H LEU 47 H LEU 47 -2.931 -3.463 8.659 393 HA LEU 47 HA LEU 47 -2.135 -1.115 6.990 394 HB2 LEU 47 HB2 LEU 47 -2.597 -3.283 5.834 395 HB3 LEU 47 HB3 LEU 47 -4.174 -3.336 6.616 396 HG LEU 47 HG LEU 47 -4.794 -1.195 5.391 397 HD11 LEU 47 HD11 LEU 47 -2.545 -0.370 4.819 398 HD12 LEU 47 HD12 LEU 47 -2.229 -1.840 3.868 399 HD13 LEU 47 HD13 LEU 47 -3.471 -0.686 3.347 400 HD21 LEU 47 HD21 LEU 47 -5.554 -3.405 4.689 401 HD22 LEU 47 HD22 LEU 47 -5.256 -2.366 3.300 402 HD23 LEU 47 HD23 LEU 47 -4.070 -3.620 3.737 403 H ARG 48 H ARG 48 -3.342 0.736 7.064 404 HA ARG 48 HA ARG 48 -6.214 0.528 7.640 405 HB2 ARG 48 HB2 ARG 48 -5.271 1.088 9.844 406 HB3 ARG 48 HB3 ARG 48 -4.511 2.540 9.182 407 HG2 ARG 48 HG2 ARG 48 -6.634 3.587 8.781 408 HG3 ARG 48 HG3 ARG 48 -7.509 2.071 8.912 409 HD2 ARG 48 HD2 ARG 48 -7.992 3.168 10.935 410 HD3 ARG 48 HD3 ARG 48 -6.777 1.976 11.370 411 HE ARG 48 HE ARG 48 -5.184 3.679 11.736 412 HH11 ARG 48 HH11 ARG 48 -4.469 5.780 11.852 413 HH12 ARG 48 HH12 ARG 48 -5.580 7.104 11.380 414 HH21 ARG 48 HH21 ARG 48 -8.209 5.183 10.645 415 HH22 ARG 48 HH22 ARG 48 -7.460 6.785 10.759 416 H ILE 49 H ILE 49 -6.627 0.836 5.566 417 HA ILE 49 HA ILE 49 -5.651 3.196 4.103 418 HB ILE 49 HB ILE 49 -7.963 1.423 3.285 419 HG12 ILE 49 HG12 ILE 49 -4.995 1.098 2.657 420 HG13 ILE 49 HG13 ILE 49 -6.022 -0.015 3.572 421 HG21 ILE 49 HG21 ILE 49 -6.101 3.224 1.655 422 HG22 ILE 49 HG22 ILE 49 -7.522 2.341 1.051 423 HG23 ILE 49 HG23 ILE 49 -7.735 3.677 2.165 424 HD11 ILE 49 HD11 ILE 49 -7.469 -0.189 1.446 425 HD12 ILE 49 HD12 ILE 49 -6.070 0.525 0.603 426 HD13 ILE 49 HD13 ILE 49 -5.909 -1.005 1.484 427 H THR 50 H THR 50 -6.578 5.086 4.060 428 HA THR 50 HA THR 50 -9.247 5.614 5.250 429 HB THR 50 HB THR 50 -7.932 7.782 6.098 430 HG1 THR 50 HG1 THR 50 -5.973 5.770 6.241 431 HG21 THR 50 HG21 THR 50 -7.969 5.096 7.510 432 HG22 THR 50 HG22 THR 50 -7.590 6.649 8.291 433 HG23 THR 50 HG23 THR 50 -9.197 6.384 7.598 434 H SER 51 H SER 51 -9.860 8.051 4.759 435 HA SER 51 HA SER 51 -8.746 9.159 2.279 436 HB2 SER 51 HB2 SER 51 -10.896 9.070 1.114 437 HB3 SER 51 HB3 SER 51 -10.241 7.452 1.386 438 HG SER 51 HG SER 51 -11.644 7.347 3.267 439 H LYS 52 H LYS 52 -9.354 11.208 1.864 440 HA LYS 52 HA LYS 52 -11.751 12.253 2.963 441 HB2 LYS 52 HB2 LYS 52 -9.994 12.606 4.815 442 HB3 LYS 52 HB3 LYS 52 -9.291 13.831 3.776 443 HG2 LYS 52 HG2 LYS 52 -10.812 14.690 5.513 444 HG3 LYS 52 HG3 LYS 52 -11.282 15.165 3.883 445 HD2 LYS 52 HD2 LYS 52 -13.200 14.640 5.335 446 HD3 LYS 52 HD3 LYS 52 -13.144 13.571 3.934 447 HE2 LYS 52 HE2 LYS 52 -12.273 11.747 5.257 448 HE3 LYS 52 HE3 LYS 52 -12.078 12.785 6.675 449 HZ1 LYS 52 HZ1 LYS 52 -14.710 12.290 5.399 450 HZ2 LYS 52 HZ2 LYS 52 -14.159 11.368 6.607 451 HZ3 LYS 52 HZ3 LYS 52 -14.451 12.972 6.862 452 H GLY 53 H GLY 53 -12.639 13.428 1.436 453 HA2 GLY 53 HA2 GLY 53 -13.005 15.077 -0.147 454 HA3 GLY 53 HA3 GLY 53 -11.518 15.815 0.448 455 H LYS 54 H LYS 54 -12.267 12.890 -1.462 456 HA LYS 54 HA LYS 54 -11.487 12.003 -3.393 457 HB2 LYS 54 HB2 LYS 54 -11.016 14.855 -4.308 458 HB3 LYS 54 HB3 LYS 54 -11.019 13.419 -5.335 459 HG2 LYS 54 HG2 LYS 54 -13.364 12.947 -4.709 460 HG3 LYS 54 HG3 LYS 54 -13.416 14.428 -3.745 461 HD2 LYS 54 HD2 LYS 54 -12.898 14.291 -6.746 462 HD3 LYS 54 HD3 LYS 54 -14.448 14.678 -5.983 463 HE2 LYS 54 HE2 LYS 54 -13.406 16.652 -4.874 464 HE3 LYS 54 HE3 LYS 54 -11.876 16.294 -5.685 465 HZ1 LYS 54 HZ1 LYS 54 -13.148 17.964 -6.899 466 HZ2 LYS 54 HZ2 LYS 54 -13.007 16.626 -7.820 467 HZ3 LYS 54 HZ3 LYS 54 -14.421 16.960 -7.070 468 H THR 55 H THR 55 -9.664 12.552 -1.133 469 HA THR 55 HA THR 55 -7.256 11.550 -2.568 470 HB THR 55 HB THR 55 -7.274 13.107 0.050 471 HG1 THR 55 HG1 THR 55 -7.539 14.468 -1.706 472 HG21 THR 55 HG21 THR 55 -4.812 13.065 -0.238 473 HG22 THR 55 HG22 THR 55 -5.497 11.458 0.031 474 HG23 THR 55 HG23 THR 55 -5.009 11.948 -1.612 475 H ALA 56 H ALA 56 -6.689 9.537 -1.973 476 HA ALA 56 HA ALA 56 -7.892 8.304 0.474 477 HB1 ALA 56 HB1 ALA 56 -8.438 7.066 -1.577 478 HB2 ALA 56 HB2 ALA 56 -6.704 6.912 -1.948 479 HB3 ALA 56 HB3 ALA 56 -7.378 6.137 -0.504 480 H TYR 57 H TYR 57 -6.449 7.054 1.785 481 HA TYR 57 HA TYR 57 -3.564 7.833 1.695 482 HB2 TYR 57 HB2 TYR 57 -5.406 7.911 4.111 483 HB3 TYR 57 HB3 TYR 57 -3.693 8.290 4.089 484 HD1 TYR 57 HD1 TYR 57 -2.951 10.334 2.663 485 HD2 TYR 57 HD2 TYR 57 -7.019 9.645 3.945 486 HE1 TYR 57 HE1 TYR 57 -3.466 12.757 2.386 487 HE2 TYR 57 HE2 TYR 57 -7.526 12.043 3.637 488 HH TYR 57 HH TYR 57 -5.055 14.401 2.561 489 H ILE 58 H ILE 58 -2.600 5.821 1.377 490 HA ILE 58 HA ILE 58 -3.565 3.464 2.943 491 HB ILE 58 HB ILE 58 -1.204 3.727 1.050 492 HG12 ILE 58 HG12 ILE 58 -2.499 1.939 -0.227 493 HG13 ILE 58 HG13 ILE 58 -3.907 2.345 0.749 494 HG21 ILE 58 HG21 ILE 58 -0.703 2.111 2.856 495 HG22 ILE 58 HG22 ILE 58 -2.251 1.294 2.559 496 HG23 ILE 58 HG23 ILE 58 -0.959 1.285 1.336 497 HD11 ILE 58 HD11 ILE 58 -2.370 4.336 -0.980 498 HD12 ILE 58 HD12 ILE 58 -3.757 3.394 -1.553 499 HD13 ILE 58 HD13 ILE 58 -3.986 4.568 -0.255 500 H LYS 59 H LYS 59 -3.364 4.134 5.075 501 HA LYS 59 HA LYS 59 -0.631 4.860 5.991 502 HB2 LYS 59 HB2 LYS 59 -3.160 4.788 7.661 503 HB3 LYS 59 HB3 LYS 59 -1.586 5.473 8.070 504 HG2 LYS 59 HG2 LYS 59 -1.906 6.916 5.907 505 HG3 LYS 59 HG3 LYS 59 -3.598 6.452 6.017 506 HD2 LYS 59 HD2 LYS 59 -3.714 7.467 8.294 507 HD3 LYS 59 HD3 LYS 59 -1.994 7.920 8.156 508 HE2 LYS 59 HE2 LYS 59 -2.572 9.194 6.046 509 HE3 LYS 59 HE3 LYS 59 -4.280 8.841 6.357 510 HZ1 LYS 59 HZ1 LYS 59 -4.085 10.039 8.458 511 HZ2 LYS 59 HZ2 LYS 59 -2.504 10.375 8.183 512 HZ3 LYS 59 HZ3 LYS 59 -3.659 11.021 7.216 513 H LEU 60 H LEU 60 0.660 3.678 7.125 514 HA LEU 60 HA LEU 60 -0.095 0.888 7.910 515 HB2 LEU 60 HB2 LEU 60 2.352 2.121 6.683 516 HB3 LEU 60 HB3 LEU 60 2.612 0.931 7.953 517 HG LEU 60 HG LEU 60 1.398 -0.771 6.789 518 HD11 LEU 60 HD11 LEU 60 0.920 1.296 4.592 519 HD12 LEU 60 HD12 LEU 60 0.659 -0.455 4.413 520 HD13 LEU 60 HD13 LEU 60 -0.321 0.460 5.556 521 HD21 LEU 60 HD21 LEU 60 3.813 -0.297 6.289 522 HD22 LEU 60 HD22 LEU 60 2.959 -1.116 4.979 523 HD23 LEU 60 HD23 LEU 60 3.305 0.627 4.862 524 H GLU 61 H GLU 61 0.095 0.311 9.991 525 HA GLU 61 HA GLU 61 1.147 2.294 11.979 526 HB2 GLU 61 HB2 GLU 61 -1.601 1.024 12.016 527 HB3 GLU 61 HB3 GLU 61 -0.902 2.082 13.261 528 HG2 GLU 61 HG2 GLU 61 -0.801 3.923 11.577 529 HG3 GLU 61 HG3 GLU 61 -1.656 2.886 10.423 530 H ASP 62 H ASP 62 1.567 1.453 14.098 531 HA ASP 62 HA ASP 62 2.628 -1.217 13.982 532 HB2 ASP 62 HB2 ASP 62 3.584 0.812 15.112 533 HB3 ASP 62 HB3 ASP 62 2.319 0.617 16.349 534 H LYS 63 H LYS 63 2.167 -2.973 15.223 535 HA LYS 63 HA LYS 63 -0.675 -3.385 15.878 536 HB2 LYS 63 HB2 LYS 63 0.044 -5.842 15.881 537 HB3 LYS 63 HB3 LYS 63 0.190 -4.991 14.347 538 HG2 LYS 63 HG2 LYS 63 2.584 -4.685 14.649 539 HG3 LYS 63 HG3 LYS 63 2.528 -5.406 16.263 540 HD2 LYS 63 HD2 LYS 63 2.088 -7.568 15.399 541 HD3 LYS 63 HD3 LYS 63 1.621 -6.930 13.800 542 HE2 LYS 63 HE2 LYS 63 3.952 -6.082 13.486 543 HE3 LYS 63 HE3 LYS 63 4.425 -6.833 15.010 544 HZ1 LYS 63 HZ1 LYS 63 3.993 -8.988 14.067 545 HZ2 LYS 63 HZ2 LYS 63 3.294 -8.364 12.724 546 HZ3 LYS 63 HZ3 LYS 63 4.895 -8.163 12.965 547 H VAL 64 H VAL 64 1.852 -2.405 17.697 548 HA VAL 64 HA VAL 64 0.659 -3.596 20.164 549 HB VAL 64 HB VAL 64 3.577 -3.108 19.476 550 HG11 VAL 64 HG11 VAL 64 2.367 -3.996 22.137 551 HG12 VAL 64 HG12 VAL 64 4.098 -4.039 21.733 552 HG13 VAL 64 HG13 VAL 64 3.267 -2.489 21.840 553 HG21 VAL 64 HG21 VAL 64 2.720 -5.221 18.588 554 HG22 VAL 64 HG22 VAL 64 3.813 -5.535 19.933 555 HG23 VAL 64 HG23 VAL 64 2.056 -5.653 20.179 556 H SER 65 H SER 65 2.372 -0.696 18.801 557 HA SER 65 HA SER 65 1.421 0.867 21.164 558 HB2 SER 65 HB2 SER 65 2.759 2.711 20.164 559 HB3 SER 65 HB3 SER 65 3.721 1.260 20.555 560 HG SER 65 HG SER 65 4.229 2.046 18.504 561 H GLY 66 H GLY 66 0.745 0.432 17.743 562 HA2 GLY 66 HA2 GLY 66 -1.049 1.219 16.483 563 HA3 GLY 66 HA3 GLY 66 -1.611 2.201 17.838 564 H GLU 67 H GLU 67 1.754 2.674 17.238 565 HA GLU 67 HA GLU 67 1.330 5.383 16.426 566 HB2 GLU 67 HB2 GLU 67 3.648 5.662 16.567 567 HB3 GLU 67 HB3 GLU 67 3.192 4.546 17.855 568 HG2 GLU 67 HG2 GLU 67 3.926 2.649 16.302 569 HG3 GLU 67 HG3 GLU 67 4.574 3.876 15.219 570 H LEU 68 H LEU 68 1.992 6.416 14.454 571 HA LEU 68 HA LEU 68 1.404 4.908 12.038 572 HB2 LEU 68 HB2 LEU 68 0.751 7.299 12.398 573 HB3 LEU 68 HB3 LEU 68 2.457 7.740 12.398 574 HG LEU 68 HG LEU 68 2.598 6.806 10.017 575 HD11 LEU 68 HD11 LEU 68 0.500 6.628 8.754 576 HD12 LEU 68 HD12 LEU 68 0.516 5.434 10.049 577 HD13 LEU 68 HD13 LEU 68 -0.446 6.910 10.235 578 HD21 LEU 68 HD21 LEU 68 0.679 9.118 10.512 579 HD22 LEU 68 HD22 LEU 68 2.454 9.219 10.483 580 HD23 LEU 68 HD23 LEU 68 1.572 8.797 9.007 581 H PHE 69 H PHE 69 2.785 3.799 10.791 582 HA PHE 69 HA PHE 69 5.727 4.055 11.121 583 HB2 PHE 69 HB2 PHE 69 4.918 1.812 11.036 584 HB3 PHE 69 HB3 PHE 69 3.941 2.128 9.611 585 HD1 PHE 69 HD1 PHE 69 4.789 1.583 7.469 586 HD2 PHE 69 HD2 PHE 69 7.532 2.192 10.744 587 HE1 PHE 69 HE1 PHE 69 6.689 1.002 5.991 588 HE2 PHE 69 HE2 PHE 69 9.425 1.546 9.271 589 HZ PHE 69 HZ PHE 69 9.007 0.956 6.890 590 H ALA 70 H ALA 70 3.312 4.228 8.455 591 HA ALA 70 HA ALA 70 4.722 6.451 7.173 592 HB1 ALA 70 HB1 ALA 70 5.182 5.216 5.107 593 HB2 ALA 70 HB2 ALA 70 6.021 4.433 6.445 594 HB3 ALA 70 HB3 ALA 70 4.523 3.721 5.806 595 H GLN 71 H GLN 71 3.506 7.326 5.318 596 HA GLN 71 HA GLN 71 0.811 6.195 4.870 597 HB2 GLN 71 HB2 GLN 71 -0.335 8.265 5.201 598 HB3 GLN 71 HB3 GLN 71 0.533 7.826 6.658 599 HG2 GLN 71 HG2 GLN 71 1.067 10.034 6.639 600 HG3 GLN 71 HG3 GLN 71 2.402 9.478 5.648 601 HE21 GLN 71 HE21 GLN 71 1.373 11.952 3.306 602 HE22 GLN 71 HE22 GLN 71 2.703 11.185 4.179 603 H ALA 72 H ALA 72 0.181 6.188 2.816 604 HA ALA 72 HA ALA 72 1.686 7.823 0.808 605 HB1 ALA 72 HB1 ALA 72 0.407 5.094 0.557 606 HB2 ALA 72 HB2 ALA 72 1.128 6.018 -0.773 607 HB3 ALA 72 HB3 ALA 72 2.135 5.470 0.576 608 HA PRO 73 HA PRO 73 -2.532 9.518 0.255 609 HB2 PRO 73 HB2 PRO 73 -1.846 11.961 -0.729 610 HB3 PRO 73 HB3 PRO 73 -1.790 11.568 1.016 611 HG2 PRO 73 HG2 PRO 73 0.492 11.543 -0.965 612 HG3 PRO 73 HG3 PRO 73 0.455 12.279 0.668 613 HD2 PRO 73 HD2 PRO 73 1.524 9.805 0.201 614 HD3 PRO 73 HD3 PRO 73 0.670 10.180 1.720 615 H VAL 74 H VAL 74 -3.754 9.449 -1.536 616 HA VAL 74 HA VAL 74 -2.541 9.093 -4.253 617 HB VAL 74 HB VAL 74 -4.896 7.487 -3.194 618 HG11 VAL 74 HG11 VAL 74 -4.656 7.602 -5.625 619 HG12 VAL 74 HG12 VAL 74 -2.976 7.026 -5.513 620 HG13 VAL 74 HG13 VAL 74 -4.325 5.968 -5.051 621 HG21 VAL 74 HG21 VAL 74 -3.103 6.804 -1.732 622 HG22 VAL 74 HG22 VAL 74 -3.419 5.545 -2.921 623 HG23 VAL 74 HG23 VAL 74 -1.998 6.592 -3.106 624 H GLU 75 H GLU 75 -3.505 10.468 -5.731 625 HA GLU 75 HA GLU 75 -5.961 11.930 -4.918 626 HB2 GLU 75 HB2 GLU 75 -4.090 12.245 -7.294 627 HB3 GLU 75 HB3 GLU 75 -5.493 13.270 -6.962 628 HG2 GLU 75 HG2 GLU 75 -4.507 13.895 -4.757 629 HG3 GLU 75 HG3 GLU 75 -3.070 12.945 -5.139 630 H GLN 76 H GLN 76 -5.132 9.347 -7.075 631 HA GLN 76 HA GLN 76 -7.870 8.630 -7.453 632 HB2 GLN 76 HB2 GLN 76 -8.094 8.725 -9.803 633 HB3 GLN 76 HB3 GLN 76 -7.674 10.342 -9.283 634 HG2 GLN 76 HG2 GLN 76 -5.829 8.342 -10.657 635 HG3 GLN 76 HG3 GLN 76 -6.586 9.738 -11.389 636 HE21 GLN 76 HE21 GLN 76 -3.148 10.238 -9.244 637 HE22 GLN 76 HE22 GLN 76 -4.034 8.702 -9.158 638 H TYR 77 H TYR 77 -8.067 6.447 -8.181 639 HA TYR 77 HA TYR 77 -5.518 4.939 -8.466 640 HB2 TYR 77 HB2 TYR 77 -6.533 4.631 -6.252 641 HB3 TYR 77 HB3 TYR 77 -8.015 4.065 -7.027 642 HD1 TYR 77 HD1 TYR 77 -4.321 3.346 -7.154 643 HD2 TYR 77 HD2 TYR 77 -8.329 1.761 -7.115 644 HE1 TYR 77 HE1 TYR 77 -3.414 1.042 -7.353 645 HE2 TYR 77 HE2 TYR 77 -7.413 -0.556 -7.200 646 HH TYR 77 HH TYR 77 -3.892 -1.195 -7.436 647 HA PRO 78 HA PRO 78 -4.595 3.196 -9.689 648 HB2 PRO 78 HB2 PRO 78 -4.395 3.416 -12.677 649 HB3 PRO 78 HB3 PRO 78 -3.664 2.208 -11.574 650 HG2 PRO 78 HG2 PRO 78 -5.854 1.558 -13.021 651 HG3 PRO 78 HG3 PRO 78 -5.774 1.097 -11.286 652 HD2 PRO 78 HD2 PRO 78 -7.149 3.512 -12.521 653 HD3 PRO 78 HD3 PRO 78 -7.805 2.323 -11.357 654 H GLY 79 H GLY 79 -2.737 4.429 -9.585 655 HA2 GLY 79 HA2 GLY 79 -2.326 6.929 -11.052 656 HA3 GLY 79 HA3 GLY 79 -2.679 7.129 -9.331 657 H ILE 80 H ILE 80 -0.428 8.119 -9.435 658 HA ILE 80 HA ILE 80 1.846 6.398 -9.898 659 HB ILE 80 HB ILE 80 2.034 8.777 -10.217 660 HG12 ILE 80 HG12 ILE 80 3.820 7.887 -7.909 661 HG13 ILE 80 HG13 ILE 80 4.021 7.386 -9.591 662 HG21 ILE 80 HG21 ILE 80 0.490 9.547 -8.378 663 HG22 ILE 80 HG22 ILE 80 1.766 9.172 -7.199 664 HG23 ILE 80 HG23 ILE 80 2.013 10.421 -8.431 665 HD11 ILE 80 HD11 ILE 80 4.431 9.765 -10.216 666 HD12 ILE 80 HD12 ILE 80 4.317 10.209 -8.491 667 HD13 ILE 80 HD13 ILE 80 5.599 9.122 -9.038 668 H ALA 81 H ALA 81 0.035 7.168 -6.952 669 HA ALA 81 HA ALA 81 2.208 6.278 -5.222 670 HB1 ALA 81 HB1 ALA 81 0.704 7.099 -3.434 671 HB2 ALA 81 HB2 ALA 81 0.942 8.294 -4.720 672 HB3 ALA 81 HB3 ALA 81 -0.566 7.365 -4.652 673 H VAL 82 H VAL 82 0.363 4.323 -6.898 674 HA VAL 82 HA VAL 82 0.514 2.160 -4.935 675 HB VAL 82 HB VAL 82 -2.120 2.750 -6.281 676 HG11 VAL 82 HG11 VAL 82 -1.337 0.707 -4.132 677 HG12 VAL 82 HG12 VAL 82 -2.978 0.940 -4.759 678 HG13 VAL 82 HG13 VAL 82 -1.710 0.324 -5.821 679 HG21 VAL 82 HG21 VAL 82 -1.944 4.406 -4.547 680 HG22 VAL 82 HG22 VAL 82 -3.114 3.181 -4.077 681 HG23 VAL 82 HG23 VAL 82 -1.497 3.174 -3.347 682 H GLU 83 H GLU 83 1.180 0.367 -5.955 683 HA GLU 83 HA GLU 83 0.533 -0.180 -8.812 684 HB2 GLU 83 HB2 GLU 83 3.306 0.180 -7.641 685 HB3 GLU 83 HB3 GLU 83 3.046 -1.023 -8.902 686 HG2 GLU 83 HG2 GLU 83 2.001 0.743 -10.336 687 HG3 GLU 83 HG3 GLU 83 2.496 1.947 -9.137 688 H THR 84 H THR 84 0.982 -2.377 -9.470 689 HA THR 84 HA THR 84 0.666 -4.425 -7.302 690 HB THR 84 HB THR 84 -0.314 -5.804 -9.124 691 HG1 THR 84 HG1 THR 84 -0.870 -4.779 -11.050 692 HG21 THR 84 HG21 THR 84 -1.796 -4.481 -7.669 693 HG22 THR 84 HG22 THR 84 -1.691 -3.100 -8.783 694 HG23 THR 84 HG23 THR 84 -2.458 -4.619 -9.302 695 H VAL 85 H VAL 85 1.671 -6.503 -7.654 696 HA VAL 85 HA VAL 85 4.194 -6.516 -9.206 697 HB VAL 85 HB VAL 85 4.621 -8.636 -8.181 698 HG11 VAL 85 HG11 VAL 85 4.861 -7.931 -5.864 699 HG12 VAL 85 HG12 VAL 85 5.160 -6.556 -6.936 700 HG13 VAL 85 HG13 VAL 85 3.621 -6.690 -6.064 701 HG21 VAL 85 HG21 VAL 85 2.285 -9.521 -8.104 702 HG22 VAL 85 HG22 VAL 85 3.128 -9.678 -6.576 703 HG23 VAL 85 HG23 VAL 85 1.922 -8.396 -6.786 704 H THR 86 H THR 86 4.543 -8.561 -10.479 705 HA THR 86 HA THR 86 2.273 -9.075 -12.312 706 HB THR 86 HB THR 86 4.042 -9.826 -13.852 707 HG1 THR 86 HG1 THR 86 5.930 -8.864 -12.012 708 HG21 THR 86 HG21 THR 86 4.643 -7.156 -12.499 709 HG22 THR 86 HG22 THR 86 5.180 -7.646 -14.121 710 HG23 THR 86 HG23 THR 86 3.446 -7.433 -13.773 711 H ASP 87 H ASP 87 4.215 -10.833 -9.993 712 HA ASP 87 HA ASP 87 3.540 -13.432 -11.222 713 HB2 ASP 87 HB2 ASP 87 5.860 -12.813 -10.518 714 HB3 ASP 87 HB3 ASP 87 5.298 -12.835 -8.840 715 H SER 88 H SER 88 2.911 -11.754 -8.120 716 HA SER 88 HA SER 88 0.981 -13.949 -7.389 717 HB2 SER 88 HB2 SER 88 3.139 -14.248 -6.225 718 HB3 SER 88 HB3 SER 88 2.968 -12.633 -5.520 719 HG SER 88 HG SER 88 1.387 -14.959 -5.092 720 H SER 89 H SER 89 -1.001 -13.190 -7.202 721 HA SER 89 HA SER 89 -1.613 -10.439 -7.205 722 HB2 SER 89 HB2 SER 89 -3.490 -12.776 -6.759 723 HB3 SER 89 HB3 SER 89 -3.930 -11.156 -7.340 724 HG SER 89 HG SER 89 -3.677 -12.658 -9.064 725 H ARG 90 H ARG 90 -0.307 -11.213 -4.656 726 HA ARG 90 HA ARG 90 -2.194 -9.914 -2.778 727 HB2 ARG 90 HB2 ARG 90 -1.710 -11.440 -0.976 728 HB3 ARG 90 HB3 ARG 90 -2.479 -12.223 -2.345 729 HG2 ARG 90 HG2 ARG 90 -0.319 -13.150 -3.079 730 HG3 ARG 90 HG3 ARG 90 0.489 -12.343 -1.714 731 HD2 ARG 90 HD2 ARG 90 -0.932 -13.662 -0.133 732 HD3 ARG 90 HD3 ARG 90 -1.705 -14.451 -1.511 733 HE ARG 90 HE ARG 90 0.167 -15.784 -1.836 734 HH11 ARG 90 HH11 ARG 90 2.262 -16.502 -1.575 735 HH12 ARG 90 HH12 ARG 90 3.322 -15.678 -0.468 736 HH21 ARG 90 HH21 ARG 90 1.054 -13.329 0.538 737 HH22 ARG 90 HH22 ARG 90 2.721 -13.849 0.514 738 H TYR 91 H TYR 91 0.092 -8.861 -4.295 739 HA TYR 91 HA TYR 91 1.568 -7.636 -2.038 740 HB2 TYR 91 HB2 TYR 91 2.758 -8.868 -4.539 741 HB3 TYR 91 HB3 TYR 91 3.632 -7.804 -3.471 742 HD1 TYR 91 HD1 TYR 91 4.408 -8.556 -1.272 743 HD2 TYR 91 HD2 TYR 91 2.212 -11.184 -3.891 744 HE1 TYR 91 HE1 TYR 91 5.090 -10.504 0.108 745 HE2 TYR 91 HE2 TYR 91 2.899 -13.131 -2.518 746 HH TYR 91 HH TYR 91 5.042 -12.769 0.358 747 H PHE 92 H PHE 92 2.059 -5.487 -2.328 748 HA PHE 92 HA PHE 92 1.506 -4.162 -4.937 749 HB2 PHE 92 HB2 PHE 92 0.385 -3.231 -2.265 750 HB3 PHE 92 HB3 PHE 92 0.208 -2.407 -3.802 751 HD1 PHE 92 HD1 PHE 92 -0.937 -5.155 -1.708 752 HD2 PHE 92 HD2 PHE 92 -1.282 -3.324 -5.583 753 HE1 PHE 92 HE1 PHE 92 -2.999 -6.427 -2.103 754 HE2 PHE 92 HE2 PHE 92 -3.338 -4.674 -6.026 755 HZ PHE 92 HZ PHE 92 -4.196 -6.235 -4.301 756 H VAL 93 H VAL 93 2.318 -1.955 -5.000 757 HA VAL 93 HA VAL 93 4.390 -1.280 -2.956 758 HB VAL 93 HB VAL 93 4.518 -0.846 -5.951 759 HG11 VAL 93 HG11 VAL 93 6.348 0.371 -3.842 760 HG12 VAL 93 HG12 VAL 93 6.614 0.396 -5.596 761 HG13 VAL 93 HG13 VAL 93 5.236 1.255 -4.914 762 HG21 VAL 93 HG21 VAL 93 5.327 -2.991 -5.190 763 HG22 VAL 93 HG22 VAL 93 6.721 -2.007 -5.646 764 HG23 VAL 93 HG23 VAL 93 6.338 -2.231 -3.940 765 H ILE 94 H ILE 94 4.312 0.826 -2.151 766 HA ILE 94 HA ILE 94 2.407 2.661 -3.461 767 HB ILE 94 HB ILE 94 1.442 3.440 -1.441 768 HG12 ILE 94 HG12 ILE 94 3.243 2.665 0.180 769 HG13 ILE 94 HG13 ILE 94 1.577 2.535 0.702 770 HG21 ILE 94 HG21 ILE 94 -0.162 1.653 -1.039 771 HG22 ILE 94 HG22 ILE 94 0.226 1.835 -2.753 772 HG23 ILE 94 HG23 ILE 94 0.906 0.482 -1.847 773 HD11 ILE 94 HD11 ILE 94 2.901 0.604 1.415 774 HD12 ILE 94 HD12 ILE 94 1.596 0.105 0.337 775 HD13 ILE 94 HD13 ILE 94 3.262 0.182 -0.265 776 H ARG 95 H ARG 95 2.726 4.827 -3.208 777 HA ARG 95 HA ARG 95 5.546 5.576 -2.576 778 HB2 ARG 95 HB2 ARG 95 4.474 6.294 -4.740 779 HB3 ARG 95 HB3 ARG 95 3.406 7.345 -3.793 780 HG2 ARG 95 HG2 ARG 95 5.461 8.446 -2.823 781 HG3 ARG 95 HG3 ARG 95 6.447 7.485 -3.936 782 HD2 ARG 95 HD2 ARG 95 5.322 8.551 -5.857 783 HD3 ARG 95 HD3 ARG 95 4.234 9.414 -4.752 784 HE ARG 95 HE ARG 95 7.119 9.869 -4.312 785 HH11 ARG 95 HH11 ARG 95 7.852 11.860 -4.265 786 HH12 ARG 95 HH12 ARG 95 6.996 13.168 -5.052 787 HH21 ARG 95 HH21 ARG 95 4.321 11.188 -5.972 788 HH22 ARG 95 HH22 ARG 95 5.003 12.790 -5.982 789 H ILE 96 H ILE 96 5.521 5.414 -0.338 790 HA ILE 96 HA ILE 96 3.687 7.053 1.243 791 HB ILE 96 HB ILE 96 4.867 6.492 3.194 792 HG12 ILE 96 HG12 ILE 96 6.736 4.566 2.813 793 HG13 ILE 96 HG13 ILE 96 7.060 5.520 1.377 794 HG21 ILE 96 HG21 ILE 96 4.433 4.079 1.425 795 HG22 ILE 96 HG22 ILE 96 4.521 4.055 3.190 796 HG23 ILE 96 HG23 ILE 96 3.216 4.932 2.411 797 HD11 ILE 96 HD11 ILE 96 7.421 7.526 2.854 798 HD12 ILE 96 HD12 ILE 96 7.063 6.507 4.269 799 HD13 ILE 96 HD13 ILE 96 8.489 6.175 3.274 800 H GLN 97 H GLN 97 4.042 8.975 2.252 801 HA GLN 97 HA GLN 97 6.277 10.657 1.202 802 HB2 GLN 97 HB2 GLN 97 3.288 11.055 0.918 803 HB3 GLN 97 HB3 GLN 97 4.399 12.422 0.858 804 HG2 GLN 97 HG2 GLN 97 5.379 11.788 -1.125 805 HG3 GLN 97 HG3 GLN 97 4.981 10.076 -0.945 806 HE21 GLN 97 HE21 GLN 97 1.878 10.331 -2.616 807 HE22 GLN 97 HE22 GLN 97 3.001 9.288 -1.747 808 H ASP 98 H ASP 98 6.806 12.453 2.347 809 HA ASP 98 HA ASP 98 6.125 12.325 5.229 810 HB2 ASP 98 HB2 ASP 98 8.471 12.199 4.328 811 HB3 ASP 98 HB3 ASP 98 8.299 13.868 3.793 812 H GLY 99 H GLY 99 4.542 13.781 2.928 813 HA2 GLY 99 HA2 GLY 99 2.942 15.455 2.983 814 HA3 GLY 99 HA3 GLY 99 3.514 15.947 4.576 815 H THR 100 H THR 100 6.159 15.958 2.564 816 HA THR 100 HA THR 100 5.867 18.841 1.799 817 HB THR 100 HB THR 100 7.179 18.385 3.860 818 HG1 THR 100 HG1 THR 100 8.804 19.795 3.318 819 HG21 THR 100 HG21 THR 100 9.454 17.534 3.709 820 HG22 THR 100 HG22 THR 100 8.317 16.292 3.180 821 HG23 THR 100 HG23 THR 100 9.265 17.203 1.977 822 H GLY 101 H GLY 101 6.039 15.925 0.375 823 HA2 GLY 101 HA2 GLY 101 6.218 15.594 -1.977 824 HA3 GLY 101 HA3 GLY 101 7.344 16.944 -2.105 825 H ARG 102 H ARG 102 8.519 15.464 0.478 826 HA ARG 102 HA ARG 102 10.565 13.753 -0.674 827 HB2 ARG 102 HB2 ARG 102 11.050 15.105 1.252 828 HB3 ARG 102 HB3 ARG 102 9.602 14.543 2.090 829 HG2 ARG 102 HG2 ARG 102 10.572 12.250 2.191 830 HG3 ARG 102 HG3 ARG 102 12.085 12.892 1.506 831 HD2 ARG 102 HD2 ARG 102 10.690 13.808 4.046 832 HD3 ARG 102 HD3 ARG 102 12.070 12.705 4.015 833 HE ARG 102 HE ARG 102 13.306 14.660 2.875 834 HH11 ARG 102 HH11 ARG 102 14.162 16.577 3.528 835 HH12 ARG 102 HH12 ARG 102 13.419 17.478 4.814 836 HH21 ARG 102 HH21 ARG 102 10.845 15.274 5.378 837 HH22 ARG 102 HH22 ARG 102 11.630 16.761 5.822 838 H SER 103 H SER 103 10.383 11.691 -0.977 839 HA SER 103 HA SER 103 8.216 10.045 0.209 840 HB2 SER 103 HB2 SER 103 7.438 9.294 -1.994 841 HB3 SER 103 HB3 SER 103 7.232 11.034 -1.787 842 HG SER 103 HG SER 103 9.482 9.926 -3.135 843 H ALA 104 H ALA 104 8.247 7.801 -0.276 844 HA ALA 104 HA ALA 104 10.581 6.668 -1.672 845 HB1 ALA 104 HB1 ALA 104 9.708 5.738 1.101 846 HB2 ALA 104 HB2 ALA 104 10.924 4.953 0.072 847 HB3 ALA 104 HB3 ALA 104 11.228 6.578 0.716 848 H PHE 105 H PHE 105 10.104 4.722 -2.728 849 HA PHE 105 HA PHE 105 7.246 3.847 -2.764 850 HB2 PHE 105 HB2 PHE 105 9.568 3.384 -4.648 851 HB3 PHE 105 HB3 PHE 105 8.116 2.403 -4.676 852 HD1 PHE 105 HD1 PHE 105 9.409 5.860 -5.271 853 HD2 PHE 105 HD2 PHE 105 6.025 3.205 -5.557 854 HE1 PHE 105 HE1 PHE 105 8.270 7.461 -6.780 855 HE2 PHE 105 HE2 PHE 105 4.898 4.788 -7.073 856 HZ PHE 105 HZ PHE 105 6.027 6.922 -7.708 857 H ILE 106 H ILE 106 6.730 2.308 -1.367 858 HA ILE 106 HA ILE 106 8.785 0.272 -0.575 859 HB ILE 106 HB ILE 106 7.882 0.104 1.587 860 HG12 ILE 106 HG12 ILE 106 5.814 2.240 0.924 861 HG13 ILE 106 HG13 ILE 106 5.473 0.518 1.095 862 HG21 ILE 106 HG21 ILE 106 8.192 3.073 1.001 863 HG22 ILE 106 HG22 ILE 106 8.586 2.224 2.512 864 HG23 ILE 106 HG23 ILE 106 9.544 1.920 1.059 865 HD11 ILE 106 HD11 ILE 106 6.444 2.322 3.332 866 HD12 ILE 106 HD12 ILE 106 4.839 1.605 3.130 867 HD13 ILE 106 HD13 ILE 106 6.236 0.563 3.445 868 H GLY 107 H GLY 107 8.171 -1.881 -0.365 869 HA2 GLY 107 HA2 GLY 107 5.728 -2.660 -1.875 870 HA3 GLY 107 HA3 GLY 107 7.104 -3.693 -1.495 871 H ILE 108 H ILE 108 4.109 -3.825 -0.933 872 HA ILE 108 HA ILE 108 4.415 -4.739 1.852 873 HB ILE 108 HB ILE 108 2.091 -4.249 2.361 874 HG12 ILE 108 HG12 ILE 108 2.035 -2.425 -0.080 875 HG13 ILE 108 HG13 ILE 108 1.222 -3.986 0.014 876 HG21 ILE 108 HG21 ILE 108 3.790 -1.810 1.722 877 HG22 ILE 108 HG22 ILE 108 2.476 -1.893 2.911 878 HG23 ILE 108 HG23 ILE 108 3.928 -2.868 3.144 879 HD11 ILE 108 HD11 ILE 108 0.592 -1.561 1.754 880 HD12 ILE 108 HD12 ILE 108 -0.399 -2.272 0.475 881 HD13 ILE 108 HD13 ILE 108 -0.113 -3.172 1.974 882 H GLY 109 H GLY 109 3.629 -6.674 2.359 883 HA2 GLY 109 HA2 GLY 109 2.335 -8.303 0.190 884 HA3 GLY 109 HA3 GLY 109 3.518 -8.935 1.325 885 H PHE 110 H PHE 110 0.651 -9.528 0.617 886 HA PHE 110 HA PHE 110 -0.611 -9.490 3.320 887 HB2 PHE 110 HB2 PHE 110 -1.778 -9.779 0.527 888 HB3 PHE 110 HB3 PHE 110 -2.690 -10.030 1.998 889 HD1 PHE 110 HD1 PHE 110 -0.597 -7.418 0.244 890 HD2 PHE 110 HD2 PHE 110 -3.804 -8.240 3.011 891 HE1 PHE 110 HE1 PHE 110 -1.049 -4.989 0.457 892 HE2 PHE 110 HE2 PHE 110 -4.319 -5.818 3.120 893 HZ PHE 110 HZ PHE 110 -2.914 -4.192 1.856 894 H THR 111 H THR 111 -1.648 -11.410 4.055 895 HA THR 111 HA THR 111 -0.059 -13.791 3.612 896 HB THR 111 HB THR 111 -0.989 -13.016 5.789 897 HG1 THR 111 HG1 THR 111 -1.367 -15.098 6.501 898 HG21 THR 111 HG21 THR 111 -3.615 -14.249 4.859 899 HG22 THR 111 HG22 THR 111 -3.237 -13.609 6.470 900 HG23 THR 111 HG23 THR 111 -3.333 -12.510 5.088 901 H ASP 112 H ASP 112 -3.007 -12.613 2.190 902 HA ASP 112 HA ASP 112 -3.255 -14.984 0.529 903 HB2 ASP 112 HB2 ASP 112 -4.519 -15.568 2.648 904 HB3 ASP 112 HB3 ASP 112 -5.585 -14.200 2.331 905 H ARG 113 H ARG 113 -4.582 -14.659 -1.310 906 HA ARG 113 HA ARG 113 -4.669 -12.007 -2.377 907 HB2 ARG 113 HB2 ARG 113 -4.458 -14.092 -3.676 908 HB3 ARG 113 HB3 ARG 113 -6.122 -14.533 -3.292 909 HG2 ARG 113 HG2 ARG 113 -5.582 -11.838 -4.540 910 HG3 ARG 113 HG3 ARG 113 -5.405 -13.277 -5.552 911 HD2 ARG 113 HD2 ARG 113 -7.740 -13.952 -5.020 912 HD3 ARG 113 HD3 ARG 113 -7.934 -12.496 -4.051 913 HE ARG 113 HE ARG 113 -7.873 -11.129 -5.972 914 HH11 ARG 113 HH11 ARG 113 -8.398 -10.729 -8.051 915 HH12 ARG 113 HH12 ARG 113 -8.488 -12.028 -9.209 916 HH21 ARG 113 HH21 ARG 113 -7.663 -14.491 -6.966 917 HH22 ARG 113 HH22 ARG 113 -8.078 -14.109 -8.613 918 H GLY 114 H GLY 114 -7.147 -13.836 -0.600 919 HA2 GLY 114 HA2 GLY 114 -9.383 -12.161 -1.217 920 HA3 GLY 114 HA3 GLY 114 -9.196 -13.195 0.204 921 H ASP 115 H ASP 115 -6.629 -11.511 0.844 922 HA ASP 115 HA ASP 115 -8.063 -9.314 2.287 923 HB2 ASP 115 HB2 ASP 115 -5.296 -10.508 2.680 924 HB3 ASP 115 HB3 ASP 115 -5.949 -9.139 3.582 925 H ALA 116 H ALA 116 -5.377 -9.864 0.016 926 HA ALA 116 HA ALA 116 -4.741 -7.135 -0.563 927 HB1 ALA 116 HB1 ALA 116 -3.983 -8.250 -2.748 928 HB2 ALA 116 HB2 ALA 116 -3.325 -8.919 -1.233 929 HB3 ALA 116 HB3 ALA 116 -4.631 -9.756 -2.111 930 H PHE 117 H PHE 117 -7.351 -9.250 -1.691 931 HA PHE 117 HA PHE 117 -8.560 -7.058 -3.265 932 HB2 PHE 117 HB2 PHE 117 -9.069 -10.009 -3.135 933 HB3 PHE 117 HB3 PHE 117 -10.282 -8.919 -3.775 934 HD1 PHE 117 HD1 PHE 117 -6.568 -9.586 -4.157 935 HD2 PHE 117 HD2 PHE 117 -10.239 -8.278 -6.015 936 HE1 PHE 117 HE1 PHE 117 -5.384 -9.321 -6.310 937 HE2 PHE 117 HE2 PHE 117 -9.044 -8.015 -8.172 938 HZ PHE 117 HZ PHE 117 -6.613 -8.531 -8.325 939 H ASP 118 H ASP 118 -8.418 -7.191 -0.175 940 HA ASP 118 HA ASP 118 -10.921 -5.547 -0.230 941 HB2 ASP 118 HB2 ASP 118 -9.264 -6.445 2.149 942 HB3 ASP 118 HB3 ASP 118 -10.385 -5.090 2.197 943 H PHE 119 H PHE 119 -7.331 -5.478 0.232 944 HA PHE 119 HA PHE 119 -7.001 -2.721 0.538 945 HB2 PHE 119 HB2 PHE 119 -5.183 -4.228 0.848 946 HB3 PHE 119 HB3 PHE 119 -5.249 -4.798 -0.806 947 HD1 PHE 119 HD1 PHE 119 -4.415 -3.419 -2.696 948 HD2 PHE 119 HD2 PHE 119 -4.004 -2.146 1.391 949 HE1 PHE 119 HE1 PHE 119 -2.844 -1.645 -3.411 950 HE2 PHE 119 HE2 PHE 119 -2.442 -0.371 0.681 951 HZ PHE 119 HZ PHE 119 -1.853 -0.107 -1.726 952 H ASN 120 H ASN 120 -6.874 -4.410 -2.660 953 HA ASN 120 HA ASN 120 -6.785 -1.797 -3.967 954 HB2 ASN 120 HB2 ASN 120 -6.383 -2.868 -5.960 955 HB3 ASN 120 HB3 ASN 120 -5.563 -3.877 -4.776 956 HD21 ASN 120 HD21 ASN 120 -7.621 -6.699 -5.557 957 HD22 ASN 120 HD22 ASN 120 -6.647 -6.012 -4.259 958 H VAL 121 H VAL 121 -9.355 -3.932 -3.119 959 HA VAL 121 HA VAL 121 -11.214 -2.894 -5.119 960 HB VAL 121 HB VAL 121 -11.612 -4.751 -2.762 961 HG11 VAL 121 HG11 VAL 121 -13.767 -3.666 -3.256 962 HG12 VAL 121 HG12 VAL 121 -13.561 -3.999 -4.991 963 HG13 VAL 121 HG13 VAL 121 -13.789 -5.331 -3.837 964 HG21 VAL 121 HG21 VAL 121 -11.817 -6.476 -4.550 965 HG22 VAL 121 HG22 VAL 121 -11.463 -5.242 -5.777 966 HG23 VAL 121 HG23 VAL 121 -10.231 -5.704 -4.586 967 H SER 122 H SER 122 -10.642 -2.390 -1.600 968 HA SER 122 HA SER 122 -12.785 -0.511 -1.240 969 HB2 SER 122 HB2 SER 122 -11.667 0.104 0.802 970 HB3 SER 122 HB3 SER 122 -11.623 -1.660 0.611 971 HG SER 122 HG SER 122 -9.520 -1.577 0.081 972 H LEU 123 H LEU 123 -9.454 -0.096 -2.410 973 HA LEU 123 HA LEU 123 -9.538 2.781 -2.584 974 HB2 LEU 123 HB2 LEU 123 -7.870 0.638 -3.940 975 HB3 LEU 123 HB3 LEU 123 -7.638 2.353 -4.268 976 HG LEU 123 HG LEU 123 -7.415 1.153 -1.475 977 HD11 LEU 123 HD11 LEU 123 -5.219 1.858 -3.474 978 HD12 LEU 123 HD12 LEU 123 -4.983 1.301 -1.798 979 HD13 LEU 123 HD13 LEU 123 -5.695 0.217 -2.990 980 HD21 LEU 123 HD21 LEU 123 -6.537 3.843 -2.624 981 HD22 LEU 123 HD22 LEU 123 -7.858 3.580 -1.462 982 HD23 LEU 123 HD23 LEU 123 -6.194 3.251 -0.985 983 H GLN 124 H GLN 124 -10.083 0.286 -5.185 984 HA GLN 124 HA GLN 124 -10.777 2.328 -7.076 985 HB2 GLN 124 HB2 GLN 124 -11.251 0.615 -8.602 986 HB3 GLN 124 HB3 GLN 124 -9.940 0.019 -7.583 987 HG2 GLN 124 HG2 GLN 124 -11.734 -1.185 -6.227 988 HG3 GLN 124 HG3 GLN 124 -12.861 -0.811 -7.530 989 HE21 GLN 124 HE21 GLN 124 -9.817 -3.559 -8.119 990 HE22 GLN 124 HE22 GLN 124 -9.674 -2.349 -6.856 991 H ASP 125 H ASP 125 -12.788 0.645 -4.699 992 HA ASP 125 HA ASP 125 -15.265 1.743 -5.788 993 HB2 ASP 125 HB2 ASP 125 -15.119 -0.498 -4.700 994 HB3 ASP 125 HB3 ASP 125 -14.738 0.298 -3.168 995 H HIS 126 H HIS 126 -12.747 3.121 -4.021 996 HA HIS 126 HA HIS 126 -14.513 5.161 -2.786 997 HB2 HIS 126 HB2 HIS 126 -12.604 4.454 -1.454 998 HB3 HIS 126 HB3 HIS 126 -11.490 4.834 -2.768 999 HD2 HIS 126 HD2 HIS 126 -10.545 7.246 -2.869 1000 HE1 HIS 126 HE1 HIS 126 -13.188 9.160 -0.122 1001 HE2 HIS 126 HE2 HIS 126 -11.108 9.465 -1.569 1002 H PHE 127 H PHE 127 -12.453 4.704 -5.617 1003 HA PHE 127 HA PHE 127 -12.852 7.543 -6.376 1004 HB2 PHE 127 HB2 PHE 127 -10.985 5.400 -7.401 1005 HB3 PHE 127 HB3 PHE 127 -11.122 7.001 -8.111 1006 HD1 PHE 127 HD1 PHE 127 -9.352 5.113 -5.709 1007 HD2 PHE 127 HD2 PHE 127 -10.946 9.050 -6.402 1008 HE1 PHE 127 HE1 PHE 127 -7.613 6.063 -4.225 1009 HE2 PHE 127 HE2 PHE 127 -9.225 10.007 -4.887 1010 HZ PHE 127 HZ PHE 127 -7.547 8.520 -3.816 1011 H LYS 128 H LYS 128 -14.533 4.683 -7.143 1012 HA LYS 128 HA LYS 128 -14.894 4.899 -9.866 1013 HB2 LYS 128 HB2 LYS 128 -16.721 3.533 -9.789 1014 HB3 LYS 128 HB3 LYS 128 -15.753 3.051 -8.413 1015 HG2 LYS 128 HG2 LYS 128 -18.236 4.849 -8.254 1016 HG3 LYS 128 HG3 LYS 128 -18.234 3.097 -8.056 1017 HD2 LYS 128 HD2 LYS 128 -16.703 3.308 -6.136 1018 HD3 LYS 128 HD3 LYS 128 -16.722 5.065 -6.294 1019 HE2 LYS 128 HE2 LYS 128 -18.230 4.558 -4.565 1020 HE3 LYS 128 HE3 LYS 128 -19.212 5.013 -5.968 1021 HZ1 LYS 128 HZ1 LYS 128 -18.617 2.203 -5.151 1022 HZ2 LYS 128 HZ2 LYS 128 -20.014 2.982 -4.793 1023 HZ3 LYS 128 HZ3 LYS 128 -19.639 2.649 -6.347 1024 H TRP 129 H TRP 129 -16.367 7.057 -7.569 1025 HA TRP 129 HA TRP 129 -18.172 8.279 -9.553 1026 HB2 TRP 129 HB2 TRP 129 -18.869 9.713 -7.753 1027 HB3 TRP 129 HB3 TRP 129 -18.876 8.040 -7.226 1028 HD1 TRP 129 HD1 TRP 129 -16.761 7.293 -5.609 1029 HE1 TRP 129 HE1 TRP 129 -15.328 8.591 -3.983 1030 HE3 TRP 129 HE3 TRP 129 -18.065 12.057 -7.006 1031 HZ2 TRP 129 HZ2 TRP 129 -15.134 11.344 -3.038 1032 HZ3 TRP 129 HZ3 TRP 129 -17.297 13.997 -5.661 1033 HH2 TRP 129 HH2 TRP 129 -15.857 13.655 -3.667 1034 H VAL 130 H VAL 130 -14.926 8.811 -8.405 1035 HA VAL 130 HA VAL 130 -14.682 11.558 -9.438 1036 HB VAL 130 HB VAL 130 -12.510 9.662 -8.452 1037 HG11 VAL 130 HG11 VAL 130 -12.569 12.696 -8.746 1038 HG12 VAL 130 HG12 VAL 130 -11.259 11.757 -7.994 1039 HG13 VAL 130 HG13 VAL 130 -11.596 11.566 -9.713 1040 HG21 VAL 130 HG21 VAL 130 -14.088 9.970 -6.620 1041 HG22 VAL 130 HG22 VAL 130 -12.658 10.947 -6.305 1042 HG23 VAL 130 HG23 VAL 130 -14.140 11.722 -6.907 1043 H LYS 131 H LYS 131 -14.039 8.268 -10.494 1044 HA LYS 131 HA LYS 131 -12.661 9.121 -12.989 1045 HB2 LYS 131 HB2 LYS 131 -13.022 6.416 -11.644 1046 HB3 LYS 131 HB3 LYS 131 -12.183 6.653 -13.170 1047 HG2 LYS 131 HG2 LYS 131 -11.294 7.847 -10.503 1048 HG3 LYS 131 HG3 LYS 131 -10.654 6.404 -11.278 1049 HD2 LYS 131 HD2 LYS 131 -9.080 7.891 -12.002 1050 HD3 LYS 131 HD3 LYS 131 -10.224 8.019 -13.337 1051 HE2 LYS 131 HE2 LYS 131 -11.252 10.007 -11.966 1052 HE3 LYS 131 HE3 LYS 131 -9.777 9.931 -11.005 1053 HZ1 LYS 131 HZ1 LYS 131 -9.547 11.508 -12.835 1054 HZ2 LYS 131 HZ2 LYS 131 -8.535 10.254 -13.133 1055 HZ3 LYS 131 HZ3 LYS 131 -9.954 10.380 -13.944 1056 H GLN 132 H GLN 132 -15.467 9.701 -12.678 1057 HA GLN 132 HA GLN 132 -16.796 7.966 -14.642 1058 HB2 GLN 132 HB2 GLN 132 -17.691 10.528 -13.291 1059 HB3 GLN 132 HB3 GLN 132 -18.616 9.641 -14.520 1060 HG2 GLN 132 HG2 GLN 132 -18.613 7.622 -13.078 1061 HG3 GLN 132 HG3 GLN 132 -17.731 8.512 -11.838 1062 HE21 GLN 132 HE21 GLN 132 -21.309 8.572 -10.854 1063 HE22 GLN 132 HE22 GLN 132 -20.076 7.336 -11.073 1064 H GLU 133 H GLU 133 -15.541 8.085 -16.378 1065 HA GLU 133 HA GLU 133 -15.321 10.614 -17.970 1066 HB2 GLU 133 HB2 GLU 133 -13.076 8.657 -17.331 1067 HB3 GLU 133 HB3 GLU 133 -12.997 9.925 -18.559 1068 HG2 GLU 133 HG2 GLU 133 -13.375 11.652 -16.803 1069 HG3 GLU 133 HG3 GLU 133 -13.397 10.387 -15.570 Start of MODEL 7 1 H1 GLY -4 H1 GLY -4 2.059 26.027 11.823 2 H2 GLY -4 H2 GLY -4 1.327 25.577 10.424 3 H3 GLY -4 H3 GLY -4 0.654 25.175 11.863 4 HA2 GLY -4 HA2 GLY -4 0.913 27.899 10.780 5 HA3 GLY -4 HA3 GLY -4 -0.589 26.963 10.921 6 H SER -3 H SER -3 -0.179 29.542 12.062 7 HA SER -3 HA SER -3 0.673 29.443 14.769 8 HB2 SER -3 HB2 SER -3 -1.113 31.476 13.395 9 HB3 SER -3 HB3 SER -3 -0.269 31.703 14.939 10 HG SER -3 HG SER -3 0.906 32.575 13.154 11 HA PRO -2 HA PRO -2 -3.001 27.812 16.738 12 HB2 PRO -2 HB2 PRO -2 -2.571 28.509 19.353 13 HB3 PRO -2 HB3 PRO -2 -1.632 27.244 18.505 14 HG2 PRO -2 HG2 PRO -2 -0.866 30.151 18.933 15 HG3 PRO -2 HG3 PRO -2 0.123 28.688 19.244 16 HD2 PRO -2 HD2 PRO -2 0.376 30.113 16.945 17 HD3 PRO -2 HD3 PRO -2 0.486 28.327 16.937 18 H ASN -1 H ASN -1 -2.138 31.236 17.159 19 HA ASN -1 HA ASN -1 -4.703 32.167 18.072 20 HB2 ASN -1 HB2 ASN -1 -2.478 33.598 16.544 21 HB3 ASN -1 HB3 ASN -1 -3.826 34.389 17.353 22 HD21 ASN -1 HD21 ASN -1 -0.597 33.635 19.533 23 HD22 ASN -1 HD22 ASN -1 -0.611 33.661 17.777 24 H SER 0 H SER 0 -3.640 31.130 14.930 25 HA SER 0 HA SER 0 -5.891 32.450 13.513 26 HB2 SER 0 HB2 SER 0 -3.560 30.839 12.421 27 HB3 SER 0 HB3 SER 0 -4.754 31.752 11.481 28 HG SER 0 HG SER 0 -2.877 32.989 11.760 29 H MET 1 H MET 1 -5.440 29.532 15.126 30 HA MET 1 HA MET 1 -6.261 27.415 14.989 31 HB2 MET 1 HB2 MET 1 -8.701 28.925 13.991 32 HB3 MET 1 HB3 MET 1 -8.707 27.270 14.605 33 HG2 MET 1 HG2 MET 1 -7.846 29.709 16.202 34 HG3 MET 1 HG3 MET 1 -9.426 28.939 16.284 35 HE1 MET 1 HE1 MET 1 -7.665 28.165 19.748 36 HE2 MET 1 HE2 MET 1 -7.376 29.598 18.736 37 HE3 MET 1 HE3 MET 1 -9.031 28.978 18.950 38 H ALA 2 H ALA 2 -4.536 27.458 13.135 39 HA ALA 2 HA ALA 2 -5.731 26.897 10.458 40 HB1 ALA 2 HB1 ALA 2 -3.005 27.998 11.258 41 HB2 ALA 2 HB2 ALA 2 -3.602 27.778 9.598 42 HB3 ALA 2 HB3 ALA 2 -4.393 28.946 10.671 43 H THR 3 H THR 3 -4.281 25.258 12.990 44 HA THR 3 HA THR 3 -3.536 22.941 11.274 45 HB THR 3 HB THR 3 -1.877 23.875 13.637 46 HG1 THR 3 HG1 THR 3 -1.526 24.111 10.836 47 HG21 THR 3 HG21 THR 3 -0.246 22.235 12.723 48 HG22 THR 3 HG22 THR 3 -1.751 21.447 13.222 49 HG23 THR 3 HG23 THR 3 -1.444 21.740 11.498 50 H GLU 4 H GLU 4 -5.722 22.555 11.828 51 HA GLU 4 HA GLU 4 -6.196 21.393 14.540 52 HB2 GLU 4 HB2 GLU 4 -8.442 22.325 14.468 53 HB3 GLU 4 HB3 GLU 4 -7.201 23.584 14.389 54 HG2 GLU 4 HG2 GLU 4 -7.592 24.023 12.090 55 HG3 GLU 4 HG3 GLU 4 -8.508 22.533 11.863 56 H LEU 5 H LEU 5 -5.336 20.017 12.136 57 HA LEU 5 HA LEU 5 -7.378 18.725 10.705 58 HB2 LEU 5 HB2 LEU 5 -4.801 18.994 10.353 59 HB3 LEU 5 HB3 LEU 5 -4.653 17.510 11.282 60 HG LEU 5 HG LEU 5 -6.155 17.924 8.670 61 HD11 LEU 5 HD11 LEU 5 -3.600 16.384 9.281 62 HD12 LEU 5 HD12 LEU 5 -4.387 16.528 7.692 63 HD13 LEU 5 HD13 LEU 5 -3.698 17.962 8.467 64 HD21 LEU 5 HD21 LEU 5 -7.305 16.125 9.810 65 HD22 LEU 5 HD22 LEU 5 -6.279 15.401 8.585 66 HD23 LEU 5 HD23 LEU 5 -5.763 15.364 10.286 67 H GLU 6 H GLU 6 -8.922 17.432 11.453 68 HA GLU 6 HA GLU 6 -8.313 15.164 13.248 69 HB2 GLU 6 HB2 GLU 6 -8.984 17.198 14.626 70 HB3 GLU 6 HB3 GLU 6 -10.555 17.140 13.846 71 HG2 GLU 6 HG2 GLU 6 -10.702 16.104 16.013 72 HG3 GLU 6 HG3 GLU 6 -10.904 14.839 14.815 73 H TYR 7 H TYR 7 -8.553 14.583 10.749 74 HA TYR 7 HA TYR 7 -11.146 13.276 10.418 75 HB2 TYR 7 HB2 TYR 7 -11.522 14.151 8.197 76 HB3 TYR 7 HB3 TYR 7 -11.539 15.447 9.370 77 HD1 TYR 7 HD1 TYR 7 -10.200 17.382 9.024 78 HD2 TYR 7 HD2 TYR 7 -9.349 13.786 6.782 79 HE1 TYR 7 HE1 TYR 7 -8.626 18.645 7.570 80 HE2 TYR 7 HE2 TYR 7 -7.843 15.047 5.310 81 HH TYR 7 HH TYR 7 -7.208 18.565 5.770 82 H GLU 8 H GLU 8 -11.008 11.469 9.168 83 HA GLU 8 HA GLU 8 -9.574 10.977 6.923 84 HB2 GLU 8 HB2 GLU 8 -7.861 10.412 9.293 85 HB3 GLU 8 HB3 GLU 8 -8.056 9.007 8.253 86 HG2 GLU 8 HG2 GLU 8 -7.122 10.031 6.374 87 HG3 GLU 8 HG3 GLU 8 -7.374 11.660 6.982 88 H SER 9 H SER 9 -11.285 9.869 6.133 89 HA SER 9 HA SER 9 -12.865 8.120 7.895 90 HB2 SER 9 HB2 SER 9 -13.223 9.152 5.076 91 HB3 SER 9 HB3 SER 9 -14.337 7.986 5.827 92 HG SER 9 HG SER 9 -14.789 9.462 7.449 93 H VAL 10 H VAL 10 -12.581 6.038 8.090 94 HA VAL 10 HA VAL 10 -10.569 4.642 6.612 95 HB VAL 10 HB VAL 10 -11.069 4.406 9.027 96 HG11 VAL 10 HG11 VAL 10 -13.540 4.149 8.918 97 HG12 VAL 10 HG12 VAL 10 -13.329 2.559 8.154 98 HG13 VAL 10 HG13 VAL 10 -12.753 2.837 9.808 99 HG21 VAL 10 HG21 VAL 10 -9.612 2.806 7.813 100 HG22 VAL 10 HG22 VAL 10 -10.443 2.110 9.209 101 HG23 VAL 10 HG23 VAL 10 -11.021 1.740 7.575 102 H LEU 11 H LEU 11 -10.592 2.741 5.453 103 HA LEU 11 HA LEU 11 -13.051 2.174 3.832 104 HB2 LEU 11 HB2 LEU 11 -10.228 2.760 2.842 105 HB3 LEU 11 HB3 LEU 11 -11.541 2.177 1.830 106 HG LEU 11 HG LEU 11 -11.528 4.866 3.265 107 HD11 LEU 11 HD11 LEU 11 -11.066 4.128 0.348 108 HD12 LEU 11 HD12 LEU 11 -11.257 5.776 0.976 109 HD13 LEU 11 HD13 LEU 11 -9.869 4.801 1.477 110 HD21 LEU 11 HD21 LEU 11 -13.459 5.375 1.805 111 HD22 LEU 11 HD22 LEU 11 -13.441 3.711 1.184 112 HD23 LEU 11 HD23 LEU 11 -13.832 4.036 2.889 113 H CYS 12 H CYS 12 -9.815 1.041 4.863 114 HA CYS 12 HA CYS 12 -10.846 -1.692 5.093 115 HB2 CYS 12 HB2 CYS 12 -10.005 -1.547 2.725 116 HB3 CYS 12 HB3 CYS 12 -8.400 -1.137 3.368 117 HG CYS 12 HG CYS 12 -8.463 -3.639 2.563 118 H VAL 13 H VAL 13 -9.905 -2.747 6.729 119 HA VAL 13 HA VAL 13 -7.266 -1.859 7.768 120 HB VAL 13 HB VAL 13 -9.677 -2.472 9.511 121 HG11 VAL 13 HG11 VAL 13 -7.618 -3.360 10.554 122 HG12 VAL 13 HG12 VAL 13 -6.807 -1.796 10.304 123 HG13 VAL 13 HG13 VAL 13 -8.185 -1.929 11.414 124 HG21 VAL 13 HG21 VAL 13 -9.749 -0.184 8.613 125 HG22 VAL 13 HG22 VAL 13 -9.355 -0.149 10.334 126 HG23 VAL 13 HG23 VAL 13 -8.073 0.090 9.126 127 H LYS 14 H LYS 14 -5.895 -3.475 7.900 128 HA LYS 14 HA LYS 14 -6.855 -6.256 8.328 129 HB2 LYS 14 HB2 LYS 14 -4.678 -5.531 6.334 130 HB3 LYS 14 HB3 LYS 14 -5.134 -7.154 6.801 131 HG2 LYS 14 HG2 LYS 14 -7.003 -5.189 5.401 132 HG3 LYS 14 HG3 LYS 14 -6.033 -6.423 4.596 133 HD2 LYS 14 HD2 LYS 14 -7.208 -8.202 5.837 134 HD3 LYS 14 HD3 LYS 14 -8.216 -6.984 6.649 135 HE2 LYS 14 HE2 LYS 14 -9.100 -6.235 4.480 136 HE3 LYS 14 HE3 LYS 14 -8.063 -7.400 3.642 137 HZ1 LYS 14 HZ1 LYS 14 -10.235 -8.110 5.541 138 HZ2 LYS 14 HZ2 LYS 14 -10.282 -8.299 3.910 139 HZ3 LYS 14 HZ3 LYS 14 -9.234 -9.190 4.811 140 HA PRO 15 HA PRO 15 -3.979 -5.783 11.617 141 HB2 PRO 15 HB2 PRO 15 -3.898 -8.298 12.665 142 HB3 PRO 15 HB3 PRO 15 -5.353 -7.250 12.748 143 HG2 PRO 15 HG2 PRO 15 -4.738 -9.438 10.729 144 HG3 PRO 15 HG3 PRO 15 -6.249 -9.199 11.670 145 HD2 PRO 15 HD2 PRO 15 -5.994 -8.316 9.115 146 HD3 PRO 15 HD3 PRO 15 -6.888 -7.366 10.344 147 H ASP 16 H ASP 16 -3.151 -7.977 9.022 148 HA ASP 16 HA ASP 16 -0.288 -8.030 9.902 149 HB2 ASP 16 HB2 ASP 16 -1.986 -10.287 8.785 150 HB3 ASP 16 HB3 ASP 16 -0.226 -10.306 8.801 151 H VAL 17 H VAL 17 0.696 -6.695 8.622 152 HA VAL 17 HA VAL 17 0.850 -7.366 5.758 153 HB VAL 17 HB VAL 17 -0.780 -5.515 5.868 154 HG11 VAL 17 HG11 VAL 17 1.511 -3.807 6.928 155 HG12 VAL 17 HG12 VAL 17 -0.069 -3.222 6.378 156 HG13 VAL 17 HG13 VAL 17 0.035 -4.257 7.806 157 HG21 VAL 17 HG21 VAL 17 1.835 -4.687 4.569 158 HG22 VAL 17 HG22 VAL 17 0.652 -5.833 3.885 159 HG23 VAL 17 HG23 VAL 17 0.202 -4.143 4.141 160 H SER 18 H SER 18 2.854 -7.167 4.914 161 HA SER 18 HA SER 18 5.070 -6.502 6.831 162 HB2 SER 18 HB2 SER 18 4.898 -8.671 4.710 163 HB3 SER 18 HB3 SER 18 6.279 -8.357 5.781 164 HG SER 18 HG SER 18 4.863 -10.055 6.527 165 H VAL 19 H VAL 19 6.526 -5.034 6.201 166 HA VAL 19 HA VAL 19 6.458 -3.984 3.435 167 HB VAL 19 HB VAL 19 7.619 -2.860 5.980 168 HG11 VAL 19 HG11 VAL 19 7.845 -1.743 3.145 169 HG12 VAL 19 HG12 VAL 19 8.129 -0.802 4.629 170 HG13 VAL 19 HG13 VAL 19 9.180 -2.160 4.248 171 HG21 VAL 19 HG21 VAL 19 5.106 -2.682 5.486 172 HG22 VAL 19 HG22 VAL 19 5.968 -1.155 5.710 173 HG23 VAL 19 HG23 VAL 19 5.552 -1.699 4.076 174 H TYR 20 H TYR 20 7.950 -4.063 2.029 175 HA TYR 20 HA TYR 20 10.711 -4.878 2.787 176 HB2 TYR 20 HB2 TYR 20 9.722 -5.568 0.054 177 HB3 TYR 20 HB3 TYR 20 10.938 -6.345 1.056 178 HD1 TYR 20 HD1 TYR 20 10.194 -7.888 2.927 179 HD2 TYR 20 HD2 TYR 20 7.463 -6.288 0.016 180 HE1 TYR 20 HE1 TYR 20 8.497 -9.581 3.603 181 HE2 TYR 20 HE2 TYR 20 5.777 -8.015 0.647 182 HH TYR 20 HH TYR 20 6.408 -10.449 3.200 183 H ARG 21 H ARG 21 12.036 -3.217 2.398 184 HA ARG 21 HA ARG 21 11.459 -1.046 0.485 185 HB2 ARG 21 HB2 ARG 21 13.718 -1.735 2.344 186 HB3 ARG 21 HB3 ARG 21 14.131 -0.840 0.887 187 HG2 ARG 21 HG2 ARG 21 13.721 0.720 2.676 188 HG3 ARG 21 HG3 ARG 21 12.521 0.911 1.399 189 HD2 ARG 21 HD2 ARG 21 10.891 -0.402 2.805 190 HD3 ARG 21 HD3 ARG 21 12.103 -0.460 4.085 191 HE ARG 21 HE ARG 21 10.938 2.067 2.947 192 HH11 ARG 21 HH11 ARG 21 10.524 3.750 4.283 193 HH12 ARG 21 HH12 ARG 21 10.861 3.619 5.980 194 HH21 ARG 21 HH21 ARG 21 12.088 0.420 5.889 195 HH22 ARG 21 HH22 ARG 21 11.739 1.835 6.837 196 H ILE 22 H ILE 22 11.327 -1.441 -1.569 197 HA ILE 22 HA ILE 22 12.290 -3.917 -2.656 198 HB ILE 22 HB ILE 22 11.077 -3.244 -4.710 199 HG12 ILE 22 HG12 ILE 22 10.403 -0.671 -3.220 200 HG13 ILE 22 HG13 ILE 22 11.427 -0.808 -4.651 201 HG21 ILE 22 HG21 ILE 22 9.414 -2.840 -2.213 202 HG22 ILE 22 HG22 ILE 22 8.891 -3.492 -3.780 203 HG23 ILE 22 HG23 ILE 22 10.008 -4.414 -2.771 204 HD11 ILE 22 HD11 ILE 22 9.396 -1.861 -5.832 205 HD12 ILE 22 HD12 ILE 22 8.450 -1.296 -4.444 206 HD13 ILE 22 HD13 ILE 22 9.305 -0.123 -5.460 207 HA PRO 23 HA PRO 23 15.702 -2.483 -5.350 208 HB2 PRO 23 HB2 PRO 23 15.336 -4.140 -7.503 209 HB3 PRO 23 HB3 PRO 23 16.032 -4.717 -5.956 210 HG2 PRO 23 HG2 PRO 23 13.127 -4.870 -6.862 211 HG3 PRO 23 HG3 PRO 23 14.163 -6.206 -6.255 212 HD2 PRO 23 HD2 PRO 23 12.493 -4.924 -4.599 213 HD3 PRO 23 HD3 PRO 23 14.132 -5.356 -4.043 214 HA PRO 24 HA PRO 24 13.561 0.383 -8.036 215 HB2 PRO 24 HB2 PRO 24 15.162 0.569 -10.274 216 HB3 PRO 24 HB3 PRO 24 15.565 1.297 -8.690 217 HG2 PRO 24 HG2 PRO 24 16.491 -1.374 -9.797 218 HG3 PRO 24 HG3 PRO 24 17.487 -0.078 -9.057 219 HD2 PRO 24 HD2 PRO 24 16.683 -2.206 -7.607 220 HD3 PRO 24 HD3 PRO 24 16.667 -0.573 -6.881 221 H ARG 25 H ARG 25 12.146 0.490 -9.780 222 HA ARG 25 HA ARG 25 10.864 -1.928 -10.584 223 HB2 ARG 25 HB2 ARG 25 9.910 0.457 -10.371 224 HB3 ARG 25 HB3 ARG 25 10.620 0.760 -11.967 225 HG2 ARG 25 HG2 ARG 25 9.191 -1.240 -12.768 226 HG3 ARG 25 HG3 ARG 25 8.377 -1.139 -11.207 227 HD2 ARG 25 HD2 ARG 25 8.585 1.090 -13.283 228 HD3 ARG 25 HD3 ARG 25 7.217 0.011 -13.083 229 HE ARG 25 HE ARG 25 6.527 1.108 -11.137 230 HH11 ARG 25 HH11 ARG 25 6.442 2.705 -9.691 231 HH12 ARG 25 HH12 ARG 25 7.574 4.039 -9.748 232 HH21 ARG 25 HH21 ARG 25 9.424 2.711 -12.328 233 HH22 ARG 25 HH22 ARG 25 9.231 4.035 -11.213 234 H ALA 26 H ALA 26 10.671 -2.968 -12.518 235 HA ALA 26 HA ALA 26 12.764 -3.015 -14.504 236 HB1 ALA 26 HB1 ALA 26 9.853 -3.848 -14.613 237 HB2 ALA 26 HB2 ALA 26 11.119 -4.429 -15.710 238 HB3 ALA 26 HB3 ALA 26 11.163 -4.874 -13.991 239 H SER 27 H SER 27 12.091 -2.695 -16.849 240 HA SER 27 HA SER 27 11.468 0.172 -17.257 241 HB2 SER 27 HB2 SER 27 12.367 -0.216 -19.514 242 HB3 SER 27 HB3 SER 27 13.493 -0.746 -18.251 243 HG SER 27 HG SER 27 13.354 -2.329 -19.844 244 H ASN 28 H ASN 28 10.170 -2.973 -18.079 245 HA ASN 28 HA ASN 28 7.703 -1.758 -19.223 246 HB2 ASN 28 HB2 ASN 28 7.801 -3.293 -21.090 247 HB3 ASN 28 HB3 ASN 28 9.309 -2.394 -21.017 248 HD21 ASN 28 HD21 ASN 28 11.274 -5.317 -20.254 249 HD22 ASN 28 HD22 ASN 28 11.249 -3.574 -20.038 250 H ARG 29 H ARG 29 8.631 -3.452 -16.669 251 HA ARG 29 HA ARG 29 6.322 -5.373 -16.733 252 HB2 ARG 29 HB2 ARG 29 8.837 -5.773 -15.069 253 HB3 ARG 29 HB3 ARG 29 7.499 -6.874 -15.279 254 HG2 ARG 29 HG2 ARG 29 9.463 -6.048 -17.464 255 HG3 ARG 29 HG3 ARG 29 9.474 -7.573 -16.570 256 HD2 ARG 29 HD2 ARG 29 7.266 -8.163 -17.446 257 HD3 ARG 29 HD3 ARG 29 7.133 -6.594 -18.229 258 HE ARG 29 HE ARG 29 8.628 -7.170 -19.898 259 HH11 ARG 29 HH11 ARG 29 9.580 -8.585 -21.269 260 HH12 ARG 29 HH12 ARG 29 9.845 -10.241 -20.799 261 HH21 ARG 29 HH21 ARG 29 8.428 -9.895 -17.687 262 HH22 ARG 29 HH22 ARG 29 9.203 -10.973 -18.816 263 H GLY 30 H GLY 30 8.263 -3.550 -14.251 264 HA2 GLY 30 HA2 GLY 30 6.818 -2.297 -12.546 265 HA3 GLY 30 HA3 GLY 30 5.856 -3.787 -12.558 266 H TYR 31 H TYR 31 6.286 -4.948 -10.921 267 HA TYR 31 HA TYR 31 9.039 -5.642 -10.012 268 HB2 TYR 31 HB2 TYR 31 6.543 -5.305 -8.316 269 HB3 TYR 31 HB3 TYR 31 8.210 -5.465 -7.782 270 HD1 TYR 31 HD1 TYR 31 5.559 -3.170 -8.525 271 HD2 TYR 31 HD2 TYR 31 9.834 -3.562 -8.761 272 HE1 TYR 31 HE1 TYR 31 5.790 -0.728 -8.258 273 HE2 TYR 31 HE2 TYR 31 10.084 -1.128 -8.380 274 HH TYR 31 HH TYR 31 7.205 1.038 -8.131 275 H ARG 32 H ARG 32 9.172 -7.712 -9.099 276 HA ARG 32 HA ARG 32 6.755 -9.415 -9.098 277 HB2 ARG 32 HB2 ARG 32 7.891 -11.406 -9.691 278 HB3 ARG 32 HB3 ARG 32 7.986 -10.243 -10.997 279 HG2 ARG 32 HG2 ARG 32 10.267 -10.933 -9.097 280 HG3 ARG 32 HG3 ARG 32 10.044 -11.549 -10.733 281 HD2 ARG 32 HD2 ARG 32 10.138 -9.156 -11.587 282 HD3 ARG 32 HD3 ARG 32 10.541 -8.659 -9.948 283 HE ARG 32 HE ARG 32 12.652 -9.628 -10.049 284 HH11 ARG 32 HH11 ARG 32 14.377 -10.236 -10.891 285 HH12 ARG 32 HH12 ARG 32 14.492 -10.827 -12.552 286 HH21 ARG 32 HH21 ARG 32 11.086 -10.403 -13.103 287 HH22 ARG 32 HH22 ARG 32 12.602 -10.917 -13.795 288 H ALA 33 H ALA 33 6.341 -10.227 -7.244 289 HA ALA 33 HA ALA 33 7.394 -9.208 -4.922 290 HB1 ALA 33 HB1 ALA 33 5.906 -11.818 -5.430 291 HB2 ALA 33 HB2 ALA 33 5.929 -10.906 -3.889 292 HB3 ALA 33 HB3 ALA 33 5.184 -10.209 -5.350 293 H SER 34 H SER 34 8.423 -12.233 -6.525 294 HA SER 34 HA SER 34 10.072 -13.262 -4.429 295 HB2 SER 34 HB2 SER 34 11.047 -14.624 -6.304 296 HB3 SER 34 HB3 SER 34 9.280 -14.689 -6.186 297 HG SER 34 HG SER 34 10.032 -14.360 -8.352 298 H ASP 35 H ASP 35 10.662 -10.507 -6.452 299 HA ASP 35 HA ASP 35 13.588 -10.640 -6.102 300 HB2 ASP 35 HB2 ASP 35 11.953 -9.420 -7.995 301 HB3 ASP 35 HB3 ASP 35 12.401 -8.068 -6.991 302 H TRP 36 H TRP 36 10.958 -9.784 -4.103 303 HA TRP 36 HA TRP 36 12.384 -7.682 -2.610 304 HB2 TRP 36 HB2 TRP 36 9.631 -8.846 -2.148 305 HB3 TRP 36 HB3 TRP 36 10.284 -7.368 -1.493 306 HD1 TRP 36 HD1 TRP 36 11.209 -6.798 -4.884 307 HE1 TRP 36 HE1 TRP 36 9.389 -5.507 -6.192 308 HE3 TRP 36 HE3 TRP 36 7.218 -7.660 -1.804 309 HZ2 TRP 36 HZ2 TRP 36 6.644 -4.837 -5.866 310 HZ3 TRP 36 HZ3 TRP 36 5.014 -6.595 -2.281 311 HH2 TRP 36 HH2 TRP 36 4.720 -5.216 -4.316 312 H LYS 37 H LYS 37 12.072 -7.856 -0.207 313 HA LYS 37 HA LYS 37 13.525 -10.180 0.778 314 HB2 LYS 37 HB2 LYS 37 12.677 -7.610 2.109 315 HB3 LYS 37 HB3 LYS 37 13.592 -8.893 2.896 316 HG2 LYS 37 HG2 LYS 37 15.317 -8.754 1.050 317 HG3 LYS 37 HG3 LYS 37 14.462 -7.312 0.469 318 HD2 LYS 37 HD2 LYS 37 16.051 -6.360 1.861 319 HD3 LYS 37 HD3 LYS 37 14.633 -6.487 2.912 320 HE2 LYS 37 HE2 LYS 37 16.470 -7.130 4.242 321 HE3 LYS 37 HE3 LYS 37 15.591 -8.609 3.869 322 HZ1 LYS 37 HZ1 LYS 37 18.062 -7.668 2.491 323 HZ2 LYS 37 HZ2 LYS 37 18.007 -8.872 3.582 324 HZ3 LYS 37 HZ3 LYS 37 17.285 -9.058 2.129 325 H LEU 38 H LEU 38 11.176 -11.231 0.036 326 HA LEU 38 HA LEU 38 8.942 -11.057 1.663 327 HB2 LEU 38 HB2 LEU 38 9.909 -13.522 0.179 328 HB3 LEU 38 HB3 LEU 38 8.273 -13.264 0.781 329 HG LEU 38 HG LEU 38 9.669 -11.654 -1.386 330 HD11 LEU 38 HD11 LEU 38 7.277 -13.570 -1.381 331 HD12 LEU 38 HD12 LEU 38 7.851 -12.680 -2.793 332 HD13 LEU 38 HD13 LEU 38 8.887 -13.911 -2.056 333 HD21 LEU 38 HD21 LEU 38 7.396 -10.596 -1.707 334 HD22 LEU 38 HD22 LEU 38 6.926 -11.289 -0.138 335 HD23 LEU 38 HD23 LEU 38 8.240 -10.097 -0.243 336 H ASP 39 H ASP 39 11.707 -13.181 2.355 337 HA ASP 39 HA ASP 39 10.279 -14.347 4.679 338 HB2 ASP 39 HB2 ASP 39 11.526 -15.745 3.014 339 HB3 ASP 39 HB3 ASP 39 13.024 -15.020 3.587 340 H GLN 40 H GLN 40 11.958 -11.565 4.224 341 HA GLN 40 HA GLN 40 12.625 -11.263 7.070 342 HB2 GLN 40 HB2 GLN 40 14.886 -10.250 6.451 343 HB3 GLN 40 HB3 GLN 40 14.753 -11.986 6.577 344 HG2 GLN 40 HG2 GLN 40 14.550 -10.582 3.892 345 HG3 GLN 40 HG3 GLN 40 16.108 -10.938 4.622 346 HE21 GLN 40 HE21 GLN 40 14.955 -13.737 2.296 347 HE22 GLN 40 HE22 GLN 40 14.876 -11.997 2.079 348 HA PRO 41 HA PRO 41 10.595 -7.567 5.008 349 HB2 PRO 41 HB2 PRO 41 8.782 -7.096 7.079 350 HB3 PRO 41 HB3 PRO 41 8.466 -8.073 5.624 351 HG2 PRO 41 HG2 PRO 41 9.374 -9.030 8.354 352 HG3 PRO 41 HG3 PRO 41 8.071 -9.705 7.321 353 HD2 PRO 41 HD2 PRO 41 10.510 -10.842 7.397 354 HD3 PRO 41 HD3 PRO 41 9.648 -10.687 5.838 355 H ASP 42 H ASP 42 10.962 -5.476 5.470 356 HA ASP 42 HA ASP 42 13.080 -4.845 7.397 357 HB2 ASP 42 HB2 ASP 42 12.970 -3.929 5.081 358 HB3 ASP 42 HB3 ASP 42 11.475 -3.088 5.496 359 H TRP 43 H TRP 43 9.600 -4.517 7.190 360 HA TRP 43 HA TRP 43 9.420 -4.014 10.070 361 HB2 TRP 43 HB2 TRP 43 9.530 -1.718 9.333 362 HB3 TRP 43 HB3 TRP 43 8.396 -2.012 8.029 363 HD1 TRP 43 HD1 TRP 43 8.527 -1.129 11.693 364 HE1 TRP 43 HE1 TRP 43 6.176 -0.478 12.498 365 HE3 TRP 43 HE3 TRP 43 5.826 -2.802 7.697 366 HZ2 TRP 43 HZ2 TRP 43 3.481 -0.455 11.411 367 HZ3 TRP 43 HZ3 TRP 43 3.377 -2.318 7.544 368 HH2 TRP 43 HH2 TRP 43 2.200 -1.196 9.411 369 H THR 44 H THR 44 7.334 -4.604 10.921 370 HA THR 44 HA THR 44 5.282 -5.548 8.996 371 HB THR 44 HB THR 44 4.759 -7.500 10.393 372 HG1 THR 44 HG1 THR 44 6.445 -8.242 11.797 373 HG21 THR 44 HG21 THR 44 6.139 -7.721 8.377 374 HG22 THR 44 HG22 THR 44 7.609 -7.601 9.375 375 HG23 THR 44 HG23 THR 44 6.476 -8.964 9.586 376 H GLY 45 H GLY 45 3.208 -5.265 9.591 377 HA2 GLY 45 HA2 GLY 45 2.293 -4.735 12.238 378 HA3 GLY 45 HA3 GLY 45 2.606 -3.198 11.443 379 H ARG 46 H ARG 46 0.584 -2.492 11.302 380 HA ARG 46 HA ARG 46 -1.610 -4.192 10.195 381 HB2 ARG 46 HB2 ARG 46 -1.775 -1.639 11.834 382 HB3 ARG 46 HB3 ARG 46 -3.102 -2.720 11.412 383 HG2 ARG 46 HG2 ARG 46 -2.114 -4.496 12.852 384 HG3 ARG 46 HG3 ARG 46 -0.762 -3.419 13.267 385 HD2 ARG 46 HD2 ARG 46 -2.369 -1.761 14.176 386 HD3 ARG 46 HD3 ARG 46 -3.715 -2.860 13.812 387 HE ARG 46 HE ARG 46 -2.054 -4.388 15.404 388 HH11 ARG 46 HH11 ARG 46 -1.858 -4.388 17.651 389 HH12 ARG 46 HH12 ARG 46 -2.766 -3.223 18.571 390 HH21 ARG 46 HH21 ARG 46 -3.792 -1.390 15.871 391 HH22 ARG 46 HH22 ARG 46 -3.761 -1.529 17.607 392 H LEU 47 H LEU 47 -2.920 -3.469 8.620 393 HA LEU 47 HA LEU 47 -2.083 -1.164 6.927 394 HB2 LEU 47 HB2 LEU 47 -2.467 -3.354 5.821 395 HB3 LEU 47 HB3 LEU 47 -4.060 -3.443 6.570 396 HG LEU 47 HG LEU 47 -4.759 -1.400 5.256 397 HD11 LEU 47 HD11 LEU 47 -3.411 -0.804 3.274 398 HD12 LEU 47 HD12 LEU 47 -2.526 -0.448 4.760 399 HD13 LEU 47 HD13 LEU 47 -2.117 -1.894 3.810 400 HD21 LEU 47 HD21 LEU 47 -5.342 -3.662 4.569 401 HD22 LEU 47 HD22 LEU 47 -5.041 -2.640 3.167 402 HD23 LEU 47 HD23 LEU 47 -3.799 -3.803 3.702 403 H ARG 48 H ARG 48 -3.291 0.680 6.850 404 HA ARG 48 HA ARG 48 -6.173 0.598 7.552 405 HB2 ARG 48 HB2 ARG 48 -4.914 1.197 9.601 406 HB3 ARG 48 HB3 ARG 48 -4.212 2.588 8.789 407 HG2 ARG 48 HG2 ARG 48 -7.224 2.316 8.787 408 HG3 ARG 48 HG3 ARG 48 -6.454 2.660 10.331 409 HD2 ARG 48 HD2 ARG 48 -6.048 4.352 7.832 410 HD3 ARG 48 HD3 ARG 48 -7.235 4.670 9.106 411 HE ARG 48 HE ARG 48 -4.802 4.437 10.463 412 HH11 ARG 48 HH11 ARG 48 -3.875 6.075 11.293 413 HH12 ARG 48 HH12 ARG 48 -4.068 7.716 10.647 414 HH21 ARG 48 HH21 ARG 48 -5.860 6.603 7.900 415 HH22 ARG 48 HH22 ARG 48 -5.271 8.013 8.762 416 H ILE 49 H ILE 49 -6.890 0.951 5.567 417 HA ILE 49 HA ILE 49 -5.816 3.146 3.877 418 HB ILE 49 HB ILE 49 -8.069 1.219 3.234 419 HG12 ILE 49 HG12 ILE 49 -5.085 1.051 2.628 420 HG13 ILE 49 HG13 ILE 49 -6.060 -0.081 3.571 421 HG21 ILE 49 HG21 ILE 49 -8.076 3.341 1.908 422 HG22 ILE 49 HG22 ILE 49 -6.407 3.012 1.405 423 HG23 ILE 49 HG23 ILE 49 -7.729 1.941 0.904 424 HD11 ILE 49 HD11 ILE 49 -6.062 0.309 0.576 425 HD12 ILE 49 HD12 ILE 49 -5.790 -1.152 1.538 426 HD13 ILE 49 HD13 ILE 49 -7.415 -0.484 1.422 427 H THR 50 H THR 50 -6.764 5.028 3.669 428 HA THR 50 HA THR 50 -9.377 5.653 4.933 429 HB THR 50 HB THR 50 -7.767 7.770 5.745 430 HG1 THR 50 HG1 THR 50 -5.926 6.202 5.230 431 HG21 THR 50 HG21 THR 50 -8.433 5.210 7.237 432 HG22 THR 50 HG22 THR 50 -7.920 6.728 8.003 433 HG23 THR 50 HG23 THR 50 -9.442 6.674 7.135 434 H SER 51 H SER 51 -10.036 8.045 4.464 435 HA SER 51 HA SER 51 -8.619 9.359 2.243 436 HB2 SER 51 HB2 SER 51 -10.088 7.801 1.041 437 HB3 SER 51 HB3 SER 51 -11.484 8.371 1.972 438 HG SER 51 HG SER 51 -9.851 10.044 0.325 439 H LYS 52 H LYS 52 -8.972 11.470 2.041 440 HA LYS 52 HA LYS 52 -11.525 12.460 2.743 441 HB2 LYS 52 HB2 LYS 52 -10.199 12.786 4.908 442 HB3 LYS 52 HB3 LYS 52 -9.276 13.997 4.023 443 HG2 LYS 52 HG2 LYS 52 -11.084 15.015 5.336 444 HG3 LYS 52 HG3 LYS 52 -11.304 15.298 3.615 445 HD2 LYS 52 HD2 LYS 52 -13.417 14.826 4.757 446 HD3 LYS 52 HD3 LYS 52 -13.074 13.572 3.563 447 HE2 LYS 52 HE2 LYS 52 -12.288 12.052 5.315 448 HE3 LYS 52 HE3 LYS 52 -12.505 13.306 6.546 449 HZ1 LYS 52 HZ1 LYS 52 -14.379 11.680 6.356 450 HZ2 LYS 52 HZ2 LYS 52 -14.875 13.237 6.171 451 HZ3 LYS 52 HZ3 LYS 52 -14.725 12.245 4.877 452 H GLY 53 H GLY 53 -12.203 13.801 1.242 453 HA2 GLY 53 HA2 GLY 53 -12.306 15.567 -0.247 454 HA3 GLY 53 HA3 GLY 53 -10.722 16.074 0.334 455 H LYS 54 H LYS 54 -12.032 13.372 -1.605 456 HA LYS 54 HA LYS 54 -11.392 12.330 -3.524 457 HB2 LYS 54 HB2 LYS 54 -10.519 15.097 -4.427 458 HB3 LYS 54 HB3 LYS 54 -10.769 13.693 -5.469 459 HG2 LYS 54 HG2 LYS 54 -13.150 13.608 -4.851 460 HG3 LYS 54 HG3 LYS 54 -12.939 15.021 -3.794 461 HD2 LYS 54 HD2 LYS 54 -12.198 16.365 -5.755 462 HD3 LYS 54 HD3 LYS 54 -12.482 14.961 -6.810 463 HE2 LYS 54 HE2 LYS 54 -14.860 14.932 -6.141 464 HE3 LYS 54 HE3 LYS 54 -14.586 16.293 -5.045 465 HZ1 LYS 54 HZ1 LYS 54 -14.256 16.394 -8.002 466 HZ2 LYS 54 HZ2 LYS 54 -15.503 17.040 -7.171 467 HZ3 LYS 54 HZ3 LYS 54 -14.002 17.651 -6.989 468 H THR 55 H THR 55 -9.541 12.448 -1.341 469 HA THR 55 HA THR 55 -7.090 11.529 -2.746 470 HB THR 55 HB THR 55 -7.052 13.233 -0.222 471 HG1 THR 55 HG1 THR 55 -7.552 14.555 -1.936 472 HG21 THR 55 HG21 THR 55 -4.632 13.345 -0.697 473 HG22 THR 55 HG22 THR 55 -5.167 11.683 -0.407 474 HG23 THR 55 HG23 THR 55 -4.855 12.234 -2.072 475 H ALA 56 H ALA 56 -6.665 9.513 -2.139 476 HA ALA 56 HA ALA 56 -7.791 8.413 0.388 477 HB1 ALA 56 HB1 ALA 56 -8.275 7.115 -1.626 478 HB2 ALA 56 HB2 ALA 56 -6.530 6.975 -1.966 479 HB3 ALA 56 HB3 ALA 56 -7.223 6.220 -0.517 480 H TYR 57 H TYR 57 -6.401 7.168 1.726 481 HA TYR 57 HA TYR 57 -3.524 7.953 1.819 482 HB2 TYR 57 HB2 TYR 57 -5.589 8.199 4.057 483 HB3 TYR 57 HB3 TYR 57 -3.864 8.478 4.219 484 HD1 TYR 57 HD1 TYR 57 -2.871 10.293 2.512 485 HD2 TYR 57 HD2 TYR 57 -6.980 10.120 3.847 486 HE1 TYR 57 HE1 TYR 57 -3.151 12.712 1.999 487 HE2 TYR 57 HE2 TYR 57 -7.247 12.532 3.314 488 HH TYR 57 HH TYR 57 -4.567 14.510 2.009 489 H ILE 58 H ILE 58 -2.740 5.865 1.430 490 HA ILE 58 HA ILE 58 -3.678 3.587 3.121 491 HB ILE 58 HB ILE 58 -1.346 3.751 1.164 492 HG12 ILE 58 HG12 ILE 58 -2.761 1.938 -0.035 493 HG13 ILE 58 HG13 ILE 58 -4.131 2.553 0.881 494 HG21 ILE 58 HG21 ILE 58 -2.483 1.357 2.671 495 HG22 ILE 58 HG22 ILE 58 -1.157 1.328 1.484 496 HG23 ILE 58 HG23 ILE 58 -0.924 2.140 3.013 497 HD11 ILE 58 HD11 ILE 58 -3.892 4.736 -0.247 498 HD12 ILE 58 HD12 ILE 58 -2.361 4.195 -0.992 499 HD13 ILE 58 HD13 ILE 58 -3.899 3.444 -1.452 500 H LYS 59 H LYS 59 -3.296 4.019 5.237 501 HA LYS 59 HA LYS 59 -0.494 4.780 5.956 502 HB2 LYS 59 HB2 LYS 59 -2.959 4.962 7.706 503 HB3 LYS 59 HB3 LYS 59 -1.315 5.498 8.081 504 HG2 LYS 59 HG2 LYS 59 -1.634 6.868 5.775 505 HG3 LYS 59 HG3 LYS 59 -3.340 6.686 6.191 506 HD2 LYS 59 HD2 LYS 59 -2.813 7.756 8.432 507 HD3 LYS 59 HD3 LYS 59 -1.160 8.015 7.868 508 HE2 LYS 59 HE2 LYS 59 -2.156 9.238 5.844 509 HE3 LYS 59 HE3 LYS 59 -3.728 9.092 6.645 510 HZ1 LYS 59 HZ1 LYS 59 -3.058 11.116 7.365 511 HZ2 LYS 59 HZ2 LYS 59 -2.490 10.238 8.588 512 HZ3 LYS 59 HZ3 LYS 59 -1.430 10.750 7.418 513 H LEU 60 H LEU 60 0.729 3.657 7.184 514 HA LEU 60 HA LEU 60 -0.032 0.856 7.928 515 HB2 LEU 60 HB2 LEU 60 2.429 2.143 6.796 516 HB3 LEU 60 HB3 LEU 60 2.675 0.906 8.017 517 HG LEU 60 HG LEU 60 1.522 -0.762 6.761 518 HD11 LEU 60 HD11 LEU 60 0.962 1.393 4.670 519 HD12 LEU 60 HD12 LEU 60 0.755 -0.354 4.408 520 HD13 LEU 60 HD13 LEU 60 -0.245 0.473 5.600 521 HD21 LEU 60 HD21 LEU 60 3.908 -0.243 6.263 522 HD22 LEU 60 HD22 LEU 60 3.061 -0.945 4.880 523 HD23 LEU 60 HD23 LEU 60 3.390 0.802 4.926 524 H GLU 61 H GLU 61 0.086 0.220 9.998 525 HA GLU 61 HA GLU 61 0.972 2.228 12.035 526 HB2 GLU 61 HB2 GLU 61 -1.666 0.740 11.907 527 HB3 GLU 61 HB3 GLU 61 -1.091 1.658 13.307 528 HG2 GLU 61 HG2 GLU 61 -0.968 3.710 11.903 529 HG3 GLU 61 HG3 GLU 61 -1.618 2.809 10.530 530 H ASP 62 H ASP 62 1.666 1.491 14.039 531 HA ASP 62 HA ASP 62 3.075 -0.963 14.012 532 HB2 ASP 62 HB2 ASP 62 3.683 1.093 15.281 533 HB3 ASP 62 HB3 ASP 62 2.315 0.765 16.372 534 H LYS 63 H LYS 63 2.806 -2.904 14.939 535 HA LYS 63 HA LYS 63 0.085 -3.681 15.427 536 HB2 LYS 63 HB2 LYS 63 1.239 -6.066 15.635 537 HB3 LYS 63 HB3 LYS 63 0.977 -5.256 14.108 538 HG2 LYS 63 HG2 LYS 63 3.148 -6.191 14.051 539 HG3 LYS 63 HG3 LYS 63 3.311 -4.443 14.098 540 HD2 LYS 63 HD2 LYS 63 3.689 -4.710 16.644 541 HD3 LYS 63 HD3 LYS 63 3.877 -6.435 16.320 542 HE2 LYS 63 HE2 LYS 63 5.563 -4.106 15.292 543 HE3 LYS 63 HE3 LYS 63 6.056 -5.376 16.410 544 HZ1 LYS 63 HZ1 LYS 63 6.933 -5.892 14.266 545 HZ2 LYS 63 HZ2 LYS 63 5.731 -6.965 14.499 546 HZ3 LYS 63 HZ3 LYS 63 5.519 -5.671 13.504 547 H VAL 64 H VAL 64 2.194 -2.513 17.644 548 HA VAL 64 HA VAL 64 0.620 -3.808 19.841 549 HB VAL 64 HB VAL 64 3.288 -2.368 20.088 550 HG11 VAL 64 HG11 VAL 64 1.941 -2.297 22.153 551 HG12 VAL 64 HG12 VAL 64 1.697 -4.057 22.072 552 HG13 VAL 64 HG13 VAL 64 3.317 -3.381 22.352 553 HG21 VAL 64 HG21 VAL 64 3.708 -4.453 18.907 554 HG22 VAL 64 HG22 VAL 64 4.237 -4.637 20.575 555 HG23 VAL 64 HG23 VAL 64 2.697 -5.361 20.056 556 H SER 65 H SER 65 2.035 -0.696 18.724 557 HA SER 65 HA SER 65 0.414 0.721 20.747 558 HB2 SER 65 HB2 SER 65 2.658 1.656 18.931 559 HB3 SER 65 HB3 SER 65 1.877 2.637 20.189 560 HG SER 65 HG SER 65 3.813 1.618 20.918 561 H GLY 66 H GLY 66 0.200 0.179 17.352 562 HA2 GLY 66 HA2 GLY 66 -1.342 0.897 15.789 563 HA3 GLY 66 HA3 GLY 66 -2.172 1.829 17.041 564 H GLU 67 H GLU 67 1.186 2.532 16.762 565 HA GLU 67 HA GLU 67 0.580 5.248 15.908 566 HB2 GLU 67 HB2 GLU 67 2.708 5.815 16.725 567 HB3 GLU 67 HB3 GLU 67 1.986 4.663 17.862 568 HG2 GLU 67 HG2 GLU 67 3.388 2.857 16.970 569 HG3 GLU 67 HG3 GLU 67 4.098 3.956 15.782 570 H LEU 68 H LEU 68 1.726 6.403 14.249 571 HA LEU 68 HA LEU 68 1.454 4.983 11.789 572 HB2 LEU 68 HB2 LEU 68 0.796 7.344 12.174 573 HB3 LEU 68 HB3 LEU 68 2.491 7.783 12.375 574 HG LEU 68 HG LEU 68 2.920 7.094 9.990 575 HD11 LEU 68 HD11 LEU 68 0.953 6.848 8.493 576 HD12 LEU 68 HD12 LEU 68 1.060 5.520 9.640 577 HD13 LEU 68 HD13 LEU 68 -0.120 6.817 9.914 578 HD21 LEU 68 HD21 LEU 68 1.795 9.046 8.990 579 HD22 LEU 68 HD22 LEU 68 0.713 9.159 10.395 580 HD23 LEU 68 HD23 LEU 68 2.458 9.443 10.582 581 H PHE 69 H PHE 69 2.873 3.786 10.729 582 HA PHE 69 HA PHE 69 5.799 4.102 11.080 583 HB2 PHE 69 HB2 PHE 69 5.063 1.840 11.014 584 HB3 PHE 69 HB3 PHE 69 4.042 2.116 9.614 585 HD1 PHE 69 HD1 PHE 69 7.658 2.171 10.654 586 HD2 PHE 69 HD2 PHE 69 4.844 1.626 7.429 587 HE1 PHE 69 HE1 PHE 69 9.510 1.507 9.138 588 HE2 PHE 69 HE2 PHE 69 6.698 1.026 5.913 589 HZ PHE 69 HZ PHE 69 9.029 0.941 6.758 590 H ALA 70 H ALA 70 3.415 4.191 8.389 591 HA ALA 70 HA ALA 70 4.790 6.409 7.076 592 HB1 ALA 70 HB1 ALA 70 4.669 3.669 5.723 593 HB2 ALA 70 HB2 ALA 70 5.281 5.183 5.017 594 HB3 ALA 70 HB3 ALA 70 6.146 4.431 6.362 595 H GLN 71 H GLN 71 3.634 7.148 5.140 596 HA GLN 71 HA GLN 71 0.828 6.221 4.841 597 HB2 GLN 71 HB2 GLN 71 0.121 8.646 4.875 598 HB3 GLN 71 HB3 GLN 71 0.548 7.937 6.434 599 HG2 GLN 71 HG2 GLN 71 2.543 9.155 6.637 600 HG3 GLN 71 HG3 GLN 71 2.662 9.453 4.915 601 HE21 GLN 71 HE21 GLN 71 1.504 12.694 5.450 602 HE22 GLN 71 HE22 GLN 71 2.747 11.618 4.792 603 H ALA 72 H ALA 72 0.144 6.195 2.765 604 HA ALA 72 HA ALA 72 1.668 7.740 0.691 605 HB1 ALA 72 HB1 ALA 72 0.374 5.007 0.513 606 HB2 ALA 72 HB2 ALA 72 1.069 5.911 -0.848 607 HB3 ALA 72 HB3 ALA 72 2.106 5.387 0.489 608 HA PRO 73 HA PRO 73 -2.451 9.651 0.171 609 HB2 PRO 73 HB2 PRO 73 -0.655 11.653 -1.164 610 HB3 PRO 73 HB3 PRO 73 -2.045 11.929 -0.072 611 HG2 PRO 73 HG2 PRO 73 0.507 12.202 0.816 612 HG3 PRO 73 HG3 PRO 73 -0.728 11.402 1.848 613 HD2 PRO 73 HD2 PRO 73 1.346 10.100 0.059 614 HD3 PRO 73 HD3 PRO 73 0.934 9.730 1.760 615 H VAL 74 H VAL 74 -3.689 9.415 -1.635 616 HA VAL 74 HA VAL 74 -2.440 9.042 -4.324 617 HB VAL 74 HB VAL 74 -4.857 7.424 -3.487 618 HG11 VAL 74 HG11 VAL 74 -4.246 7.571 -5.857 619 HG12 VAL 74 HG12 VAL 74 -2.646 6.887 -5.503 620 HG13 VAL 74 HG13 VAL 74 -4.114 5.919 -5.249 621 HG21 VAL 74 HG21 VAL 74 -3.286 6.740 -1.784 622 HG22 VAL 74 HG22 VAL 74 -3.465 5.469 -2.992 623 HG23 VAL 74 HG23 VAL 74 -2.010 6.490 -2.993 624 H GLU 75 H GLU 75 -3.456 10.310 -5.887 625 HA GLU 75 HA GLU 75 -5.901 11.794 -5.086 626 HB2 GLU 75 HB2 GLU 75 -4.091 12.022 -7.513 627 HB3 GLU 75 HB3 GLU 75 -5.495 13.047 -7.192 628 HG2 GLU 75 HG2 GLU 75 -4.469 13.767 -5.034 629 HG3 GLU 75 HG3 GLU 75 -3.029 12.820 -5.414 630 H GLN 76 H GLN 76 -5.140 9.086 -7.137 631 HA GLN 76 HA GLN 76 -7.887 8.379 -7.415 632 HB2 GLN 76 HB2 GLN 76 -7.631 8.181 -10.047 633 HB3 GLN 76 HB3 GLN 76 -8.321 9.584 -9.269 634 HG2 GLN 76 HG2 GLN 76 -6.868 10.222 -11.110 635 HG3 GLN 76 HG3 GLN 76 -6.312 10.892 -9.593 636 HE21 GLN 76 HE21 GLN 76 -3.092 9.474 -9.994 637 HE22 GLN 76 HE22 GLN 76 -4.111 10.613 -9.130 638 H TYR 77 H TYR 77 -8.149 6.202 -8.100 639 HA TYR 77 HA TYR 77 -5.628 4.632 -8.320 640 HB2 TYR 77 HB2 TYR 77 -6.528 4.487 -6.065 641 HB3 TYR 77 HB3 TYR 77 -8.084 3.957 -6.710 642 HD1 TYR 77 HD1 TYR 77 -8.505 1.672 -7.152 643 HD2 TYR 77 HD2 TYR 77 -4.458 3.038 -6.598 644 HE1 TYR 77 HE1 TYR 77 -7.707 -0.690 -7.210 645 HE2 TYR 77 HE2 TYR 77 -3.657 0.680 -6.780 646 HH TYR 77 HH TYR 77 -5.893 -2.077 -7.172 647 HA PRO 78 HA PRO 78 -4.787 2.703 -9.236 648 HB2 PRO 78 HB2 PRO 78 -4.588 2.380 -12.212 649 HB3 PRO 78 HB3 PRO 78 -3.916 1.352 -10.907 650 HG2 PRO 78 HG2 PRO 78 -6.136 0.562 -12.231 651 HG3 PRO 78 HG3 PRO 78 -6.078 0.415 -10.441 652 HD2 PRO 78 HD2 PRO 78 -7.331 2.639 -12.095 653 HD3 PRO 78 HD3 PRO 78 -8.049 1.704 -10.748 654 H GLY 79 H GLY 79 -2.900 3.926 -9.287 655 HA2 GLY 79 HA2 GLY 79 -2.370 6.093 -11.139 656 HA3 GLY 79 HA3 GLY 79 -3.023 6.677 -9.612 657 H ILE 80 H ILE 80 -0.828 7.767 -9.777 658 HA ILE 80 HA ILE 80 1.607 6.489 -9.927 659 HB ILE 80 HB ILE 80 1.319 8.860 -10.249 660 HG12 ILE 80 HG12 ILE 80 3.201 9.853 -9.030 661 HG13 ILE 80 HG13 ILE 80 3.234 8.500 -7.902 662 HG21 ILE 80 HG21 ILE 80 0.900 9.207 -7.244 663 HG22 ILE 80 HG22 ILE 80 0.985 10.486 -8.461 664 HG23 ILE 80 HG23 ILE 80 -0.369 9.364 -8.480 665 HD11 ILE 80 HD11 ILE 80 4.996 8.348 -9.609 666 HD12 ILE 80 HD12 ILE 80 3.886 6.977 -9.744 667 HD13 ILE 80 HD13 ILE 80 3.772 8.328 -10.899 668 H ALA 81 H ALA 81 -0.192 6.943 -6.904 669 HA ALA 81 HA ALA 81 2.164 6.135 -5.310 670 HB1 ALA 81 HB1 ALA 81 0.959 8.147 -4.685 671 HB2 ALA 81 HB2 ALA 81 -0.546 7.228 -4.524 672 HB3 ALA 81 HB3 ALA 81 0.808 6.922 -3.414 673 H VAL 82 H VAL 82 0.225 4.205 -6.942 674 HA VAL 82 HA VAL 82 0.541 2.052 -4.967 675 HB VAL 82 HB VAL 82 -2.157 2.468 -6.240 676 HG11 VAL 82 HG11 VAL 82 -1.126 0.566 -4.078 677 HG12 VAL 82 HG12 VAL 82 -2.831 0.712 -4.537 678 HG13 VAL 82 HG13 VAL 82 -1.646 0.116 -5.705 679 HG21 VAL 82 HG21 VAL 82 -2.009 4.235 -4.601 680 HG22 VAL 82 HG22 VAL 82 -3.105 2.980 -4.035 681 HG23 VAL 82 HG23 VAL 82 -1.473 3.090 -3.354 682 H GLU 83 H GLU 83 1.243 0.276 -5.943 683 HA GLU 83 HA GLU 83 0.671 -0.306 -8.818 684 HB2 GLU 83 HB2 GLU 83 3.382 0.008 -7.496 685 HB3 GLU 83 HB3 GLU 83 3.166 -1.010 -8.921 686 HG2 GLU 83 HG2 GLU 83 2.263 0.914 -10.163 687 HG3 GLU 83 HG3 GLU 83 2.562 1.968 -8.767 688 H THR 84 H THR 84 1.254 -2.500 -9.448 689 HA THR 84 HA THR 84 0.800 -4.553 -7.295 690 HB THR 84 HB THR 84 -0.198 -5.881 -9.116 691 HG1 THR 84 HG1 THR 84 -0.620 -4.879 -11.094 692 HG21 THR 84 HG21 THR 84 -2.271 -4.609 -9.407 693 HG22 THR 84 HG22 THR 84 -1.658 -4.407 -7.762 694 HG23 THR 84 HG23 THR 84 -1.449 -3.098 -8.943 695 H VAL 85 H VAL 85 1.753 -6.635 -7.639 696 HA VAL 85 HA VAL 85 4.350 -6.649 -9.080 697 HB VAL 85 HB VAL 85 4.771 -8.757 -8.040 698 HG11 VAL 85 HG11 VAL 85 3.661 -6.830 -5.970 699 HG12 VAL 85 HG12 VAL 85 4.941 -8.031 -5.739 700 HG13 VAL 85 HG13 VAL 85 5.214 -6.655 -6.813 701 HG21 VAL 85 HG21 VAL 85 2.450 -9.689 -8.043 702 HG22 VAL 85 HG22 VAL 85 3.253 -9.834 -6.488 703 HG23 VAL 85 HG23 VAL 85 2.026 -8.570 -6.741 704 H THR 86 H THR 86 4.805 -8.689 -10.374 705 HA THR 86 HA THR 86 2.520 -9.456 -12.107 706 HB THR 86 HB THR 86 4.184 -10.299 -13.625 707 HG1 THR 86 HG1 THR 86 6.361 -10.212 -13.080 708 HG21 THR 86 HG21 THR 86 3.783 -7.807 -13.516 709 HG22 THR 86 HG22 THR 86 5.196 -7.667 -12.460 710 HG23 THR 86 HG23 THR 86 5.398 -8.249 -14.123 711 H ASP 87 H ASP 87 4.547 -10.927 -9.655 712 HA ASP 87 HA ASP 87 4.142 -13.639 -10.522 713 HB2 ASP 87 HB2 ASP 87 6.152 -12.868 -9.370 714 HB3 ASP 87 HB3 ASP 87 5.218 -12.509 -7.916 715 H SER 88 H SER 88 2.625 -11.756 -7.875 716 HA SER 88 HA SER 88 0.358 -13.620 -7.807 717 HB2 SER 88 HB2 SER 88 1.997 -14.785 -6.370 718 HB3 SER 88 HB3 SER 88 2.070 -13.360 -5.320 719 HG SER 88 HG SER 88 0.569 -14.978 -4.601 720 H SER 89 H SER 89 -1.500 -12.628 -7.299 721 HA SER 89 HA SER 89 -1.539 -9.835 -6.851 722 HB2 SER 89 HB2 SER 89 -3.903 -11.716 -6.672 723 HB3 SER 89 HB3 SER 89 -3.916 -9.988 -7.069 724 HG SER 89 HG SER 89 -4.036 -11.268 -8.957 725 H ARG 90 H ARG 90 -0.424 -11.364 -4.496 726 HA ARG 90 HA ARG 90 -2.064 -10.087 -2.384 727 HB2 ARG 90 HB2 ARG 90 -1.475 -11.674 -0.765 728 HB3 ARG 90 HB3 ARG 90 -2.118 -12.504 -2.180 729 HG2 ARG 90 HG2 ARG 90 0.171 -13.038 -2.917 730 HG3 ARG 90 HG3 ARG 90 0.819 -12.246 -1.472 731 HD2 ARG 90 HD2 ARG 90 -1.211 -14.429 -1.060 732 HD3 ARG 90 HD3 ARG 90 0.396 -14.887 -1.643 733 HE ARG 90 HE ARG 90 0.373 -13.114 0.712 734 HH11 ARG 90 HH11 ARG 90 1.402 -13.746 2.454 735 HH12 ARG 90 HH12 ARG 90 1.884 -15.418 2.700 736 HH21 ARG 90 HH21 ARG 90 0.561 -16.478 -0.300 737 HH22 ARG 90 HH22 ARG 90 1.405 -16.937 1.154 738 H TYR 91 H TYR 91 0.093 -8.930 -4.120 739 HA TYR 91 HA TYR 91 1.721 -7.746 -1.959 740 HB2 TYR 91 HB2 TYR 91 2.766 -8.957 -4.531 741 HB3 TYR 91 HB3 TYR 91 3.723 -8.041 -3.397 742 HD1 TYR 91 HD1 TYR 91 2.372 -11.331 -4.235 743 HD2 TYR 91 HD2 TYR 91 4.163 -8.963 -1.102 744 HE1 TYR 91 HE1 TYR 91 2.997 -13.404 -3.022 745 HE2 TYR 91 HE2 TYR 91 4.678 -11.049 0.172 746 HH TYR 91 HH TYR 91 3.941 -14.303 -1.137 747 H PHE 92 H PHE 92 2.051 -5.589 -2.248 748 HA PHE 92 HA PHE 92 1.532 -4.315 -4.892 749 HB2 PHE 92 HB2 PHE 92 0.388 -3.371 -2.234 750 HB3 PHE 92 HB3 PHE 92 0.267 -2.516 -3.759 751 HD1 PHE 92 HD1 PHE 92 -1.145 -5.107 -1.679 752 HD2 PHE 92 HD2 PHE 92 -1.066 -3.514 -5.670 753 HE1 PHE 92 HE1 PHE 92 -3.238 -6.303 -2.185 754 HE2 PHE 92 HE2 PHE 92 -3.137 -4.802 -6.212 755 HZ PHE 92 HZ PHE 92 -4.218 -6.201 -4.486 756 H VAL 93 H VAL 93 2.335 -2.093 -4.960 757 HA VAL 93 HA VAL 93 4.429 -1.425 -2.939 758 HB VAL 93 HB VAL 93 4.516 -0.869 -5.917 759 HG11 VAL 93 HG11 VAL 93 5.387 1.078 -4.656 760 HG12 VAL 93 HG12 VAL 93 6.528 0.008 -3.815 761 HG13 VAL 93 HG13 VAL 93 6.641 0.244 -5.569 762 HG21 VAL 93 HG21 VAL 93 5.218 -3.103 -5.448 763 HG22 VAL 93 HG22 VAL 93 6.666 -2.149 -5.773 764 HG23 VAL 93 HG23 VAL 93 6.258 -2.568 -4.105 765 H ILE 94 H ILE 94 4.324 0.700 -2.139 766 HA ILE 94 HA ILE 94 2.390 2.500 -3.464 767 HB ILE 94 HB ILE 94 1.501 3.357 -1.444 768 HG12 ILE 94 HG12 ILE 94 3.317 2.566 0.152 769 HG13 ILE 94 HG13 ILE 94 1.659 2.484 0.714 770 HG21 ILE 94 HG21 ILE 94 0.895 0.405 -1.803 771 HG22 ILE 94 HG22 ILE 94 -0.137 1.602 -0.980 772 HG23 ILE 94 HG23 ILE 94 0.226 1.769 -2.703 773 HD11 ILE 94 HD11 ILE 94 3.282 0.083 -0.245 774 HD12 ILE 94 HD12 ILE 94 2.946 0.535 1.433 775 HD13 ILE 94 HD13 ILE 94 1.620 0.046 0.375 776 H ARG 95 H ARG 95 2.741 4.656 -3.318 777 HA ARG 95 HA ARG 95 5.565 5.403 -2.716 778 HB2 ARG 95 HB2 ARG 95 4.484 6.046 -4.904 779 HB3 ARG 95 HB3 ARG 95 3.472 7.178 -3.990 780 HG2 ARG 95 HG2 ARG 95 5.557 8.262 -3.106 781 HG3 ARG 95 HG3 ARG 95 6.518 7.178 -4.132 782 HD2 ARG 95 HD2 ARG 95 5.372 8.099 -6.138 783 HD3 ARG 95 HD3 ARG 95 4.415 9.168 -5.094 784 HE ARG 95 HE ARG 95 7.172 9.619 -4.522 785 HH11 ARG 95 HH11 ARG 95 8.219 11.347 -5.177 786 HH12 ARG 95 HH12 ARG 95 7.738 12.233 -6.610 787 HH21 ARG 95 HH21 ARG 95 4.997 10.227 -7.208 788 HH22 ARG 95 HH22 ARG 95 5.921 11.608 -7.735 789 H ILE 96 H ILE 96 5.593 5.368 -0.495 790 HA ILE 96 HA ILE 96 3.704 6.972 1.042 791 HB ILE 96 HB ILE 96 4.920 6.478 3.016 792 HG12 ILE 96 HG12 ILE 96 6.787 4.533 2.619 793 HG13 ILE 96 HG13 ILE 96 7.096 5.497 1.187 794 HG21 ILE 96 HG21 ILE 96 4.484 4.033 1.299 795 HG22 ILE 96 HG22 ILE 96 4.585 4.047 3.064 796 HG23 ILE 96 HG23 ILE 96 3.267 4.895 2.277 797 HD11 ILE 96 HD11 ILE 96 7.142 6.438 4.089 798 HD12 ILE 96 HD12 ILE 96 8.545 6.156 3.044 799 HD13 ILE 96 HD13 ILE 96 7.440 7.498 2.683 800 H GLN 97 H GLN 97 3.996 8.936 2.024 801 HA GLN 97 HA GLN 97 6.190 10.672 0.986 802 HB2 GLN 97 HB2 GLN 97 3.201 11.064 0.673 803 HB3 GLN 97 HB3 GLN 97 4.350 12.387 0.513 804 HG2 GLN 97 HG2 GLN 97 5.218 11.647 -1.480 805 HG3 GLN 97 HG3 GLN 97 4.841 9.951 -1.183 806 HE21 GLN 97 HE21 GLN 97 1.721 10.065 -2.800 807 HE22 GLN 97 HE22 GLN 97 2.946 9.100 -1.976 808 H ASP 98 H ASP 98 6.693 12.398 2.154 809 HA ASP 98 HA ASP 98 5.856 12.323 4.997 810 HB2 ASP 98 HB2 ASP 98 8.240 12.124 4.226 811 HB3 ASP 98 HB3 ASP 98 8.149 13.797 3.686 812 H GLY 99 H GLY 99 4.429 13.809 2.621 813 HA2 GLY 99 HA2 GLY 99 2.889 15.530 2.565 814 HA3 GLY 99 HA3 GLY 99 3.331 15.963 4.215 815 H THR 100 H THR 100 6.092 15.954 2.316 816 HA THR 100 HA THR 100 5.970 18.894 1.742 817 HB THR 100 HB THR 100 7.091 18.255 3.868 818 HG1 THR 100 HG1 THR 100 8.819 19.613 3.549 819 HG21 THR 100 HG21 THR 100 9.279 17.098 2.089 820 HG22 THR 100 HG22 THR 100 9.322 17.296 3.852 821 HG23 THR 100 HG23 THR 100 8.185 16.152 3.130 822 H GLY 101 H GLY 101 6.220 16.027 0.177 823 HA2 GLY 101 HA2 GLY 101 6.606 15.835 -2.174 824 HA3 GLY 101 HA3 GLY 101 7.779 17.148 -2.111 825 H ARG 102 H ARG 102 8.588 15.423 0.496 826 HA ARG 102 HA ARG 102 10.679 13.706 -0.608 827 HB2 ARG 102 HB2 ARG 102 11.129 14.942 1.389 828 HB3 ARG 102 HB3 ARG 102 9.604 14.447 2.122 829 HG2 ARG 102 HG2 ARG 102 10.428 12.092 2.196 830 HG3 ARG 102 HG3 ARG 102 12.015 12.665 1.629 831 HD2 ARG 102 HD2 ARG 102 10.515 13.610 4.098 832 HD3 ARG 102 HD3 ARG 102 11.808 12.406 4.133 833 HE ARG 102 HE ARG 102 13.274 14.270 3.141 834 HH11 ARG 102 HH11 ARG 102 14.211 16.120 3.867 835 HH12 ARG 102 HH12 ARG 102 13.434 17.077 5.091 836 HH21 ARG 102 HH21 ARG 102 10.669 15.068 5.440 837 HH22 ARG 102 HH22 ARG 102 11.522 16.497 5.948 838 H SER 103 H SER 103 10.408 11.678 -1.037 839 HA SER 103 HA SER 103 8.143 10.064 -0.044 840 HB2 SER 103 HB2 SER 103 7.191 9.608 -2.193 841 HB3 SER 103 HB3 SER 103 7.280 11.363 -1.991 842 HG SER 103 HG SER 103 9.335 11.199 -3.187 843 H ALA 104 H ALA 104 8.142 7.833 -0.657 844 HA ALA 104 HA ALA 104 10.465 6.708 -2.071 845 HB1 ALA 104 HB1 ALA 104 9.745 5.891 0.784 846 HB2 ALA 104 HB2 ALA 104 10.943 5.092 -0.257 847 HB3 ALA 104 HB3 ALA 104 11.220 6.757 0.291 848 H PHE 105 H PHE 105 10.041 4.692 -2.995 849 HA PHE 105 HA PHE 105 7.220 3.716 -2.918 850 HB2 PHE 105 HB2 PHE 105 9.533 3.188 -4.797 851 HB3 PHE 105 HB3 PHE 105 8.106 2.176 -4.746 852 HD1 PHE 105 HD1 PHE 105 5.969 2.896 -5.633 853 HD2 PHE 105 HD2 PHE 105 9.338 5.580 -5.605 854 HE1 PHE 105 HE1 PHE 105 4.777 4.374 -7.204 855 HE2 PHE 105 HE2 PHE 105 8.143 7.076 -7.191 856 HZ PHE 105 HZ PHE 105 5.869 6.469 -8.006 857 H ILE 106 H ILE 106 6.753 2.241 -1.443 858 HA ILE 106 HA ILE 106 8.836 0.242 -0.627 859 HB ILE 106 HB ILE 106 7.931 0.067 1.537 860 HG12 ILE 106 HG12 ILE 106 5.858 2.195 0.863 861 HG13 ILE 106 HG13 ILE 106 5.522 0.473 1.048 862 HG21 ILE 106 HG21 ILE 106 8.232 3.033 0.937 863 HG22 ILE 106 HG22 ILE 106 8.619 2.191 2.455 864 HG23 ILE 106 HG23 ILE 106 9.586 1.883 0.999 865 HD11 ILE 106 HD11 ILE 106 6.296 0.541 3.396 866 HD12 ILE 106 HD12 ILE 106 6.485 2.303 3.266 867 HD13 ILE 106 HD13 ILE 106 4.887 1.567 3.073 868 H GLY 107 H GLY 107 8.252 -1.906 -0.394 869 HA2 GLY 107 HA2 GLY 107 5.835 -2.749 -1.909 870 HA3 GLY 107 HA3 GLY 107 7.212 -3.759 -1.480 871 H ILE 108 H ILE 108 4.239 -3.953 -0.959 872 HA ILE 108 HA ILE 108 4.518 -4.771 1.858 873 HB ILE 108 HB ILE 108 2.143 -4.331 2.270 874 HG12 ILE 108 HG12 ILE 108 2.193 -2.461 -0.131 875 HG13 ILE 108 HG13 ILE 108 1.400 -4.036 -0.115 876 HG21 ILE 108 HG21 ILE 108 3.866 -1.881 1.762 877 HG22 ILE 108 HG22 ILE 108 2.497 -1.990 2.889 878 HG23 ILE 108 HG23 ILE 108 3.937 -2.965 3.170 879 HD11 ILE 108 HD11 ILE 108 0.655 -1.671 1.658 880 HD12 ILE 108 HD12 ILE 108 -0.267 -2.353 0.311 881 HD13 ILE 108 HD13 ILE 108 -0.034 -3.296 1.796 882 H GLY 109 H GLY 109 3.796 -6.704 2.380 883 HA2 GLY 109 HA2 GLY 109 2.440 -8.397 0.307 884 HA3 GLY 109 HA3 GLY 109 3.680 -8.997 1.409 885 H PHE 110 H PHE 110 0.797 -9.654 0.867 886 HA PHE 110 HA PHE 110 -0.440 -9.277 3.559 887 HB2 PHE 110 HB2 PHE 110 -1.541 -9.948 0.814 888 HB3 PHE 110 HB3 PHE 110 -2.496 -10.087 2.274 889 HD1 PHE 110 HD1 PHE 110 -0.362 -7.527 0.466 890 HD2 PHE 110 HD2 PHE 110 -3.805 -8.293 2.957 891 HE1 PHE 110 HE1 PHE 110 -0.897 -5.117 0.477 892 HE2 PHE 110 HE2 PHE 110 -4.400 -5.893 2.854 893 HZ PHE 110 HZ PHE 110 -2.911 -4.293 1.645 894 H THR 111 H THR 111 -1.688 -11.097 4.423 895 HA THR 111 HA THR 111 -0.142 -13.571 4.411 896 HB THR 111 HB THR 111 -1.178 -12.524 6.420 897 HG1 THR 111 HG1 THR 111 -1.745 -14.498 7.311 898 HG21 THR 111 HG21 THR 111 -3.801 -13.706 5.413 899 HG22 THR 111 HG22 THR 111 -3.505 -12.926 6.979 900 HG23 THR 111 HG23 THR 111 -3.430 -11.970 5.495 901 H ASP 112 H ASP 112 -2.972 -12.477 2.686 902 HA ASP 112 HA ASP 112 -3.077 -14.971 1.187 903 HB2 ASP 112 HB2 ASP 112 -4.517 -15.388 3.245 904 HB3 ASP 112 HB3 ASP 112 -5.561 -14.073 2.709 905 H ARG 113 H ARG 113 -4.245 -14.790 -0.770 906 HA ARG 113 HA ARG 113 -4.276 -12.194 -2.002 907 HB2 ARG 113 HB2 ARG 113 -3.839 -14.384 -3.123 908 HB3 ARG 113 HB3 ARG 113 -5.546 -14.806 -2.932 909 HG2 ARG 113 HG2 ARG 113 -6.210 -12.899 -4.326 910 HG3 ARG 113 HG3 ARG 113 -4.533 -12.351 -4.445 911 HD2 ARG 113 HD2 ARG 113 -5.565 -15.040 -5.447 912 HD3 ARG 113 HD3 ARG 113 -5.408 -13.591 -6.452 913 HE ARG 113 HE ARG 113 -2.894 -14.187 -5.164 914 HH11 ARG 113 HH11 ARG 113 -1.183 -15.056 -6.311 915 HH12 ARG 113 HH12 ARG 113 -1.496 -15.862 -7.822 916 HH21 ARG 113 HH21 ARG 113 -4.880 -15.364 -7.799 917 HH22 ARG 113 HH22 ARG 113 -3.512 -16.008 -8.663 918 H GLY 114 H GLY 114 -6.878 -14.039 -0.433 919 HA2 GLY 114 HA2 GLY 114 -9.075 -12.425 -1.361 920 HA3 GLY 114 HA3 GLY 114 -9.030 -13.424 0.097 921 H ASP 115 H ASP 115 -6.702 -11.935 1.242 922 HA ASP 115 HA ASP 115 -8.177 -9.639 2.385 923 HB2 ASP 115 HB2 ASP 115 -5.501 -10.923 3.041 924 HB3 ASP 115 HB3 ASP 115 -6.095 -9.452 3.811 925 H ALA 116 H ALA 116 -5.282 -10.193 0.327 926 HA ALA 116 HA ALA 116 -4.621 -7.442 -0.088 927 HB1 ALA 116 HB1 ALA 116 -4.370 -9.913 -1.847 928 HB2 ALA 116 HB2 ALA 116 -3.499 -8.400 -2.090 929 HB3 ALA 116 HB3 ALA 116 -3.201 -9.360 -0.627 930 H PHE 117 H PHE 117 -7.050 -9.540 -1.713 931 HA PHE 117 HA PHE 117 -7.825 -7.647 -3.689 932 HB2 PHE 117 HB2 PHE 117 -8.939 -10.129 -2.565 933 HB3 PHE 117 HB3 PHE 117 -10.181 -8.978 -3.007 934 HD1 PHE 117 HD1 PHE 117 -6.987 -10.424 -4.411 935 HD2 PHE 117 HD2 PHE 117 -10.936 -8.894 -5.227 936 HE1 PHE 117 HE1 PHE 117 -6.719 -11.010 -6.810 937 HE2 PHE 117 HE2 PHE 117 -10.662 -9.473 -7.625 938 HZ PHE 117 HZ PHE 117 -8.557 -10.535 -8.420 939 H ASP 118 H ASP 118 -8.740 -7.712 -0.221 940 HA ASP 118 HA ASP 118 -10.761 -5.650 -0.548 941 HB2 ASP 118 HB2 ASP 118 -9.249 -6.659 1.891 942 HB3 ASP 118 HB3 ASP 118 -10.466 -5.394 1.962 943 H PHE 119 H PHE 119 -7.246 -5.507 -0.001 944 HA PHE 119 HA PHE 119 -7.007 -2.674 0.489 945 HB2 PHE 119 HB2 PHE 119 -5.148 -4.080 0.883 946 HB3 PHE 119 HB3 PHE 119 -5.184 -4.764 -0.723 947 HD1 PHE 119 HD1 PHE 119 -4.535 -3.378 -2.744 948 HD2 PHE 119 HD2 PHE 119 -3.825 -2.106 1.309 949 HE1 PHE 119 HE1 PHE 119 -2.965 -1.655 -3.559 950 HE2 PHE 119 HE2 PHE 119 -2.286 -0.373 0.497 951 HZ PHE 119 HZ PHE 119 -1.836 -0.127 -1.941 952 H ASN 120 H ASN 120 -7.165 -4.564 -2.508 953 HA ASN 120 HA ASN 120 -6.883 -2.229 -4.212 954 HB2 ASN 120 HB2 ASN 120 -5.877 -4.264 -4.933 955 HB3 ASN 120 HB3 ASN 120 -7.273 -5.233 -4.484 956 HD21 ASN 120 HD21 ASN 120 -8.435 -5.346 -7.734 957 HD22 ASN 120 HD22 ASN 120 -8.441 -6.011 -6.110 958 H VAL 121 H VAL 121 -9.681 -4.224 -3.211 959 HA VAL 121 HA VAL 121 -11.493 -2.903 -5.049 960 HB VAL 121 HB VAL 121 -11.956 -4.772 -2.715 961 HG11 VAL 121 HG11 VAL 121 -14.022 -3.606 -4.635 962 HG12 VAL 121 HG12 VAL 121 -14.294 -4.996 -3.561 963 HG13 VAL 121 HG13 VAL 121 -13.983 -3.406 -2.868 964 HG21 VAL 121 HG21 VAL 121 -12.544 -6.357 -4.502 965 HG22 VAL 121 HG22 VAL 121 -12.325 -5.097 -5.737 966 HG23 VAL 121 HG23 VAL 121 -10.934 -5.706 -4.828 967 H SER 122 H SER 122 -10.745 -2.423 -1.558 968 HA SER 122 HA SER 122 -12.806 -0.501 -1.092 969 HB2 SER 122 HB2 SER 122 -11.507 0.164 0.867 970 HB3 SER 122 HB3 SER 122 -11.632 -1.600 0.738 971 HG SER 122 HG SER 122 -9.571 -1.736 0.140 972 H LEU 123 H LEU 123 -9.616 -0.083 -2.556 973 HA LEU 123 HA LEU 123 -9.767 2.834 -2.642 974 HB2 LEU 123 HB2 LEU 123 -8.064 0.767 -4.074 975 HB3 LEU 123 HB3 LEU 123 -7.908 2.501 -4.351 976 HG LEU 123 HG LEU 123 -7.509 1.205 -1.622 977 HD11 LEU 123 HD11 LEU 123 -5.445 2.113 -3.674 978 HD12 LEU 123 HD12 LEU 123 -5.114 1.470 -2.045 979 HD13 LEU 123 HD13 LEU 123 -5.831 0.427 -3.274 980 HD21 LEU 123 HD21 LEU 123 -8.069 3.600 -1.475 981 HD22 LEU 123 HD22 LEU 123 -6.367 3.342 -1.100 982 HD23 LEU 123 HD23 LEU 123 -6.826 3.981 -2.690 983 H GLN 124 H GLN 124 -10.225 0.294 -5.200 984 HA GLN 124 HA GLN 124 -10.901 2.251 -7.148 985 HB2 GLN 124 HB2 GLN 124 -11.246 0.489 -8.645 986 HB3 GLN 124 HB3 GLN 124 -10.039 -0.110 -7.508 987 HG2 GLN 124 HG2 GLN 124 -11.970 -1.241 -6.270 988 HG3 GLN 124 HG3 GLN 124 -12.988 -0.846 -7.654 989 HE21 GLN 124 HE21 GLN 124 -9.987 -3.642 -8.111 990 HE22 GLN 124 HE22 GLN 124 -9.849 -2.440 -6.831 991 H ASP 125 H ASP 125 -12.995 0.546 -4.886 992 HA ASP 125 HA ASP 125 -15.444 1.637 -6.098 993 HB2 ASP 125 HB2 ASP 125 -15.286 -0.729 -5.307 994 HB3 ASP 125 HB3 ASP 125 -15.087 -0.128 -3.657 995 H HIS 126 H HIS 126 -13.129 2.967 -4.172 996 HA HIS 126 HA HIS 126 -15.093 4.800 -2.862 997 HB2 HIS 126 HB2 HIS 126 -13.304 4.013 -1.413 998 HB3 HIS 126 HB3 HIS 126 -12.081 4.600 -2.551 999 HD2 HIS 126 HD2 HIS 126 -11.223 6.998 -2.105 1000 HE1 HIS 126 HE1 HIS 126 -14.391 8.471 0.341 1001 HE2 HIS 126 HE2 HIS 126 -12.079 8.973 -0.589 1002 H PHE 127 H PHE 127 -12.588 4.666 -5.390 1003 HA PHE 127 HA PHE 127 -12.964 7.510 -6.043 1004 HB2 PHE 127 HB2 PHE 127 -11.171 5.299 -7.076 1005 HB3 PHE 127 HB3 PHE 127 -11.255 6.866 -7.861 1006 HD1 PHE 127 HD1 PHE 127 -9.490 5.040 -5.434 1007 HD2 PHE 127 HD2 PHE 127 -10.997 8.984 -6.274 1008 HE1 PHE 127 HE1 PHE 127 -7.653 6.021 -4.090 1009 HE2 PHE 127 HE2 PHE 127 -9.180 9.969 -4.896 1010 HZ PHE 127 HZ PHE 127 -7.492 8.489 -3.833 1011 H LYS 128 H LYS 128 -14.845 4.854 -6.999 1012 HA LYS 128 HA LYS 128 -15.019 5.187 -9.755 1013 HB2 LYS 128 HB2 LYS 128 -17.001 4.011 -9.822 1014 HB3 LYS 128 HB3 LYS 128 -16.042 3.322 -8.532 1015 HG2 LYS 128 HG2 LYS 128 -18.378 5.264 -8.118 1016 HG3 LYS 128 HG3 LYS 128 -18.503 3.506 -8.118 1017 HD2 LYS 128 HD2 LYS 128 -16.832 3.434 -6.245 1018 HD3 LYS 128 HD3 LYS 128 -16.899 5.200 -6.165 1019 HE2 LYS 128 HE2 LYS 128 -18.337 4.424 -4.486 1020 HE3 LYS 128 HE3 LYS 128 -19.362 5.050 -5.791 1021 HZ1 LYS 128 HZ1 LYS 128 -18.713 2.158 -5.404 1022 HZ2 LYS 128 HZ2 LYS 128 -20.095 2.857 -4.872 1023 HZ3 LYS 128 HZ3 LYS 128 -19.790 2.764 -6.471 1024 H TRP 129 H TRP 129 -16.617 7.271 -7.434 1025 HA TRP 129 HA TRP 129 -18.148 8.718 -9.451 1026 HB2 TRP 129 HB2 TRP 129 -18.739 10.211 -7.654 1027 HB3 TRP 129 HB3 TRP 129 -18.900 8.547 -7.119 1028 HD1 TRP 129 HD1 TRP 129 -16.831 7.624 -5.504 1029 HE1 TRP 129 HE1 TRP 129 -15.365 8.805 -3.819 1030 HE3 TRP 129 HE3 TRP 129 -17.864 12.473 -6.824 1031 HZ2 TRP 129 HZ2 TRP 129 -14.907 11.538 -2.920 1032 HZ3 TRP 129 HZ3 TRP 129 -16.979 14.345 -5.456 1033 HH2 TRP 129 HH2 TRP 129 -15.498 13.894 -3.509 1034 H VAL 130 H VAL 130 -14.935 9.096 -8.020 1035 HA VAL 130 HA VAL 130 -14.370 11.697 -9.210 1036 HB VAL 130 HB VAL 130 -12.411 9.594 -8.208 1037 HG11 VAL 130 HG11 VAL 130 -10.893 11.524 -7.896 1038 HG12 VAL 130 HG12 VAL 130 -11.319 11.313 -9.594 1039 HG13 VAL 130 HG13 VAL 130 -12.099 12.597 -8.641 1040 HG21 VAL 130 HG21 VAL 130 -13.895 10.185 -6.367 1041 HG22 VAL 130 HG22 VAL 130 -12.358 11.012 -6.127 1042 HG23 VAL 130 HG23 VAL 130 -13.754 11.914 -6.750 1043 H LYS 131 H LYS 131 -13.888 8.306 -10.131 1044 HA LYS 131 HA LYS 131 -12.780 8.925 -12.764 1045 HB2 LYS 131 HB2 LYS 131 -13.824 6.362 -11.484 1046 HB3 LYS 131 HB3 LYS 131 -13.132 6.413 -13.101 1047 HG2 LYS 131 HG2 LYS 131 -10.975 7.124 -12.273 1048 HG3 LYS 131 HG3 LYS 131 -11.573 7.249 -10.612 1049 HD2 LYS 131 HD2 LYS 131 -11.715 4.650 -12.193 1050 HD3 LYS 131 HD3 LYS 131 -10.277 5.098 -11.269 1051 HE2 LYS 131 HE2 LYS 131 -11.308 4.905 -9.213 1052 HE3 LYS 131 HE3 LYS 131 -12.914 5.275 -9.856 1053 HZ1 LYS 131 HZ1 LYS 131 -13.001 3.100 -10.857 1054 HZ2 LYS 131 HZ2 LYS 131 -11.504 2.709 -10.296 1055 HZ3 LYS 131 HZ3 LYS 131 -12.757 2.941 -9.242 1056 H GLN 132 H GLN 132 -15.691 9.386 -11.688 1057 HA GLN 132 HA GLN 132 -17.847 9.564 -12.462 1058 HB2 GLN 132 HB2 GLN 132 -16.361 10.261 -14.989 1059 HB3 GLN 132 HB3 GLN 132 -18.029 10.718 -14.608 1060 HG2 GLN 132 HG2 GLN 132 -17.222 12.026 -12.640 1061 HG3 GLN 132 HG3 GLN 132 -15.553 11.669 -13.101 1062 HE21 GLN 132 HE21 GLN 132 -15.575 13.932 -15.911 1063 HE22 GLN 132 HE22 GLN 132 -14.812 12.474 -15.295 1064 H GLU 133 H GLU 133 -16.914 6.907 -12.645 1065 HA GLU 133 HA GLU 133 -18.258 5.794 -15.040 1066 HB2 GLU 133 HB2 GLU 133 -17.199 3.725 -14.650 1067 HB3 GLU 133 HB3 GLU 133 -15.988 4.997 -14.534 1068 HG2 GLU 133 HG2 GLU 133 -16.103 4.868 -12.053 1069 HG3 GLU 133 HG3 GLU 133 -17.297 3.568 -12.175 Start of MODEL 8 1 H1 GLY -4 H1 GLY -4 7.135 6.045 18.744 2 H2 GLY -4 H2 GLY -4 6.009 6.207 19.915 3 H3 GLY -4 H3 GLY -4 7.539 6.739 20.183 4 HA2 GLY -4 HA2 GLY -4 7.329 8.469 18.564 5 HA3 GLY -4 HA3 GLY -4 5.737 7.827 18.118 6 H SER -3 H SER -3 6.751 10.486 19.333 7 HA SER -3 HA SER -3 5.358 10.649 21.897 8 HB2 SER -3 HB2 SER -3 6.040 13.072 21.729 9 HB3 SER -3 HB3 SER -3 7.356 11.892 21.716 10 HG SER -3 HG SER -3 7.720 13.416 20.119 11 HA PRO -2 HA PRO -2 1.442 12.016 20.329 12 HB2 PRO -2 HB2 PRO -2 0.450 13.575 22.334 13 HB3 PRO -2 HB3 PRO -2 0.677 11.810 22.486 14 HG2 PRO -2 HG2 PRO -2 2.537 14.007 23.446 15 HG3 PRO -2 HG3 PRO -2 1.950 12.576 24.350 16 HD2 PRO -2 HD2 PRO -2 4.377 12.615 23.113 17 HD3 PRO -2 HD3 PRO -2 3.388 11.129 23.182 18 H ASN -1 H ASN -1 1.919 13.160 18.519 19 HA ASN -1 HA ASN -1 2.607 16.059 18.691 20 HB2 ASN -1 HB2 ASN -1 2.855 13.984 16.483 21 HB3 ASN -1 HB3 ASN -1 3.045 15.709 16.192 22 HD21 ASN -1 HD21 ASN -1 5.976 13.753 18.295 23 HD22 ASN -1 HD22 ASN -1 4.438 12.973 18.044 24 H SER 0 H SER 0 -0.261 14.291 18.389 25 HA SER 0 HA SER 0 -1.581 15.656 16.267 26 HB2 SER 0 HB2 SER 0 -3.653 14.746 17.316 27 HB3 SER 0 HB3 SER 0 -2.382 13.542 17.040 28 HG SER 0 HG SER 0 -3.326 13.369 19.138 29 H MET 1 H MET 1 -0.919 16.780 19.485 30 HA MET 1 HA MET 1 -2.922 18.878 19.543 31 HB2 MET 1 HB2 MET 1 -0.339 18.649 21.144 32 HB3 MET 1 HB3 MET 1 -1.724 19.682 21.492 33 HG2 MET 1 HG2 MET 1 -2.039 17.946 22.964 34 HG3 MET 1 HG3 MET 1 -3.111 17.512 21.636 35 HE1 MET 1 HE1 MET 1 -3.386 15.049 22.435 36 HE2 MET 1 HE2 MET 1 -2.040 14.001 22.935 37 HE3 MET 1 HE3 MET 1 -2.425 15.459 23.876 38 H ALA 2 H ALA 2 -0.326 18.590 17.519 39 HA ALA 2 HA ALA 2 -0.095 21.531 17.072 40 HB1 ALA 2 HB1 ALA 2 2.350 21.291 16.819 41 HB2 ALA 2 HB2 ALA 2 1.829 20.860 18.459 42 HB3 ALA 2 HB3 ALA 2 2.246 19.582 17.296 43 H THR 3 H THR 3 0.738 18.278 15.767 44 HA THR 3 HA THR 3 0.228 19.105 12.976 45 HB THR 3 HB THR 3 0.606 16.299 14.070 46 HG1 THR 3 HG1 THR 3 2.536 18.119 13.050 47 HG21 THR 3 HG21 THR 3 1.378 15.844 11.750 48 HG22 THR 3 HG22 THR 3 -0.295 16.421 11.767 49 HG23 THR 3 HG23 THR 3 1.008 17.528 11.298 50 H GLU 4 H GLU 4 -1.811 20.009 13.799 51 HA GLU 4 HA GLU 4 -3.727 18.192 14.988 52 HB2 GLU 4 HB2 GLU 4 -3.071 20.471 15.817 53 HB3 GLU 4 HB3 GLU 4 -4.013 21.164 14.492 54 HG2 GLU 4 HG2 GLU 4 -6.015 19.829 15.370 55 HG3 GLU 4 HG3 GLU 4 -4.996 19.321 16.719 56 H LEU 5 H LEU 5 -4.227 16.838 13.259 57 HA LEU 5 HA LEU 5 -6.656 17.831 11.874 58 HB2 LEU 5 HB2 LEU 5 -6.328 16.695 9.906 59 HB3 LEU 5 HB3 LEU 5 -4.884 17.626 10.218 60 HG LEU 5 HG LEU 5 -3.964 15.336 11.200 61 HD11 LEU 5 HD11 LEU 5 -6.086 14.043 10.953 62 HD12 LEU 5 HD12 LEU 5 -6.095 14.395 9.218 63 HD13 LEU 5 HD13 LEU 5 -4.816 13.384 9.925 64 HD21 LEU 5 HD21 LEU 5 -3.046 16.524 9.255 65 HD22 LEU 5 HD22 LEU 5 -3.099 14.780 8.954 66 HD23 LEU 5 HD23 LEU 5 -4.322 15.843 8.219 67 H GLU 6 H GLU 6 -8.397 16.645 11.962 68 HA GLU 6 HA GLU 6 -8.374 14.013 13.344 69 HB2 GLU 6 HB2 GLU 6 -8.718 15.973 14.952 70 HB3 GLU 6 HB3 GLU 6 -10.259 16.264 14.147 71 HG2 GLU 6 HG2 GLU 6 -10.951 13.909 14.757 72 HG3 GLU 6 HG3 GLU 6 -9.388 13.679 15.532 73 H TYR 7 H TYR 7 -8.503 14.020 10.717 74 HA TYR 7 HA TYR 7 -11.324 13.382 10.099 75 HB2 TYR 7 HB2 TYR 7 -11.334 14.494 8.031 76 HB3 TYR 7 HB3 TYR 7 -10.798 15.682 9.190 77 HD1 TYR 7 HD1 TYR 7 -9.658 13.393 6.434 78 HD2 TYR 7 HD2 TYR 7 -8.628 16.741 8.963 79 HE1 TYR 7 HE1 TYR 7 -7.734 13.890 4.974 80 HE2 TYR 7 HE2 TYR 7 -6.628 17.182 7.534 81 HH TYR 7 HH TYR 7 -5.908 15.234 4.613 82 H GLU 8 H GLU 8 -11.521 11.466 9.092 83 HA GLU 8 HA GLU 8 -9.990 10.689 6.924 84 HB2 GLU 8 HB2 GLU 8 -8.892 8.661 7.662 85 HB3 GLU 8 HB3 GLU 8 -8.223 10.031 8.523 86 HG2 GLU 8 HG2 GLU 8 -9.619 9.414 10.521 87 HG3 GLU 8 HG3 GLU 8 -10.163 7.978 9.635 88 H SER 9 H SER 9 -11.376 9.541 5.720 89 HA SER 9 HA SER 9 -13.671 8.118 6.964 90 HB2 SER 9 HB2 SER 9 -12.943 8.838 4.103 91 HB3 SER 9 HB3 SER 9 -14.283 7.749 4.520 92 HG SER 9 HG SER 9 -15.149 9.758 4.342 93 H VAL 10 H VAL 10 -13.054 6.089 7.667 94 HA VAL 10 HA VAL 10 -10.802 4.643 6.545 95 HB VAL 10 HB VAL 10 -13.000 3.633 8.396 96 HG11 VAL 10 HG11 VAL 10 -10.220 2.518 7.796 97 HG12 VAL 10 HG12 VAL 10 -11.281 1.967 9.111 98 HG13 VAL 10 HG13 VAL 10 -11.783 1.733 7.441 99 HG21 VAL 10 HG21 VAL 10 -11.768 5.558 9.386 100 HG22 VAL 10 HG22 VAL 10 -11.391 4.051 10.216 101 HG23 VAL 10 HG23 VAL 10 -10.229 4.730 9.063 102 H LEU 11 H LEU 11 -10.647 2.845 5.305 103 HA LEU 11 HA LEU 11 -13.014 2.119 3.605 104 HB2 LEU 11 HB2 LEU 11 -10.154 2.712 2.756 105 HB3 LEU 11 HB3 LEU 11 -11.376 2.018 1.705 106 HG LEU 11 HG LEU 11 -11.514 4.801 2.939 107 HD11 LEU 11 HD11 LEU 11 -10.878 3.828 0.121 108 HD12 LEU 11 HD12 LEU 11 -11.175 5.517 0.569 109 HD13 LEU 11 HD13 LEU 11 -9.781 4.671 1.239 110 HD21 LEU 11 HD21 LEU 11 -13.385 5.145 1.340 111 HD22 LEU 11 HD22 LEU 11 -13.313 3.427 0.887 112 HD23 LEU 11 HD23 LEU 11 -13.780 3.911 2.535 113 H CYS 12 H CYS 12 -9.787 1.078 4.796 114 HA CYS 12 HA CYS 12 -10.833 -1.631 5.177 115 HB2 CYS 12 HB2 CYS 12 -9.966 -1.574 2.779 116 HB3 CYS 12 HB3 CYS 12 -8.355 -1.254 3.456 117 HG CYS 12 HG CYS 12 -10.402 -3.811 3.977 118 H VAL 13 H VAL 13 -9.972 -2.533 6.926 119 HA VAL 13 HA VAL 13 -7.286 -1.680 7.895 120 HB VAL 13 HB VAL 13 -9.766 -2.061 9.606 121 HG11 VAL 13 HG11 VAL 13 -8.298 -1.543 11.537 122 HG12 VAL 13 HG12 VAL 13 -7.840 -3.067 10.776 123 HG13 VAL 13 HG13 VAL 13 -6.875 -1.601 10.478 124 HG21 VAL 13 HG21 VAL 13 -7.916 0.325 9.200 125 HG22 VAL 13 HG22 VAL 13 -9.564 0.185 8.564 126 HG23 VAL 13 HG23 VAL 13 -9.302 0.266 10.310 127 H LYS 14 H LYS 14 -5.955 -3.311 8.151 128 HA LYS 14 HA LYS 14 -6.974 -6.077 8.539 129 HB2 LYS 14 HB2 LYS 14 -4.789 -5.305 6.562 130 HB3 LYS 14 HB3 LYS 14 -5.214 -6.943 7.000 131 HG2 LYS 14 HG2 LYS 14 -7.142 -4.997 5.656 132 HG3 LYS 14 HG3 LYS 14 -6.134 -6.171 4.807 133 HD2 LYS 14 HD2 LYS 14 -7.217 -8.021 6.034 134 HD3 LYS 14 HD3 LYS 14 -8.280 -6.861 6.862 135 HE2 LYS 14 HE2 LYS 14 -9.247 -6.158 4.735 136 HE3 LYS 14 HE3 LYS 14 -8.110 -7.185 3.845 137 HZ1 LYS 14 HZ1 LYS 14 -10.176 -8.191 5.730 138 HZ2 LYS 14 HZ2 LYS 14 -10.246 -8.294 4.092 139 HZ3 LYS 14 HZ3 LYS 14 -9.090 -9.121 4.916 140 HA PRO 15 HA PRO 15 -3.924 -5.892 11.774 141 HB2 PRO 15 HB2 PRO 15 -3.836 -8.498 12.564 142 HB3 PRO 15 HB3 PRO 15 -5.261 -7.447 12.858 143 HG2 PRO 15 HG2 PRO 15 -4.834 -9.422 10.585 144 HG3 PRO 15 HG3 PRO 15 -6.267 -9.268 11.657 145 HD2 PRO 15 HD2 PRO 15 -6.182 -8.129 9.195 146 HD3 PRO 15 HD3 PRO 15 -6.975 -7.302 10.573 147 H ASP 16 H ASP 16 -3.453 -7.873 8.913 148 HA ASP 16 HA ASP 16 -0.547 -8.125 9.493 149 HB2 ASP 16 HB2 ASP 16 -0.450 -9.909 7.956 150 HB3 ASP 16 HB3 ASP 16 -1.716 -10.247 9.128 151 H VAL 17 H VAL 17 0.717 -6.714 8.605 152 HA VAL 17 HA VAL 17 0.830 -6.757 5.735 153 HB VAL 17 HB VAL 17 -0.581 -4.763 5.974 154 HG11 VAL 17 HG11 VAL 17 1.751 -3.475 7.434 155 HG12 VAL 17 HG12 VAL 17 0.259 -2.674 6.889 156 HG13 VAL 17 HG13 VAL 17 0.189 -3.926 8.136 157 HG21 VAL 17 HG21 VAL 17 0.985 -4.965 4.082 158 HG22 VAL 17 HG22 VAL 17 0.659 -3.285 4.537 159 HG23 VAL 17 HG23 VAL 17 2.200 -4.030 4.994 160 H SER 18 H SER 18 2.896 -6.561 4.994 161 HA SER 18 HA SER 18 5.085 -6.012 6.953 162 HB2 SER 18 HB2 SER 18 6.377 -7.862 5.844 163 HB3 SER 18 HB3 SER 18 5.031 -8.380 6.868 164 HG SER 18 HG SER 18 3.795 -8.787 5.063 165 H VAL 19 H VAL 19 6.901 -4.987 6.147 166 HA VAL 19 HA VAL 19 6.635 -3.834 3.394 167 HB VAL 19 HB VAL 19 7.811 -2.618 5.901 168 HG11 VAL 19 HG11 VAL 19 7.883 -1.604 3.017 169 HG12 VAL 19 HG12 VAL 19 8.200 -0.589 4.447 170 HG13 VAL 19 HG13 VAL 19 9.273 -1.934 4.077 171 HG21 VAL 19 HG21 VAL 19 5.262 -2.520 5.490 172 HG22 VAL 19 HG22 VAL 19 6.103 -0.981 5.713 173 HG23 VAL 19 HG23 VAL 19 5.645 -1.503 4.089 174 H TYR 20 H TYR 20 8.098 -4.216 1.981 175 HA TYR 20 HA TYR 20 10.913 -4.720 2.779 176 HB2 TYR 20 HB2 TYR 20 10.529 -6.313 0.495 177 HB3 TYR 20 HB3 TYR 20 10.891 -6.819 2.132 178 HD1 TYR 20 HD1 TYR 20 9.349 -8.033 3.447 179 HD2 TYR 20 HD2 TYR 20 8.050 -6.128 -0.196 180 HE1 TYR 20 HE1 TYR 20 7.130 -9.137 3.666 181 HE2 TYR 20 HE2 TYR 20 5.827 -7.260 0.015 182 HH TYR 20 HH TYR 20 5.021 -9.232 2.880 183 H ARG 21 H ARG 21 12.087 -3.238 1.948 184 HA ARG 21 HA ARG 21 11.179 -1.439 -0.129 185 HB2 ARG 21 HB2 ARG 21 13.945 -1.722 1.112 186 HB3 ARG 21 HB3 ARG 21 13.388 -0.381 0.094 187 HG2 ARG 21 HG2 ARG 21 11.574 0.104 1.769 188 HG3 ARG 21 HG3 ARG 21 12.214 -1.187 2.799 189 HD2 ARG 21 HD2 ARG 21 14.434 0.046 2.791 190 HD3 ARG 21 HD3 ARG 21 13.595 1.403 2.031 191 HE ARG 21 HE ARG 21 13.091 0.259 4.775 192 HH11 ARG 21 HH11 ARG 21 12.136 1.298 6.223 193 HH12 ARG 21 HH12 ARG 21 11.509 2.933 5.989 194 HH21 ARG 21 HH21 ARG 21 12.476 2.999 2.656 195 HH22 ARG 21 HH22 ARG 21 11.688 3.870 3.943 196 H ILE 22 H ILE 22 11.577 -1.357 -2.200 197 HA ILE 22 HA ILE 22 12.010 -3.989 -3.311 198 HB ILE 22 HB ILE 22 10.935 -3.097 -5.344 199 HG12 ILE 22 HG12 ILE 22 10.820 -0.445 -3.847 200 HG13 ILE 22 HG13 ILE 22 11.727 -0.789 -5.324 201 HG21 ILE 22 HG21 ILE 22 9.425 -2.402 -2.802 202 HG22 ILE 22 HG22 ILE 22 8.750 -2.962 -4.345 203 HG23 ILE 22 HG23 ILE 22 9.716 -4.058 -3.364 204 HD11 ILE 22 HD11 ILE 22 9.506 -1.357 -6.434 205 HD12 ILE 22 HD12 ILE 22 8.708 -0.700 -4.991 206 HD13 ILE 22 HD13 ILE 22 9.732 0.348 -5.987 207 HA PRO 23 HA PRO 23 15.877 -3.483 -5.507 208 HB2 PRO 23 HB2 PRO 23 15.495 -5.119 -7.684 209 HB3 PRO 23 HB3 PRO 23 15.692 -5.753 -6.021 210 HG2 PRO 23 HG2 PRO 23 13.093 -5.181 -7.502 211 HG3 PRO 23 HG3 PRO 23 13.587 -6.706 -6.695 212 HD2 PRO 23 HD2 PRO 23 12.049 -4.925 -5.413 213 HD3 PRO 23 HD3 PRO 23 13.374 -5.738 -4.534 214 HA PRO 24 HA PRO 24 15.251 -0.431 -8.754 215 HB2 PRO 24 HB2 PRO 24 17.230 -0.940 -10.596 216 HB3 PRO 24 HB3 PRO 24 17.517 -0.209 -8.990 217 HG2 PRO 24 HG2 PRO 24 17.805 -3.128 -9.772 218 HG3 PRO 24 HG3 PRO 24 18.972 -2.097 -8.882 219 HD2 PRO 24 HD2 PRO 24 17.302 -3.757 -7.568 220 HD3 PRO 24 HD3 PRO 24 17.643 -2.130 -6.920 221 H ARG 25 H ARG 25 13.283 -0.924 -9.475 222 HA ARG 25 HA ARG 25 12.919 -2.278 -12.074 223 HB2 ARG 25 HB2 ARG 25 11.982 -3.312 -9.428 224 HB3 ARG 25 HB3 ARG 25 10.688 -3.124 -10.589 225 HG2 ARG 25 HG2 ARG 25 13.183 -4.785 -11.100 226 HG3 ARG 25 HG3 ARG 25 11.606 -5.388 -10.567 227 HD2 ARG 25 HD2 ARG 25 10.639 -4.175 -12.646 228 HD3 ARG 25 HD3 ARG 25 12.302 -4.113 -13.237 229 HE ARG 25 HE ARG 25 10.506 -6.431 -13.006 230 HH11 ARG 25 HH11 ARG 25 10.928 -8.120 -14.285 231 HH12 ARG 25 HH12 ARG 25 12.559 -8.490 -14.772 232 HH21 ARG 25 HH21 ARG 25 13.908 -5.648 -13.379 233 HH22 ARG 25 HH22 ARG 25 14.213 -7.088 -14.307 234 H ALA 26 H ALA 26 10.795 -1.857 -12.977 235 HA ALA 26 HA ALA 26 9.401 0.594 -12.030 236 HB1 ALA 26 HB1 ALA 26 10.379 0.058 -14.875 237 HB2 ALA 26 HB2 ALA 26 9.443 1.468 -14.337 238 HB3 ALA 26 HB3 ALA 26 11.102 1.232 -13.750 239 H SER 27 H SER 27 7.259 0.806 -12.973 240 HA SER 27 HA SER 27 5.605 -1.455 -12.995 241 HB2 SER 27 HB2 SER 27 4.854 0.870 -12.645 242 HB3 SER 27 HB3 SER 27 5.201 1.248 -14.341 243 HG SER 27 HG SER 27 3.260 -0.531 -13.270 244 H ASN 28 H ASN 28 7.113 0.189 -15.799 245 HA ASN 28 HA ASN 28 5.880 -1.578 -17.750 246 HB2 ASN 28 HB2 ASN 28 7.181 -0.370 -19.391 247 HB3 ASN 28 HB3 ASN 28 6.414 0.754 -18.283 248 HD21 ASN 28 HD21 ASN 28 9.509 2.121 -17.210 249 HD22 ASN 28 HD22 ASN 28 7.762 2.160 -17.053 250 H ARG 29 H ARG 29 8.395 -2.163 -15.616 251 HA ARG 29 HA ARG 29 9.592 -4.333 -17.319 252 HB2 ARG 29 HB2 ARG 29 10.780 -3.025 -14.836 253 HB3 ARG 29 HB3 ARG 29 11.546 -4.238 -15.864 254 HG2 ARG 29 HG2 ARG 29 10.912 -1.350 -16.565 255 HG3 ARG 29 HG3 ARG 29 12.507 -2.078 -16.360 256 HD2 ARG 29 HD2 ARG 29 12.133 -3.481 -18.358 257 HD3 ARG 29 HD3 ARG 29 10.494 -2.853 -18.499 258 HE ARG 29 HE ARG 29 11.254 -0.707 -19.090 259 HH11 ARG 29 HH11 ARG 29 12.579 0.544 -20.327 260 HH12 ARG 29 HH12 ARG 29 14.198 0.023 -20.701 261 HH21 ARG 29 HH21 ARG 29 13.960 -2.950 -19.000 262 HH22 ARG 29 HH22 ARG 29 14.965 -1.910 -19.972 263 H GLY 30 H GLY 30 7.917 -3.598 -14.336 264 HA2 GLY 30 HA2 GLY 30 6.296 -4.977 -13.489 265 HA3 GLY 30 HA3 GLY 30 6.944 -6.339 -14.412 266 H TYR 31 H TYR 31 6.792 -4.815 -11.337 267 HA TYR 31 HA TYR 31 8.813 -6.216 -9.885 268 HB2 TYR 31 HB2 TYR 31 6.007 -5.499 -8.966 269 HB3 TYR 31 HB3 TYR 31 7.459 -5.689 -7.993 270 HD1 TYR 31 HD1 TYR 31 9.405 -3.969 -8.501 271 HD2 TYR 31 HD2 TYR 31 5.277 -3.385 -9.627 272 HE1 TYR 31 HE1 TYR 31 9.809 -1.546 -8.739 273 HE2 TYR 31 HE2 TYR 31 5.693 -0.954 -9.871 274 HH TYR 31 HH TYR 31 8.931 0.498 -9.322 275 H ARG 32 H ARG 32 8.701 -8.289 -8.968 276 HA ARG 32 HA ARG 32 6.379 -10.039 -9.732 277 HB2 ARG 32 HB2 ARG 32 7.989 -11.869 -10.175 278 HB3 ARG 32 HB3 ARG 32 8.010 -10.561 -11.335 279 HG2 ARG 32 HG2 ARG 32 10.035 -10.625 -9.071 280 HG3 ARG 32 HG3 ARG 32 10.246 -11.631 -10.506 281 HD2 ARG 32 HD2 ARG 32 10.073 -9.589 -11.953 282 HD3 ARG 32 HD3 ARG 32 9.998 -8.597 -10.509 283 HE ARG 32 HE ARG 32 12.276 -8.867 -10.126 284 HH11 ARG 32 HH11 ARG 32 14.263 -9.299 -10.574 285 HH12 ARG 32 HH12 ARG 32 14.719 -10.384 -11.884 286 HH21 ARG 32 HH21 ARG 32 11.439 -11.128 -12.691 287 HH22 ARG 32 HH22 ARG 32 13.117 -11.423 -13.053 288 H ALA 33 H ALA 33 7.053 -8.797 -7.180 289 HA ALA 33 HA ALA 33 7.240 -9.112 -4.967 290 HB1 ALA 33 HB1 ALA 33 5.062 -9.958 -5.443 291 HB2 ALA 33 HB2 ALA 33 5.677 -11.584 -5.751 292 HB3 ALA 33 HB3 ALA 33 5.766 -10.889 -4.105 293 H SER 34 H SER 34 8.194 -12.244 -6.456 294 HA SER 34 HA SER 34 9.641 -13.236 -4.238 295 HB2 SER 34 HB2 SER 34 10.459 -14.887 -5.843 296 HB3 SER 34 HB3 SER 34 8.732 -14.555 -6.110 297 HG SER 34 HG SER 34 9.934 -14.588 -8.074 298 H ASP 35 H ASP 35 10.558 -10.844 -6.527 299 HA ASP 35 HA ASP 35 13.448 -11.049 -6.047 300 HB2 ASP 35 HB2 ASP 35 12.237 -10.438 -8.218 301 HB3 ASP 35 HB3 ASP 35 11.892 -8.872 -7.487 302 H TRP 36 H TRP 36 10.903 -9.857 -4.215 303 HA TRP 36 HA TRP 36 12.364 -7.592 -2.993 304 HB2 TRP 36 HB2 TRP 36 9.603 -8.655 -2.348 305 HB3 TRP 36 HB3 TRP 36 10.302 -7.141 -1.843 306 HD1 TRP 36 HD1 TRP 36 11.087 -7.006 -5.336 307 HE1 TRP 36 HE1 TRP 36 9.274 -5.788 -6.700 308 HE3 TRP 36 HE3 TRP 36 7.180 -7.339 -2.048 309 HZ2 TRP 36 HZ2 TRP 36 6.674 -4.688 -6.234 310 HZ3 TRP 36 HZ3 TRP 36 5.007 -6.229 -2.573 311 HH2 TRP 36 HH2 TRP 36 4.768 -4.893 -4.647 312 H LYS 37 H LYS 37 12.252 -7.559 -0.592 313 HA LYS 37 HA LYS 37 13.478 -9.950 0.550 314 HB2 LYS 37 HB2 LYS 37 13.083 -7.133 1.517 315 HB3 LYS 37 HB3 LYS 37 13.630 -8.414 2.600 316 HG2 LYS 37 HG2 LYS 37 15.491 -8.975 1.048 317 HG3 LYS 37 HG3 LYS 37 14.968 -7.656 -0.016 318 HD2 LYS 37 HD2 LYS 37 16.741 -6.822 1.297 319 HD3 LYS 37 HD3 LYS 37 15.240 -6.086 1.906 320 HE2 LYS 37 HE2 LYS 37 15.228 -7.697 3.795 321 HE3 LYS 37 HE3 LYS 37 16.706 -8.443 3.168 322 HZ1 LYS 37 HZ1 LYS 37 17.195 -6.842 4.928 323 HZ2 LYS 37 HZ2 LYS 37 17.849 -6.320 3.528 324 HZ3 LYS 37 HZ3 LYS 37 16.482 -5.630 4.102 325 H LEU 38 H LEU 38 11.078 -10.826 -0.053 326 HA LEU 38 HA LEU 38 8.908 -10.428 1.678 327 HB2 LEU 38 HB2 LEU 38 9.650 -13.045 0.311 328 HB3 LEU 38 HB3 LEU 38 8.061 -12.595 0.918 329 HG LEU 38 HG LEU 38 9.537 -11.378 -1.437 330 HD11 LEU 38 HD11 LEU 38 6.922 -12.932 -1.163 331 HD12 LEU 38 HD12 LEU 38 7.558 -12.269 -2.673 332 HD13 LEU 38 HD13 LEU 38 8.446 -13.552 -1.835 333 HD21 LEU 38 HD21 LEU 38 8.382 -9.532 -0.389 334 HD22 LEU 38 HD22 LEU 38 7.423 -10.038 -1.784 335 HD23 LEU 38 HD23 LEU 38 6.925 -10.510 -0.145 336 H ASP 39 H ASP 39 11.610 -12.669 2.211 337 HA ASP 39 HA ASP 39 10.344 -13.746 4.658 338 HB2 ASP 39 HB2 ASP 39 11.419 -15.191 2.908 339 HB3 ASP 39 HB3 ASP 39 12.977 -14.512 3.368 340 H GLN 40 H GLN 40 12.091 -11.033 4.034 341 HA GLN 40 HA GLN 40 12.954 -10.752 6.835 342 HB2 GLN 40 HB2 GLN 40 15.151 -9.667 5.958 343 HB3 GLN 40 HB3 GLN 40 15.057 -11.385 6.230 344 HG2 GLN 40 HG2 GLN 40 14.602 -10.202 3.470 345 HG3 GLN 40 HG3 GLN 40 16.220 -10.493 4.091 346 HE21 GLN 40 HE21 GLN 40 14.971 -13.479 2.098 347 HE22 GLN 40 HE22 GLN 40 14.918 -11.763 1.733 348 HA PRO 41 HA PRO 41 10.697 -7.066 5.097 349 HB2 PRO 41 HB2 PRO 41 9.508 -7.250 7.865 350 HB3 PRO 41 HB3 PRO 41 8.704 -6.804 6.338 351 HG2 PRO 41 HG2 PRO 41 8.362 -9.281 7.376 352 HG3 PRO 41 HG3 PRO 41 8.644 -9.089 5.616 353 HD2 PRO 41 HD2 PRO 41 10.650 -9.838 7.761 354 HD3 PRO 41 HD3 PRO 41 10.359 -10.589 6.165 355 H ASP 42 H ASP 42 11.091 -4.927 5.577 356 HA ASP 42 HA ASP 42 13.256 -4.213 7.444 357 HB2 ASP 42 HB2 ASP 42 12.979 -3.188 5.179 358 HB3 ASP 42 HB3 ASP 42 11.436 -2.506 5.695 359 H TRP 43 H TRP 43 9.755 -4.208 7.351 360 HA TRP 43 HA TRP 43 9.507 -3.685 10.211 361 HB2 TRP 43 HB2 TRP 43 9.600 -1.396 9.416 362 HB3 TRP 43 HB3 TRP 43 8.480 -1.743 8.111 363 HD1 TRP 43 HD1 TRP 43 8.566 -0.863 11.795 364 HE1 TRP 43 HE1 TRP 43 6.198 -0.239 12.569 365 HE3 TRP 43 HE3 TRP 43 5.953 -2.469 7.719 366 HZ2 TRP 43 HZ2 TRP 43 3.529 -0.215 11.429 367 HZ3 TRP 43 HZ3 TRP 43 3.500 -2.025 7.539 368 HH2 TRP 43 HH2 TRP 43 2.281 -0.939 9.400 369 H THR 44 H THR 44 7.370 -4.207 10.999 370 HA THR 44 HA THR 44 5.361 -5.187 9.078 371 HB THR 44 HB THR 44 4.809 -7.140 10.465 372 HG1 THR 44 HG1 THR 44 7.339 -6.690 11.664 373 HG21 THR 44 HG21 THR 44 6.232 -7.381 8.450 374 HG22 THR 44 HG22 THR 44 7.673 -7.330 9.484 375 HG23 THR 44 HG23 THR 44 6.482 -8.644 9.665 376 H GLY 45 H GLY 45 3.227 -5.084 9.790 377 HA2 GLY 45 HA2 GLY 45 2.413 -4.304 12.428 378 HA3 GLY 45 HA3 GLY 45 2.610 -2.874 11.429 379 H ARG 46 H ARG 46 0.561 -2.264 11.236 380 HA ARG 46 HA ARG 46 -1.530 -4.121 10.145 381 HB2 ARG 46 HB2 ARG 46 -1.973 -1.731 11.970 382 HB3 ARG 46 HB3 ARG 46 -3.172 -2.900 11.411 383 HG2 ARG 46 HG2 ARG 46 -1.873 -4.693 12.695 384 HG3 ARG 46 HG3 ARG 46 -0.884 -3.382 13.367 385 HD2 ARG 46 HD2 ARG 46 -3.001 -2.286 14.186 386 HD3 ARG 46 HD3 ARG 46 -3.911 -3.696 13.611 387 HE ARG 46 HE ARG 46 -1.858 -4.619 15.353 388 HH11 ARG 46 HH11 ARG 46 -2.027 -4.767 17.593 389 HH12 ARG 46 HH12 ARG 46 -3.564 -4.426 18.334 390 HH21 ARG 46 HH21 ARG 46 -4.951 -2.999 15.546 391 HH22 ARG 46 HH22 ARG 46 -5.135 -3.355 17.241 392 H LEU 47 H LEU 47 -3.005 -3.320 8.728 393 HA LEU 47 HA LEU 47 -2.181 -1.026 7.027 394 HB2 LEU 47 HB2 LEU 47 -2.726 -3.251 6.006 395 HB3 LEU 47 HB3 LEU 47 -4.312 -3.169 6.764 396 HG LEU 47 HG LEU 47 -4.746 -1.042 5.380 397 HD11 LEU 47 HD11 LEU 47 -2.339 -2.122 3.855 398 HD12 LEU 47 HD12 LEU 47 -3.436 -0.838 3.308 399 HD13 LEU 47 HD13 LEU 47 -2.407 -0.572 4.720 400 HD21 LEU 47 HD21 LEU 47 -5.812 -3.153 4.899 401 HD22 LEU 47 HD22 LEU 47 -5.352 -2.365 3.392 402 HD23 LEU 47 HD23 LEU 47 -4.380 -3.709 4.011 403 H ARG 48 H ARG 48 -3.325 0.853 6.931 404 HA ARG 48 HA ARG 48 -6.214 0.818 7.568 405 HB2 ARG 48 HB2 ARG 48 -5.104 1.676 9.649 406 HB3 ARG 48 HB3 ARG 48 -4.341 2.954 8.700 407 HG2 ARG 48 HG2 ARG 48 -6.737 3.651 8.008 408 HG3 ARG 48 HG3 ARG 48 -7.314 2.551 9.255 409 HD2 ARG 48 HD2 ARG 48 -5.545 5.000 9.631 410 HD3 ARG 48 HD3 ARG 48 -7.259 4.852 10.025 411 HE ARG 48 HE ARG 48 -5.113 3.232 11.384 412 HH11 ARG 48 HH11 ARG 48 -5.137 2.967 13.377 413 HH12 ARG 48 HH12 ARG 48 -6.387 3.617 14.443 414 HH21 ARG 48 HH21 ARG 48 -7.820 5.458 11.881 415 HH22 ARG 48 HH22 ARG 48 -7.927 4.982 13.557 416 H ILE 49 H ILE 49 -6.700 0.871 5.483 417 HA ILE 49 HA ILE 49 -5.813 3.113 3.771 418 HB ILE 49 HB ILE 49 -8.051 1.154 3.205 419 HG12 ILE 49 HG12 ILE 49 -5.094 1.019 2.449 420 HG13 ILE 49 HG13 ILE 49 -5.984 -0.096 3.493 421 HG21 ILE 49 HG21 ILE 49 -8.064 3.344 1.958 422 HG22 ILE 49 HG22 ILE 49 -6.429 2.994 1.378 423 HG23 ILE 49 HG23 ILE 49 -7.805 1.967 0.903 424 HD11 ILE 49 HD11 ILE 49 -7.498 -0.577 1.505 425 HD12 ILE 49 HD12 ILE 49 -6.255 0.226 0.508 426 HD13 ILE 49 HD13 ILE 49 -5.858 -1.208 1.467 427 H THR 50 H THR 50 -6.718 4.967 3.770 428 HA THR 50 HA THR 50 -9.438 5.484 4.826 429 HB THR 50 HB THR 50 -8.205 7.627 5.822 430 HG1 THR 50 HG1 THR 50 -6.177 5.684 5.812 431 HG21 THR 50 HG21 THR 50 -8.373 4.884 7.085 432 HG22 THR 50 HG22 THR 50 -7.801 6.308 7.977 433 HG23 THR 50 HG23 THR 50 -9.436 6.288 7.303 434 H SER 51 H SER 51 -10.152 7.764 4.210 435 HA SER 51 HA SER 51 -8.640 9.114 2.065 436 HB2 SER 51 HB2 SER 51 -10.586 9.168 0.622 437 HB3 SER 51 HB3 SER 51 -10.100 7.487 0.909 438 HG SER 51 HG SER 51 -12.382 7.838 1.074 439 H LYS 52 H LYS 52 -9.472 11.220 1.541 440 HA LYS 52 HA LYS 52 -11.925 11.961 2.847 441 HB2 LYS 52 HB2 LYS 52 -10.077 12.649 4.440 442 HB3 LYS 52 HB3 LYS 52 -9.570 13.834 3.244 443 HG2 LYS 52 HG2 LYS 52 -10.978 14.768 5.005 444 HG3 LYS 52 HG3 LYS 52 -11.682 14.981 3.401 445 HD2 LYS 52 HD2 LYS 52 -13.396 14.499 5.065 446 HD3 LYS 52 HD3 LYS 52 -13.334 13.194 3.887 447 HE2 LYS 52 HE2 LYS 52 -11.975 11.832 5.485 448 HE3 LYS 52 HE3 LYS 52 -12.034 13.169 6.646 449 HZ1 LYS 52 HZ1 LYS 52 -14.537 12.909 6.546 450 HZ2 LYS 52 HZ2 LYS 52 -14.305 11.507 5.715 451 HZ3 LYS 52 HZ3 LYS 52 -13.763 11.642 7.229 452 H GLY 53 H GLY 53 -13.144 12.626 1.269 453 HA2 GLY 53 HA2 GLY 53 -13.990 13.805 -0.519 454 HA3 GLY 53 HA3 GLY 53 -12.505 14.761 -0.586 455 H LYS 54 H LYS 54 -11.370 14.455 -2.316 456 HA LYS 54 HA LYS 54 -11.551 11.975 -3.966 457 HB2 LYS 54 HB2 LYS 54 -10.928 14.874 -4.512 458 HB3 LYS 54 HB3 LYS 54 -10.631 13.605 -5.728 459 HG2 LYS 54 HG2 LYS 54 -13.032 12.942 -5.593 460 HG3 LYS 54 HG3 LYS 54 -13.331 14.298 -4.499 461 HD2 LYS 54 HD2 LYS 54 -12.288 14.543 -7.355 462 HD3 LYS 54 HD3 LYS 54 -13.975 14.750 -6.859 463 HE2 LYS 54 HE2 LYS 54 -13.302 16.630 -5.366 464 HE3 LYS 54 HE3 LYS 54 -11.626 16.451 -5.906 465 HZ1 LYS 54 HZ1 LYS 54 -13.916 17.145 -7.669 466 HZ2 LYS 54 HZ2 LYS 54 -12.772 18.186 -7.154 467 HZ3 LYS 54 HZ3 LYS 54 -12.369 16.976 -8.169 468 H THR 55 H THR 55 -9.738 12.482 -1.546 469 HA THR 55 HA THR 55 -7.268 11.445 -2.874 470 HB THR 55 HB THR 55 -7.359 13.111 -0.335 471 HG1 THR 55 HG1 THR 55 -6.522 14.750 -1.618 472 HG21 THR 55 HG21 THR 55 -4.906 13.284 -0.757 473 HG22 THR 55 HG22 THR 55 -5.403 11.604 -0.518 474 HG23 THR 55 HG23 THR 55 -5.082 12.204 -2.161 475 H ALA 56 H ALA 56 -6.661 9.487 -2.211 476 HA ALA 56 HA ALA 56 -7.806 8.327 0.288 477 HB1 ALA 56 HB1 ALA 56 -8.290 7.038 -1.756 478 HB2 ALA 56 HB2 ALA 56 -6.549 6.860 -2.043 479 HB3 ALA 56 HB3 ALA 56 -7.287 6.147 -0.601 480 H TYR 57 H TYR 57 -6.374 7.041 1.574 481 HA TYR 57 HA TYR 57 -3.507 7.842 1.640 482 HB2 TYR 57 HB2 TYR 57 -5.470 7.990 3.966 483 HB3 TYR 57 HB3 TYR 57 -3.761 8.389 4.013 484 HD1 TYR 57 HD1 TYR 57 -3.005 10.332 2.369 485 HD2 TYR 57 HD2 TYR 57 -7.053 9.750 3.779 486 HE1 TYR 57 HE1 TYR 57 -3.539 12.712 1.860 487 HE2 TYR 57 HE2 TYR 57 -7.581 12.105 3.228 488 HH TYR 57 HH TYR 57 -5.140 14.359 1.902 489 H ILE 58 H ILE 58 -2.573 5.801 1.396 490 HA ILE 58 HA ILE 58 -3.609 3.508 3.023 491 HB ILE 58 HB ILE 58 -1.216 3.619 1.149 492 HG12 ILE 58 HG12 ILE 58 -2.616 1.825 -0.080 493 HG13 ILE 58 HG13 ILE 58 -4.008 2.444 0.803 494 HG21 ILE 58 HG21 ILE 58 -2.453 1.270 2.651 495 HG22 ILE 58 HG22 ILE 58 -1.095 1.191 1.501 496 HG23 ILE 58 HG23 ILE 58 -0.888 2.019 3.027 497 HD11 ILE 58 HD11 ILE 58 -3.780 4.602 -0.334 498 HD12 ILE 58 HD12 ILE 58 -2.201 4.110 -1.009 499 HD13 ILE 58 HD13 ILE 58 -3.689 3.309 -1.536 500 H LYS 59 H LYS 59 -3.388 4.243 5.113 501 HA LYS 59 HA LYS 59 -0.702 5.068 6.062 502 HB2 LYS 59 HB2 LYS 59 -3.256 4.687 7.659 503 HB3 LYS 59 HB3 LYS 59 -1.787 5.505 8.170 504 HG2 LYS 59 HG2 LYS 59 -2.185 7.216 6.333 505 HG3 LYS 59 HG3 LYS 59 -3.720 6.414 5.982 506 HD2 LYS 59 HD2 LYS 59 -4.408 6.832 8.371 507 HD3 LYS 59 HD3 LYS 59 -2.905 7.770 8.581 508 HE2 LYS 59 HE2 LYS 59 -3.619 9.293 6.753 509 HE3 LYS 59 HE3 LYS 59 -5.097 8.344 6.541 510 HZ1 LYS 59 HZ1 LYS 59 -4.372 9.822 9.014 511 HZ2 LYS 59 HZ2 LYS 59 -5.523 10.270 7.943 512 HZ3 LYS 59 HZ3 LYS 59 -5.720 8.915 8.841 513 H LEU 60 H LEU 60 0.697 3.832 7.132 514 HA LEU 60 HA LEU 60 -0.010 1.018 7.881 515 HB2 LEU 60 HB2 LEU 60 2.364 2.312 6.595 516 HB3 LEU 60 HB3 LEU 60 2.727 1.168 7.876 517 HG LEU 60 HG LEU 60 1.560 -0.609 6.791 518 HD11 LEU 60 HD11 LEU 60 0.886 1.385 4.583 519 HD12 LEU 60 HD12 LEU 60 0.707 -0.379 4.441 520 HD13 LEU 60 HD13 LEU 60 -0.269 0.509 5.612 521 HD21 LEU 60 HD21 LEU 60 3.926 -0.063 6.165 522 HD22 LEU 60 HD22 LEU 60 3.044 -0.907 4.886 523 HD23 LEU 60 HD23 LEU 60 3.322 0.846 4.768 524 H GLU 61 H GLU 61 0.125 0.422 9.966 525 HA GLU 61 HA GLU 61 1.222 2.388 11.944 526 HB2 GLU 61 HB2 GLU 61 -1.456 0.966 12.056 527 HB3 GLU 61 HB3 GLU 61 -0.756 1.953 13.348 528 HG2 GLU 61 HG2 GLU 61 -0.715 3.914 11.798 529 HG3 GLU 61 HG3 GLU 61 -1.563 2.947 10.582 530 H ASP 62 H ASP 62 1.959 1.618 13.930 531 HA ASP 62 HA ASP 62 3.148 -0.996 13.922 532 HB2 ASP 62 HB2 ASP 62 3.997 1.118 15.041 533 HB3 ASP 62 HB3 ASP 62 2.694 0.907 16.233 534 H LYS 63 H LYS 63 2.545 -2.842 14.816 535 HA LYS 63 HA LYS 63 -0.223 -3.171 15.532 536 HB2 LYS 63 HB2 LYS 63 0.480 -5.676 15.659 537 HB3 LYS 63 HB3 LYS 63 0.710 -4.876 14.104 538 HG2 LYS 63 HG2 LYS 63 3.050 -4.534 14.506 539 HG3 LYS 63 HG3 LYS 63 2.931 -5.117 16.172 540 HD2 LYS 63 HD2 LYS 63 2.624 -7.361 15.476 541 HD3 LYS 63 HD3 LYS 63 2.234 -6.879 13.799 542 HE2 LYS 63 HE2 LYS 63 4.514 -5.951 13.530 543 HE3 LYS 63 HE3 LYS 63 4.936 -6.453 15.166 544 HZ1 LYS 63 HZ1 LYS 63 5.615 -7.982 13.303 545 HZ2 LYS 63 HZ2 LYS 63 4.787 -8.733 14.515 546 HZ3 LYS 63 HZ3 LYS 63 4.056 -8.385 13.090 547 H VAL 64 H VAL 64 2.228 -2.315 17.523 548 HA VAL 64 HA VAL 64 0.790 -3.437 19.899 549 HB VAL 64 HB VAL 64 3.732 -2.798 19.496 550 HG11 VAL 64 HG11 VAL 64 2.300 -3.723 22.029 551 HG12 VAL 64 HG12 VAL 64 4.064 -3.674 21.812 552 HG13 VAL 64 HG13 VAL 64 3.142 -2.172 21.795 553 HG21 VAL 64 HG21 VAL 64 4.061 -5.209 20.007 554 HG22 VAL 64 HG22 VAL 64 2.296 -5.426 20.071 555 HG23 VAL 64 HG23 VAL 64 3.096 -4.968 18.552 556 H SER 65 H SER 65 2.563 -0.578 18.618 557 HA SER 65 HA SER 65 1.589 1.027 20.910 558 HB2 SER 65 HB2 SER 65 3.428 1.709 18.594 559 HB3 SER 65 HB3 SER 65 3.021 2.804 19.929 560 HG SER 65 HG SER 65 4.978 1.690 20.312 561 H GLY 66 H GLY 66 0.654 0.479 17.615 562 HA2 GLY 66 HA2 GLY 66 -1.147 1.276 16.403 563 HA3 GLY 66 HA3 GLY 66 -1.647 2.252 17.787 564 H GLU 67 H GLU 67 1.617 2.724 16.782 565 HA GLU 67 HA GLU 67 0.986 5.483 16.005 566 HB2 GLU 67 HB2 GLU 67 3.212 5.998 16.549 567 HB3 GLU 67 HB3 GLU 67 2.590 4.914 17.804 568 HG2 GLU 67 HG2 GLU 67 3.821 3.020 16.795 569 HG3 GLU 67 HG3 GLU 67 4.438 4.080 15.523 570 H LEU 68 H LEU 68 1.935 6.540 14.152 571 HA LEU 68 HA LEU 68 1.602 4.925 11.792 572 HB2 LEU 68 HB2 LEU 68 0.902 7.355 12.091 573 HB3 LEU 68 HB3 LEU 68 2.609 7.786 11.991 574 HG LEU 68 HG LEU 68 2.606 6.577 9.688 575 HD11 LEU 68 HD11 LEU 68 0.459 6.415 8.557 576 HD12 LEU 68 HD12 LEU 68 0.392 5.418 10.006 577 HD13 LEU 68 HD13 LEU 68 -0.402 7.000 9.999 578 HD21 LEU 68 HD21 LEU 68 1.694 8.542 8.536 579 HD22 LEU 68 HD22 LEU 68 0.921 9.086 10.045 580 HD23 LEU 68 HD23 LEU 68 2.693 9.022 9.917 581 H PHE 69 H PHE 69 3.040 3.873 10.603 582 HA PHE 69 HA PHE 69 5.965 4.188 10.999 583 HB2 PHE 69 HB2 PHE 69 5.259 1.940 10.851 584 HB3 PHE 69 HB3 PHE 69 4.194 2.249 9.491 585 HD1 PHE 69 HD1 PHE 69 7.827 2.199 10.441 586 HD2 PHE 69 HD2 PHE 69 4.932 1.915 7.252 587 HE1 PHE 69 HE1 PHE 69 9.627 1.553 8.856 588 HE2 PHE 69 HE2 PHE 69 6.738 1.312 5.671 589 HZ PHE 69 HZ PHE 69 9.086 1.108 6.468 590 H ALA 70 H ALA 70 3.667 4.239 8.249 591 HA ALA 70 HA ALA 70 4.845 6.638 7.078 592 HB1 ALA 70 HB1 ALA 70 4.960 3.943 5.626 593 HB2 ALA 70 HB2 ALA 70 5.424 5.519 4.957 594 HB3 ALA 70 HB3 ALA 70 6.367 4.815 6.274 595 H GLN 71 H GLN 71 3.540 7.293 5.096 596 HA GLN 71 HA GLN 71 1.143 5.732 4.606 597 HB2 GLN 71 HB2 GLN 71 -0.479 7.487 4.920 598 HB3 GLN 71 HB3 GLN 71 0.368 7.140 6.412 599 HG2 GLN 71 HG2 GLN 71 0.266 9.435 6.485 600 HG3 GLN 71 HG3 GLN 71 1.882 9.183 5.848 601 HE21 GLN 71 HE21 GLN 71 0.764 11.756 3.607 602 HE22 GLN 71 HE22 GLN 71 1.728 11.414 5.038 603 H ALA 72 H ALA 72 0.197 5.992 2.630 604 HA ALA 72 HA ALA 72 1.702 7.644 0.633 605 HB1 ALA 72 HB1 ALA 72 2.119 5.305 0.343 606 HB2 ALA 72 HB2 ALA 72 0.386 4.927 0.382 607 HB3 ALA 72 HB3 ALA 72 1.059 5.860 -0.966 608 HA PRO 73 HA PRO 73 -2.398 9.558 0.078 609 HB2 PRO 73 HB2 PRO 73 -0.724 11.535 -1.425 610 HB3 PRO 73 HB3 PRO 73 -1.983 11.827 -0.188 611 HG2 PRO 73 HG2 PRO 73 0.672 12.113 0.382 612 HG3 PRO 73 HG3 PRO 73 -0.465 11.406 1.575 613 HD2 PRO 73 HD2 PRO 73 1.396 9.947 -0.332 614 HD3 PRO 73 HD3 PRO 73 1.146 9.683 1.416 615 H VAL 74 H VAL 74 -3.705 9.426 -1.745 616 HA VAL 74 HA VAL 74 -2.521 8.885 -4.439 617 HB VAL 74 HB VAL 74 -4.897 7.344 -3.357 618 HG11 VAL 74 HG11 VAL 74 -2.998 6.829 -5.677 619 HG12 VAL 74 HG12 VAL 74 -4.343 5.780 -5.189 620 HG13 VAL 74 HG13 VAL 74 -4.680 7.406 -5.781 621 HG21 VAL 74 HG21 VAL 74 -3.092 6.656 -1.891 622 HG22 VAL 74 HG22 VAL 74 -3.466 5.379 -3.041 623 HG23 VAL 74 HG23 VAL 74 -2.019 6.385 -3.282 624 H GLU 75 H GLU 75 -3.460 10.209 -5.962 625 HA GLU 75 HA GLU 75 -5.945 11.692 -5.214 626 HB2 GLU 75 HB2 GLU 75 -3.934 12.083 -7.460 627 HB3 GLU 75 HB3 GLU 75 -5.365 13.086 -7.191 628 HG2 GLU 75 HG2 GLU 75 -4.529 13.671 -4.918 629 HG3 GLU 75 HG3 GLU 75 -3.063 12.736 -5.223 630 H GLN 76 H GLN 76 -5.007 9.105 -7.287 631 HA GLN 76 HA GLN 76 -7.729 8.456 -7.867 632 HB2 GLN 76 HB2 GLN 76 -7.749 8.478 -10.231 633 HB3 GLN 76 HB3 GLN 76 -7.324 10.095 -9.722 634 HG2 GLN 76 HG2 GLN 76 -5.423 8.005 -10.871 635 HG3 GLN 76 HG3 GLN 76 -6.084 9.391 -11.709 636 HE21 GLN 76 HE21 GLN 76 -2.831 9.895 -9.289 637 HE22 GLN 76 HE22 GLN 76 -3.765 8.386 -9.218 638 H TYR 77 H TYR 77 -7.941 6.248 -8.351 639 HA TYR 77 HA TYR 77 -5.450 4.663 -8.660 640 HB2 TYR 77 HB2 TYR 77 -6.291 4.510 -6.359 641 HB3 TYR 77 HB3 TYR 77 -7.840 3.934 -6.977 642 HD1 TYR 77 HD1 TYR 77 -4.177 3.140 -7.311 643 HD2 TYR 77 HD2 TYR 77 -8.200 1.631 -6.985 644 HE1 TYR 77 HE1 TYR 77 -3.317 0.816 -7.463 645 HE2 TYR 77 HE2 TYR 77 -7.330 -0.704 -7.039 646 HH TYR 77 HH TYR 77 -3.836 -1.415 -7.443 647 HA PRO 78 HA PRO 78 -4.679 2.784 -9.798 648 HB2 PRO 78 HB2 PRO 78 -3.880 2.442 -12.384 649 HB3 PRO 78 HB3 PRO 78 -4.796 1.215 -11.455 650 HG2 PRO 78 HG2 PRO 78 -5.899 3.282 -13.392 651 HG3 PRO 78 HG3 PRO 78 -6.220 1.517 -13.358 652 HD2 PRO 78 HD2 PRO 78 -7.930 3.274 -12.205 653 HD3 PRO 78 HD3 PRO 78 -7.571 1.710 -11.417 654 H GLY 79 H GLY 79 -2.787 3.922 -9.881 655 HA2 GLY 79 HA2 GLY 79 -2.352 6.343 -11.459 656 HA3 GLY 79 HA3 GLY 79 -2.702 6.638 -9.752 657 H ILE 80 H ILE 80 -0.538 7.552 -9.587 658 HA ILE 80 HA ILE 80 1.775 5.850 -10.120 659 HB ILE 80 HB ILE 80 1.898 8.212 -10.563 660 HG12 ILE 80 HG12 ILE 80 3.770 7.459 -8.273 661 HG13 ILE 80 HG13 ILE 80 3.932 6.898 -9.940 662 HG21 ILE 80 HG21 ILE 80 0.393 9.037 -8.700 663 HG22 ILE 80 HG22 ILE 80 1.739 8.780 -7.567 664 HG23 ILE 80 HG23 ILE 80 1.879 9.951 -8.887 665 HD11 ILE 80 HD11 ILE 80 4.248 9.254 -10.684 666 HD12 ILE 80 HD12 ILE 80 4.159 9.777 -8.983 667 HD13 ILE 80 HD13 ILE 80 5.472 8.718 -9.508 668 H ALA 81 H ALA 81 0.092 6.851 -7.138 669 HA ALA 81 HA ALA 81 2.301 5.958 -5.459 670 HB1 ALA 81 HB1 ALA 81 -0.426 7.110 -4.794 671 HB2 ALA 81 HB2 ALA 81 0.925 6.908 -3.657 672 HB3 ALA 81 HB3 ALA 81 1.077 8.029 -5.019 673 H VAL 82 H VAL 82 0.395 3.981 -6.973 674 HA VAL 82 HA VAL 82 0.481 1.875 -4.961 675 HB VAL 82 HB VAL 82 -2.187 2.553 -6.212 676 HG11 VAL 82 HG11 VAL 82 -1.426 0.517 -4.054 677 HG12 VAL 82 HG12 VAL 82 -3.067 0.804 -4.661 678 HG13 VAL 82 HG13 VAL 82 -1.842 0.117 -5.728 679 HG21 VAL 82 HG21 VAL 82 -1.869 4.222 -4.514 680 HG22 VAL 82 HG22 VAL 82 -3.071 3.054 -3.981 681 HG23 VAL 82 HG23 VAL 82 -1.427 2.986 -3.314 682 H GLU 83 H GLU 83 1.052 0.034 -6.023 683 HA GLU 83 HA GLU 83 0.185 -0.469 -8.806 684 HB2 GLU 83 HB2 GLU 83 2.810 0.559 -8.121 685 HB3 GLU 83 HB3 GLU 83 3.010 -1.097 -8.672 686 HG2 GLU 83 HG2 GLU 83 1.409 0.998 -10.185 687 HG3 GLU 83 HG3 GLU 83 3.130 0.704 -10.436 688 H THR 84 H THR 84 0.644 -2.635 -9.586 689 HA THR 84 HA THR 84 0.625 -4.688 -7.390 690 HB THR 84 HB THR 84 -0.530 -6.126 -8.939 691 HG1 THR 84 HG1 THR 84 -1.172 -5.359 -10.962 692 HG21 THR 84 HG21 THR 84 -1.842 -3.368 -8.981 693 HG22 THR 84 HG22 THR 84 -2.654 -4.943 -9.152 694 HG23 THR 84 HG23 THR 84 -1.887 -4.510 -7.621 695 H VAL 85 H VAL 85 1.619 -6.770 -7.820 696 HA VAL 85 HA VAL 85 4.093 -6.684 -9.442 697 HB VAL 85 HB VAL 85 4.693 -8.714 -8.319 698 HG11 VAL 85 HG11 VAL 85 4.953 -7.870 -6.057 699 HG12 VAL 85 HG12 VAL 85 5.062 -6.507 -7.169 700 HG13 VAL 85 HG13 VAL 85 3.579 -6.778 -6.242 701 HG21 VAL 85 HG21 VAL 85 2.420 -9.740 -8.153 702 HG22 VAL 85 HG22 VAL 85 3.299 -9.778 -6.640 703 HG23 VAL 85 HG23 VAL 85 2.016 -8.581 -6.876 704 H THR 86 H THR 86 4.521 -8.818 -10.649 705 HA THR 86 HA THR 86 2.253 -9.419 -12.437 706 HB THR 86 HB THR 86 3.967 -10.349 -13.897 707 HG1 THR 86 HG1 THR 86 6.122 -10.298 -13.251 708 HG21 THR 86 HG21 THR 86 3.625 -7.868 -13.865 709 HG22 THR 86 HG22 THR 86 4.937 -7.724 -12.684 710 HG23 THR 86 HG23 THR 86 5.284 -8.329 -14.314 711 H ASP 87 H ASP 87 4.243 -11.100 -10.066 712 HA ASP 87 HA ASP 87 3.507 -13.730 -11.077 713 HB2 ASP 87 HB2 ASP 87 5.778 -13.121 -10.249 714 HB3 ASP 87 HB3 ASP 87 5.099 -12.985 -8.620 715 H SER 88 H SER 88 2.799 -11.926 -8.054 716 HA SER 88 HA SER 88 0.516 -13.815 -7.541 717 HB2 SER 88 HB2 SER 88 2.436 -14.720 -6.340 718 HB3 SER 88 HB3 SER 88 2.653 -13.178 -5.489 719 HG SER 88 HG SER 88 1.362 -14.896 -4.408 720 H SER 89 H SER 89 -1.330 -12.790 -7.080 721 HA SER 89 HA SER 89 -1.405 -9.984 -7.049 722 HB2 SER 89 HB2 SER 89 -3.732 -11.576 -6.027 723 HB3 SER 89 HB3 SER 89 -3.726 -10.145 -7.054 724 HG SER 89 HG SER 89 -2.832 -11.496 -8.732 725 H ARG 90 H ARG 90 -0.653 -11.826 -4.306 726 HA ARG 90 HA ARG 90 -1.988 -10.040 -2.401 727 HB2 ARG 90 HB2 ARG 90 -1.516 -11.479 -0.678 728 HB3 ARG 90 HB3 ARG 90 -2.119 -12.399 -2.046 729 HG2 ARG 90 HG2 ARG 90 0.242 -13.084 -2.573 730 HG3 ARG 90 HG3 ARG 90 0.762 -12.259 -1.081 731 HD2 ARG 90 HD2 ARG 90 -0.735 -13.704 0.257 732 HD3 ARG 90 HD3 ARG 90 -1.333 -14.467 -1.211 733 HE ARG 90 HE ARG 90 0.651 -15.671 -1.475 734 HH11 ARG 90 HH11 ARG 90 2.349 -16.800 -0.638 735 HH12 ARG 90 HH12 ARG 90 3.084 -16.295 0.853 736 HH21 ARG 90 HH21 ARG 90 1.024 -13.599 1.356 737 HH22 ARG 90 HH22 ARG 90 2.347 -14.563 1.957 738 H TYR 91 H TYR 91 0.154 -8.946 -4.125 739 HA TYR 91 HA TYR 91 1.790 -7.671 -2.021 740 HB2 TYR 91 HB2 TYR 91 2.874 -8.983 -4.531 741 HB3 TYR 91 HB3 TYR 91 3.810 -8.022 -3.407 742 HD1 TYR 91 HD1 TYR 91 4.232 -8.856 -1.077 743 HD2 TYR 91 HD2 TYR 91 2.376 -11.327 -4.086 744 HE1 TYR 91 HE1 TYR 91 4.722 -10.883 0.279 745 HE2 TYR 91 HE2 TYR 91 2.964 -13.361 -2.772 746 HH TYR 91 HH TYR 91 4.646 -13.161 0.384 747 H PHE 92 H PHE 92 2.301 -5.558 -2.427 748 HA PHE 92 HA PHE 92 1.646 -4.314 -5.051 749 HB2 PHE 92 HB2 PHE 92 0.642 -3.298 -2.361 750 HB3 PHE 92 HB3 PHE 92 0.385 -2.529 -3.914 751 HD1 PHE 92 HD1 PHE 92 -0.677 -5.165 -1.639 752 HD2 PHE 92 HD2 PHE 92 -1.161 -3.549 -5.597 753 HE1 PHE 92 HE1 PHE 92 -2.754 -6.471 -1.911 754 HE2 PHE 92 HE2 PHE 92 -3.232 -4.913 -5.895 755 HZ PHE 92 HZ PHE 92 -4.012 -6.389 -4.080 756 H VAL 93 H VAL 93 2.707 -2.336 -5.466 757 HA VAL 93 HA VAL 93 4.757 -1.423 -3.483 758 HB VAL 93 HB VAL 93 4.366 -0.570 -6.374 759 HG11 VAL 93 HG11 VAL 93 6.536 0.147 -4.353 760 HG12 VAL 93 HG12 VAL 93 6.547 0.569 -6.081 761 HG13 VAL 93 HG13 VAL 93 5.313 1.249 -5.019 762 HG21 VAL 93 HG21 VAL 93 6.587 -1.699 -6.701 763 HG22 VAL 93 HG22 VAL 93 6.457 -2.350 -5.055 764 HG23 VAL 93 HG23 VAL 93 5.279 -2.816 -6.308 765 H ILE 94 H ILE 94 4.470 0.614 -2.461 766 HA ILE 94 HA ILE 94 2.448 2.388 -3.658 767 HB ILE 94 HB ILE 94 1.549 3.199 -1.633 768 HG12 ILE 94 HG12 ILE 94 3.418 2.582 -0.061 769 HG13 ILE 94 HG13 ILE 94 1.779 2.406 0.530 770 HG21 ILE 94 HG21 ILE 94 0.017 1.379 -1.058 771 HG22 ILE 94 HG22 ILE 94 0.291 1.518 -2.798 772 HG23 ILE 94 HG23 ILE 94 1.070 0.215 -1.896 773 HD11 ILE 94 HD11 ILE 94 3.528 0.092 -0.397 774 HD12 ILE 94 HD12 ILE 94 3.203 0.574 1.279 775 HD13 ILE 94 HD13 ILE 94 1.887 -0.031 0.272 776 H ARG 95 H ARG 95 2.771 4.598 -3.377 777 HA ARG 95 HA ARG 95 5.607 5.330 -2.741 778 HB2 ARG 95 HB2 ARG 95 4.531 5.999 -4.970 779 HB3 ARG 95 HB3 ARG 95 3.598 7.175 -4.045 780 HG2 ARG 95 HG2 ARG 95 5.915 7.948 -3.088 781 HG3 ARG 95 HG3 ARG 95 6.615 6.967 -4.371 782 HD2 ARG 95 HD2 ARG 95 6.535 9.178 -5.219 783 HD3 ARG 95 HD3 ARG 95 5.215 8.311 -6.026 784 HE ARG 95 HE ARG 95 4.413 9.704 -3.568 785 HH11 ARG 95 HH11 ARG 95 2.971 11.382 -3.660 786 HH12 ARG 95 HH12 ARG 95 2.768 12.250 -5.156 787 HH21 ARG 95 HH21 ARG 95 5.010 10.371 -6.939 788 HH22 ARG 95 HH22 ARG 95 3.886 11.702 -6.967 789 H ILE 96 H ILE 96 5.715 5.479 -0.584 790 HA ILE 96 HA ILE 96 3.689 6.968 0.946 791 HB ILE 96 HB ILE 96 4.865 6.484 2.930 792 HG12 ILE 96 HG12 ILE 96 6.787 4.665 2.717 793 HG13 ILE 96 HG13 ILE 96 7.081 5.407 1.157 794 HG21 ILE 96 HG21 ILE 96 4.577 4.015 1.216 795 HG22 ILE 96 HG22 ILE 96 4.595 4.065 2.987 796 HG23 ILE 96 HG23 ILE 96 3.287 4.848 2.122 797 HD11 ILE 96 HD11 ILE 96 8.531 6.271 2.972 798 HD12 ILE 96 HD12 ILE 96 7.535 7.576 2.311 799 HD13 ILE 96 HD13 ILE 96 7.108 6.818 3.868 800 H GLN 97 H GLN 97 4.062 8.849 2.181 801 HA GLN 97 HA GLN 97 6.361 10.569 1.359 802 HB2 GLN 97 HB2 GLN 97 3.411 11.321 1.423 803 HB3 GLN 97 HB3 GLN 97 4.672 12.495 1.762 804 HG2 GLN 97 HG2 GLN 97 4.312 12.916 -0.432 805 HG3 GLN 97 HG3 GLN 97 5.715 11.869 -0.502 806 HE21 GLN 97 HE21 GLN 97 3.685 9.109 -1.827 807 HE22 GLN 97 HE22 GLN 97 5.201 9.489 -1.048 808 H ASP 98 H ASP 98 7.154 11.937 2.922 809 HA ASP 98 HA ASP 98 6.449 11.275 5.734 810 HB2 ASP 98 HB2 ASP 98 8.815 11.185 4.782 811 HB3 ASP 98 HB3 ASP 98 8.735 12.946 4.686 812 H GLY 99 H GLY 99 5.248 13.420 3.615 813 HA2 GLY 99 HA2 GLY 99 3.756 15.164 3.959 814 HA3 GLY 99 HA3 GLY 99 4.163 15.182 5.675 815 H THR 100 H THR 100 6.904 15.402 3.672 816 HA THR 100 HA THR 100 7.055 18.380 3.832 817 HB THR 100 HB THR 100 7.940 17.239 5.863 818 HG1 THR 100 HG1 THR 100 9.757 18.515 5.971 819 HG21 THR 100 HG21 THR 100 8.992 15.271 4.721 820 HG22 THR 100 HG22 THR 100 10.257 16.359 4.102 821 HG23 THR 100 HG23 THR 100 10.061 16.115 5.849 822 H GLY 101 H GLY 101 6.865 16.275 1.563 823 HA2 GLY 101 HA2 GLY 101 7.468 16.536 -0.681 824 HA3 GLY 101 HA3 GLY 101 8.823 17.567 -0.232 825 H ARG 102 H ARG 102 9.083 14.907 1.724 826 HA ARG 102 HA ARG 102 10.996 13.383 0.082 827 HB2 ARG 102 HB2 ARG 102 9.809 12.869 2.838 828 HB3 ARG 102 HB3 ARG 102 11.076 11.900 2.089 829 HG2 ARG 102 HG2 ARG 102 12.634 13.726 2.169 830 HG3 ARG 102 HG3 ARG 102 11.371 14.852 2.722 831 HD2 ARG 102 HD2 ARG 102 11.061 13.526 4.774 832 HD3 ARG 102 HD3 ARG 102 12.347 12.416 4.273 833 HE ARG 102 HE ARG 102 13.738 14.673 4.227 834 HH11 ARG 102 HH11 ARG 102 14.771 15.767 5.833 835 HH12 ARG 102 HH12 ARG 102 14.145 15.746 7.455 836 HH21 ARG 102 HH21 ARG 102 11.414 13.775 6.775 837 HH22 ARG 102 HH22 ARG 102 12.338 14.647 7.963 838 H SER 103 H SER 103 10.515 11.557 -0.885 839 HA SER 103 HA SER 103 8.206 10.010 -0.043 840 HB2 SER 103 HB2 SER 103 7.242 9.633 -2.245 841 HB3 SER 103 HB3 SER 103 7.276 11.372 -1.910 842 HG SER 103 HG SER 103 9.095 11.562 -3.239 843 H ALA 104 H ALA 104 8.142 7.802 -0.722 844 HA ALA 104 HA ALA 104 10.495 6.687 -2.107 845 HB1 ALA 104 HB1 ALA 104 10.934 5.059 -0.298 846 HB2 ALA 104 HB2 ALA 104 11.190 6.719 0.270 847 HB3 ALA 104 HB3 ALA 104 9.709 5.843 0.721 848 H PHE 105 H PHE 105 10.051 4.800 -3.184 849 HA PHE 105 HA PHE 105 7.277 3.727 -3.123 850 HB2 PHE 105 HB2 PHE 105 9.627 3.255 -4.976 851 HB3 PHE 105 HB3 PHE 105 8.164 2.290 -5.000 852 HD1 PHE 105 HD1 PHE 105 9.610 5.570 -5.874 853 HD2 PHE 105 HD2 PHE 105 5.991 3.234 -5.714 854 HE1 PHE 105 HE1 PHE 105 8.507 7.156 -7.431 855 HE2 PHE 105 HE2 PHE 105 4.897 4.796 -7.282 856 HZ PHE 105 HZ PHE 105 6.162 6.764 -8.157 857 H ILE 106 H ILE 106 6.834 2.183 -1.709 858 HA ILE 106 HA ILE 106 8.973 0.262 -0.869 859 HB ILE 106 HB ILE 106 8.080 0.113 1.306 860 HG12 ILE 106 HG12 ILE 106 5.923 2.136 0.565 861 HG13 ILE 106 HG13 ILE 106 5.666 0.407 0.816 862 HG21 ILE 106 HG21 ILE 106 8.264 3.076 0.649 863 HG22 ILE 106 HG22 ILE 106 8.707 2.276 2.174 864 HG23 ILE 106 HG23 ILE 106 9.665 1.984 0.718 865 HD11 ILE 106 HD11 ILE 106 6.549 2.369 2.962 866 HD12 ILE 106 HD12 ILE 106 4.976 1.578 2.804 867 HD13 ILE 106 HD13 ILE 106 6.414 0.612 3.169 868 H GLY 107 H GLY 107 8.375 -1.915 -0.502 869 HA2 GLY 107 HA2 GLY 107 6.012 -2.804 -2.090 870 HA3 GLY 107 HA3 GLY 107 7.406 -3.784 -1.641 871 H ILE 108 H ILE 108 4.326 -3.791 -1.090 872 HA ILE 108 HA ILE 108 4.658 -4.805 1.651 873 HB ILE 108 HB ILE 108 2.464 -4.154 2.347 874 HG12 ILE 108 HG12 ILE 108 2.102 -2.509 -0.181 875 HG13 ILE 108 HG13 ILE 108 1.347 -4.081 0.095 876 HG21 ILE 108 HG21 ILE 108 4.042 -1.747 1.385 877 HG22 ILE 108 HG22 ILE 108 2.888 -1.788 2.736 878 HG23 ILE 108 HG23 ILE 108 4.377 -2.735 2.818 879 HD11 ILE 108 HD11 ILE 108 -0.242 -2.322 0.610 880 HD12 ILE 108 HD12 ILE 108 0.158 -3.219 2.080 881 HD13 ILE 108 HD13 ILE 108 0.843 -1.605 1.807 882 H GLY 109 H GLY 109 3.191 -6.481 2.295 883 HA2 GLY 109 HA2 GLY 109 1.517 -7.689 0.209 884 HA3 GLY 109 HA3 GLY 109 2.874 -8.679 0.741 885 H PHE 110 H PHE 110 0.500 -9.666 0.886 886 HA PHE 110 HA PHE 110 -0.522 -9.459 3.694 887 HB2 PHE 110 HB2 PHE 110 -1.945 -9.956 1.051 888 HB3 PHE 110 HB3 PHE 110 -2.699 -10.129 2.626 889 HD1 PHE 110 HD1 PHE 110 -3.211 -8.231 4.034 890 HD2 PHE 110 HD2 PHE 110 -1.292 -7.662 0.210 891 HE1 PHE 110 HE1 PHE 110 -3.742 -5.820 4.123 892 HE2 PHE 110 HE2 PHE 110 -1.857 -5.243 0.297 893 HZ PHE 110 HZ PHE 110 -3.123 -4.331 2.200 894 H THR 111 H THR 111 -1.470 -11.354 4.611 895 HA THR 111 HA THR 111 0.079 -13.756 4.187 896 HB THR 111 HB THR 111 -0.895 -12.836 6.346 897 HG1 THR 111 HG1 THR 111 -1.083 -14.906 7.178 898 HG21 THR 111 HG21 THR 111 -3.073 -13.550 7.072 899 HG22 THR 111 HG22 THR 111 -3.288 -12.640 5.572 900 HG23 THR 111 HG23 THR 111 -3.379 -14.413 5.552 901 H ASP 112 H ASP 112 -2.800 -12.587 2.676 902 HA ASP 112 HA ASP 112 -3.156 -15.072 1.227 903 HB2 ASP 112 HB2 ASP 112 -4.477 -15.428 3.350 904 HB3 ASP 112 HB3 ASP 112 -5.455 -14.023 2.930 905 H ARG 113 H ARG 113 -4.439 -14.868 -0.630 906 HA ARG 113 HA ARG 113 -4.337 -12.353 -1.982 907 HB2 ARG 113 HB2 ARG 113 -4.233 -14.699 -2.934 908 HB3 ARG 113 HB3 ARG 113 -5.983 -14.825 -2.693 909 HG2 ARG 113 HG2 ARG 113 -6.346 -12.934 -4.231 910 HG3 ARG 113 HG3 ARG 113 -4.593 -12.680 -4.345 911 HD2 ARG 113 HD2 ARG 113 -4.387 -15.039 -5.254 912 HD3 ARG 113 HD3 ARG 113 -6.146 -15.131 -5.295 913 HE ARG 113 HE ARG 113 -4.406 -13.283 -6.922 914 HH11 ARG 113 HH11 ARG 113 -5.014 -12.682 -8.839 915 HH12 ARG 113 HH12 ARG 113 -6.535 -13.205 -9.535 916 HH21 ARG 113 HH21 ARG 113 -7.492 -14.955 -6.717 917 HH22 ARG 113 HH22 ARG 113 -7.921 -14.480 -8.337 918 H GLY 114 H GLY 114 -6.983 -13.836 -0.121 919 HA2 GLY 114 HA2 GLY 114 -9.112 -12.155 -1.054 920 HA3 GLY 114 HA3 GLY 114 -9.039 -13.020 0.483 921 H ASP 115 H ASP 115 -6.545 -11.571 1.328 922 HA ASP 115 HA ASP 115 -7.896 -9.189 2.454 923 HB2 ASP 115 HB2 ASP 115 -5.155 -10.392 2.965 924 HB3 ASP 115 HB3 ASP 115 -5.813 -8.978 3.794 925 H ALA 116 H ALA 116 -5.254 -9.913 0.202 926 HA ALA 116 HA ALA 116 -4.608 -7.184 -0.480 927 HB1 ALA 116 HB1 ALA 116 -3.119 -9.008 -0.925 928 HB2 ALA 116 HB2 ALA 116 -4.343 -9.875 -1.887 929 HB3 ALA 116 HB3 ALA 116 -3.649 -8.374 -2.501 930 H PHE 117 H PHE 117 -7.089 -9.479 -1.659 931 HA PHE 117 HA PHE 117 -8.164 -7.797 -3.712 932 HB2 PHE 117 HB2 PHE 117 -9.148 -10.143 -2.177 933 HB3 PHE 117 HB3 PHE 117 -10.355 -9.088 -2.886 934 HD1 PHE 117 HD1 PHE 117 -11.243 -10.226 -4.719 935 HD2 PHE 117 HD2 PHE 117 -6.954 -10.083 -4.241 936 HE1 PHE 117 HE1 PHE 117 -10.950 -11.257 -6.955 937 HE2 PHE 117 HE2 PHE 117 -6.672 -11.090 -6.480 938 HZ PHE 117 HZ PHE 117 -8.667 -11.682 -7.847 939 H ASP 118 H ASP 118 -9.035 -7.941 -0.193 940 HA ASP 118 HA ASP 118 -10.848 -5.729 -0.364 941 HB2 ASP 118 HB2 ASP 118 -9.221 -6.816 1.963 942 HB3 ASP 118 HB3 ASP 118 -10.369 -5.495 2.120 943 H PHE 119 H PHE 119 -7.282 -5.695 0.156 944 HA PHE 119 HA PHE 119 -6.959 -2.931 0.601 945 HB2 PHE 119 HB2 PHE 119 -5.124 -4.429 0.861 946 HB3 PHE 119 HB3 PHE 119 -5.207 -4.964 -0.804 947 HD1 PHE 119 HD1 PHE 119 -4.380 -3.572 -2.670 948 HD2 PHE 119 HD2 PHE 119 -3.963 -2.326 1.427 949 HE1 PHE 119 HE1 PHE 119 -2.821 -1.783 -3.378 950 HE2 PHE 119 HE2 PHE 119 -2.434 -0.514 0.715 951 HZ PHE 119 HZ PHE 119 -1.849 -0.239 -1.686 952 H ASN 120 H ASN 120 -6.869 -4.561 -2.607 953 HA ASN 120 HA ASN 120 -6.783 -1.940 -3.897 954 HB2 ASN 120 HB2 ASN 120 -6.373 -2.963 -5.893 955 HB3 ASN 120 HB3 ASN 120 -5.557 -3.999 -4.727 956 HD21 ASN 120 HD21 ASN 120 -7.676 -6.773 -5.535 957 HD22 ASN 120 HD22 ASN 120 -6.639 -6.131 -4.259 958 H VAL 121 H VAL 121 -9.427 -4.199 -3.271 959 HA VAL 121 HA VAL 121 -11.209 -2.904 -5.154 960 HB VAL 121 HB VAL 121 -11.709 -4.874 -2.920 961 HG11 VAL 121 HG11 VAL 121 -13.790 -3.611 -3.159 962 HG12 VAL 121 HG12 VAL 121 -13.712 -3.756 -4.930 963 HG13 VAL 121 HG13 VAL 121 -13.975 -5.192 -3.915 964 HG21 VAL 121 HG21 VAL 121 -12.102 -6.433 -4.786 965 HG22 VAL 121 HG22 VAL 121 -11.867 -5.124 -5.967 966 HG23 VAL 121 HG23 VAL 121 -10.510 -5.693 -4.984 967 H SER 122 H SER 122 -10.624 -2.515 -1.618 968 HA SER 122 HA SER 122 -12.747 -0.619 -1.226 969 HB2 SER 122 HB2 SER 122 -11.622 -0.036 0.830 970 HB3 SER 122 HB3 SER 122 -11.627 -1.798 0.619 971 HG SER 122 HG SER 122 -9.531 -1.789 0.164 972 H LEU 123 H LEU 123 -9.417 -0.197 -2.383 973 HA LEU 123 HA LEU 123 -9.480 2.686 -2.509 974 HB2 LEU 123 HB2 LEU 123 -7.849 0.540 -3.905 975 HB3 LEU 123 HB3 LEU 123 -7.624 2.251 -4.257 976 HG LEU 123 HG LEU 123 -7.336 1.089 -1.459 977 HD11 LEU 123 HD11 LEU 123 -5.189 1.734 -3.525 978 HD12 LEU 123 HD12 LEU 123 -4.910 1.215 -1.843 979 HD13 LEU 123 HD13 LEU 123 -5.664 0.107 -2.990 980 HD21 LEU 123 HD21 LEU 123 -6.460 3.748 -2.678 981 HD22 LEU 123 HD22 LEU 123 -7.757 3.523 -1.481 982 HD23 LEU 123 HD23 LEU 123 -6.087 3.187 -1.036 983 H GLN 124 H GLN 124 -10.032 0.241 -5.154 984 HA GLN 124 HA GLN 124 -10.713 2.314 -7.004 985 HB2 GLN 124 HB2 GLN 124 -11.170 0.638 -8.573 986 HB3 GLN 124 HB3 GLN 124 -9.868 0.027 -7.553 987 HG2 GLN 124 HG2 GLN 124 -11.706 -1.200 -6.240 988 HG3 GLN 124 HG3 GLN 124 -12.780 -0.831 -7.588 989 HE21 GLN 124 HE21 GLN 124 -9.679 -3.542 -8.047 990 HE22 GLN 124 HE22 GLN 124 -9.608 -2.334 -6.778 991 H ASP 125 H ASP 125 -12.735 0.650 -4.650 992 HA ASP 125 HA ASP 125 -15.227 1.692 -5.757 993 HB2 ASP 125 HB2 ASP 125 -15.091 -0.513 -4.626 994 HB3 ASP 125 HB3 ASP 125 -14.610 0.288 -3.127 995 H HIS 126 H HIS 126 -12.714 3.146 -4.000 996 HA HIS 126 HA HIS 126 -14.569 5.233 -2.976 997 HB2 HIS 126 HB2 HIS 126 -12.837 4.711 -1.416 998 HB3 HIS 126 HB3 HIS 126 -11.590 4.782 -2.653 999 HD2 HIS 126 HD2 HIS 126 -14.255 7.474 -1.581 1000 HE1 HIS 126 HE1 HIS 126 -10.417 9.320 -1.684 1001 HE2 HIS 126 HE2 HIS 126 -12.901 9.741 -1.383 1002 H PHE 127 H PHE 127 -12.450 4.586 -5.706 1003 HA PHE 127 HA PHE 127 -12.743 7.395 -6.600 1004 HB2 PHE 127 HB2 PHE 127 -10.969 5.124 -7.521 1005 HB3 PHE 127 HB3 PHE 127 -11.059 6.674 -8.341 1006 HD1 PHE 127 HD1 PHE 127 -10.745 8.833 -6.844 1007 HD2 PHE 127 HD2 PHE 127 -9.370 4.899 -5.772 1008 HE1 PHE 127 HE1 PHE 127 -9.017 9.832 -5.370 1009 HE2 PHE 127 HE2 PHE 127 -7.634 5.894 -4.307 1010 HZ PHE 127 HZ PHE 127 -7.458 8.370 -4.106 1011 H LYS 128 H LYS 128 -14.506 4.547 -7.274 1012 HA LYS 128 HA LYS 128 -14.856 4.665 -9.994 1013 HB2 LYS 128 HB2 LYS 128 -16.759 3.378 -9.856 1014 HB3 LYS 128 HB3 LYS 128 -15.784 2.896 -8.486 1015 HG2 LYS 128 HG2 LYS 128 -18.092 4.897 -8.198 1016 HG3 LYS 128 HG3 LYS 128 -18.356 3.163 -8.237 1017 HD2 LYS 128 HD2 LYS 128 -17.003 2.788 -6.318 1018 HD3 LYS 128 HD3 LYS 128 -16.502 4.490 -6.222 1019 HE2 LYS 128 HE2 LYS 128 -18.559 5.216 -5.463 1020 HE3 LYS 128 HE3 LYS 128 -19.445 3.866 -6.210 1021 HZ1 LYS 128 HZ1 LYS 128 -17.681 3.633 -3.841 1022 HZ2 LYS 128 HZ2 LYS 128 -19.333 3.584 -3.797 1023 HZ3 LYS 128 HZ3 LYS 128 -18.447 2.392 -4.526 1024 H TRP 129 H TRP 129 -16.195 7.015 -7.851 1025 HA TRP 129 HA TRP 129 -18.098 8.104 -9.827 1026 HB2 TRP 129 HB2 TRP 129 -18.797 9.553 -8.044 1027 HB3 TRP 129 HB3 TRP 129 -18.711 7.904 -7.450 1028 HD1 TRP 129 HD1 TRP 129 -16.542 7.317 -5.859 1029 HE1 TRP 129 HE1 TRP 129 -15.098 8.746 -4.340 1030 HE3 TRP 129 HE3 TRP 129 -17.958 11.962 -7.520 1031 HZ2 TRP 129 HZ2 TRP 129 -14.856 11.552 -3.641 1032 HZ3 TRP 129 HZ3 TRP 129 -17.148 13.998 -6.354 1033 HH2 TRP 129 HH2 TRP 129 -15.628 13.810 -4.401 1034 H VAL 130 H VAL 130 -14.797 8.642 -8.982 1035 HA VAL 130 HA VAL 130 -14.761 11.517 -9.449 1036 HB VAL 130 HB VAL 130 -12.459 9.553 -9.109 1037 HG11 VAL 130 HG11 VAL 130 -12.553 12.591 -8.867 1038 HG12 VAL 130 HG12 VAL 130 -11.190 11.568 -8.355 1039 HG13 VAL 130 HG13 VAL 130 -11.628 11.649 -10.059 1040 HG21 VAL 130 HG21 VAL 130 -13.894 9.516 -7.126 1041 HG22 VAL 130 HG22 VAL 130 -12.446 10.447 -6.750 1042 HG23 VAL 130 HG23 VAL 130 -13.966 11.289 -7.105 1043 H LYS 131 H LYS 131 -14.294 8.710 -11.475 1044 HA LYS 131 HA LYS 131 -13.423 10.432 -13.758 1045 HB2 LYS 131 HB2 LYS 131 -11.884 8.535 -12.777 1046 HB3 LYS 131 HB3 LYS 131 -12.913 7.452 -13.695 1047 HG2 LYS 131 HG2 LYS 131 -11.298 9.820 -14.754 1048 HG3 LYS 131 HG3 LYS 131 -10.861 8.118 -14.895 1049 HD2 LYS 131 HD2 LYS 131 -12.904 7.736 -16.293 1050 HD3 LYS 131 HD3 LYS 131 -13.222 9.478 -16.272 1051 HE2 LYS 131 HE2 LYS 131 -10.676 8.173 -17.332 1052 HE3 LYS 131 HE3 LYS 131 -12.056 8.640 -18.329 1053 HZ1 LYS 131 HZ1 LYS 131 -10.379 10.368 -18.355 1054 HZ2 LYS 131 HZ2 LYS 131 -11.724 10.952 -17.638 1055 HZ3 LYS 131 HZ3 LYS 131 -10.422 10.535 -16.733 1056 H GLN 132 H GLN 132 -15.827 10.846 -13.479 1057 HA GLN 132 HA GLN 132 -17.262 9.165 -15.454 1058 HB2 GLN 132 HB2 GLN 132 -18.508 10.400 -12.968 1059 HB3 GLN 132 HB3 GLN 132 -19.386 9.679 -14.328 1060 HG2 GLN 132 HG2 GLN 132 -18.115 7.517 -13.894 1061 HG3 GLN 132 HG3 GLN 132 -17.476 8.260 -12.427 1062 HE21 GLN 132 HE21 GLN 132 -20.287 6.374 -11.130 1063 HE22 GLN 132 HE22 GLN 132 -18.564 6.252 -11.515 1064 H GLU 133 H GLU 133 -17.426 10.311 -17.195 1065 HA GLU 133 HA GLU 133 -17.832 13.281 -17.182 1066 HB2 GLU 133 HB2 GLU 133 -15.792 11.683 -18.779 1067 HB3 GLU 133 HB3 GLU 133 -16.189 13.382 -19.052 1068 HG2 GLU 133 HG2 GLU 133 -15.424 13.958 -16.773 1069 HG3 GLU 133 HG3 GLU 133 -15.036 12.264 -16.456 Start of MODEL 9 1 H1 GLY -4 H1 GLY -4 -6.839 29.749 19.482 2 H2 GLY -4 H2 GLY -4 -6.039 31.131 19.850 3 H3 GLY -4 H3 GLY -4 -5.788 30.400 18.406 4 HA2 GLY -4 HA2 GLY -4 -8.323 31.640 19.277 5 HA3 GLY -4 HA3 GLY -4 -7.180 32.352 18.127 6 H SER -3 H SER -3 -9.987 30.589 18.389 7 HA SER -3 HA SER -3 -9.918 28.403 16.829 8 HB2 SER -3 HB2 SER -3 -12.212 30.388 16.878 9 HB3 SER -3 HB3 SER -3 -12.320 28.653 16.538 10 HG SER -3 HG SER -3 -11.690 28.217 18.654 11 HA PRO -2 HA PRO -2 -11.172 30.455 12.706 12 HB2 PRO -2 HB2 PRO -2 -10.256 32.967 12.017 13 HB3 PRO -2 HB3 PRO -2 -11.825 32.627 12.806 14 HG2 PRO -2 HG2 PRO -2 -9.210 33.422 14.127 15 HG3 PRO -2 HG3 PRO -2 -10.839 34.139 14.373 16 HD2 PRO -2 HD2 PRO -2 -9.893 32.324 16.079 17 HD3 PRO -2 HD3 PRO -2 -11.597 32.220 15.558 18 H ASN -1 H ASN -1 -8.010 30.537 14.090 19 HA ASN -1 HA ASN -1 -6.494 30.512 11.601 20 HB2 ASN -1 HB2 ASN -1 -5.800 29.584 14.423 21 HB3 ASN -1 HB3 ASN -1 -4.669 29.631 13.076 22 HD21 ASN -1 HD21 ASN -1 -5.580 33.091 14.999 23 HD22 ASN -1 HD22 ASN -1 -6.388 31.576 15.419 24 H SER 0 H SER 0 -8.366 28.049 13.306 25 HA SER 0 HA SER 0 -7.055 25.733 12.234 26 HB2 SER 0 HB2 SER 0 -9.935 26.135 13.130 27 HB3 SER 0 HB3 SER 0 -9.162 24.569 12.813 28 HG SER 0 HG SER 0 -9.099 25.146 15.045 29 H MET 1 H MET 1 -9.465 27.901 10.839 30 HA MET 1 HA MET 1 -10.299 26.184 8.689 31 HB2 MET 1 HB2 MET 1 -10.574 29.184 9.120 32 HB3 MET 1 HB3 MET 1 -11.323 28.288 7.801 33 HG2 MET 1 HG2 MET 1 -13.000 28.528 9.401 34 HG3 MET 1 HG3 MET 1 -12.496 26.844 9.473 35 HE1 MET 1 HE1 MET 1 -14.382 28.197 11.619 36 HE2 MET 1 HE2 MET 1 -13.840 26.504 11.702 37 HE3 MET 1 HE3 MET 1 -13.690 27.556 13.126 38 H ALA 2 H ALA 2 -7.298 27.346 9.059 39 HA ALA 2 HA ALA 2 -6.730 28.323 6.351 40 HB1 ALA 2 HB1 ALA 2 -5.515 29.161 8.336 41 HB2 ALA 2 HB2 ALA 2 -4.871 27.528 8.632 42 HB3 ALA 2 HB3 ALA 2 -4.415 28.412 7.161 43 H THR 3 H THR 3 -6.613 25.234 8.017 44 HA THR 3 HA THR 3 -5.963 23.829 5.465 45 HB THR 3 HB THR 3 -4.646 22.148 6.742 46 HG1 THR 3 HG1 THR 3 -3.865 22.787 8.784 47 HG21 THR 3 HG21 THR 3 -3.529 23.994 5.488 48 HG22 THR 3 HG22 THR 3 -3.494 24.956 6.983 49 HG23 THR 3 HG23 THR 3 -2.589 23.427 6.883 50 H GLU 4 H GLU 4 -7.209 23.582 8.727 51 HA GLU 4 HA GLU 4 -9.040 22.663 9.624 52 HB2 GLU 4 HB2 GLU 4 -9.720 24.162 7.499 53 HB3 GLU 4 HB3 GLU 4 -10.444 22.639 6.976 54 HG2 GLU 4 HG2 GLU 4 -11.498 22.536 9.324 55 HG3 GLU 4 HG3 GLU 4 -10.931 24.202 9.537 56 H LEU 5 H LEU 5 -7.151 20.666 8.583 57 HA LEU 5 HA LEU 5 -8.825 18.678 7.266 58 HB2 LEU 5 HB2 LEU 5 -6.364 19.892 6.764 59 HB3 LEU 5 HB3 LEU 5 -5.922 18.240 7.153 60 HG LEU 5 HG LEU 5 -8.119 18.994 5.178 61 HD11 LEU 5 HD11 LEU 5 -5.192 18.338 4.609 62 HD12 LEU 5 HD12 LEU 5 -6.469 18.541 3.386 63 HD13 LEU 5 HD13 LEU 5 -5.982 19.916 4.389 64 HD21 LEU 5 HD21 LEU 5 -6.500 16.430 5.522 65 HD22 LEU 5 HD22 LEU 5 -8.177 16.645 6.056 66 HD23 LEU 5 HD23 LEU 5 -7.790 16.700 4.327 67 H GLU 6 H GLU 6 -9.220 18.617 9.971 68 HA GLU 6 HA GLU 6 -7.761 16.363 11.147 69 HB2 GLU 6 HB2 GLU 6 -8.507 18.459 12.364 70 HB3 GLU 6 HB3 GLU 6 -10.152 17.824 12.314 71 HG2 GLU 6 HG2 GLU 6 -9.353 15.793 13.572 72 HG3 GLU 6 HG3 GLU 6 -7.718 16.447 13.555 73 H TYR 7 H TYR 7 -8.599 15.199 9.008 74 HA TYR 7 HA TYR 7 -10.504 13.197 9.851 75 HB2 TYR 7 HB2 TYR 7 -11.832 13.418 7.720 76 HB3 TYR 7 HB3 TYR 7 -12.112 14.640 8.953 77 HD1 TYR 7 HD1 TYR 7 -11.680 16.955 8.577 78 HD2 TYR 7 HD2 TYR 7 -10.580 14.009 5.604 79 HE1 TYR 7 HE1 TYR 7 -11.518 18.752 6.877 80 HE2 TYR 7 HE2 TYR 7 -10.381 15.863 3.917 81 HH TYR 7 HH TYR 7 -11.074 19.270 4.686 82 H GLU 8 H GLU 8 -10.562 11.446 8.377 83 HA GLU 8 HA GLU 8 -8.736 10.821 6.295 84 HB2 GLU 8 HB2 GLU 8 -7.152 9.428 7.518 85 HB3 GLU 8 HB3 GLU 8 -6.942 11.184 7.733 86 HG2 GLU 8 HG2 GLU 8 -7.776 11.108 9.977 87 HG3 GLU 8 HG3 GLU 8 -8.252 9.421 9.809 88 H SER 9 H SER 9 -10.788 9.990 5.729 89 HA SER 9 HA SER 9 -12.188 8.383 7.593 90 HB2 SER 9 HB2 SER 9 -12.964 10.040 5.654 91 HB3 SER 9 HB3 SER 9 -13.012 8.556 4.695 92 HG SER 9 HG SER 9 -15.027 8.991 5.769 93 H VAL 10 H VAL 10 -12.373 6.191 7.839 94 HA VAL 10 HA VAL 10 -10.346 4.583 6.602 95 HB VAL 10 HB VAL 10 -12.596 3.817 8.494 96 HG11 VAL 10 HG11 VAL 10 -10.109 2.268 7.657 97 HG12 VAL 10 HG12 VAL 10 -11.144 1.856 9.048 98 HG13 VAL 10 HG13 VAL 10 -11.805 1.770 7.421 99 HG21 VAL 10 HG21 VAL 10 -9.636 4.400 8.963 100 HG22 VAL 10 HG22 VAL 10 -10.982 5.464 9.433 101 HG23 VAL 10 HG23 VAL 10 -10.807 3.884 10.201 102 H LEU 11 H LEU 11 -10.329 2.922 5.242 103 HA LEU 11 HA LEU 11 -12.811 2.252 3.686 104 HB2 LEU 11 HB2 LEU 11 -9.961 2.550 2.656 105 HB3 LEU 11 HB3 LEU 11 -11.337 1.983 1.723 106 HG LEU 11 HG LEU 11 -10.949 4.796 2.821 107 HD11 LEU 11 HD11 LEU 11 -10.897 3.572 0.029 108 HD12 LEU 11 HD12 LEU 11 -10.935 5.307 0.339 109 HD13 LEU 11 HD13 LEU 11 -9.552 4.346 0.892 110 HD21 LEU 11 HD21 LEU 11 -13.235 3.680 1.135 111 HD22 LEU 11 HD22 LEU 11 -13.363 4.238 2.819 112 HD23 LEU 11 HD23 LEU 11 -12.967 5.390 1.555 113 H CYS 12 H CYS 12 -9.610 1.068 4.799 114 HA CYS 12 HA CYS 12 -10.755 -1.603 5.240 115 HB2 CYS 12 HB2 CYS 12 -9.916 -1.604 2.842 116 HB3 CYS 12 HB3 CYS 12 -8.291 -1.275 3.485 117 HG CYS 12 HG CYS 12 -8.514 -3.803 2.808 118 H VAL 13 H VAL 13 -9.941 -2.423 7.059 119 HA VAL 13 HA VAL 13 -7.204 -1.662 7.954 120 HB VAL 13 HB VAL 13 -9.674 -1.811 9.707 121 HG11 VAL 13 HG11 VAL 13 -6.745 -1.561 10.543 122 HG12 VAL 13 HG12 VAL 13 -8.142 -1.315 11.610 123 HG13 VAL 13 HG13 VAL 13 -7.838 -2.911 10.929 124 HG21 VAL 13 HG21 VAL 13 -7.629 0.404 9.286 125 HG22 VAL 13 HG22 VAL 13 -9.237 0.362 8.543 126 HG23 VAL 13 HG23 VAL 13 -9.085 0.489 10.301 127 H LYS 14 H LYS 14 -5.936 -3.339 8.232 128 HA LYS 14 HA LYS 14 -7.063 -5.933 9.102 129 HB2 LYS 14 HB2 LYS 14 -5.105 -5.653 6.793 130 HB3 LYS 14 HB3 LYS 14 -5.509 -7.170 7.599 131 HG2 LYS 14 HG2 LYS 14 -7.921 -6.821 7.007 132 HG3 LYS 14 HG3 LYS 14 -7.451 -5.375 6.086 133 HD2 LYS 14 HD2 LYS 14 -5.929 -6.786 4.707 134 HD3 LYS 14 HD3 LYS 14 -6.505 -8.229 5.551 135 HE2 LYS 14 HE2 LYS 14 -8.334 -6.281 4.061 136 HE3 LYS 14 HE3 LYS 14 -7.579 -7.674 3.288 137 HZ1 LYS 14 HZ1 LYS 14 -9.462 -7.852 5.572 138 HZ2 LYS 14 HZ2 LYS 14 -9.788 -8.233 4.004 139 HZ3 LYS 14 HZ3 LYS 14 -8.710 -9.129 4.846 140 HA PRO 15 HA PRO 15 -3.911 -5.543 12.109 141 HB2 PRO 15 HB2 PRO 15 -3.695 -8.091 13.077 142 HB3 PRO 15 HB3 PRO 15 -5.154 -7.075 13.321 143 HG2 PRO 15 HG2 PRO 15 -4.680 -9.167 11.156 144 HG3 PRO 15 HG3 PRO 15 -6.091 -9.028 12.262 145 HD2 PRO 15 HD2 PRO 15 -6.169 -8.029 9.765 146 HD3 PRO 15 HD3 PRO 15 -6.890 -7.116 11.126 147 H ASP 16 H ASP 16 -3.271 -7.625 9.379 148 HA ASP 16 HA ASP 16 -0.380 -7.841 10.110 149 HB2 ASP 16 HB2 ASP 16 -1.598 -9.903 10.663 150 HB3 ASP 16 HB3 ASP 16 -2.202 -10.003 9.007 151 H VAL 17 H VAL 17 0.645 -6.641 8.742 152 HA VAL 17 HA VAL 17 0.737 -7.458 5.933 153 HB VAL 17 HB VAL 17 -0.905 -5.560 6.008 154 HG11 VAL 17 HG11 VAL 17 1.504 -3.800 6.620 155 HG12 VAL 17 HG12 VAL 17 -0.149 -3.271 6.263 156 HG13 VAL 17 HG13 VAL 17 0.188 -4.161 7.755 157 HG21 VAL 17 HG21 VAL 17 -0.017 -4.402 4.073 158 HG22 VAL 17 HG22 VAL 17 1.620 -4.991 4.417 159 HG23 VAL 17 HG23 VAL 17 0.330 -6.130 3.958 160 H SER 18 H SER 18 2.753 -7.129 4.998 161 HA SER 18 HA SER 18 4.959 -6.424 6.918 162 HB2 SER 18 HB2 SER 18 4.848 -8.652 4.861 163 HB3 SER 18 HB3 SER 18 6.214 -8.270 5.930 164 HG SER 18 HG SER 18 4.843 -9.987 6.713 165 H VAL 19 H VAL 19 6.526 -5.111 6.234 166 HA VAL 19 HA VAL 19 6.469 -4.050 3.448 167 HB VAL 19 HB VAL 19 7.593 -2.892 5.995 168 HG11 VAL 19 HG11 VAL 19 7.753 -1.799 3.146 169 HG12 VAL 19 HG12 VAL 19 8.035 -0.831 4.616 170 HG13 VAL 19 HG13 VAL 19 9.107 -2.171 4.239 171 HG21 VAL 19 HG21 VAL 19 5.056 -2.763 5.519 172 HG22 VAL 19 HG22 VAL 19 5.908 -1.245 5.815 173 HG23 VAL 19 HG23 VAL 19 5.490 -1.707 4.159 174 H TYR 20 H TYR 20 7.995 -4.078 2.121 175 HA TYR 20 HA TYR 20 10.725 -4.941 2.927 176 HB2 TYR 20 HB2 TYR 20 9.671 -5.561 0.188 177 HB3 TYR 20 HB3 TYR 20 10.977 -6.322 1.097 178 HD1 TYR 20 HD1 TYR 20 7.481 -6.438 0.192 179 HD2 TYR 20 HD2 TYR 20 10.345 -7.817 3.085 180 HE1 TYR 20 HE1 TYR 20 5.865 -8.174 0.952 181 HE2 TYR 20 HE2 TYR 20 8.723 -9.545 3.874 182 HH TYR 20 HH TYR 20 5.472 -9.905 2.424 183 H ARG 21 H ARG 21 12.167 -3.475 2.454 184 HA ARG 21 HA ARG 21 11.795 -1.374 0.399 185 HB2 ARG 21 HB2 ARG 21 14.216 -2.277 2.005 186 HB3 ARG 21 HB3 ARG 21 14.313 -1.089 0.692 187 HG2 ARG 21 HG2 ARG 21 12.639 0.339 1.807 188 HG3 ARG 21 HG3 ARG 21 12.515 -0.802 3.150 189 HD2 ARG 21 HD2 ARG 21 15.095 0.592 2.329 190 HD3 ARG 21 HD3 ARG 21 13.974 1.228 3.533 191 HE ARG 21 HE ARG 21 14.323 -0.776 4.906 192 HH11 ARG 21 HH11 ARG 21 15.811 -1.994 5.923 193 HH12 ARG 21 HH12 ARG 21 17.484 -1.985 5.398 194 HH21 ARG 21 HH21 ARG 21 16.916 0.008 2.655 195 HH22 ARG 21 HH22 ARG 21 18.085 -0.906 3.566 196 H ILE 22 H ILE 22 12.501 -1.400 -1.646 197 HA ILE 22 HA ILE 22 12.942 -4.108 -2.826 198 HB ILE 22 HB ILE 22 11.299 -3.530 -4.538 199 HG12 ILE 22 HG12 ILE 22 10.803 -0.946 -3.002 200 HG13 ILE 22 HG13 ILE 22 11.567 -1.079 -4.589 201 HG21 ILE 22 HG21 ILE 22 9.353 -3.882 -3.218 202 HG22 ILE 22 HG22 ILE 22 10.681 -4.639 -2.331 203 HG23 ILE 22 HG23 ILE 22 10.054 -3.058 -1.821 204 HD11 ILE 22 HD11 ILE 22 9.442 -2.172 -5.437 205 HD12 ILE 22 HD12 ILE 22 8.689 -1.726 -3.889 206 HD13 ILE 22 HD13 ILE 22 9.303 -0.462 -4.971 207 HA PRO 23 HA PRO 23 15.989 -2.385 -5.628 208 HB2 PRO 23 HB2 PRO 23 15.563 -3.821 -7.940 209 HB3 PRO 23 HB3 PRO 23 16.315 -4.518 -6.472 210 HG2 PRO 23 HG2 PRO 23 13.386 -4.635 -7.295 211 HG3 PRO 23 HG3 PRO 23 14.465 -6.001 -6.837 212 HD2 PRO 23 HD2 PRO 23 12.831 -4.912 -5.020 213 HD3 PRO 23 HD3 PRO 23 14.506 -5.314 -4.559 214 HA PRO 24 HA PRO 24 13.972 0.789 -7.989 215 HB2 PRO 24 HB2 PRO 24 15.673 1.290 -10.089 216 HB3 PRO 24 HB3 PRO 24 16.019 1.733 -8.391 217 HG2 PRO 24 HG2 PRO 24 16.957 -0.731 -9.894 218 HG3 PRO 24 HG3 PRO 24 17.929 0.395 -8.893 219 HD2 PRO 24 HD2 PRO 24 17.003 -1.941 -7.888 220 HD3 PRO 24 HD3 PRO 24 17.022 -0.463 -6.883 221 H ARG 25 H ARG 25 12.100 0.203 -8.813 222 HA ARG 25 HA ARG 25 11.863 -0.847 -11.541 223 HB2 ARG 25 HB2 ARG 25 11.181 -2.390 -9.042 224 HB3 ARG 25 HB3 ARG 25 9.990 -2.470 -10.329 225 HG2 ARG 25 HG2 ARG 25 12.895 -3.286 -10.612 226 HG3 ARG 25 HG3 ARG 25 11.511 -4.360 -10.401 227 HD2 ARG 25 HD2 ARG 25 10.490 -3.553 -12.476 228 HD3 ARG 25 HD3 ARG 25 11.820 -2.438 -12.759 229 HE ARG 25 HE ARG 25 11.749 -5.174 -13.483 230 HH11 ARG 25 HH11 ARG 25 13.478 -6.079 -14.510 231 HH12 ARG 25 HH12 ARG 25 15.056 -5.361 -14.377 232 HH21 ARG 25 HH21 ARG 25 14.087 -2.789 -12.317 233 HH22 ARG 25 HH22 ARG 25 15.384 -3.540 -13.196 234 H ALA 26 H ALA 26 9.475 -1.193 -12.026 235 HA ALA 26 HA ALA 26 7.584 0.777 -10.992 236 HB1 ALA 26 HB1 ALA 26 8.593 0.816 -13.890 237 HB2 ALA 26 HB2 ALA 26 7.240 1.775 -13.247 238 HB3 ALA 26 HB3 ALA 26 8.890 2.082 -12.678 239 H SER 27 H SER 27 5.397 0.263 -11.940 240 HA SER 27 HA SER 27 4.776 -2.493 -12.260 241 HB2 SER 27 HB2 SER 27 3.173 -0.764 -11.576 242 HB3 SER 27 HB3 SER 27 3.252 -0.030 -13.192 243 HG SER 27 HG SER 27 1.441 -1.430 -12.958 244 H ASN 28 H ASN 28 5.378 0.018 -14.720 245 HA ASN 28 HA ASN 28 4.972 -1.754 -16.996 246 HB2 ASN 28 HB2 ASN 28 6.205 1.028 -16.778 247 HB3 ASN 28 HB3 ASN 28 5.834 0.202 -18.287 248 HD21 ASN 28 HD21 ASN 28 2.883 2.230 -16.529 249 HD22 ASN 28 HD22 ASN 28 4.566 2.399 -16.056 250 H ARG 29 H ARG 29 7.374 -1.860 -14.784 251 HA ARG 29 HA ARG 29 9.365 -3.047 -16.690 252 HB2 ARG 29 HB2 ARG 29 9.931 -1.487 -14.122 253 HB3 ARG 29 HB3 ARG 29 11.144 -2.265 -15.138 254 HG2 ARG 29 HG2 ARG 29 9.361 0.070 -15.980 255 HG3 ARG 29 HG3 ARG 29 11.066 0.165 -15.521 256 HD2 ARG 29 HD2 ARG 29 11.669 -1.328 -17.381 257 HD3 ARG 29 HD3 ARG 29 9.983 -1.481 -17.839 258 HE ARG 29 HE ARG 29 11.686 0.949 -18.133 259 HH11 ARG 29 HH11 ARG 29 11.115 2.434 -19.663 260 HH12 ARG 29 HH12 ARG 29 9.596 2.295 -20.497 261 HH21 ARG 29 HH21 ARG 29 8.577 -0.555 -18.871 262 HH22 ARG 29 HH22 ARG 29 8.221 0.644 -20.089 263 H GLY 30 H GLY 30 7.549 -3.419 -13.783 264 HA2 GLY 30 HA2 GLY 30 6.701 -5.450 -13.148 265 HA3 GLY 30 HA3 GLY 30 7.956 -6.292 -14.080 266 H TYR 31 H TYR 31 7.097 -4.766 -11.050 267 HA TYR 31 HA TYR 31 9.005 -6.149 -9.367 268 HB2 TYR 31 HB2 TYR 31 6.086 -5.617 -8.803 269 HB3 TYR 31 HB3 TYR 31 7.423 -5.792 -7.675 270 HD1 TYR 31 HD1 TYR 31 5.292 -3.512 -9.450 271 HD2 TYR 31 HD2 TYR 31 9.286 -3.919 -7.843 272 HE1 TYR 31 HE1 TYR 31 5.479 -1.069 -9.275 273 HE2 TYR 31 HE2 TYR 31 9.462 -1.466 -7.683 274 HH TYR 31 HH TYR 31 6.705 0.705 -8.575 275 H ARG 32 H ARG 32 8.769 -8.352 -8.718 276 HA ARG 32 HA ARG 32 6.484 -9.978 -9.765 277 HB2 ARG 32 HB2 ARG 32 8.029 -11.808 -10.344 278 HB3 ARG 32 HB3 ARG 32 8.070 -10.428 -11.413 279 HG2 ARG 32 HG2 ARG 32 10.154 -10.745 -9.221 280 HG3 ARG 32 HG3 ARG 32 10.284 -11.583 -10.772 281 HD2 ARG 32 HD2 ARG 32 10.089 -9.386 -11.965 282 HD3 ARG 32 HD3 ARG 32 10.137 -8.574 -10.392 283 HE ARG 32 HE ARG 32 12.384 -10.377 -10.845 284 HH11 ARG 32 HH11 ARG 32 14.420 -9.478 -10.852 285 HH12 ARG 32 HH12 ARG 32 14.624 -7.774 -11.114 286 HH21 ARG 32 HH21 ARG 32 11.260 -7.101 -11.433 287 HH22 ARG 32 HH22 ARG 32 12.877 -6.445 -11.316 288 H ALA 33 H ALA 33 7.097 -8.878 -7.190 289 HA ALA 33 HA ALA 33 7.200 -9.266 -4.998 290 HB1 ALA 33 HB1 ALA 33 5.899 -11.135 -4.174 291 HB2 ALA 33 HB2 ALA 33 5.141 -10.442 -5.630 292 HB3 ALA 33 HB3 ALA 33 6.027 -11.962 -5.750 293 H SER 34 H SER 34 8.529 -12.189 -6.604 294 HA SER 34 HA SER 34 10.241 -13.033 -4.522 295 HB2 SER 34 HB2 SER 34 10.484 -13.446 -7.521 296 HB3 SER 34 HB3 SER 34 11.337 -14.379 -6.276 297 HG SER 34 HG SER 34 9.417 -15.429 -6.985 298 H ASP 35 H ASP 35 10.629 -10.283 -6.549 299 HA ASP 35 HA ASP 35 13.541 -10.100 -6.306 300 HB2 ASP 35 HB2 ASP 35 13.240 -7.937 -7.405 301 HB3 ASP 35 HB3 ASP 35 12.511 -9.261 -8.291 302 H TRP 36 H TRP 36 11.042 -9.677 -4.058 303 HA TRP 36 HA TRP 36 12.466 -7.548 -2.562 304 HB2 TRP 36 HB2 TRP 36 9.740 -8.706 -1.999 305 HB3 TRP 36 HB3 TRP 36 10.423 -7.206 -1.411 306 HD1 TRP 36 HD1 TRP 36 11.195 -6.622 -4.788 307 HE1 TRP 36 HE1 TRP 36 9.286 -5.780 -6.243 308 HE3 TRP 36 HE3 TRP 36 7.268 -7.644 -1.670 309 HZ2 TRP 36 HZ2 TRP 36 6.524 -5.017 -5.830 310 HZ3 TRP 36 HZ3 TRP 36 5.011 -6.717 -2.171 311 HH2 TRP 36 HH2 TRP 36 4.632 -5.428 -4.255 312 H LYS 37 H LYS 37 12.393 -7.821 -0.201 313 HA LYS 37 HA LYS 37 13.584 -10.344 0.661 314 HB2 LYS 37 HB2 LYS 37 13.061 -7.718 2.105 315 HB3 LYS 37 HB3 LYS 37 13.862 -9.107 2.810 316 HG2 LYS 37 HG2 LYS 37 15.319 -8.861 0.492 317 HG3 LYS 37 HG3 LYS 37 14.872 -7.179 0.805 318 HD2 LYS 37 HD2 LYS 37 16.871 -7.379 1.997 319 HD3 LYS 37 HD3 LYS 37 15.671 -7.717 3.271 320 HE2 LYS 37 HE2 LYS 37 15.960 -10.145 2.874 321 HE3 LYS 37 HE3 LYS 37 17.170 -9.810 1.633 322 HZ1 LYS 37 HZ1 LYS 37 18.613 -8.878 3.300 323 HZ2 LYS 37 HZ2 LYS 37 17.466 -8.951 4.465 324 HZ3 LYS 37 HZ3 LYS 37 18.101 -10.331 3.871 325 H LEU 38 H LEU 38 11.256 -11.203 -0.029 326 HA LEU 38 HA LEU 38 8.995 -10.921 1.566 327 HB2 LEU 38 HB2 LEU 38 9.934 -13.393 0.071 328 HB3 LEU 38 HB3 LEU 38 8.295 -13.130 0.664 329 HG LEU 38 HG LEU 38 9.712 -11.537 -1.504 330 HD11 LEU 38 HD11 LEU 38 8.867 -13.769 -2.163 331 HD12 LEU 38 HD12 LEU 38 7.263 -13.367 -1.509 332 HD13 LEU 38 HD13 LEU 38 7.894 -12.496 -2.913 333 HD21 LEU 38 HD21 LEU 38 6.985 -11.101 -0.241 334 HD22 LEU 38 HD22 LEU 38 8.329 -9.944 -0.334 335 HD23 LEU 38 HD23 LEU 38 7.473 -10.410 -1.805 336 H ASP 39 H ASP 39 11.700 -13.083 2.285 337 HA ASP 39 HA ASP 39 10.273 -14.347 4.549 338 HB2 ASP 39 HB2 ASP 39 11.770 -15.591 2.977 339 HB3 ASP 39 HB3 ASP 39 13.136 -14.653 3.578 340 H GLN 40 H GLN 40 11.786 -11.430 4.163 341 HA GLN 40 HA GLN 40 13.042 -11.236 6.875 342 HB2 GLN 40 HB2 GLN 40 14.200 -10.731 4.112 343 HB3 GLN 40 HB3 GLN 40 14.961 -10.092 5.580 344 HG2 GLN 40 HG2 GLN 40 15.527 -12.171 6.365 345 HG3 GLN 40 HG3 GLN 40 14.388 -13.020 5.304 346 HE21 GLN 40 HE21 GLN 40 16.517 -12.944 2.415 347 HE22 GLN 40 HE22 GLN 40 14.838 -13.016 2.913 348 HA PRO 41 HA PRO 41 10.558 -7.698 5.251 349 HB2 PRO 41 HB2 PRO 41 8.707 -7.208 7.314 350 HB3 PRO 41 HB3 PRO 41 8.443 -8.317 5.942 351 HG2 PRO 41 HG2 PRO 41 9.494 -9.004 8.705 352 HG3 PRO 41 HG3 PRO 41 8.220 -9.847 7.768 353 HD2 PRO 41 HD2 PRO 41 10.778 -10.768 7.824 354 HD3 PRO 41 HD3 PRO 41 9.814 -10.827 6.315 355 H ASP 42 H ASP 42 10.884 -5.554 5.589 356 HA ASP 42 HA ASP 42 12.996 -4.799 7.472 357 HB2 ASP 42 HB2 ASP 42 12.785 -4.043 5.060 358 HB3 ASP 42 HB3 ASP 42 11.387 -3.079 5.543 359 H TRP 43 H TRP 43 9.527 -4.522 7.248 360 HA TRP 43 HA TRP 43 9.334 -3.869 10.092 361 HB2 TRP 43 HB2 TRP 43 9.419 -1.613 9.226 362 HB3 TRP 43 HB3 TRP 43 8.269 -1.985 7.958 363 HD1 TRP 43 HD1 TRP 43 8.460 -0.869 11.536 364 HE1 TRP 43 HE1 TRP 43 6.112 -0.272 12.388 365 HE3 TRP 43 HE3 TRP 43 5.689 -2.935 7.768 366 HZ2 TRP 43 HZ2 TRP 43 3.395 -0.429 11.408 367 HZ3 TRP 43 HZ3 TRP 43 3.214 -2.610 7.710 368 HH2 TRP 43 HH2 TRP 43 2.063 -1.373 9.521 369 H THR 44 H THR 44 7.244 -4.418 10.966 370 HA THR 44 HA THR 44 5.192 -5.483 9.112 371 HB THR 44 HB THR 44 4.701 -7.368 10.622 372 HG1 THR 44 HG1 THR 44 6.355 -8.014 12.067 373 HG21 THR 44 HG21 THR 44 6.068 -7.680 8.585 374 HG22 THR 44 HG22 THR 44 7.542 -7.515 9.569 375 HG23 THR 44 HG23 THR 44 6.412 -8.864 9.852 376 H GLY 45 H GLY 45 3.083 -5.304 9.796 377 HA2 GLY 45 HA2 GLY 45 2.162 -4.805 12.395 378 HA3 GLY 45 HA3 GLY 45 2.500 -3.216 11.699 379 H ARG 46 H ARG 46 0.471 -2.468 11.513 380 HA ARG 46 HA ARG 46 -1.698 -4.133 10.358 381 HB2 ARG 46 HB2 ARG 46 -1.982 -1.409 11.645 382 HB3 ARG 46 HB3 ARG 46 -3.226 -2.628 11.370 383 HG2 ARG 46 HG2 ARG 46 -1.939 -4.112 13.048 384 HG3 ARG 46 HG3 ARG 46 -0.972 -2.688 13.423 385 HD2 ARG 46 HD2 ARG 46 -3.995 -2.948 13.718 386 HD3 ARG 46 HD3 ARG 46 -2.806 -2.957 15.022 387 HE ARG 46 HE ARG 46 -2.861 -0.533 13.314 388 HH11 ARG 46 HH11 ARG 46 -3.603 1.415 14.142 389 HH12 ARG 46 HH12 ARG 46 -4.205 1.447 15.774 390 HH21 ARG 46 HH21 ARG 46 -3.938 -1.910 16.348 391 HH22 ARG 46 HH22 ARG 46 -4.406 -0.359 16.984 392 H LEU 47 H LEU 47 -2.939 -3.518 8.724 393 HA LEU 47 HA LEU 47 -2.124 -1.345 6.869 394 HB2 LEU 47 HB2 LEU 47 -2.695 -3.596 5.946 395 HB3 LEU 47 HB3 LEU 47 -4.255 -3.528 6.764 396 HG LEU 47 HG LEU 47 -4.864 -1.520 5.349 397 HD11 LEU 47 HD11 LEU 47 -3.538 -1.131 3.289 398 HD12 LEU 47 HD12 LEU 47 -2.598 -0.741 4.727 399 HD13 LEU 47 HD13 LEU 47 -2.303 -2.268 3.863 400 HD21 LEU 47 HD21 LEU 47 -5.269 -2.855 3.317 401 HD22 LEU 47 HD22 LEU 47 -4.118 -4.075 3.914 402 HD23 LEU 47 HD23 LEU 47 -5.631 -3.764 4.790 403 H ARG 48 H ARG 48 -3.230 0.580 6.854 404 HA ARG 48 HA ARG 48 -6.093 0.613 7.564 405 HB2 ARG 48 HB2 ARG 48 -5.076 1.169 9.682 406 HB3 ARG 48 HB3 ARG 48 -4.064 2.417 8.949 407 HG2 ARG 48 HG2 ARG 48 -5.835 3.900 8.673 408 HG3 ARG 48 HG3 ARG 48 -7.069 2.631 8.633 409 HD2 ARG 48 HD2 ARG 48 -6.924 2.273 11.005 410 HD3 ARG 48 HD3 ARG 48 -5.495 3.283 11.147 411 HE ARG 48 HE ARG 48 -8.285 4.181 10.858 412 HH11 ARG 48 HH11 ARG 48 -8.736 6.411 10.836 413 HH12 ARG 48 HH12 ARG 48 -7.364 7.514 10.929 414 HH21 ARG 48 HH21 ARG 48 -4.900 5.284 11.126 415 HH22 ARG 48 HH22 ARG 48 -5.456 6.963 10.993 416 H ILE 49 H ILE 49 -6.487 0.774 5.443 417 HA ILE 49 HA ILE 49 -5.487 3.013 3.817 418 HB ILE 49 HB ILE 49 -7.873 1.232 3.231 419 HG12 ILE 49 HG12 ILE 49 -4.943 0.817 2.481 420 HG13 ILE 49 HG13 ILE 49 -5.932 -0.206 3.534 421 HG21 ILE 49 HG21 ILE 49 -6.088 2.902 1.395 422 HG22 ILE 49 HG22 ILE 49 -7.529 1.979 0.913 423 HG23 ILE 49 HG23 ILE 49 -7.700 3.388 1.952 424 HD11 ILE 49 HD11 ILE 49 -7.490 -0.522 1.508 425 HD12 ILE 49 HD12 ILE 49 -6.123 0.085 0.540 426 HD13 ILE 49 HD13 ILE 49 -5.948 -1.369 1.545 427 H THR 50 H THR 50 -6.254 4.968 3.866 428 HA THR 50 HA THR 50 -8.966 5.581 4.903 429 HB THR 50 HB THR 50 -7.864 7.733 5.838 430 HG1 THR 50 HG1 THR 50 -5.623 6.035 5.704 431 HG21 THR 50 HG21 THR 50 -7.375 5.048 7.164 432 HG22 THR 50 HG22 THR 50 -7.289 6.637 7.965 433 HG23 THR 50 HG23 THR 50 -8.823 6.074 7.292 434 H SER 51 H SER 51 -9.769 7.739 4.117 435 HA SER 51 HA SER 51 -8.470 9.031 1.853 436 HB2 SER 51 HB2 SER 51 -9.476 6.934 0.832 437 HB3 SER 51 HB3 SER 51 -11.069 7.512 1.373 438 HG SER 51 HG SER 51 -10.796 8.231 -0.689 439 H LYS 52 H LYS 52 -9.387 10.926 1.302 440 HA LYS 52 HA LYS 52 -11.493 11.966 3.134 441 HB2 LYS 52 HB2 LYS 52 -9.045 13.416 2.164 442 HB3 LYS 52 HB3 LYS 52 -10.261 13.853 3.415 443 HG2 LYS 52 HG2 LYS 52 -9.448 12.183 4.893 444 HG3 LYS 52 HG3 LYS 52 -8.321 11.549 3.691 445 HD2 LYS 52 HD2 LYS 52 -7.308 13.972 3.641 446 HD3 LYS 52 HD3 LYS 52 -8.219 14.208 5.140 447 HE2 LYS 52 HE2 LYS 52 -7.124 11.986 5.892 448 HE3 LYS 52 HE3 LYS 52 -5.998 12.209 4.556 449 HZ1 LYS 52 HZ1 LYS 52 -5.435 14.404 5.564 450 HZ2 LYS 52 HZ2 LYS 52 -6.463 14.070 6.817 451 HZ3 LYS 52 HZ3 LYS 52 -5.113 13.179 6.600 452 H GLY 53 H GLY 53 -10.515 14.438 1.287 453 HA2 GLY 53 HA2 GLY 53 -12.829 14.377 -0.554 454 HA3 GLY 53 HA3 GLY 53 -11.727 15.721 -0.277 455 H LYS 54 H LYS 54 -12.247 12.758 -2.034 456 HA LYS 54 HA LYS 54 -11.448 11.853 -3.958 457 HB2 LYS 54 HB2 LYS 54 -10.749 14.715 -4.699 458 HB3 LYS 54 HB3 LYS 54 -10.877 13.350 -5.811 459 HG2 LYS 54 HG2 LYS 54 -13.278 13.094 -5.247 460 HG3 LYS 54 HG3 LYS 54 -13.172 14.505 -4.175 461 HD2 LYS 54 HD2 LYS 54 -12.467 15.916 -6.087 462 HD3 LYS 54 HD3 LYS 54 -12.573 14.510 -7.170 463 HE2 LYS 54 HE2 LYS 54 -14.979 14.283 -6.661 464 HE3 LYS 54 HE3 LYS 54 -14.886 15.650 -5.541 465 HZ1 LYS 54 HZ1 LYS 54 -14.364 15.814 -8.466 466 HZ2 LYS 54 HZ2 LYS 54 -15.713 16.347 -7.720 467 HZ3 LYS 54 HZ3 LYS 54 -14.284 17.073 -7.426 468 H THR 55 H THR 55 -9.652 11.917 -1.731 469 HA THR 55 HA THR 55 -7.077 11.373 -3.072 470 HB THR 55 HB THR 55 -7.215 13.173 -0.616 471 HG1 THR 55 HG1 THR 55 -7.970 14.387 -2.305 472 HG21 THR 55 HG21 THR 55 -4.860 13.603 -1.192 473 HG22 THR 55 HG22 THR 55 -5.135 11.875 -0.906 474 HG23 THR 55 HG23 THR 55 -4.985 12.486 -2.572 475 H ALA 56 H ALA 56 -6.434 9.447 -2.359 476 HA ALA 56 HA ALA 56 -7.464 8.345 0.201 477 HB1 ALA 56 HB1 ALA 56 -6.942 6.149 -0.719 478 HB2 ALA 56 HB2 ALA 56 -8.041 7.043 -1.784 479 HB3 ALA 56 HB3 ALA 56 -6.317 6.896 -2.200 480 H TYR 57 H TYR 57 -5.991 6.976 1.411 481 HA TYR 57 HA TYR 57 -3.114 7.697 1.360 482 HB2 TYR 57 HB2 TYR 57 -4.973 8.085 3.736 483 HB3 TYR 57 HB3 TYR 57 -3.233 8.322 3.738 484 HD1 TYR 57 HD1 TYR 57 -6.506 9.712 2.783 485 HD2 TYR 57 HD2 TYR 57 -2.243 10.291 2.601 486 HE1 TYR 57 HE1 TYR 57 -6.869 12.059 2.112 487 HE2 TYR 57 HE2 TYR 57 -2.606 12.693 1.988 488 HH TYR 57 HH TYR 57 -5.875 14.089 1.594 489 H ILE 58 H ILE 58 -2.282 5.627 1.182 490 HA ILE 58 HA ILE 58 -3.391 3.420 2.852 491 HB ILE 58 HB ILE 58 -0.983 3.476 1.001 492 HG12 ILE 58 HG12 ILE 58 -2.336 1.758 -0.273 493 HG13 ILE 58 HG13 ILE 58 -3.743 2.216 0.682 494 HG21 ILE 58 HG21 ILE 58 -2.215 1.148 2.544 495 HG22 ILE 58 HG22 ILE 58 -0.880 1.046 1.369 496 HG23 ILE 58 HG23 ILE 58 -0.638 1.894 2.879 497 HD11 ILE 58 HD11 ILE 58 -2.141 4.139 -1.068 498 HD12 ILE 58 HD12 ILE 58 -3.555 3.227 -1.628 499 HD13 ILE 58 HD13 ILE 58 -3.753 4.427 -0.353 500 H LYS 59 H LYS 59 -3.211 4.148 4.961 501 HA LYS 59 HA LYS 59 -0.485 4.799 5.949 502 HB2 LYS 59 HB2 LYS 59 -3.138 4.836 7.434 503 HB3 LYS 59 HB3 LYS 59 -1.564 5.322 8.059 504 HG2 LYS 59 HG2 LYS 59 -1.438 6.964 6.082 505 HG3 LYS 59 HG3 LYS 59 -3.150 6.632 5.808 506 HD2 LYS 59 HD2 LYS 59 -3.711 7.480 8.044 507 HD3 LYS 59 HD3 LYS 59 -1.983 7.661 8.429 508 HE2 LYS 59 HE2 LYS 59 -1.807 9.223 6.421 509 HE3 LYS 59 HE3 LYS 59 -3.576 9.188 6.328 510 HZ1 LYS 59 HZ1 LYS 59 -2.012 10.077 8.700 511 HZ2 LYS 59 HZ2 LYS 59 -2.723 11.080 7.635 512 HZ3 LYS 59 HZ3 LYS 59 -3.647 10.114 8.586 513 H LEU 60 H LEU 60 0.733 3.595 7.152 514 HA LEU 60 HA LEU 60 -0.134 0.846 7.958 515 HB2 LEU 60 HB2 LEU 60 2.337 1.913 6.638 516 HB3 LEU 60 HB3 LEU 60 2.579 0.760 7.943 517 HG LEU 60 HG LEU 60 1.249 -0.919 6.877 518 HD11 LEU 60 HD11 LEU 60 0.823 1.088 4.623 519 HD12 LEU 60 HD12 LEU 60 0.506 -0.659 4.486 520 HD13 LEU 60 HD13 LEU 60 -0.429 0.311 5.620 521 HD21 LEU 60 HD21 LEU 60 3.187 0.287 4.855 522 HD22 LEU 60 HD22 LEU 60 3.675 -0.603 6.306 523 HD23 LEU 60 HD23 LEU 60 2.746 -1.428 5.049 524 H GLU 61 H GLU 61 0.117 0.258 10.042 525 HA GLU 61 HA GLU 61 1.205 2.282 11.974 526 HB2 GLU 61 HB2 GLU 61 -1.512 0.936 12.039 527 HB3 GLU 61 HB3 GLU 61 -0.831 1.924 13.341 528 HG2 GLU 61 HG2 GLU 61 -0.788 3.895 11.867 529 HG3 GLU 61 HG3 GLU 61 -1.438 2.938 10.527 530 H ASP 62 H ASP 62 1.882 1.479 14.034 531 HA ASP 62 HA ASP 62 2.774 -1.287 14.002 532 HB2 ASP 62 HB2 ASP 62 4.031 0.574 15.095 533 HB3 ASP 62 HB3 ASP 62 2.708 0.680 16.288 534 H LYS 63 H LYS 63 2.109 -2.938 15.066 535 HA LYS 63 HA LYS 63 -0.675 -3.075 15.831 536 HB2 LYS 63 HB2 LYS 63 -0.446 -5.472 15.484 537 HB3 LYS 63 HB3 LYS 63 0.288 -4.604 14.154 538 HG2 LYS 63 HG2 LYS 63 1.683 -6.143 16.353 539 HG3 LYS 63 HG3 LYS 63 1.646 -6.446 14.611 540 HD2 LYS 63 HD2 LYS 63 2.949 -4.260 14.323 541 HD3 LYS 63 HD3 LYS 63 3.162 -4.263 16.089 542 HE2 LYS 63 HE2 LYS 63 4.392 -6.337 15.976 543 HE3 LYS 63 HE3 LYS 63 4.078 -6.468 14.230 544 HZ1 LYS 63 HZ1 LYS 63 5.371 -4.523 13.835 545 HZ2 LYS 63 HZ2 LYS 63 5.548 -4.184 15.428 546 HZ3 LYS 63 HZ3 LYS 63 6.289 -5.498 14.769 547 H VAL 64 H VAL 64 1.856 -2.392 17.712 548 HA VAL 64 HA VAL 64 0.456 -3.485 20.123 549 HB VAL 64 HB VAL 64 3.367 -2.640 19.882 550 HG11 VAL 64 HG11 VAL 64 1.837 -3.957 22.166 551 HG12 VAL 64 HG12 VAL 64 3.594 -3.689 22.123 552 HG13 VAL 64 HG13 VAL 64 2.501 -2.306 22.152 553 HG21 VAL 64 HG21 VAL 64 3.053 -4.761 18.683 554 HG22 VAL 64 HG22 VAL 64 3.885 -5.060 20.209 555 HG23 VAL 64 HG23 VAL 64 2.152 -5.435 20.061 556 H SER 65 H SER 65 2.216 -0.638 18.788 557 HA SER 65 HA SER 65 1.190 1.009 21.023 558 HB2 SER 65 HB2 SER 65 3.154 1.610 18.790 559 HB3 SER 65 HB3 SER 65 2.732 2.723 20.106 560 HG SER 65 HG SER 65 4.634 1.507 20.543 561 H GLY 66 H GLY 66 0.387 0.502 17.672 562 HA2 GLY 66 HA2 GLY 66 -1.364 1.353 16.421 563 HA3 GLY 66 HA3 GLY 66 -1.841 2.389 17.770 564 H GLU 67 H GLU 67 1.466 2.710 16.954 565 HA GLU 67 HA GLU 67 1.019 5.458 16.088 566 HB2 GLU 67 HB2 GLU 67 3.290 5.821 16.577 567 HB3 GLU 67 HB3 GLU 67 2.631 4.785 17.852 568 HG2 GLU 67 HG2 GLU 67 3.688 2.807 16.791 569 HG3 GLU 67 HG3 GLU 67 4.364 3.839 15.528 570 H LEU 68 H LEU 68 1.874 6.436 14.207 571 HA LEU 68 HA LEU 68 1.504 4.847 11.835 572 HB2 LEU 68 HB2 LEU 68 0.859 7.270 12.140 573 HB3 LEU 68 HB3 LEU 68 2.571 7.680 12.138 574 HG LEU 68 HG LEU 68 2.701 6.648 9.787 575 HD11 LEU 68 HD11 LEU 68 -0.337 6.833 10.043 576 HD12 LEU 68 HD12 LEU 68 0.566 6.532 8.539 577 HD13 LEU 68 HD13 LEU 68 0.593 5.341 9.840 578 HD21 LEU 68 HD21 LEU 68 0.862 9.038 10.217 579 HD22 LEU 68 HD22 LEU 68 2.639 9.077 10.163 580 HD23 LEU 68 HD23 LEU 68 1.722 8.639 8.713 581 H PHE 69 H PHE 69 2.943 3.683 10.721 582 HA PHE 69 HA PHE 69 5.872 4.039 11.072 583 HB2 PHE 69 HB2 PHE 69 5.298 1.774 10.971 584 HB3 PHE 69 HB3 PHE 69 4.124 2.007 9.683 585 HD1 PHE 69 HD1 PHE 69 7.832 2.560 10.233 586 HD2 PHE 69 HD2 PHE 69 4.717 1.273 7.542 587 HE1 PHE 69 HE1 PHE 69 9.517 2.192 8.446 588 HE2 PHE 69 HE2 PHE 69 6.393 0.978 5.745 589 HZ PHE 69 HZ PHE 69 8.790 1.446 6.180 590 H ALA 70 H ALA 70 3.515 4.031 8.347 591 HA ALA 70 HA ALA 70 4.801 6.376 7.132 592 HB1 ALA 70 HB1 ALA 70 4.718 3.689 5.685 593 HB2 ALA 70 HB2 ALA 70 5.309 5.241 5.043 594 HB3 ALA 70 HB3 ALA 70 6.184 4.443 6.354 595 H GLN 71 H GLN 71 3.675 7.106 5.210 596 HA GLN 71 HA GLN 71 0.871 6.207 4.865 597 HB2 GLN 71 HB2 GLN 71 0.171 8.610 4.793 598 HB3 GLN 71 HB3 GLN 71 0.609 8.023 6.402 599 HG2 GLN 71 HG2 GLN 71 2.646 9.240 6.450 600 HG3 GLN 71 HG3 GLN 71 2.664 9.469 4.713 601 HE21 GLN 71 HE21 GLN 71 1.591 12.739 5.292 602 HE22 GLN 71 HE22 GLN 71 2.864 11.663 4.696 603 H ALA 72 H ALA 72 0.257 6.136 2.762 604 HA ALA 72 HA ALA 72 1.925 7.566 0.713 605 HB1 ALA 72 HB1 ALA 72 0.636 4.834 0.588 606 HB2 ALA 72 HB2 ALA 72 1.423 5.661 -0.768 607 HB3 ALA 72 HB3 ALA 72 2.366 5.207 0.666 608 HA PRO 73 HA PRO 73 -2.142 9.617 0.068 609 HB2 PRO 73 HB2 PRO 73 -0.153 11.465 -1.225 610 HB3 PRO 73 HB3 PRO 73 -1.595 11.863 -0.249 611 HG2 PRO 73 HG2 PRO 73 0.930 12.003 0.773 612 HG3 PRO 73 HG3 PRO 73 -0.440 11.426 1.769 613 HD2 PRO 73 HD2 PRO 73 1.710 9.811 0.424 614 HD3 PRO 73 HD3 PRO 73 0.909 9.561 1.994 615 H VAL 74 H VAL 74 -3.318 9.445 -1.724 616 HA VAL 74 HA VAL 74 -2.100 8.976 -4.406 617 HB VAL 74 HB VAL 74 -4.533 7.429 -3.446 618 HG11 VAL 74 HG11 VAL 74 -2.502 6.872 -5.643 619 HG12 VAL 74 HG12 VAL 74 -3.939 5.900 -5.263 620 HG13 VAL 74 HG13 VAL 74 -4.131 7.548 -5.860 621 HG21 VAL 74 HG21 VAL 74 -2.878 6.692 -1.874 622 HG22 VAL 74 HG22 VAL 74 -3.158 5.437 -3.071 623 HG23 VAL 74 HG23 VAL 74 -1.686 6.431 -3.162 624 H GLU 75 H GLU 75 -3.023 10.391 -5.895 625 HA GLU 75 HA GLU 75 -5.459 11.890 -5.082 626 HB2 GLU 75 HB2 GLU 75 -3.579 12.180 -7.459 627 HB3 GLU 75 HB3 GLU 75 -4.960 13.233 -7.121 628 HG2 GLU 75 HG2 GLU 75 -3.962 13.823 -4.912 629 HG3 GLU 75 HG3 GLU 75 -2.545 12.845 -5.300 630 H GLN 76 H GLN 76 -4.731 9.260 -7.216 631 HA GLN 76 HA GLN 76 -7.519 8.694 -7.543 632 HB2 GLN 76 HB2 GLN 76 -7.755 8.706 -9.890 633 HB3 GLN 76 HB3 GLN 76 -7.233 10.311 -9.434 634 HG2 GLN 76 HG2 GLN 76 -5.520 8.158 -10.749 635 HG3 GLN 76 HG3 GLN 76 -6.210 9.567 -11.525 636 HE21 GLN 76 HE21 GLN 76 -2.732 9.962 -9.414 637 HE22 GLN 76 HE22 GLN 76 -3.705 8.482 -9.263 638 H TYR 77 H TYR 77 -7.855 6.497 -7.991 639 HA TYR 77 HA TYR 77 -5.432 4.819 -8.394 640 HB2 TYR 77 HB2 TYR 77 -6.327 4.616 -6.127 641 HB3 TYR 77 HB3 TYR 77 -7.894 4.149 -6.790 642 HD1 TYR 77 HD1 TYR 77 -8.376 1.873 -7.121 643 HD2 TYR 77 HD2 TYR 77 -4.271 3.171 -6.898 644 HE1 TYR 77 HE1 TYR 77 -7.625 -0.490 -7.300 645 HE2 TYR 77 HE2 TYR 77 -3.519 0.804 -7.180 646 HH TYR 77 HH TYR 77 -5.820 -1.892 -7.579 647 HA PRO 78 HA PRO 78 -4.693 2.998 -9.521 648 HB2 PRO 78 HB2 PRO 78 -3.843 2.544 -12.067 649 HB3 PRO 78 HB3 PRO 78 -4.845 1.384 -11.142 650 HG2 PRO 78 HG2 PRO 78 -5.785 3.449 -13.165 651 HG3 PRO 78 HG3 PRO 78 -6.190 1.701 -13.100 652 HD2 PRO 78 HD2 PRO 78 -7.848 3.575 -12.046 653 HD3 PRO 78 HD3 PRO 78 -7.606 2.004 -11.226 654 H GLY 79 H GLY 79 -2.758 4.084 -9.616 655 HA2 GLY 79 HA2 GLY 79 -2.239 6.420 -11.296 656 HA3 GLY 79 HA3 GLY 79 -2.583 6.805 -9.607 657 H ILE 80 H ILE 80 -0.344 7.695 -9.677 658 HA ILE 80 HA ILE 80 1.899 5.948 -10.133 659 HB ILE 80 HB ILE 80 2.087 8.309 -10.527 660 HG12 ILE 80 HG12 ILE 80 3.917 7.530 -8.219 661 HG13 ILE 80 HG13 ILE 80 4.083 6.923 -9.869 662 HG21 ILE 80 HG21 ILE 80 1.879 8.807 -7.517 663 HG22 ILE 80 HG22 ILE 80 2.121 10.015 -8.793 664 HG23 ILE 80 HG23 ILE 80 0.590 9.161 -8.688 665 HD11 ILE 80 HD11 ILE 80 4.406 9.812 -8.971 666 HD12 ILE 80 HD12 ILE 80 5.679 8.684 -9.455 667 HD13 ILE 80 HD13 ILE 80 4.494 9.245 -10.660 668 H ALA 81 H ALA 81 0.184 6.805 -7.152 669 HA ALA 81 HA ALA 81 2.401 5.889 -5.478 670 HB1 ALA 81 HB1 ALA 81 -0.303 7.100 -4.819 671 HB2 ALA 81 HB2 ALA 81 1.010 6.819 -3.656 672 HB3 ALA 81 HB3 ALA 81 1.231 7.972 -4.983 673 H VAL 82 H VAL 82 0.445 3.970 -7.033 674 HA VAL 82 HA VAL 82 0.610 1.849 -5.029 675 HB VAL 82 HB VAL 82 -2.069 2.480 -6.273 676 HG11 VAL 82 HG11 VAL 82 -1.223 0.431 -4.157 677 HG12 VAL 82 HG12 VAL 82 -2.890 0.696 -4.702 678 HG13 VAL 82 HG13 VAL 82 -1.690 0.053 -5.825 679 HG21 VAL 82 HG21 VAL 82 -1.767 4.140 -4.554 680 HG22 VAL 82 HG22 VAL 82 -2.953 2.949 -4.035 681 HG23 VAL 82 HG23 VAL 82 -1.309 2.896 -3.371 682 H GLU 83 H GLU 83 1.341 0.123 -6.072 683 HA GLU 83 HA GLU 83 0.680 -0.422 -8.939 684 HB2 GLU 83 HB2 GLU 83 3.435 -0.147 -7.684 685 HB3 GLU 83 HB3 GLU 83 3.156 -1.040 -9.185 686 HG2 GLU 83 HG2 GLU 83 2.193 0.925 -10.230 687 HG3 GLU 83 HG3 GLU 83 2.473 1.890 -8.768 688 H THR 84 H THR 84 1.209 -2.597 -9.638 689 HA THR 84 HA THR 84 0.893 -4.661 -7.480 690 HB THR 84 HB THR 84 -0.278 -5.960 -9.229 691 HG1 THR 84 HG1 THR 84 -0.893 -4.903 -11.123 692 HG21 THR 84 HG21 THR 84 -1.444 -3.166 -8.794 693 HG22 THR 84 HG22 THR 84 -2.351 -4.611 -9.305 694 HG23 THR 84 HG23 THR 84 -1.605 -4.567 -7.707 695 H VAL 85 H VAL 85 1.827 -6.721 -7.819 696 HA VAL 85 HA VAL 85 4.346 -6.771 -9.372 697 HB VAL 85 HB VAL 85 4.804 -8.849 -8.290 698 HG11 VAL 85 HG11 VAL 85 5.262 -6.764 -7.015 699 HG12 VAL 85 HG12 VAL 85 3.689 -6.915 -6.216 700 HG13 VAL 85 HG13 VAL 85 4.936 -8.143 -5.962 701 HG21 VAL 85 HG21 VAL 85 3.300 -9.891 -6.695 702 HG22 VAL 85 HG22 VAL 85 2.067 -8.647 -6.974 703 HG23 VAL 85 HG23 VAL 85 2.499 -9.797 -8.251 704 H THR 86 H THR 86 4.764 -8.852 -10.646 705 HA THR 86 HA THR 86 2.482 -9.449 -12.434 706 HB THR 86 HB THR 86 4.153 -10.418 -13.900 707 HG1 THR 86 HG1 THR 86 6.309 -10.422 -13.283 708 HG21 THR 86 HG21 THR 86 3.852 -7.932 -13.860 709 HG22 THR 86 HG22 THR 86 5.193 -7.818 -12.708 710 HG23 THR 86 HG23 THR 86 5.494 -8.429 -14.348 711 H ASP 87 H ASP 87 4.395 -11.126 -10.009 712 HA ASP 87 HA ASP 87 3.756 -13.759 -11.071 713 HB2 ASP 87 HB2 ASP 87 5.952 -13.152 -10.092 714 HB3 ASP 87 HB3 ASP 87 5.173 -12.986 -8.510 715 H SER 88 H SER 88 2.845 -11.975 -8.115 716 HA SER 88 HA SER 88 0.460 -13.771 -7.814 717 HB2 SER 88 HB2 SER 88 2.204 -14.850 -6.503 718 HB3 SER 88 HB3 SER 88 2.474 -13.353 -5.591 719 HG SER 88 HG SER 88 0.988 -14.984 -4.643 720 H SER 89 H SER 89 -1.361 -12.652 -7.421 721 HA SER 89 HA SER 89 -1.234 -9.844 -7.201 722 HB2 SER 89 HB2 SER 89 -3.788 -11.253 -6.549 723 HB3 SER 89 HB3 SER 89 -3.516 -9.805 -7.512 724 HG SER 89 HG SER 89 -2.602 -11.169 -9.142 725 H ARG 90 H ARG 90 -0.583 -11.742 -4.589 726 HA ARG 90 HA ARG 90 -2.042 -10.109 -2.638 727 HB2 ARG 90 HB2 ARG 90 -1.598 -11.628 -0.980 728 HB3 ARG 90 HB3 ARG 90 -2.011 -12.568 -2.404 729 HG2 ARG 90 HG2 ARG 90 0.383 -13.042 -2.805 730 HG3 ARG 90 HG3 ARG 90 0.818 -12.055 -1.396 731 HD2 ARG 90 HD2 ARG 90 -0.539 -13.605 0.045 732 HD3 ARG 90 HD3 ARG 90 -0.746 -14.656 -1.371 733 HE ARG 90 HE ARG 90 2.036 -14.031 -0.991 734 HH11 ARG 90 HH11 ARG 90 3.459 -15.507 -0.376 735 HH12 ARG 90 HH12 ARG 90 2.972 -16.906 0.553 736 HH21 ARG 90 HH21 ARG 90 -0.307 -15.935 0.823 737 HH22 ARG 90 HH22 ARG 90 0.869 -17.164 1.156 738 H TYR 91 H TYR 91 0.211 -9.002 -4.329 739 HA TYR 91 HA TYR 91 1.782 -7.787 -2.127 740 HB2 TYR 91 HB2 TYR 91 2.885 -9.027 -4.664 741 HB3 TYR 91 HB3 TYR 91 3.814 -8.108 -3.507 742 HD1 TYR 91 HD1 TYR 91 4.227 -9.022 -1.205 743 HD2 TYR 91 HD2 TYR 91 2.432 -11.384 -4.333 744 HE1 TYR 91 HE1 TYR 91 4.715 -11.105 0.079 745 HE2 TYR 91 HE2 TYR 91 3.031 -13.463 -3.110 746 HH TYR 91 HH TYR 91 4.643 -13.386 0.086 747 H PHE 92 H PHE 92 2.232 -5.645 -2.415 748 HA PHE 92 HA PHE 92 1.690 -4.336 -5.038 749 HB2 PHE 92 HB2 PHE 92 0.621 -3.367 -2.357 750 HB3 PHE 92 HB3 PHE 92 0.423 -2.564 -3.903 751 HD1 PHE 92 HD1 PHE 92 -0.832 -5.137 -1.677 752 HD2 PHE 92 HD2 PHE 92 -1.006 -3.615 -5.696 753 HE1 PHE 92 HE1 PHE 92 -2.933 -6.385 -2.046 754 HE2 PHE 92 HE2 PHE 92 -3.087 -4.940 -6.098 755 HZ PHE 92 HZ PHE 92 -4.041 -6.322 -4.294 756 H VAL 93 H VAL 93 2.721 -2.282 -5.291 757 HA VAL 93 HA VAL 93 4.683 -1.522 -3.156 758 HB VAL 93 HB VAL 93 4.793 -0.813 -6.100 759 HG11 VAL 93 HG11 VAL 93 5.720 0.988 -4.647 760 HG12 VAL 93 HG12 VAL 93 6.804 -0.201 -3.900 761 HG13 VAL 93 HG13 VAL 93 6.951 0.190 -5.621 762 HG21 VAL 93 HG21 VAL 93 5.424 -3.098 -5.823 763 HG22 VAL 93 HG22 VAL 93 6.918 -2.178 -5.979 764 HG23 VAL 93 HG23 VAL 93 6.405 -2.731 -4.379 765 H ILE 94 H ILE 94 4.532 0.573 -2.285 766 HA ILE 94 HA ILE 94 2.589 2.379 -3.593 767 HB ILE 94 HB ILE 94 1.657 3.190 -1.584 768 HG12 ILE 94 HG12 ILE 94 3.485 2.506 0.037 769 HG13 ILE 94 HG13 ILE 94 1.828 2.343 0.578 770 HG21 ILE 94 HG21 ILE 94 1.163 0.210 -1.909 771 HG22 ILE 94 HG22 ILE 94 0.089 1.376 -1.102 772 HG23 ILE 94 HG23 ILE 94 0.437 1.530 -2.829 773 HD11 ILE 94 HD11 ILE 94 1.897 -0.088 0.276 774 HD12 ILE 94 HD12 ILE 94 3.551 0.008 -0.354 775 HD13 ILE 94 HD13 ILE 94 3.208 0.462 1.322 776 H ARG 95 H ARG 95 2.910 4.534 -3.417 777 HA ARG 95 HA ARG 95 5.724 5.338 -2.820 778 HB2 ARG 95 HB2 ARG 95 4.649 5.995 -4.989 779 HB3 ARG 95 HB3 ARG 95 3.520 7.003 -4.064 780 HG2 ARG 95 HG2 ARG 95 5.466 8.265 -3.127 781 HG3 ARG 95 HG3 ARG 95 6.543 7.324 -4.175 782 HD2 ARG 95 HD2 ARG 95 5.358 8.205 -6.167 783 HD3 ARG 95 HD3 ARG 95 4.222 9.068 -5.110 784 HE ARG 95 HE ARG 95 7.037 9.729 -4.628 785 HH11 ARG 95 HH11 ARG 95 7.714 11.717 -4.830 786 HH12 ARG 95 HH12 ARG 95 6.859 12.887 -5.819 787 HH21 ARG 95 HH21 ARG 95 4.292 10.706 -6.585 788 HH22 ARG 95 HH22 ARG 95 4.922 12.320 -6.773 789 H ILE 96 H ILE 96 5.811 5.334 -0.604 790 HA ILE 96 HA ILE 96 3.889 6.842 0.998 791 HB ILE 96 HB ILE 96 5.367 6.541 2.864 792 HG12 ILE 96 HG12 ILE 96 7.131 4.634 1.312 793 HG13 ILE 96 HG13 ILE 96 7.512 6.355 1.250 794 HG21 ILE 96 HG21 ILE 96 4.701 4.009 1.335 795 HG22 ILE 96 HG22 ILE 96 5.120 4.070 3.051 796 HG23 ILE 96 HG23 ILE 96 3.668 4.891 2.487 797 HD11 ILE 96 HD11 ILE 96 7.630 6.471 3.689 798 HD12 ILE 96 HD12 ILE 96 7.315 4.714 3.786 799 HD13 ILE 96 HD13 ILE 96 8.790 5.314 3.002 800 H GLN 97 H GLN 97 4.172 8.845 2.001 801 HA GLN 97 HA GLN 97 6.322 10.610 0.913 802 HB2 GLN 97 HB2 GLN 97 3.348 11.167 0.767 803 HB3 GLN 97 HB3 GLN 97 4.588 12.388 0.534 804 HG2 GLN 97 HG2 GLN 97 5.139 11.699 -1.556 805 HG3 GLN 97 HG3 GLN 97 4.917 9.990 -1.205 806 HE21 GLN 97 HE21 GLN 97 1.607 9.836 -2.410 807 HE22 GLN 97 HE22 GLN 97 2.993 8.985 -1.735 808 H ASP 98 H ASP 98 7.044 12.077 2.211 809 HA ASP 98 HA ASP 98 6.279 11.936 5.042 810 HB2 ASP 98 HB2 ASP 98 8.623 11.791 4.156 811 HB3 ASP 98 HB3 ASP 98 8.522 13.500 3.744 812 H GLY 99 H GLY 99 4.737 13.604 2.836 813 HA2 GLY 99 HA2 GLY 99 3.234 15.339 2.960 814 HA3 GLY 99 HA3 GLY 99 3.679 15.569 4.651 815 H THR 100 H THR 100 6.437 15.811 2.755 816 HA THR 100 HA THR 100 6.315 18.802 2.655 817 HB THR 100 HB THR 100 7.569 17.819 4.555 818 HG1 THR 100 HG1 THR 100 9.015 19.328 2.654 819 HG21 THR 100 HG21 THR 100 9.781 16.856 4.205 820 HG22 THR 100 HG22 THR 100 8.544 15.843 3.452 821 HG23 THR 100 HG23 THR 100 9.565 16.893 2.443 822 H GLY 101 H GLY 101 6.382 16.308 0.536 823 HA2 GLY 101 HA2 GLY 101 6.552 16.660 -1.807 824 HA3 GLY 101 HA3 GLY 101 7.750 17.928 -1.560 825 H ARG 102 H ARG 102 8.057 14.893 0.180 826 HA ARG 102 HA ARG 102 10.014 13.792 -1.727 827 HB2 ARG 102 HB2 ARG 102 11.787 13.667 -0.239 828 HB3 ARG 102 HB3 ARG 102 11.123 15.275 -0.018 829 HG2 ARG 102 HG2 ARG 102 11.628 14.629 2.137 830 HG3 ARG 102 HG3 ARG 102 9.891 14.395 2.032 831 HD2 ARG 102 HD2 ARG 102 11.043 12.611 3.292 832 HD3 ARG 102 HD3 ARG 102 10.184 11.969 1.898 833 HE ARG 102 HE ARG 102 13.003 12.586 1.380 834 HH11 ARG 102 HH11 ARG 102 14.398 10.935 0.885 835 HH12 ARG 102 HH12 ARG 102 13.979 9.294 1.276 836 HH21 ARG 102 HH21 ARG 102 10.933 10.059 2.653 837 HH22 ARG 102 HH22 ARG 102 12.072 8.805 2.250 838 H SER 103 H SER 103 10.323 11.608 -1.609 839 HA SER 103 HA SER 103 8.291 10.001 -0.149 840 HB2 SER 103 HB2 SER 103 7.384 9.209 -2.315 841 HB3 SER 103 HB3 SER 103 7.138 10.938 -2.052 842 HG SER 103 HG SER 103 9.339 9.937 -3.563 843 H ALA 104 H ALA 104 8.298 7.712 -0.673 844 HA ALA 104 HA ALA 104 10.621 6.594 -2.095 845 HB1 ALA 104 HB1 ALA 104 11.143 5.010 -0.269 846 HB2 ALA 104 HB2 ALA 104 11.408 6.686 0.246 847 HB3 ALA 104 HB3 ALA 104 9.954 5.811 0.779 848 H PHE 105 H PHE 105 10.222 4.579 -3.014 849 HA PHE 105 HA PHE 105 7.404 3.607 -2.964 850 HB2 PHE 105 HB2 PHE 105 9.719 3.196 -4.863 851 HB3 PHE 105 HB3 PHE 105 8.337 2.122 -4.841 852 HD1 PHE 105 HD1 PHE 105 6.265 2.690 -5.873 853 HD2 PHE 105 HD2 PHE 105 9.319 5.702 -5.428 854 HE1 PHE 105 HE1 PHE 105 5.003 4.168 -7.373 855 HE2 PHE 105 HE2 PHE 105 8.063 7.184 -6.963 856 HZ PHE 105 HZ PHE 105 5.919 6.418 -7.960 857 H ILE 106 H ILE 106 6.931 2.094 -1.538 858 HA ILE 106 HA ILE 106 9.002 0.075 -0.737 859 HB ILE 106 HB ILE 106 8.060 -0.088 1.439 860 HG12 ILE 106 HG12 ILE 106 6.103 2.141 0.731 861 HG13 ILE 106 HG13 ILE 106 5.682 0.439 0.933 862 HG21 ILE 106 HG21 ILE 106 8.852 2.017 2.340 863 HG22 ILE 106 HG22 ILE 106 9.819 1.610 0.917 864 HG23 ILE 106 HG23 ILE 106 8.542 2.840 0.791 865 HD11 ILE 106 HD11 ILE 106 6.721 2.253 3.133 866 HD12 ILE 106 HD12 ILE 106 5.088 1.598 2.947 867 HD13 ILE 106 HD13 ILE 106 6.436 0.505 3.290 868 H GLY 107 H GLY 107 8.355 -2.062 -0.377 869 HA2 GLY 107 HA2 GLY 107 5.981 -2.902 -1.979 870 HA3 GLY 107 HA3 GLY 107 7.338 -3.919 -1.503 871 H ILE 108 H ILE 108 4.305 -4.003 -1.026 872 HA ILE 108 HA ILE 108 4.558 -4.885 1.772 873 HB ILE 108 HB ILE 108 2.220 -4.364 2.239 874 HG12 ILE 108 HG12 ILE 108 2.245 -2.549 -0.206 875 HG13 ILE 108 HG13 ILE 108 1.413 -4.102 -0.131 876 HG21 ILE 108 HG21 ILE 108 4.067 -3.018 3.057 877 HG22 ILE 108 HG22 ILE 108 3.974 -1.957 1.635 878 HG23 ILE 108 HG23 ILE 108 2.637 -2.015 2.801 879 HD11 ILE 108 HD11 ILE 108 0.767 -1.685 1.611 880 HD12 ILE 108 HD12 ILE 108 -0.189 -2.346 0.279 881 HD13 ILE 108 HD13 ILE 108 0.021 -3.285 1.768 882 H GLY 109 H GLY 109 3.725 -6.799 2.293 883 HA2 GLY 109 HA2 GLY 109 2.372 -8.408 0.147 884 HA3 GLY 109 HA3 GLY 109 3.579 -9.073 1.240 885 H PHE 110 H PHE 110 0.714 -9.671 0.641 886 HA PHE 110 HA PHE 110 -0.509 -9.510 3.362 887 HB2 PHE 110 HB2 PHE 110 -1.648 -9.971 0.588 888 HB3 PHE 110 HB3 PHE 110 -2.571 -10.241 2.049 889 HD1 PHE 110 HD1 PHE 110 -0.555 -7.521 0.350 890 HD2 PHE 110 HD2 PHE 110 -3.863 -8.518 2.939 891 HE1 PHE 110 HE1 PHE 110 -1.165 -5.124 0.510 892 HE2 PHE 110 HE2 PHE 110 -4.522 -6.131 3.001 893 HZ PHE 110 HZ PHE 110 -3.156 -4.432 1.799 894 H THR 111 H THR 111 -1.715 -11.441 4.070 895 HA THR 111 HA THR 111 -0.094 -13.853 3.864 896 HB THR 111 HB THR 111 -1.170 -13.103 5.944 897 HG1 THR 111 HG1 THR 111 -1.768 -15.158 6.566 898 HG21 THR 111 HG21 THR 111 -3.796 -14.103 4.758 899 HG22 THR 111 HG22 THR 111 -3.512 -13.531 6.412 900 HG23 THR 111 HG23 THR 111 -3.404 -12.395 5.063 901 H ASP 112 H ASP 112 -3.048 -12.719 2.293 902 HA ASP 112 HA ASP 112 -3.135 -15.134 0.622 903 HB2 ASP 112 HB2 ASP 112 -4.479 -15.647 2.690 904 HB3 ASP 112 HB3 ASP 112 -5.528 -14.283 2.301 905 H ARG 113 H ARG 113 -4.331 -14.913 -1.274 906 HA ARG 113 HA ARG 113 -4.323 -12.336 -2.492 907 HB2 ARG 113 HB2 ARG 113 -4.067 -14.640 -3.552 908 HB3 ARG 113 HB3 ARG 113 -5.825 -14.823 -3.422 909 HG2 ARG 113 HG2 ARG 113 -6.124 -12.797 -4.835 910 HG3 ARG 113 HG3 ARG 113 -4.359 -12.586 -4.878 911 HD2 ARG 113 HD2 ARG 113 -4.151 -14.839 -5.956 912 HD3 ARG 113 HD3 ARG 113 -5.907 -14.976 -5.990 913 HE ARG 113 HE ARG 113 -4.207 -13.067 -7.564 914 HH11 ARG 113 HH11 ARG 113 -4.921 -12.227 -9.349 915 HH12 ARG 113 HH12 ARG 113 -6.529 -12.571 -9.958 916 HH21 ARG 113 HH21 ARG 113 -7.408 -14.478 -7.215 917 HH22 ARG 113 HH22 ARG 113 -7.935 -13.803 -8.731 918 H GLY 114 H GLY 114 -6.968 -14.084 -0.869 919 HA2 GLY 114 HA2 GLY 114 -9.116 -12.373 -1.772 920 HA3 GLY 114 HA3 GLY 114 -9.116 -13.441 -0.364 921 H ASP 115 H ASP 115 -6.698 -12.027 0.781 922 HA ASP 115 HA ASP 115 -8.132 -9.793 2.108 923 HB2 ASP 115 HB2 ASP 115 -5.481 -11.188 2.623 924 HB3 ASP 115 HB3 ASP 115 -5.947 -9.699 3.435 925 H ALA 116 H ALA 116 -5.337 -10.293 -0.063 926 HA ALA 116 HA ALA 116 -4.666 -7.511 -0.378 927 HB1 ALA 116 HB1 ALA 116 -3.182 -9.284 -1.014 928 HB2 ALA 116 HB2 ALA 116 -4.372 -9.966 -2.151 929 HB3 ALA 116 HB3 ALA 116 -3.628 -8.403 -2.493 930 H PHE 117 H PHE 117 -7.080 -9.600 -2.041 931 HA PHE 117 HA PHE 117 -7.951 -7.642 -3.906 932 HB2 PHE 117 HB2 PHE 117 -9.065 -10.163 -2.809 933 HB3 PHE 117 HB3 PHE 117 -10.248 -9.008 -3.387 934 HD1 PHE 117 HD1 PHE 117 -11.008 -9.547 -5.517 935 HD2 PHE 117 HD2 PHE 117 -6.805 -9.993 -4.643 936 HE1 PHE 117 HE1 PHE 117 -10.577 -10.167 -7.880 937 HE2 PHE 117 HE2 PHE 117 -6.380 -10.603 -7.005 938 HZ PHE 117 HZ PHE 117 -8.263 -10.688 -8.631 939 H ASP 118 H ASP 118 -8.808 -7.877 -0.431 940 HA ASP 118 HA ASP 118 -10.836 -5.810 -0.568 941 HB2 ASP 118 HB2 ASP 118 -9.042 -6.686 1.721 942 HB3 ASP 118 HB3 ASP 118 -10.328 -5.499 1.870 943 H PHE 119 H PHE 119 -7.269 -5.659 -0.194 944 HA PHE 119 HA PHE 119 -7.044 -2.844 0.280 945 HB2 PHE 119 HB2 PHE 119 -5.210 -4.284 0.690 946 HB3 PHE 119 HB3 PHE 119 -5.166 -4.875 -0.950 947 HD1 PHE 119 HD1 PHE 119 -3.967 -2.305 1.282 948 HD2 PHE 119 HD2 PHE 119 -4.428 -3.402 -2.858 949 HE1 PHE 119 HE1 PHE 119 -2.356 -0.563 0.642 950 HE2 PHE 119 HE2 PHE 119 -2.797 -1.661 -3.501 951 HZ PHE 119 HZ PHE 119 -1.752 -0.221 -1.757 952 H ASN 120 H ASN 120 -6.987 -4.628 -2.861 953 HA ASN 120 HA ASN 120 -6.893 -2.060 -4.255 954 HB2 ASN 120 HB2 ASN 120 -6.773 -3.309 -6.308 955 HB3 ASN 120 HB3 ASN 120 -5.612 -3.902 -5.130 956 HD21 ASN 120 HD21 ASN 120 -8.642 -6.382 -6.362 957 HD22 ASN 120 HD22 ASN 120 -8.901 -4.652 -6.484 958 H VAL 121 H VAL 121 -9.578 -4.172 -3.390 959 HA VAL 121 HA VAL 121 -11.412 -2.798 -5.225 960 HB VAL 121 HB VAL 121 -11.857 -4.781 -2.985 961 HG11 VAL 121 HG11 VAL 121 -13.936 -3.517 -4.829 962 HG12 VAL 121 HG12 VAL 121 -14.209 -4.952 -3.815 963 HG13 VAL 121 HG13 VAL 121 -13.880 -3.398 -3.054 964 HG21 VAL 121 HG21 VAL 121 -12.516 -6.267 -4.851 965 HG22 VAL 121 HG22 VAL 121 -12.221 -4.959 -6.019 966 HG23 VAL 121 HG23 VAL 121 -10.878 -5.669 -5.103 967 H SER 122 H SER 122 -10.670 -2.537 -1.690 968 HA SER 122 HA SER 122 -12.727 -0.626 -1.166 969 HB2 SER 122 HB2 SER 122 -11.512 -0.108 0.873 970 HB3 SER 122 HB3 SER 122 -11.580 -1.860 0.609 971 HG SER 122 HG SER 122 -9.510 -1.901 0.052 972 H LEU 123 H LEU 123 -9.409 -0.151 -2.356 973 HA LEU 123 HA LEU 123 -9.459 2.721 -2.421 974 HB2 LEU 123 HB2 LEU 123 -7.950 0.607 -3.989 975 HB3 LEU 123 HB3 LEU 123 -7.721 2.328 -4.290 976 HG LEU 123 HG LEU 123 -7.256 1.040 -1.567 977 HD11 LEU 123 HD11 LEU 123 -5.693 0.147 -3.264 978 HD12 LEU 123 HD12 LEU 123 -5.256 1.802 -3.742 979 HD13 LEU 123 HD13 LEU 123 -4.863 1.197 -2.113 980 HD21 LEU 123 HD21 LEU 123 -7.679 3.470 -1.436 981 HD22 LEU 123 HD22 LEU 123 -5.981 3.116 -1.125 982 HD23 LEU 123 HD23 LEU 123 -6.468 3.761 -2.706 983 H GLN 124 H GLN 124 -10.124 0.407 -5.144 984 HA GLN 124 HA GLN 124 -10.854 2.550 -6.880 985 HB2 GLN 124 HB2 GLN 124 -11.283 0.948 -8.511 986 HB3 GLN 124 HB3 GLN 124 -10.033 0.228 -7.493 987 HG2 GLN 124 HG2 GLN 124 -11.867 -1.037 -6.304 988 HG3 GLN 124 HG3 GLN 124 -12.989 -0.473 -7.544 989 HE21 GLN 124 HE21 GLN 124 -10.075 -3.216 -8.573 990 HE22 GLN 124 HE22 GLN 124 -9.852 -2.204 -7.133 991 H ASP 125 H ASP 125 -12.852 0.711 -4.614 992 HA ASP 125 HA ASP 125 -15.350 1.722 -5.708 993 HB2 ASP 125 HB2 ASP 125 -15.106 -0.531 -4.664 994 HB3 ASP 125 HB3 ASP 125 -14.797 0.249 -3.109 995 H HIS 126 H HIS 126 -12.937 3.179 -3.833 996 HA HIS 126 HA HIS 126 -14.898 5.155 -2.802 997 HB2 HIS 126 HB2 HIS 126 -13.031 4.365 -1.308 998 HB3 HIS 126 HB3 HIS 126 -11.908 5.222 -2.371 999 HD2 HIS 126 HD2 HIS 126 -15.081 5.932 -0.200 1000 HE1 HIS 126 HE1 HIS 126 -12.923 9.599 -0.471 1001 HE2 HIS 126 HE2 HIS 126 -14.945 8.450 0.566 1002 H PHE 127 H PHE 127 -12.745 4.643 -5.479 1003 HA PHE 127 HA PHE 127 -12.913 7.501 -6.295 1004 HB2 PHE 127 HB2 PHE 127 -11.184 5.174 -7.157 1005 HB3 PHE 127 HB3 PHE 127 -11.273 6.658 -8.081 1006 HD1 PHE 127 HD1 PHE 127 -10.969 8.918 -6.692 1007 HD2 PHE 127 HD2 PHE 127 -9.465 5.058 -5.524 1008 HE1 PHE 127 HE1 PHE 127 -9.133 10.013 -5.426 1009 HE2 PHE 127 HE2 PHE 127 -7.627 6.145 -4.266 1010 HZ PHE 127 HZ PHE 127 -7.452 8.632 -4.222 1011 H LYS 128 H LYS 128 -14.663 4.624 -7.092 1012 HA LYS 128 HA LYS 128 -14.970 4.868 -9.793 1013 HB2 LYS 128 HB2 LYS 128 -16.856 3.557 -9.773 1014 HB3 LYS 128 HB3 LYS 128 -15.891 3.029 -8.411 1015 HG2 LYS 128 HG2 LYS 128 -18.340 4.865 -8.202 1016 HG3 LYS 128 HG3 LYS 128 -18.365 3.109 -8.038 1017 HD2 LYS 128 HD2 LYS 128 -16.778 3.285 -6.128 1018 HD3 LYS 128 HD3 LYS 128 -16.854 5.045 -6.241 1019 HE2 LYS 128 HE2 LYS 128 -18.328 4.465 -4.519 1020 HE3 LYS 128 HE3 LYS 128 -19.339 4.903 -5.908 1021 HZ1 LYS 128 HZ1 LYS 128 -19.681 2.528 -6.316 1022 HZ2 LYS 128 HZ2 LYS 128 -18.644 2.105 -5.124 1023 HZ3 LYS 128 HZ3 LYS 128 -20.064 2.833 -4.758 1024 H TRP 129 H TRP 129 -16.570 7.024 -7.571 1025 HA TRP 129 HA TRP 129 -18.283 8.259 -9.590 1026 HB2 TRP 129 HB2 TRP 129 -18.927 9.761 -7.808 1027 HB3 TRP 129 HB3 TRP 129 -18.962 8.103 -7.234 1028 HD1 TRP 129 HD1 TRP 129 -16.795 7.354 -5.663 1029 HE1 TRP 129 HE1 TRP 129 -15.295 8.667 -4.110 1030 HE3 TRP 129 HE3 TRP 129 -18.125 12.103 -7.083 1031 HZ2 TRP 129 HZ2 TRP 129 -15.011 11.434 -3.250 1032 HZ3 TRP 129 HZ3 TRP 129 -17.307 14.057 -5.789 1033 HH2 TRP 129 HH2 TRP 129 -15.753 13.738 -3.873 1034 H VAL 130 H VAL 130 -15.037 8.785 -8.396 1035 HA VAL 130 HA VAL 130 -14.689 11.443 -9.597 1036 HB VAL 130 HB VAL 130 -12.543 9.537 -8.586 1037 HG11 VAL 130 HG11 VAL 130 -11.662 11.407 -9.919 1038 HG12 VAL 130 HG12 VAL 130 -12.588 12.566 -8.939 1039 HG13 VAL 130 HG13 VAL 130 -11.262 11.628 -8.217 1040 HG21 VAL 130 HG21 VAL 130 -14.055 9.891 -6.717 1041 HG22 VAL 130 HG22 VAL 130 -12.625 10.883 -6.467 1042 HG23 VAL 130 HG23 VAL 130 -14.130 11.635 -7.046 1043 H LYS 131 H LYS 131 -14.223 8.075 -10.444 1044 HA LYS 131 HA LYS 131 -12.779 8.652 -12.958 1045 HB2 LYS 131 HB2 LYS 131 -13.387 6.090 -11.426 1046 HB3 LYS 131 HB3 LYS 131 -12.544 6.109 -12.962 1047 HG2 LYS 131 HG2 LYS 131 -11.571 7.497 -10.425 1048 HG3 LYS 131 HG3 LYS 131 -11.020 5.931 -11.001 1049 HD2 LYS 131 HD2 LYS 131 -10.667 8.563 -12.505 1050 HD3 LYS 131 HD3 LYS 131 -9.439 7.776 -11.520 1051 HE2 LYS 131 HE2 LYS 131 -9.287 5.886 -12.984 1052 HE3 LYS 131 HE3 LYS 131 -10.746 6.353 -13.868 1053 HZ1 LYS 131 HZ1 LYS 131 -9.638 8.244 -14.762 1054 HZ2 LYS 131 HZ2 LYS 131 -8.270 7.981 -13.880 1055 HZ3 LYS 131 HZ3 LYS 131 -8.705 6.943 -15.068 1056 H GLN 132 H GLN 132 -15.529 9.467 -12.743 1057 HA GLN 132 HA GLN 132 -16.967 7.729 -14.621 1058 HB2 GLN 132 HB2 GLN 132 -17.652 10.437 -13.441 1059 HB3 GLN 132 HB3 GLN 132 -18.654 9.562 -14.607 1060 HG2 GLN 132 HG2 GLN 132 -17.848 8.489 -11.875 1061 HG3 GLN 132 HG3 GLN 132 -19.385 9.276 -12.218 1062 HE21 GLN 132 HE21 GLN 132 -19.048 5.342 -12.993 1063 HE22 GLN 132 HE22 GLN 132 -17.865 6.246 -12.042 1064 H GLU 133 H GLU 133 -15.692 7.650 -16.343 1065 HA GLU 133 HA GLU 133 -15.246 10.062 -18.064 1066 HB2 GLU 133 HB2 GLU 133 -13.178 7.948 -17.332 1067 HB3 GLU 133 HB3 GLU 133 -12.985 9.177 -18.584 1068 HG2 GLU 133 HG2 GLU 133 -13.256 10.962 -16.847 1069 HG3 GLU 133 HG3 GLU 133 -13.331 9.713 -15.601 Start of MODEL 10 1 H1 GLY -4 H1 GLY -4 -1.319 39.125 5.227 2 H2 GLY -4 H2 GLY -4 -0.895 37.929 4.193 3 H3 GLY -4 H3 GLY -4 -0.230 37.991 5.690 4 HA2 GLY -4 HA2 GLY -4 -1.889 36.257 5.614 5 HA3 GLY -4 HA3 GLY -4 -2.352 37.555 6.729 6 H SER -3 H SER -3 -4.473 36.375 6.248 7 HA SER -3 HA SER -3 -6.023 37.997 4.354 8 HB2 SER -3 HB2 SER -3 -6.996 36.173 3.148 9 HB3 SER -3 HB3 SER -3 -5.252 35.963 3.049 10 HG SER -3 HG SER -3 -5.372 34.366 4.626 11 HA PRO -2 HA PRO -2 -9.223 37.491 7.421 12 HB2 PRO -2 HB2 PRO -2 -11.173 36.670 5.276 13 HB3 PRO -2 HB3 PRO -2 -11.336 37.943 6.525 14 HG2 PRO -2 HG2 PRO -2 -10.760 38.628 3.978 15 HG3 PRO -2 HG3 PRO -2 -9.855 39.404 5.323 16 HD2 PRO -2 HD2 PRO -2 -9.016 37.034 3.621 17 HD3 PRO -2 HD3 PRO -2 -8.093 38.519 4.011 18 H ASN -1 H ASN -1 -8.312 34.723 5.615 19 HA ASN -1 HA ASN -1 -10.231 32.816 6.652 20 HB2 ASN -1 HB2 ASN -1 -7.510 32.386 5.348 21 HB3 ASN -1 HB3 ASN -1 -8.719 31.143 5.637 22 HD21 ASN -1 HD21 ASN -1 -9.067 33.513 2.373 23 HD22 ASN -1 HD22 ASN -1 -7.731 33.707 3.512 24 H SER 0 H SER 0 -10.116 31.439 8.376 25 HA SER 0 HA SER 0 -8.071 31.932 10.447 26 HB2 SER 0 HB2 SER 0 -9.591 30.590 11.862 27 HB3 SER 0 HB3 SER 0 -10.380 31.990 11.115 28 HG SER 0 HG SER 0 -11.651 30.073 10.950 29 H MET 1 H MET 1 -8.552 29.617 7.961 30 HA MET 1 HA MET 1 -7.545 27.286 9.264 31 HB2 MET 1 HB2 MET 1 -7.670 27.884 6.280 32 HB3 MET 1 HB3 MET 1 -7.487 26.310 7.048 33 HG2 MET 1 HG2 MET 1 -9.735 26.325 6.515 34 HG3 MET 1 HG3 MET 1 -9.737 26.781 8.211 35 HE1 MET 1 HE1 MET 1 -10.847 29.431 4.573 36 HE2 MET 1 HE2 MET 1 -9.207 28.769 4.736 37 HE3 MET 1 HE3 MET 1 -10.598 27.674 4.562 38 H ALA 2 H ALA 2 -5.616 26.302 9.183 39 HA ALA 2 HA ALA 2 -3.313 27.348 7.694 40 HB1 ALA 2 HB1 ALA 2 -3.289 27.321 10.753 41 HB2 ALA 2 HB2 ALA 2 -1.883 27.614 9.705 42 HB3 ALA 2 HB3 ALA 2 -3.235 28.760 9.713 43 H THR 3 H THR 3 -4.259 25.103 10.335 44 HA THR 3 HA THR 3 -3.310 22.783 8.763 45 HB THR 3 HB THR 3 -2.622 23.186 11.709 46 HG1 THR 3 HG1 THR 3 -1.242 24.324 10.326 47 HG21 THR 3 HG21 THR 3 -2.028 20.894 9.780 48 HG22 THR 3 HG22 THR 3 -1.335 21.072 11.407 49 HG23 THR 3 HG23 THR 3 -3.073 20.822 11.220 50 H GLU 4 H GLU 4 -5.007 21.512 8.576 51 HA GLU 4 HA GLU 4 -7.045 21.305 10.749 52 HB2 GLU 4 HB2 GLU 4 -8.831 21.586 9.124 53 HB3 GLU 4 HB3 GLU 4 -7.770 22.988 9.124 54 HG2 GLU 4 HG2 GLU 4 -6.646 22.186 7.078 55 HG3 GLU 4 HG3 GLU 4 -7.644 20.732 7.069 56 H LEU 5 H LEU 5 -4.900 19.438 9.625 57 HA LEU 5 HA LEU 5 -6.384 17.308 8.356 58 HB2 LEU 5 HB2 LEU 5 -3.870 18.177 8.081 59 HB3 LEU 5 HB3 LEU 5 -3.545 16.896 9.235 60 HG LEU 5 HG LEU 5 -4.930 16.683 6.530 61 HD11 LEU 5 HD11 LEU 5 -2.254 15.595 7.491 62 HD12 LEU 5 HD12 LEU 5 -2.946 15.395 5.864 63 HD13 LEU 5 HD13 LEU 5 -2.488 17.007 6.435 64 HD21 LEU 5 HD21 LEU 5 -4.829 14.215 6.791 65 HD22 LEU 5 HD22 LEU 5 -4.304 14.426 8.478 66 HD23 LEU 5 HD23 LEU 5 -5.921 14.957 7.956 67 H GLU 6 H GLU 6 -7.813 17.414 10.358 68 HA GLU 6 HA GLU 6 -7.159 15.094 12.137 69 HB2 GLU 6 HB2 GLU 6 -7.164 17.366 13.263 70 HB3 GLU 6 HB3 GLU 6 -8.893 17.463 12.922 71 HG2 GLU 6 HG2 GLU 6 -9.227 15.349 14.246 72 HG3 GLU 6 HG3 GLU 6 -7.491 15.270 14.528 73 H TYR 7 H TYR 7 -8.017 14.252 9.898 74 HA TYR 7 HA TYR 7 -10.845 13.494 10.098 75 HB2 TYR 7 HB2 TYR 7 -11.387 14.319 7.889 76 HB3 TYR 7 HB3 TYR 7 -10.963 15.645 8.936 77 HD1 TYR 7 HD1 TYR 7 -9.457 13.400 6.273 78 HD2 TYR 7 HD2 TYR 7 -9.448 17.277 8.179 79 HE1 TYR 7 HE1 TYR 7 -7.893 14.213 4.578 80 HE2 TYR 7 HE2 TYR 7 -7.864 18.105 6.449 81 HH TYR 7 HH TYR 7 -6.635 16.008 3.814 82 H GLU 8 H GLU 8 -11.274 11.591 9.002 83 HA GLU 8 HA GLU 8 -9.905 10.676 6.768 84 HB2 GLU 8 HB2 GLU 8 -8.843 8.620 7.678 85 HB3 GLU 8 HB3 GLU 8 -8.006 10.085 8.154 86 HG2 GLU 8 HG2 GLU 8 -9.102 9.927 10.415 87 HG3 GLU 8 HG3 GLU 8 -9.843 8.404 9.895 88 H SER 9 H SER 9 -11.396 9.545 5.744 89 HA SER 9 HA SER 9 -13.516 8.080 7.224 90 HB2 SER 9 HB2 SER 9 -13.064 8.670 4.276 91 HB3 SER 9 HB3 SER 9 -14.319 7.565 4.871 92 HG SER 9 HG SER 9 -15.286 9.518 4.664 93 H VAL 10 H VAL 10 -12.786 6.106 7.934 94 HA VAL 10 HA VAL 10 -10.656 4.559 6.725 95 HB VAL 10 HB VAL 10 -12.861 3.625 8.605 96 HG11 VAL 10 HG11 VAL 10 -10.138 2.415 7.933 97 HG12 VAL 10 HG12 VAL 10 -11.194 1.884 9.261 98 HG13 VAL 10 HG13 VAL 10 -11.735 1.693 7.599 99 HG21 VAL 10 HG21 VAL 10 -11.196 3.952 10.392 100 HG22 VAL 10 HG22 VAL 10 -10.035 4.608 9.219 101 HG23 VAL 10 HG23 VAL 10 -11.534 5.486 9.594 102 H LEU 11 H LEU 11 -10.620 2.817 5.409 103 HA LEU 11 HA LEU 11 -13.094 2.149 3.841 104 HB2 LEU 11 HB2 LEU 11 -10.283 2.700 2.808 105 HB3 LEU 11 HB3 LEU 11 -11.611 2.077 1.842 106 HG LEU 11 HG LEU 11 -11.536 4.834 3.117 107 HD11 LEU 11 HD11 LEU 11 -9.968 4.673 1.279 108 HD12 LEU 11 HD12 LEU 11 -11.166 3.845 0.261 109 HD13 LEU 11 HD13 LEU 11 -11.405 5.539 0.706 110 HD21 LEU 11 HD21 LEU 11 -13.866 4.033 2.904 111 HD22 LEU 11 HD22 LEU 11 -13.527 5.272 1.695 112 HD23 LEU 11 HD23 LEU 11 -13.560 3.563 1.214 113 H CYS 12 H CYS 12 -9.824 1.065 4.851 114 HA CYS 12 HA CYS 12 -10.862 -1.655 5.196 115 HB2 CYS 12 HB2 CYS 12 -10.086 -1.587 2.800 116 HB3 CYS 12 HB3 CYS 12 -8.459 -1.183 3.392 117 HG CYS 12 HG CYS 12 -8.562 -3.703 2.673 118 H VAL 13 H VAL 13 -9.943 -2.604 6.893 119 HA VAL 13 HA VAL 13 -7.242 -1.757 7.807 120 HB VAL 13 HB VAL 13 -9.652 -2.194 9.596 121 HG11 VAL 13 HG11 VAL 13 -7.668 -3.193 10.674 122 HG12 VAL 13 HG12 VAL 13 -6.736 -1.708 10.366 123 HG13 VAL 13 HG13 VAL 13 -8.118 -1.692 11.481 124 HG21 VAL 13 HG21 VAL 13 -9.529 0.071 8.598 125 HG22 VAL 13 HG22 VAL 13 -9.197 0.122 10.333 126 HG23 VAL 13 HG23 VAL 13 -7.858 0.229 9.168 127 H LYS 14 H LYS 14 -5.898 -3.382 7.962 128 HA LYS 14 HA LYS 14 -6.887 -6.150 8.423 129 HB2 LYS 14 HB2 LYS 14 -4.714 -5.437 6.422 130 HB3 LYS 14 HB3 LYS 14 -5.181 -7.058 6.885 131 HG2 LYS 14 HG2 LYS 14 -7.045 -5.075 5.503 132 HG3 LYS 14 HG3 LYS 14 -6.083 -6.307 4.688 133 HD2 LYS 14 HD2 LYS 14 -7.255 -8.079 5.972 134 HD3 LYS 14 HD3 LYS 14 -8.293 -6.843 6.716 135 HE2 LYS 14 HE2 LYS 14 -9.153 -6.187 4.525 136 HE3 LYS 14 HE3 LYS 14 -8.043 -7.309 3.724 137 HZ1 LYS 14 HZ1 LYS 14 -10.231 -8.109 5.564 138 HZ2 LYS 14 HZ2 LYS 14 -10.230 -8.298 3.933 139 HZ3 LYS 14 HZ3 LYS 14 -9.164 -9.143 4.861 140 HA PRO 15 HA PRO 15 -4.020 -5.662 11.707 141 HB2 PRO 15 HB2 PRO 15 -3.980 -8.153 12.806 142 HB3 PRO 15 HB3 PRO 15 -5.431 -7.096 12.841 143 HG2 PRO 15 HG2 PRO 15 -4.781 -9.320 10.870 144 HG3 PRO 15 HG3 PRO 15 -6.308 -9.069 11.783 145 HD2 PRO 15 HD2 PRO 15 -6.021 -8.221 9.223 146 HD3 PRO 15 HD3 PRO 15 -6.926 -7.251 10.426 147 H ASP 16 H ASP 16 -3.134 -7.753 9.085 148 HA ASP 16 HA ASP 16 -0.320 -7.902 10.081 149 HB2 ASP 16 HB2 ASP 16 -1.501 -10.029 10.526 150 HB3 ASP 16 HB3 ASP 16 -1.908 -10.156 8.812 151 H VAL 17 H VAL 17 0.696 -6.587 8.801 152 HA VAL 17 HA VAL 17 0.929 -7.324 5.955 153 HB VAL 17 HB VAL 17 -0.758 -5.514 6.030 154 HG11 VAL 17 HG11 VAL 17 -0.102 -3.192 6.449 155 HG12 VAL 17 HG12 VAL 17 0.083 -4.169 7.911 156 HG13 VAL 17 HG13 VAL 17 1.513 -3.707 6.964 157 HG21 VAL 17 HG21 VAL 17 0.643 -5.877 4.031 158 HG22 VAL 17 HG22 VAL 17 0.173 -4.185 4.231 159 HG23 VAL 17 HG23 VAL 17 1.822 -4.689 4.648 160 H SER 18 H SER 18 2.930 -7.023 5.096 161 HA SER 18 HA SER 18 5.111 -6.221 7.006 162 HB2 SER 18 HB2 SER 18 5.117 -8.437 4.934 163 HB3 SER 18 HB3 SER 18 6.450 -8.001 6.023 164 HG SER 18 HG SER 18 5.151 -9.796 6.766 165 H VAL 19 H VAL 19 6.610 -4.830 6.305 166 HA VAL 19 HA VAL 19 6.539 -3.847 3.490 167 HB VAL 19 HB VAL 19 7.635 -2.596 6.010 168 HG11 VAL 19 HG11 VAL 19 7.813 -1.621 3.115 169 HG12 VAL 19 HG12 VAL 19 8.083 -0.590 4.543 170 HG13 VAL 19 HG13 VAL 19 9.164 -1.941 4.227 171 HG21 VAL 19 HG21 VAL 19 5.109 -2.506 5.515 172 HG22 VAL 19 HG22 VAL 19 5.935 -0.957 5.705 173 HG23 VAL 19 HG23 VAL 19 5.531 -1.545 4.085 174 H TYR 20 H TYR 20 8.009 -4.091 2.130 175 HA TYR 20 HA TYR 20 10.772 -4.779 2.994 176 HB2 TYR 20 HB2 TYR 20 9.977 -5.650 0.282 177 HB3 TYR 20 HB3 TYR 20 11.039 -6.404 1.463 178 HD1 TYR 20 HD1 TYR 20 9.983 -7.733 3.385 179 HD2 TYR 20 HD2 TYR 20 7.733 -6.339 -0.005 180 HE1 TYR 20 HE1 TYR 20 8.169 -9.348 3.936 181 HE2 TYR 20 HE2 TYR 20 5.907 -7.955 0.545 182 HH TYR 20 HH TYR 20 6.154 -10.222 3.312 183 H ARG 21 H ARG 21 12.202 -3.381 2.341 184 HA ARG 21 HA ARG 21 11.663 -1.242 0.371 185 HB2 ARG 21 HB2 ARG 21 14.361 -2.110 1.480 186 HB3 ARG 21 HB3 ARG 21 13.987 -0.606 0.642 187 HG2 ARG 21 HG2 ARG 21 13.002 -1.456 3.395 188 HG3 ARG 21 HG3 ARG 21 14.220 -0.238 3.046 189 HD2 ARG 21 HD2 ARG 21 12.559 1.224 2.025 190 HD3 ARG 21 HD3 ARG 21 11.295 -0.013 2.215 191 HE ARG 21 HE ARG 21 12.048 0.178 4.766 192 HH11 ARG 21 HH11 ARG 21 11.603 1.377 6.312 193 HH12 ARG 21 HH12 ARG 21 11.124 3.068 6.125 194 HH21 ARG 21 HH21 ARG 21 11.428 2.931 2.667 195 HH22 ARG 21 HH22 ARG 21 11.034 3.934 4.037 196 H ILE 22 H ILE 22 12.047 -1.304 -1.755 197 HA ILE 22 HA ILE 22 12.610 -4.006 -2.850 198 HB ILE 22 HB ILE 22 11.062 -3.455 -4.652 199 HG12 ILE 22 HG12 ILE 22 10.601 -0.820 -3.187 200 HG13 ILE 22 HG13 ILE 22 11.295 -1.033 -4.797 201 HG21 ILE 22 HG21 ILE 22 9.775 -2.956 -1.954 202 HG22 ILE 22 HG22 ILE 22 9.069 -3.755 -3.367 203 HG23 ILE 22 HG23 ILE 22 10.373 -4.543 -2.477 204 HD11 ILE 22 HD11 ILE 22 9.081 -2.118 -5.484 205 HD12 ILE 22 HD12 ILE 22 8.434 -1.542 -3.933 206 HD13 ILE 22 HD13 ILE 22 9.035 -0.377 -5.123 207 HA PRO 23 HA PRO 23 15.714 -2.430 -5.742 208 HB2 PRO 23 HB2 PRO 23 15.390 -4.190 -7.825 209 HB3 PRO 23 HB3 PRO 23 16.175 -4.647 -6.282 210 HG2 PRO 23 HG2 PRO 23 13.277 -5.067 -7.101 211 HG3 PRO 23 HG3 PRO 23 14.430 -6.272 -6.439 212 HD2 PRO 23 HD2 PRO 23 12.662 -5.004 -4.841 213 HD3 PRO 23 HD3 PRO 23 14.323 -5.331 -4.274 214 HA PRO 24 HA PRO 24 13.439 0.247 -8.463 215 HB2 PRO 24 HB2 PRO 24 14.878 0.299 -10.826 216 HB3 PRO 24 HB3 PRO 24 15.367 1.131 -9.320 217 HG2 PRO 24 HG2 PRO 24 16.260 -1.596 -10.312 218 HG3 PRO 24 HG3 PRO 24 17.281 -0.246 -9.714 219 HD2 PRO 24 HD2 PRO 24 16.609 -2.277 -8.085 220 HD3 PRO 24 HD3 PRO 24 16.580 -0.602 -7.466 221 H ARG 25 H ARG 25 11.931 0.313 -10.087 222 HA ARG 25 HA ARG 25 10.483 -2.068 -10.661 223 HB2 ARG 25 HB2 ARG 25 9.686 0.354 -10.450 224 HB3 ARG 25 HB3 ARG 25 10.280 0.603 -12.095 225 HG2 ARG 25 HG2 ARG 25 8.642 -1.258 -12.785 226 HG3 ARG 25 HG3 ARG 25 7.997 -1.166 -11.151 227 HD2 ARG 25 HD2 ARG 25 8.176 1.176 -13.110 228 HD3 ARG 25 HD3 ARG 25 6.773 0.136 -12.926 229 HE ARG 25 HE ARG 25 6.197 1.106 -10.917 230 HH11 ARG 25 HH11 ARG 25 6.179 2.581 -9.374 231 HH12 ARG 25 HH12 ARG 25 7.449 3.778 -9.213 232 HH21 ARG 25 HH21 ARG 25 9.215 2.613 -11.939 233 HH22 ARG 25 HH22 ARG 25 9.118 3.812 -10.678 234 H ALA 26 H ALA 26 9.963 -3.071 -12.579 235 HA ALA 26 HA ALA 26 11.816 -3.291 -14.799 236 HB1 ALA 26 HB1 ALA 26 8.847 -3.907 -14.599 237 HB2 ALA 26 HB2 ALA 26 9.968 -4.546 -15.823 238 HB3 ALA 26 HB3 ALA 26 10.147 -5.024 -14.124 239 H SER 27 H SER 27 10.753 -2.871 -17.090 240 HA SER 27 HA SER 27 10.815 0.055 -17.285 241 HB2 SER 27 HB2 SER 27 11.156 -0.349 -19.680 242 HB3 SER 27 HB3 SER 27 12.264 -1.308 -18.685 243 HG SER 27 HG SER 27 11.435 -2.685 -20.211 244 H ASN 28 H ASN 28 8.593 -2.502 -18.291 245 HA ASN 28 HA ASN 28 6.383 -0.507 -18.686 246 HB2 ASN 28 HB2 ASN 28 7.163 -2.962 -20.330 247 HB3 ASN 28 HB3 ASN 28 5.653 -2.084 -20.531 248 HD21 ASN 28 HD21 ASN 28 9.075 -0.439 -22.025 249 HD22 ASN 28 HD22 ASN 28 9.205 -1.760 -20.869 250 H ARG 29 H ARG 29 7.289 -2.967 -16.668 251 HA ARG 29 HA ARG 29 4.603 -4.290 -16.554 252 HB2 ARG 29 HB2 ARG 29 7.278 -5.292 -15.550 253 HB3 ARG 29 HB3 ARG 29 5.725 -6.113 -15.419 254 HG2 ARG 29 HG2 ARG 29 5.552 -6.097 -17.937 255 HG3 ARG 29 HG3 ARG 29 7.203 -5.435 -17.997 256 HD2 ARG 29 HD2 ARG 29 7.986 -7.370 -16.629 257 HD3 ARG 29 HD3 ARG 29 6.360 -8.044 -16.665 258 HE ARG 29 HE ARG 29 8.352 -7.989 -18.845 259 HH11 ARG 29 HH11 ARG 29 8.001 -9.174 -20.679 260 HH12 ARG 29 HH12 ARG 29 6.428 -9.842 -21.000 261 HH21 ARG 29 HH21 ARG 29 4.967 -8.610 -18.154 262 HH22 ARG 29 HH22 ARG 29 4.754 -9.538 -19.613 263 H GLY 30 H GLY 30 7.132 -3.201 -14.178 264 HA2 GLY 30 HA2 GLY 30 6.091 -2.180 -12.022 265 HA3 GLY 30 HA3 GLY 30 5.088 -3.635 -12.090 266 H TYR 31 H TYR 31 5.746 -4.850 -10.570 267 HA TYR 31 HA TYR 31 8.594 -5.719 -10.226 268 HB2 TYR 31 HB2 TYR 31 6.397 -5.308 -8.180 269 HB3 TYR 31 HB3 TYR 31 8.082 -5.710 -7.864 270 HD1 TYR 31 HD1 TYR 31 9.857 -3.990 -8.180 271 HD2 TYR 31 HD2 TYR 31 5.708 -3.036 -8.902 272 HE1 TYR 31 HE1 TYR 31 10.373 -1.589 -7.986 273 HE2 TYR 31 HE2 TYR 31 6.214 -0.632 -8.594 274 HH TYR 31 HH TYR 31 9.520 0.554 -7.855 275 H ARG 32 H ARG 32 8.641 -7.914 -8.981 276 HA ARG 32 HA ARG 32 6.370 -9.695 -9.806 277 HB2 ARG 32 HB2 ARG 32 7.997 -11.440 -10.434 278 HB3 ARG 32 HB3 ARG 32 7.944 -10.060 -11.504 279 HG2 ARG 32 HG2 ARG 32 10.062 -10.259 -9.335 280 HG3 ARG 32 HG3 ARG 32 10.223 -11.134 -10.860 281 HD2 ARG 32 HD2 ARG 32 9.943 -8.987 -12.120 282 HD3 ARG 32 HD3 ARG 32 9.916 -8.121 -10.592 283 HE ARG 32 HE ARG 32 12.211 -8.359 -10.340 284 HH11 ARG 32 HH11 ARG 32 14.161 -8.673 -10.893 285 HH12 ARG 32 HH12 ARG 32 14.616 -9.630 -12.305 286 HH21 ARG 32 HH21 ARG 32 11.324 -10.386 -13.081 287 HH22 ARG 32 HH22 ARG 32 12.995 -10.597 -13.526 288 H ALA 33 H ALA 33 7.030 -8.591 -7.190 289 HA ALA 33 HA ALA 33 7.185 -9.089 -5.006 290 HB1 ALA 33 HB1 ALA 33 5.106 -10.220 -5.668 291 HB2 ALA 33 HB2 ALA 33 5.984 -11.735 -5.882 292 HB3 ALA 33 HB3 ALA 33 5.880 -10.988 -4.266 293 H SER 34 H SER 34 8.362 -12.034 -6.688 294 HA SER 34 HA SER 34 10.021 -12.975 -4.607 295 HB2 SER 34 HB2 SER 34 10.222 -13.455 -7.598 296 HB3 SER 34 HB3 SER 34 11.003 -14.433 -6.339 297 HG SER 34 HG SER 34 8.996 -15.332 -7.033 298 H ASP 35 H ASP 35 10.607 -10.307 -6.660 299 HA ASP 35 HA ASP 35 13.528 -10.379 -6.462 300 HB2 ASP 35 HB2 ASP 35 11.854 -9.269 -8.261 301 HB3 ASP 35 HB3 ASP 35 11.985 -7.889 -7.197 302 H TRP 36 H TRP 36 11.002 -9.549 -4.287 303 HA TRP 36 HA TRP 36 12.514 -7.485 -2.830 304 HB2 TRP 36 HB2 TRP 36 9.796 -8.646 -2.206 305 HB3 TRP 36 HB3 TRP 36 10.478 -7.140 -1.638 306 HD1 TRP 36 HD1 TRP 36 11.171 -6.634 -5.068 307 HE1 TRP 36 HE1 TRP 36 9.234 -5.517 -6.358 308 HE3 TRP 36 HE3 TRP 36 7.316 -7.569 -1.819 309 HZ2 TRP 36 HZ2 TRP 36 6.541 -4.818 -5.895 310 HZ3 TRP 36 HZ3 TRP 36 5.065 -6.584 -2.245 311 HH2 TRP 36 HH2 TRP 36 4.672 -5.217 -4.273 312 H LYS 37 H LYS 37 12.597 -7.694 -0.499 313 HA LYS 37 HA LYS 37 13.515 -10.305 0.442 314 HB2 LYS 37 HB2 LYS 37 13.809 -7.471 1.274 315 HB3 LYS 37 HB3 LYS 37 13.651 -8.577 2.628 316 HG2 LYS 37 HG2 LYS 37 15.380 -10.062 1.614 317 HG3 LYS 37 HG3 LYS 37 15.646 -8.843 0.353 318 HD2 LYS 37 HD2 LYS 37 16.408 -7.227 2.005 319 HD3 LYS 37 HD3 LYS 37 15.920 -8.298 3.346 320 HE2 LYS 37 HE2 LYS 37 17.468 -10.046 2.506 321 HE3 LYS 37 HE3 LYS 37 18.000 -8.959 1.218 322 HZ1 LYS 37 HZ1 LYS 37 19.531 -8.899 3.107 323 HZ2 LYS 37 HZ2 LYS 37 18.828 -7.435 2.951 324 HZ3 LYS 37 HZ3 LYS 37 18.345 -8.459 4.133 325 H LEU 38 H LEU 38 11.220 -11.018 -0.148 326 HA LEU 38 HA LEU 38 8.971 -10.538 1.424 327 HB2 LEU 38 HB2 LEU 38 9.832 -13.148 0.119 328 HB3 LEU 38 HB3 LEU 38 8.196 -12.774 0.664 329 HG LEU 38 HG LEU 38 9.710 -11.423 -1.595 330 HD11 LEU 38 HD11 LEU 38 8.771 -13.660 -2.090 331 HD12 LEU 38 HD12 LEU 38 7.172 -13.121 -1.524 332 HD13 LEU 38 HD13 LEU 38 7.896 -12.401 -2.972 333 HD21 LEU 38 HD21 LEU 38 7.527 -10.219 -2.017 334 HD22 LEU 38 HD22 LEU 38 6.983 -10.777 -0.421 335 HD23 LEU 38 HD23 LEU 38 8.375 -9.689 -0.561 336 H ASP 39 H ASP 39 11.642 -12.705 2.280 337 HA ASP 39 HA ASP 39 10.163 -13.811 4.600 338 HB2 ASP 39 HB2 ASP 39 12.957 -14.316 3.517 339 HB3 ASP 39 HB3 ASP 39 12.255 -15.142 4.904 340 H GLN 40 H GLN 40 11.782 -10.962 4.079 341 HA GLN 40 HA GLN 40 13.076 -10.796 6.787 342 HB2 GLN 40 HB2 GLN 40 14.232 -10.294 4.015 343 HB3 GLN 40 HB3 GLN 40 15.018 -9.734 5.500 344 HG2 GLN 40 HG2 GLN 40 15.460 -11.885 6.257 345 HG3 GLN 40 HG3 GLN 40 14.300 -12.635 5.161 346 HE21 GLN 40 HE21 GLN 40 16.466 -12.752 2.344 347 HE22 GLN 40 HE22 GLN 40 14.794 -12.847 2.871 348 HA PRO 41 HA PRO 41 10.648 -7.208 5.410 349 HB2 PRO 41 HB2 PRO 41 9.452 -7.102 8.181 350 HB3 PRO 41 HB3 PRO 41 8.621 -6.911 6.616 351 HG2 PRO 41 HG2 PRO 41 8.455 -9.255 8.008 352 HG3 PRO 41 HG3 PRO 41 8.649 -9.272 6.227 353 HD2 PRO 41 HD2 PRO 41 10.795 -9.617 8.344 354 HD3 PRO 41 HD3 PRO 41 10.474 -10.606 6.894 355 H ASP 42 H ASP 42 10.973 -4.990 5.691 356 HA ASP 42 HA ASP 42 13.125 -4.057 7.482 357 HB2 ASP 42 HB2 ASP 42 12.823 -3.135 5.208 358 HB3 ASP 42 HB3 ASP 42 11.200 -2.587 5.634 359 H TRP 43 H TRP 43 9.612 -4.154 7.365 360 HA TRP 43 HA TRP 43 9.368 -3.610 10.231 361 HB2 TRP 43 HB2 TRP 43 9.409 -1.330 9.418 362 HB3 TRP 43 HB3 TRP 43 8.294 -1.709 8.120 363 HD1 TRP 43 HD1 TRP 43 8.377 -0.779 11.785 364 HE1 TRP 43 HE1 TRP 43 6.003 -0.154 12.545 365 HE3 TRP 43 HE3 TRP 43 5.767 -2.508 7.752 366 HZ2 TRP 43 HZ2 TRP 43 3.343 -0.154 11.402 367 HZ3 TRP 43 HZ3 TRP 43 3.308 -2.062 7.561 368 HH2 TRP 43 HH2 TRP 43 2.093 -0.929 9.393 369 H THR 44 H THR 44 7.278 -4.190 11.055 370 HA THR 44 HA THR 44 5.273 -5.274 9.156 371 HB THR 44 HB THR 44 4.723 -7.119 10.704 372 HG1 THR 44 HG1 THR 44 6.329 -7.736 12.210 373 HG21 THR 44 HG21 THR 44 7.601 -7.314 9.749 374 HG22 THR 44 HG22 THR 44 6.441 -8.643 10.007 375 HG23 THR 44 HG23 THR 44 6.167 -7.473 8.709 376 H GLY 45 H GLY 45 3.153 -5.075 9.782 377 HA2 GLY 45 HA2 GLY 45 2.257 -4.302 12.383 378 HA3 GLY 45 HA3 GLY 45 2.486 -2.853 11.418 379 H ARG 46 H ARG 46 0.420 -2.268 11.289 380 HA ARG 46 HA ARG 46 -1.630 -4.111 10.123 381 HB2 ARG 46 HB2 ARG 46 -2.093 -1.645 11.839 382 HB3 ARG 46 HB3 ARG 46 -3.302 -2.787 11.251 383 HG2 ARG 46 HG2 ARG 46 -2.157 -4.582 12.684 384 HG3 ARG 46 HG3 ARG 46 -1.151 -3.302 13.354 385 HD2 ARG 46 HD2 ARG 46 -3.231 -2.063 14.022 386 HD3 ARG 46 HD3 ARG 46 -4.203 -3.415 13.409 387 HE ARG 46 HE ARG 46 -2.372 -4.478 15.294 388 HH11 ARG 46 HH11 ARG 46 -2.680 -4.558 17.520 389 HH12 ARG 46 HH12 ARG 46 -4.211 -4.039 18.167 390 HH21 ARG 46 HH21 ARG 46 -5.280 -2.532 15.281 391 HH22 ARG 46 HH22 ARG 46 -5.594 -2.828 16.969 392 H LEU 47 H LEU 47 -2.925 -3.408 8.547 393 HA LEU 47 HA LEU 47 -2.112 -1.100 6.864 394 HB2 LEU 47 HB2 LEU 47 -2.569 -3.330 5.829 395 HB3 LEU 47 HB3 LEU 47 -4.168 -3.320 6.570 396 HG LEU 47 HG LEU 47 -4.736 -1.268 5.189 397 HD11 LEU 47 HD11 LEU 47 -2.441 -0.516 4.636 398 HD12 LEU 47 HD12 LEU 47 -2.158 -2.028 3.744 399 HD13 LEU 47 HD13 LEU 47 -3.369 -0.862 3.173 400 HD21 LEU 47 HD21 LEU 47 -5.520 -3.483 4.601 401 HD22 LEU 47 HD22 LEU 47 -5.100 -2.594 3.140 402 HD23 LEU 47 HD23 LEU 47 -3.991 -3.836 3.772 403 H ARG 48 H ARG 48 -3.297 0.771 6.793 404 HA ARG 48 HA ARG 48 -6.164 0.744 7.558 405 HB2 ARG 48 HB2 ARG 48 -4.887 1.415 9.585 406 HB3 ARG 48 HB3 ARG 48 -4.125 2.727 8.684 407 HG2 ARG 48 HG2 ARG 48 -6.340 3.804 8.361 408 HG3 ARG 48 HG3 ARG 48 -7.129 2.445 9.188 409 HD2 ARG 48 HD2 ARG 48 -5.706 2.962 11.216 410 HD3 ARG 48 HD3 ARG 48 -5.094 4.381 10.363 411 HE ARG 48 HE ARG 48 -7.120 5.503 10.703 412 HH11 ARG 48 HH11 ARG 48 -8.792 5.972 11.752 413 HH12 ARG 48 HH12 ARG 48 -9.720 4.801 12.701 414 HH21 ARG 48 HH21 ARG 48 -7.570 2.209 11.865 415 HH22 ARG 48 HH22 ARG 48 -9.009 2.661 12.739 416 H ILE 49 H ILE 49 -6.670 0.830 5.465 417 HA ILE 49 HA ILE 49 -5.819 3.095 3.769 418 HB ILE 49 HB ILE 49 -8.031 1.092 3.240 419 HG12 ILE 49 HG12 ILE 49 -5.084 1.063 2.435 420 HG13 ILE 49 HG13 ILE 49 -5.919 -0.096 3.476 421 HG21 ILE 49 HG21 ILE 49 -6.529 2.979 1.365 422 HG22 ILE 49 HG22 ILE 49 -7.865 1.891 0.923 423 HG23 ILE 49 HG23 ILE 49 -8.168 3.262 1.984 424 HD11 ILE 49 HD11 ILE 49 -6.263 0.247 0.495 425 HD12 ILE 49 HD12 ILE 49 -5.725 -1.162 1.423 426 HD13 ILE 49 HD13 ILE 49 -7.408 -0.664 1.519 427 H THR 50 H THR 50 -6.684 4.959 3.847 428 HA THR 50 HA THR 50 -9.402 5.472 4.914 429 HB THR 50 HB THR 50 -8.243 7.601 5.918 430 HG1 THR 50 HG1 THR 50 -6.091 5.802 5.801 431 HG21 THR 50 HG21 THR 50 -8.117 4.843 7.163 432 HG22 THR 50 HG22 THR 50 -7.652 6.318 8.039 433 HG23 THR 50 HG23 THR 50 -9.300 6.149 7.429 434 H SER 51 H SER 51 -10.122 7.753 4.285 435 HA SER 51 HA SER 51 -8.657 9.069 2.100 436 HB2 SER 51 HB2 SER 51 -9.961 7.232 0.994 437 HB3 SER 51 HB3 SER 51 -11.454 7.940 1.648 438 HG SER 51 HG SER 51 -10.995 8.622 -0.494 439 H LYS 52 H LYS 52 -9.518 11.105 1.490 440 HA LYS 52 HA LYS 52 -12.031 11.893 2.661 441 HB2 LYS 52 HB2 LYS 52 -10.260 12.541 4.362 442 HB3 LYS 52 HB3 LYS 52 -9.705 13.742 3.196 443 HG2 LYS 52 HG2 LYS 52 -11.184 14.705 4.869 444 HG3 LYS 52 HG3 LYS 52 -11.871 14.852 3.252 445 HD2 LYS 52 HD2 LYS 52 -13.580 14.352 4.915 446 HD3 LYS 52 HD3 LYS 52 -13.462 13.010 3.778 447 HE2 LYS 52 HE2 LYS 52 -12.111 11.724 5.401 448 HE3 LYS 52 HE3 LYS 52 -12.100 13.108 6.501 449 HZ1 LYS 52 HZ1 LYS 52 -13.807 11.634 7.242 450 HZ2 LYS 52 HZ2 LYS 52 -14.609 12.872 6.537 451 HZ3 LYS 52 HZ3 LYS 52 -14.423 11.428 5.768 452 H GLY 53 H GLY 53 -13.125 12.502 0.985 453 HA2 GLY 53 HA2 GLY 53 -13.905 13.710 -0.807 454 HA3 GLY 53 HA3 GLY 53 -12.469 14.735 -0.726 455 H LYS 54 H LYS 54 -11.265 14.605 -2.417 456 HA LYS 54 HA LYS 54 -11.257 12.277 -4.262 457 HB2 LYS 54 HB2 LYS 54 -10.366 15.156 -4.384 458 HB3 LYS 54 HB3 LYS 54 -10.037 14.000 -5.703 459 HG2 LYS 54 HG2 LYS 54 -12.498 13.554 -5.872 460 HG3 LYS 54 HG3 LYS 54 -12.787 14.840 -4.692 461 HD2 LYS 54 HD2 LYS 54 -11.467 15.185 -7.415 462 HD3 LYS 54 HD3 LYS 54 -13.147 15.581 -7.011 463 HE2 LYS 54 HE2 LYS 54 -12.347 17.233 -5.324 464 HE3 LYS 54 HE3 LYS 54 -10.674 16.871 -5.770 465 HZ1 LYS 54 HZ1 LYS 54 -11.488 18.836 -6.935 466 HZ2 LYS 54 HZ2 LYS 54 -11.171 17.661 -8.023 467 HZ3 LYS 54 HZ3 LYS 54 -12.716 18.001 -7.609 468 H THR 55 H THR 55 -9.606 12.704 -1.563 469 HA THR 55 HA THR 55 -7.055 11.675 -2.736 470 HB THR 55 HB THR 55 -7.258 13.379 -0.252 471 HG1 THR 55 HG1 THR 55 -6.489 15.048 -1.555 472 HG21 THR 55 HG21 THR 55 -5.234 11.926 -0.484 473 HG22 THR 55 HG22 THR 55 -4.952 12.590 -2.107 474 HG23 THR 55 HG23 THR 55 -4.811 13.636 -0.670 475 H ALA 56 H ALA 56 -6.783 9.624 -2.221 476 HA ALA 56 HA ALA 56 -7.813 8.543 0.346 477 HB1 ALA 56 HB1 ALA 56 -6.639 7.041 -1.991 478 HB2 ALA 56 HB2 ALA 56 -7.374 6.348 -0.538 479 HB3 ALA 56 HB3 ALA 56 -8.378 7.275 -1.667 480 H TYR 57 H TYR 57 -6.410 7.174 1.601 481 HA TYR 57 HA TYR 57 -3.531 7.930 1.667 482 HB2 TYR 57 HB2 TYR 57 -5.482 8.088 3.997 483 HB3 TYR 57 HB3 TYR 57 -3.771 8.477 4.037 484 HD1 TYR 57 HD1 TYR 57 -7.083 9.827 3.742 485 HD2 TYR 57 HD2 TYR 57 -3.003 10.435 2.441 486 HE1 TYR 57 HE1 TYR 57 -7.620 12.168 3.169 487 HE2 TYR 57 HE2 TYR 57 -3.549 12.811 1.905 488 HH TYR 57 HH TYR 57 -6.849 14.143 2.299 489 H ILE 58 H ILE 58 -2.632 5.884 1.385 490 HA ILE 58 HA ILE 58 -3.658 3.582 3.002 491 HB ILE 58 HB ILE 58 -1.290 3.732 1.099 492 HG12 ILE 58 HG12 ILE 58 -2.695 1.917 -0.110 493 HG13 ILE 58 HG13 ILE 58 -4.075 2.530 0.796 494 HG21 ILE 58 HG21 ILE 58 -0.902 2.118 2.958 495 HG22 ILE 58 HG22 ILE 58 -2.462 1.349 2.604 496 HG23 ILE 58 HG23 ILE 58 -1.125 1.299 1.430 497 HD11 ILE 58 HD11 ILE 58 -3.869 4.693 -0.340 498 HD12 ILE 58 HD12 ILE 58 -2.302 4.202 -1.043 499 HD13 ILE 58 HD13 ILE 58 -3.799 3.401 -1.545 500 H LYS 59 H LYS 59 -3.422 4.262 5.103 501 HA LYS 59 HA LYS 59 -0.723 5.085 6.027 502 HB2 LYS 59 HB2 LYS 59 -3.252 4.764 7.677 503 HB3 LYS 59 HB3 LYS 59 -1.753 5.576 8.129 504 HG2 LYS 59 HG2 LYS 59 -2.187 7.186 6.170 505 HG3 LYS 59 HG3 LYS 59 -3.781 6.445 6.027 506 HD2 LYS 59 HD2 LYS 59 -4.205 7.079 8.442 507 HD3 LYS 59 HD3 LYS 59 -2.651 7.961 8.412 508 HE2 LYS 59 HE2 LYS 59 -3.490 9.329 6.505 509 HE3 LYS 59 HE3 LYS 59 -5.028 8.453 6.562 510 HZ1 LYS 59 HZ1 LYS 59 -5.367 9.302 8.820 511 HZ2 LYS 59 HZ2 LYS 59 -3.953 10.126 8.770 512 HZ3 LYS 59 HZ3 LYS 59 -5.182 10.546 7.774 513 H LEU 60 H LEU 60 0.637 3.874 7.146 514 HA LEU 60 HA LEU 60 -0.081 1.064 7.910 515 HB2 LEU 60 HB2 LEU 60 2.343 2.350 6.690 516 HB3 LEU 60 HB3 LEU 60 2.627 1.140 7.929 517 HG LEU 60 HG LEU 60 1.449 -0.557 6.730 518 HD11 LEU 60 HD11 LEU 60 -0.316 0.642 5.548 519 HD12 LEU 60 HD12 LEU 60 0.883 1.558 4.605 520 HD13 LEU 60 HD13 LEU 60 0.685 -0.193 4.361 521 HD21 LEU 60 HD21 LEU 60 3.315 0.957 4.847 522 HD22 LEU 60 HD22 LEU 60 3.838 -0.060 6.204 523 HD23 LEU 60 HD23 LEU 60 2.979 -0.789 4.843 524 H GLU 61 H GLU 61 0.025 0.508 10.006 525 HA GLU 61 HA GLU 61 1.204 2.439 11.966 526 HB2 GLU 61 HB2 GLU 61 -1.564 1.195 12.084 527 HB3 GLU 61 HB3 GLU 61 -0.790 2.099 13.394 528 HG2 GLU 61 HG2 GLU 61 -0.629 4.091 11.887 529 HG3 GLU 61 HG3 GLU 61 -1.557 3.212 10.664 530 H ASP 62 H ASP 62 1.900 1.568 13.992 531 HA ASP 62 HA ASP 62 2.813 -1.162 13.885 532 HB2 ASP 62 HB2 ASP 62 4.010 0.582 15.140 533 HB3 ASP 62 HB3 ASP 62 2.593 0.744 16.211 534 H LYS 63 H LYS 63 2.227 -2.920 15.120 535 HA LYS 63 HA LYS 63 -0.647 -3.059 15.516 536 HB2 LYS 63 HB2 LYS 63 -0.523 -5.358 15.157 537 HB3 LYS 63 HB3 LYS 63 0.712 -4.711 14.104 538 HG2 LYS 63 HG2 LYS 63 1.046 -6.149 16.749 539 HG3 LYS 63 HG3 LYS 63 1.467 -6.724 15.145 540 HD2 LYS 63 HD2 LYS 63 2.889 -4.432 16.584 541 HD3 LYS 63 HD3 LYS 63 3.438 -6.107 16.569 542 HE2 LYS 63 HE2 LYS 63 3.738 -6.063 14.157 543 HE3 LYS 63 HE3 LYS 63 3.010 -4.454 14.067 544 HZ1 LYS 63 HZ1 LYS 63 5.587 -5.059 15.391 545 HZ2 LYS 63 HZ2 LYS 63 5.369 -4.275 13.961 546 HZ3 LYS 63 HZ3 LYS 63 4.871 -3.572 15.352 547 H VAL 64 H VAL 64 1.599 -2.225 17.682 548 HA VAL 64 HA VAL 64 -0.062 -3.297 19.932 549 HB VAL 64 HB VAL 64 2.883 -2.543 20.023 550 HG11 VAL 64 HG11 VAL 64 1.068 -3.845 22.104 551 HG12 VAL 64 HG12 VAL 64 2.824 -3.619 22.262 552 HG13 VAL 64 HG13 VAL 64 1.765 -2.211 22.194 553 HG21 VAL 64 HG21 VAL 64 1.561 -5.297 20.020 554 HG22 VAL 64 HG22 VAL 64 2.655 -4.640 18.783 555 HG23 VAL 64 HG23 VAL 64 3.273 -4.988 20.392 556 H SER 65 H SER 65 1.864 -0.433 18.796 557 HA SER 65 HA SER 65 0.538 1.204 20.888 558 HB2 SER 65 HB2 SER 65 2.077 2.979 20.121 559 HB3 SER 65 HB3 SER 65 2.935 1.486 20.581 560 HG SER 65 HG SER 65 3.725 2.251 18.626 561 H GLY 66 H GLY 66 0.252 0.612 17.469 562 HA2 GLY 66 HA2 GLY 66 -1.241 1.455 15.888 563 HA3 GLY 66 HA3 GLY 66 -1.960 2.508 17.109 564 H GLU 67 H GLU 67 1.510 2.770 16.957 565 HA GLU 67 HA GLU 67 1.297 5.506 16.125 566 HB2 GLU 67 HB2 GLU 67 3.559 5.728 16.610 567 HB3 GLU 67 HB3 GLU 67 2.915 4.587 17.789 568 HG2 GLU 67 HG2 GLU 67 3.853 2.718 16.302 569 HG3 GLU 67 HG3 GLU 67 4.651 3.972 15.359 570 H LEU 68 H LEU 68 1.991 6.527 14.231 571 HA LEU 68 HA LEU 68 1.590 4.999 11.828 572 HB2 LEU 68 HB2 LEU 68 0.890 7.400 12.197 573 HB3 LEU 68 HB3 LEU 68 2.592 7.853 12.127 574 HG LEU 68 HG LEU 68 2.630 6.785 9.769 575 HD11 LEU 68 HD11 LEU 68 0.485 6.640 8.603 576 HD12 LEU 68 HD12 LEU 68 0.467 5.531 9.972 577 HD13 LEU 68 HD13 LEU 68 -0.394 7.074 10.087 578 HD21 LEU 68 HD21 LEU 68 1.655 8.781 8.719 579 HD22 LEU 68 HD22 LEU 68 0.856 9.212 10.249 580 HD23 LEU 68 HD23 LEU 68 2.630 9.215 10.131 581 H PHE 69 H PHE 69 2.993 3.912 10.636 582 HA PHE 69 HA PHE 69 5.927 4.209 10.960 583 HB2 PHE 69 HB2 PHE 69 5.175 1.971 10.857 584 HB3 PHE 69 HB3 PHE 69 4.108 2.280 9.498 585 HD1 PHE 69 HD1 PHE 69 4.822 1.864 7.274 586 HD2 PHE 69 HD2 PHE 69 7.751 2.233 10.422 587 HE1 PHE 69 HE1 PHE 69 6.614 1.245 5.684 588 HE2 PHE 69 HE2 PHE 69 9.535 1.545 8.835 589 HZ PHE 69 HZ PHE 69 8.964 1.042 6.464 590 H ALA 70 H ALA 70 3.542 4.313 8.283 591 HA ALA 70 HA ALA 70 4.802 6.628 7.028 592 HB1 ALA 70 HB1 ALA 70 6.232 4.716 6.251 593 HB2 ALA 70 HB2 ALA 70 4.778 3.904 5.627 594 HB3 ALA 70 HB3 ALA 70 5.315 5.447 4.931 595 H GLN 71 H GLN 71 3.511 7.320 5.082 596 HA GLN 71 HA GLN 71 1.039 5.864 4.604 597 HB2 GLN 71 HB2 GLN 71 -0.472 7.752 4.838 598 HB3 GLN 71 HB3 GLN 71 0.295 7.323 6.355 599 HG2 GLN 71 HG2 GLN 71 0.321 9.638 6.413 600 HG3 GLN 71 HG3 GLN 71 1.960 9.245 5.925 601 HE21 GLN 71 HE21 GLN 71 1.332 11.858 3.561 602 HE22 GLN 71 HE22 GLN 71 2.161 11.416 5.051 603 H ALA 72 H ALA 72 0.198 6.051 2.585 604 HA ALA 72 HA ALA 72 1.730 7.701 0.612 605 HB1 ALA 72 HB1 ALA 72 2.150 5.358 0.306 606 HB2 ALA 72 HB2 ALA 72 0.417 4.986 0.317 607 HB3 ALA 72 HB3 ALA 72 1.115 5.932 -1.011 608 HA PRO 73 HA PRO 73 -2.420 9.451 0.037 609 HB2 PRO 73 HB2 PRO 73 -1.764 11.870 -0.963 610 HB3 PRO 73 HB3 PRO 73 -1.519 11.465 0.767 611 HG2 PRO 73 HG2 PRO 73 0.519 11.402 -1.469 612 HG3 PRO 73 HG3 PRO 73 0.694 12.115 0.165 613 HD2 PRO 73 HD2 PRO 73 1.593 9.588 -0.522 614 HD3 PRO 73 HD3 PRO 73 1.080 10.022 1.135 615 H VAL 74 H VAL 74 -3.746 9.476 -1.751 616 HA VAL 74 HA VAL 74 -2.577 8.980 -4.468 617 HB VAL 74 HB VAL 74 -4.989 7.495 -3.388 618 HG11 VAL 74 HG11 VAL 74 -3.040 6.886 -5.646 619 HG12 VAL 74 HG12 VAL 74 -4.440 5.897 -5.180 620 HG13 VAL 74 HG13 VAL 74 -4.693 7.520 -5.818 621 HG21 VAL 74 HG21 VAL 74 -3.235 6.798 -1.867 622 HG22 VAL 74 HG22 VAL 74 -3.587 5.510 -3.013 623 HG23 VAL 74 HG23 VAL 74 -2.125 6.499 -3.222 624 H GLU 75 H GLU 75 -3.524 10.250 -6.033 625 HA GLU 75 HA GLU 75 -5.933 11.841 -5.290 626 HB2 GLU 75 HB2 GLU 75 -3.990 12.054 -7.617 627 HB3 GLU 75 HB3 GLU 75 -5.376 13.119 -7.348 628 HG2 GLU 75 HG2 GLU 75 -4.442 13.767 -5.126 629 HG3 GLU 75 HG3 GLU 75 -3.015 12.782 -5.451 630 H GLN 76 H GLN 76 -5.153 9.146 -7.293 631 HA GLN 76 HA GLN 76 -7.895 8.524 -7.717 632 HB2 GLN 76 HB2 GLN 76 -8.096 8.514 -10.070 633 HB3 GLN 76 HB3 GLN 76 -7.628 10.138 -9.622 634 HG2 GLN 76 HG2 GLN 76 -5.835 8.019 -10.883 635 HG3 GLN 76 HG3 GLN 76 -6.550 9.400 -11.687 636 HE21 GLN 76 HE21 GLN 76 -3.118 9.908 -9.528 637 HE22 GLN 76 HE22 GLN 76 -4.052 8.405 -9.378 638 H TYR 77 H TYR 77 -8.157 6.317 -8.246 639 HA TYR 77 HA TYR 77 -5.669 4.700 -8.441 640 HB2 TYR 77 HB2 TYR 77 -6.846 4.475 -6.304 641 HB3 TYR 77 HB3 TYR 77 -8.304 3.972 -7.171 642 HD1 TYR 77 HD1 TYR 77 -8.695 1.681 -7.451 643 HD2 TYR 77 HD2 TYR 77 -4.667 3.082 -6.828 644 HE1 TYR 77 HE1 TYR 77 -7.887 -0.672 -7.415 645 HE2 TYR 77 HE2 TYR 77 -3.851 0.726 -6.897 646 HH TYR 77 HH TYR 77 -6.050 -2.049 -7.365 647 HA PRO 78 HA PRO 78 -4.734 2.995 -9.510 648 HB2 PRO 78 HB2 PRO 78 -3.611 2.541 -11.945 649 HB3 PRO 78 HB3 PRO 78 -4.662 1.352 -11.116 650 HG2 PRO 78 HG2 PRO 78 -5.457 3.361 -13.255 651 HG3 PRO 78 HG3 PRO 78 -5.800 1.600 -13.210 652 HD2 PRO 78 HD2 PRO 78 -7.626 3.429 -12.361 653 HD3 PRO 78 HD3 PRO 78 -7.429 1.866 -11.516 654 H GLY 79 H GLY 79 -2.835 4.173 -9.470 655 HA2 GLY 79 HA2 GLY 79 -2.349 6.537 -11.151 656 HA3 GLY 79 HA3 GLY 79 -2.693 6.863 -9.448 657 H ILE 80 H ILE 80 -0.428 7.809 -9.654 658 HA ILE 80 HA ILE 80 1.817 6.055 -10.031 659 HB ILE 80 HB ILE 80 1.995 8.428 -10.445 660 HG12 ILE 80 HG12 ILE 80 3.857 7.587 -8.176 661 HG13 ILE 80 HG13 ILE 80 3.995 7.054 -9.854 662 HG21 ILE 80 HG21 ILE 80 0.514 9.273 -8.596 663 HG22 ILE 80 HG22 ILE 80 1.810 8.913 -7.435 664 HG23 ILE 80 HG23 ILE 80 2.046 10.127 -8.705 665 HD11 ILE 80 HD11 ILE 80 4.341 9.893 -8.816 666 HD12 ILE 80 HD12 ILE 80 5.595 8.795 -9.409 667 HD13 ILE 80 HD13 ILE 80 4.373 9.427 -10.538 668 H ALA 81 H ALA 81 0.045 6.946 -7.092 669 HA ALA 81 HA ALA 81 2.222 6.083 -5.350 670 HB1 ALA 81 HB1 ALA 81 0.743 6.936 -3.576 671 HB2 ALA 81 HB2 ALA 81 0.918 8.103 -4.896 672 HB3 ALA 81 HB3 ALA 81 -0.564 7.137 -4.765 673 H VAL 82 H VAL 82 0.293 4.099 -6.976 674 HA VAL 82 HA VAL 82 0.405 1.983 -4.952 675 HB VAL 82 HB VAL 82 -2.254 2.646 -6.229 676 HG11 VAL 82 HG11 VAL 82 -1.434 0.659 -4.052 677 HG12 VAL 82 HG12 VAL 82 -3.104 0.937 -4.579 678 HG13 VAL 82 HG13 VAL 82 -1.930 0.236 -5.695 679 HG21 VAL 82 HG21 VAL 82 -1.945 4.365 -4.573 680 HG22 VAL 82 HG22 VAL 82 -3.147 3.209 -4.018 681 HG23 VAL 82 HG23 VAL 82 -1.506 3.160 -3.340 682 H GLU 83 H GLU 83 1.037 0.182 -5.946 683 HA GLU 83 HA GLU 83 0.315 -0.424 -8.782 684 HB2 GLU 83 HB2 GLU 83 3.070 -0.029 -7.592 685 HB3 GLU 83 HB3 GLU 83 2.844 -1.193 -8.898 686 HG2 GLU 83 HG2 GLU 83 1.910 0.512 -10.350 687 HG3 GLU 83 HG3 GLU 83 2.062 1.735 -9.073 688 H THR 84 H THR 84 0.682 -2.597 -9.427 689 HA THR 84 HA THR 84 0.509 -4.653 -7.260 690 HB THR 84 HB THR 84 -0.413 -6.070 -9.069 691 HG1 THR 84 HG1 THR 84 -0.946 -5.095 -11.030 692 HG21 THR 84 HG21 THR 84 -1.854 -3.387 -8.829 693 HG22 THR 84 HG22 THR 84 -2.578 -4.939 -9.313 694 HG23 THR 84 HG23 THR 84 -1.952 -4.734 -7.671 695 H VAL 85 H VAL 85 1.551 -6.716 -7.662 696 HA VAL 85 HA VAL 85 4.101 -6.615 -9.169 697 HB VAL 85 HB VAL 85 4.600 -8.734 -8.163 698 HG11 VAL 85 HG11 VAL 85 3.560 -6.812 -6.038 699 HG12 VAL 85 HG12 VAL 85 4.832 -8.019 -5.838 700 HG13 VAL 85 HG13 VAL 85 5.091 -6.641 -6.913 701 HG21 VAL 85 HG21 VAL 85 2.307 -9.699 -8.049 702 HG22 VAL 85 HG22 VAL 85 3.157 -9.799 -6.519 703 HG23 VAL 85 HG23 VAL 85 1.906 -8.567 -6.745 704 H THR 86 H THR 86 4.480 -8.588 -10.609 705 HA THR 86 HA THR 86 2.135 -9.207 -12.281 706 HB THR 86 HB THR 86 3.802 -10.107 -13.828 707 HG1 THR 86 HG1 THR 86 5.979 -9.997 -13.277 708 HG21 THR 86 HG21 THR 86 5.035 -8.055 -14.289 709 HG22 THR 86 HG22 THR 86 3.381 -7.641 -13.771 710 HG23 THR 86 HG23 THR 86 4.737 -7.453 -12.645 711 H ASP 87 H ASP 87 4.283 -10.917 -10.072 712 HA ASP 87 HA ASP 87 3.564 -13.503 -11.203 713 HB2 ASP 87 HB2 ASP 87 5.879 -12.807 -10.552 714 HB3 ASP 87 HB3 ASP 87 5.369 -12.897 -8.860 715 H SER 88 H SER 88 2.972 -11.906 -8.064 716 HA SER 88 HA SER 88 1.064 -14.129 -7.362 717 HB2 SER 88 HB2 SER 88 3.232 -14.551 -6.263 718 HB3 SER 88 HB3 SER 88 3.140 -12.964 -5.485 719 HG SER 88 HG SER 88 1.498 -15.253 -5.101 720 H SER 89 H SER 89 -0.892 -13.372 -7.012 721 HA SER 89 HA SER 89 -1.393 -10.608 -7.017 722 HB2 SER 89 HB2 SER 89 -3.391 -12.829 -6.535 723 HB3 SER 89 HB3 SER 89 -3.707 -11.217 -7.210 724 HG SER 89 HG SER 89 -3.523 -12.790 -8.861 725 H ARG 90 H ARG 90 -0.154 -11.515 -4.412 726 HA ARG 90 HA ARG 90 -2.065 -10.215 -2.530 727 HB2 ARG 90 HB2 ARG 90 -1.514 -11.660 -0.763 728 HB3 ARG 90 HB3 ARG 90 -2.015 -12.622 -2.155 729 HG2 ARG 90 HG2 ARG 90 0.319 -13.111 -2.707 730 HG3 ARG 90 HG3 ARG 90 0.853 -12.102 -1.340 731 HD2 ARG 90 HD2 ARG 90 -0.362 -13.637 0.213 732 HD3 ARG 90 HD3 ARG 90 -0.703 -14.697 -1.162 733 HE ARG 90 HE ARG 90 2.052 -13.928 -0.210 734 HH11 ARG 90 HH11 ARG 90 3.689 -15.256 -0.563 735 HH12 ARG 90 HH12 ARG 90 3.429 -16.884 -1.148 736 HH21 ARG 90 HH21 ARG 90 0.034 -16.476 -1.549 737 HH22 ARG 90 HH22 ARG 90 1.397 -17.546 -1.737 738 H TYR 91 H TYR 91 0.208 -9.060 -4.150 739 HA TYR 91 HA TYR 91 1.696 -7.765 -1.936 740 HB2 TYR 91 HB2 TYR 91 2.873 -9.012 -4.441 741 HB3 TYR 91 HB3 TYR 91 3.754 -8.003 -3.327 742 HD1 TYR 91 HD1 TYR 91 4.261 -8.814 -1.010 743 HD2 TYR 91 HD2 TYR 91 2.489 -11.356 -3.991 744 HE1 TYR 91 HE1 TYR 91 4.777 -10.818 0.387 745 HE2 TYR 91 HE2 TYR 91 3.113 -13.363 -2.665 746 HH TYR 91 HH TYR 91 4.682 -13.095 0.550 747 H PHE 92 H PHE 92 2.175 -5.620 -2.289 748 HA PHE 92 HA PHE 92 1.549 -4.365 -4.918 749 HB2 PHE 92 HB2 PHE 92 0.454 -3.401 -2.246 750 HB3 PHE 92 HB3 PHE 92 0.251 -2.597 -3.786 751 HD1 PHE 92 HD1 PHE 92 -1.218 -3.614 -5.571 752 HD2 PHE 92 HD2 PHE 92 -0.932 -5.234 -1.598 753 HE1 PHE 92 HE1 PHE 92 -3.319 -4.907 -5.937 754 HE2 PHE 92 HE2 PHE 92 -3.047 -6.455 -1.930 755 HZ PHE 92 HZ PHE 92 -4.234 -6.332 -4.135 756 H VAL 93 H VAL 93 2.474 -2.255 -5.175 757 HA VAL 93 HA VAL 93 4.495 -1.447 -3.116 758 HB VAL 93 HB VAL 93 4.482 -0.820 -6.084 759 HG11 VAL 93 HG11 VAL 93 6.529 -0.011 -3.982 760 HG12 VAL 93 HG12 VAL 93 6.621 0.282 -5.730 761 HG13 VAL 93 HG13 VAL 93 5.379 1.086 -4.771 762 HG21 VAL 93 HG21 VAL 93 5.217 -3.054 -5.733 763 HG22 VAL 93 HG22 VAL 93 6.676 -2.088 -5.963 764 HG23 VAL 93 HG23 VAL 93 6.219 -2.592 -4.333 765 H ILE 94 H ILE 94 4.346 0.646 -2.271 766 HA ILE 94 HA ILE 94 2.399 2.451 -3.562 767 HB ILE 94 HB ILE 94 1.528 3.310 -1.520 768 HG12 ILE 94 HG12 ILE 94 3.371 2.526 0.040 769 HG13 ILE 94 HG13 ILE 94 1.723 2.463 0.629 770 HG21 ILE 94 HG21 ILE 94 0.914 0.360 -1.873 771 HG22 ILE 94 HG22 ILE 94 -0.095 1.550 -1.015 772 HG23 ILE 94 HG23 ILE 94 0.213 1.726 -2.747 773 HD11 ILE 94 HD11 ILE 94 3.312 0.044 -0.330 774 HD12 ILE 94 HD12 ILE 94 3.007 0.519 1.350 775 HD13 ILE 94 HD13 ILE 94 1.659 0.026 0.320 776 H ARG 95 H ARG 95 2.775 4.635 -3.374 777 HA ARG 95 HA ARG 95 5.617 5.307 -2.718 778 HB2 ARG 95 HB2 ARG 95 4.649 5.912 -4.976 779 HB3 ARG 95 HB3 ARG 95 3.665 7.121 -4.135 780 HG2 ARG 95 HG2 ARG 95 5.785 8.123 -3.203 781 HG3 ARG 95 HG3 ARG 95 6.713 6.938 -4.128 782 HD2 ARG 95 HD2 ARG 95 6.715 9.027 -5.337 783 HD3 ARG 95 HD3 ARG 95 5.757 7.858 -6.234 784 HE ARG 95 HE ARG 95 3.765 9.009 -5.701 785 HH11 ARG 95 HH11 ARG 95 2.603 10.831 -5.226 786 HH12 ARG 95 HH12 ARG 95 3.379 12.163 -4.432 787 HH21 ARG 95 HH21 ARG 95 6.501 10.769 -4.314 788 HH22 ARG 95 HH22 ARG 95 5.523 12.189 -4.075 789 H ILE 96 H ILE 96 5.674 5.447 -0.551 790 HA ILE 96 HA ILE 96 3.696 7.012 0.943 791 HB ILE 96 HB ILE 96 4.871 6.487 2.940 792 HG12 ILE 96 HG12 ILE 96 6.701 4.582 2.708 793 HG13 ILE 96 HG13 ILE 96 7.018 5.307 1.146 794 HG21 ILE 96 HG21 ILE 96 4.501 4.072 2.975 795 HG22 ILE 96 HG22 ILE 96 3.212 4.930 2.157 796 HG23 ILE 96 HG23 ILE 96 4.441 4.057 1.205 797 HD11 ILE 96 HD11 ILE 96 7.145 6.703 3.859 798 HD12 ILE 96 HD12 ILE 96 8.529 6.100 2.934 799 HD13 ILE 96 HD13 ILE 96 7.581 7.453 2.298 800 H GLN 97 H GLN 97 4.126 8.848 2.247 801 HA GLN 97 HA GLN 97 6.455 10.532 1.420 802 HB2 GLN 97 HB2 GLN 97 3.529 11.292 1.621 803 HB3 GLN 97 HB3 GLN 97 4.758 12.436 2.129 804 HG2 GLN 97 HG2 GLN 97 4.442 13.119 0.002 805 HG3 GLN 97 HG3 GLN 97 5.860 12.108 -0.173 806 HE21 GLN 97 HE21 GLN 97 3.862 9.533 -1.939 807 HE22 GLN 97 HE22 GLN 97 5.200 9.655 -0.814 808 H ASP 98 H ASP 98 7.392 11.791 2.979 809 HA ASP 98 HA ASP 98 6.875 11.034 5.805 810 HB2 ASP 98 HB2 ASP 98 9.167 10.978 4.691 811 HB3 ASP 98 HB3 ASP 98 9.082 12.741 4.649 812 H GLY 99 H GLY 99 5.569 13.284 3.838 813 HA2 GLY 99 HA2 GLY 99 4.101 15.008 4.352 814 HA3 GLY 99 HA3 GLY 99 4.614 14.955 6.038 815 H THR 100 H THR 100 7.217 15.252 3.863 816 HA THR 100 HA THR 100 7.396 18.219 4.122 817 HB THR 100 HB THR 100 8.395 17.013 6.068 818 HG1 THR 100 HG1 THR 100 9.129 19.041 5.623 819 HG21 THR 100 HG21 THR 100 10.568 16.136 4.134 820 HG22 THR 100 HG22 THR 100 10.496 15.868 5.886 821 HG23 THR 100 HG23 THR 100 9.332 15.058 4.826 822 H GLY 101 H GLY 101 7.053 16.211 1.807 823 HA2 GLY 101 HA2 GLY 101 7.529 16.520 -0.458 824 HA3 GLY 101 HA3 GLY 101 8.913 17.533 -0.063 825 H ARG 102 H ARG 102 9.245 14.780 1.774 826 HA ARG 102 HA ARG 102 11.071 13.335 -0.048 827 HB2 ARG 102 HB2 ARG 102 10.125 12.729 2.781 828 HB3 ARG 102 HB3 ARG 102 11.357 11.823 1.908 829 HG2 ARG 102 HG2 ARG 102 12.870 13.687 1.947 830 HG3 ARG 102 HG3 ARG 102 11.614 14.763 2.607 831 HD2 ARG 102 HD2 ARG 102 11.458 13.352 4.630 832 HD3 ARG 102 HD3 ARG 102 12.764 12.321 4.025 833 HE ARG 102 HE ARG 102 14.046 14.644 3.987 834 HH11 ARG 102 HH11 ARG 102 15.112 15.729 5.579 835 HH12 ARG 102 HH12 ARG 102 14.571 15.624 7.228 836 HH21 ARG 102 HH21 ARG 102 11.893 13.562 6.611 837 HH22 ARG 102 HH22 ARG 102 12.841 14.426 7.786 838 H SER 103 H SER 103 10.502 11.539 -1.044 839 HA SER 103 HA SER 103 8.322 9.937 0.008 840 HB2 SER 103 HB2 SER 103 7.085 9.613 -2.032 841 HB3 SER 103 HB3 SER 103 7.194 11.348 -1.717 842 HG SER 103 HG SER 103 8.939 11.396 -3.259 843 H ALA 104 H ALA 104 8.172 7.752 -0.730 844 HA ALA 104 HA ALA 104 10.435 6.644 -2.272 845 HB1 ALA 104 HB1 ALA 104 9.835 5.828 0.609 846 HB2 ALA 104 HB2 ALA 104 11.001 5.040 -0.476 847 HB3 ALA 104 HB3 ALA 104 11.278 6.709 0.056 848 H PHE 105 H PHE 105 9.967 4.723 -3.275 849 HA PHE 105 HA PHE 105 7.204 3.647 -3.126 850 HB2 PHE 105 HB2 PHE 105 9.571 3.103 -4.943 851 HB3 PHE 105 HB3 PHE 105 8.132 2.108 -4.924 852 HD1 PHE 105 HD1 PHE 105 9.512 5.359 -6.001 853 HD2 PHE 105 HD2 PHE 105 5.943 2.961 -5.699 854 HE1 PHE 105 HE1 PHE 105 8.393 6.792 -7.685 855 HE2 PHE 105 HE2 PHE 105 4.837 4.368 -7.383 856 HZ PHE 105 HZ PHE 105 6.060 6.296 -8.397 857 H ILE 106 H ILE 106 6.760 2.171 -1.624 858 HA ILE 106 HA ILE 106 8.878 0.233 -0.763 859 HB ILE 106 HB ILE 106 7.952 0.101 1.412 860 HG12 ILE 106 HG12 ILE 106 5.935 2.275 0.705 861 HG13 ILE 106 HG13 ILE 106 5.544 0.562 0.864 862 HG21 ILE 106 HG21 ILE 106 8.308 3.040 0.723 863 HG22 ILE 106 HG22 ILE 106 8.675 2.245 2.270 864 HG23 ILE 106 HG23 ILE 106 9.641 1.868 0.836 865 HD11 ILE 106 HD11 ILE 106 6.547 2.326 3.120 866 HD12 ILE 106 HD12 ILE 106 4.921 1.666 2.899 867 HD13 ILE 106 HD13 ILE 106 6.276 0.577 3.221 868 H GLY 107 H GLY 107 8.294 -1.923 -0.408 869 HA2 GLY 107 HA2 GLY 107 5.906 -2.818 -1.958 870 HA3 GLY 107 HA3 GLY 107 7.299 -3.802 -1.516 871 H ILE 108 H ILE 108 4.252 -3.881 -0.955 872 HA ILE 108 HA ILE 108 4.585 -4.742 1.848 873 HB ILE 108 HB ILE 108 2.239 -4.288 2.326 874 HG12 ILE 108 HG12 ILE 108 2.194 -2.501 -0.141 875 HG13 ILE 108 HG13 ILE 108 1.416 -4.081 -0.051 876 HG21 ILE 108 HG21 ILE 108 4.045 -2.882 3.115 877 HG22 ILE 108 HG22 ILE 108 3.923 -1.843 1.678 878 HG23 ILE 108 HG23 ILE 108 2.589 -1.922 2.851 879 HD11 ILE 108 HD11 ILE 108 -0.245 -2.378 0.352 880 HD12 ILE 108 HD12 ILE 108 0.006 -3.291 1.850 881 HD13 ILE 108 HD13 ILE 108 0.696 -1.668 1.670 882 H GLY 109 H GLY 109 3.789 -6.644 2.441 883 HA2 GLY 109 HA2 GLY 109 2.452 -8.346 0.362 884 HA3 GLY 109 HA3 GLY 109 3.703 -8.945 1.448 885 H PHE 110 H PHE 110 0.853 -9.631 0.902 886 HA PHE 110 HA PHE 110 -0.344 -9.440 3.628 887 HB2 PHE 110 HB2 PHE 110 -1.531 -10.022 0.892 888 HB3 PHE 110 HB3 PHE 110 -2.412 -10.203 2.390 889 HD1 PHE 110 HD1 PHE 110 -3.741 -8.446 3.128 890 HD2 PHE 110 HD2 PHE 110 -0.393 -7.562 0.552 891 HE1 PHE 110 HE1 PHE 110 -4.429 -6.068 3.030 892 HE2 PHE 110 HE2 PHE 110 -1.010 -5.170 0.582 893 HZ PHE 110 HZ PHE 110 -3.047 -4.424 1.763 894 H THR 111 H THR 111 -1.421 -11.355 4.454 895 HA THR 111 HA THR 111 0.269 -13.706 4.311 896 HB THR 111 HB THR 111 -0.836 -12.827 6.352 897 HG1 THR 111 HG1 THR 111 -1.233 -14.855 7.174 898 HG21 THR 111 HG21 THR 111 -3.124 -13.403 6.900 899 HG22 THR 111 HG22 THR 111 -3.125 -12.395 5.448 900 HG23 THR 111 HG23 THR 111 -3.375 -14.150 5.310 901 H ASP 112 H ASP 112 -2.591 -12.725 2.596 902 HA ASP 112 HA ASP 112 -2.713 -15.187 1.082 903 HB2 ASP 112 HB2 ASP 112 -4.012 -15.756 3.174 904 HB3 ASP 112 HB3 ASP 112 -5.095 -14.409 2.827 905 H ARG 113 H ARG 113 -4.085 -14.990 -0.785 906 HA ARG 113 HA ARG 113 -4.222 -12.388 -1.966 907 HB2 ARG 113 HB2 ARG 113 -4.075 -14.609 -3.173 908 HB3 ARG 113 HB3 ARG 113 -5.780 -14.886 -2.763 909 HG2 ARG 113 HG2 ARG 113 -6.349 -12.740 -3.955 910 HG3 ARG 113 HG3 ARG 113 -4.637 -12.579 -4.400 911 HD2 ARG 113 HD2 ARG 113 -4.763 -14.586 -5.757 912 HD3 ARG 113 HD3 ARG 113 -6.386 -14.960 -5.140 913 HE ARG 113 HE ARG 113 -6.618 -12.411 -6.241 914 HH11 ARG 113 HH11 ARG 113 -7.520 -12.025 -8.212 915 HH12 ARG 113 HH12 ARG 113 -7.444 -13.230 -9.464 916 HH21 ARG 113 HH21 ARG 113 -5.818 -15.565 -7.545 917 HH22 ARG 113 HH22 ARG 113 -6.517 -15.196 -9.098 918 H GLY 114 H GLY 114 -6.686 -14.168 -0.090 919 HA2 GLY 114 HA2 GLY 114 -8.964 -12.686 -0.891 920 HA3 GLY 114 HA3 GLY 114 -8.760 -13.527 0.650 921 H ASP 115 H ASP 115 -6.483 -11.834 1.528 922 HA ASP 115 HA ASP 115 -8.025 -9.500 2.490 923 HB2 ASP 115 HB2 ASP 115 -5.270 -10.576 3.194 924 HB3 ASP 115 HB3 ASP 115 -6.001 -9.137 3.913 925 H ALA 116 H ALA 116 -5.172 -10.129 0.411 926 HA ALA 116 HA ALA 116 -4.605 -7.393 -0.249 927 HB1 ALA 116 HB1 ALA 116 -3.658 -8.502 -2.325 928 HB2 ALA 116 HB2 ALA 116 -3.074 -9.167 -0.781 929 HB3 ALA 116 HB3 ALA 116 -4.302 -10.033 -1.738 930 H PHE 117 H PHE 117 -7.033 -9.700 -1.483 931 HA PHE 117 HA PHE 117 -8.077 -7.797 -3.387 932 HB2 PHE 117 HB2 PHE 117 -8.662 -10.619 -2.758 933 HB3 PHE 117 HB3 PHE 117 -9.986 -9.677 -3.404 934 HD1 PHE 117 HD1 PHE 117 -10.197 -9.402 -5.715 935 HD2 PHE 117 HD2 PHE 117 -6.289 -10.154 -4.051 936 HE1 PHE 117 HE1 PHE 117 -9.212 -9.342 -7.993 937 HE2 PHE 117 HE2 PHE 117 -5.304 -10.039 -6.315 938 HZ PHE 117 HZ PHE 117 -6.757 -9.637 -8.298 939 H ASP 118 H ASP 118 -8.198 -7.370 -0.253 940 HA ASP 118 HA ASP 118 -10.706 -5.773 -0.591 941 HB2 ASP 118 HB2 ASP 118 -9.216 -6.612 1.932 942 HB3 ASP 118 HB3 ASP 118 -10.382 -5.297 1.908 943 H PHE 119 H PHE 119 -7.190 -5.573 -0.059 944 HA PHE 119 HA PHE 119 -6.922 -2.794 0.408 945 HB2 PHE 119 HB2 PHE 119 -5.078 -4.291 0.657 946 HB3 PHE 119 HB3 PHE 119 -5.164 -4.819 -1.010 947 HD1 PHE 119 HD1 PHE 119 -4.433 -3.367 -2.889 948 HD2 PHE 119 HD2 PHE 119 -3.826 -2.268 1.230 949 HE1 PHE 119 HE1 PHE 119 -2.876 -1.578 -3.593 950 HE2 PHE 119 HE2 PHE 119 -2.308 -0.453 0.522 951 HZ PHE 119 HZ PHE 119 -1.816 -0.104 -1.888 952 H ASN 120 H ASN 120 -7.103 -4.516 -2.707 953 HA ASN 120 HA ASN 120 -6.952 -2.061 -4.274 954 HB2 ASN 120 HB2 ASN 120 -7.214 -3.611 -6.188 955 HB3 ASN 120 HB3 ASN 120 -5.963 -4.161 -5.077 956 HD21 ASN 120 HD21 ASN 120 -7.933 -7.161 -5.938 957 HD22 ASN 120 HD22 ASN 120 -6.868 -6.055 -6.804 958 H VAL 121 H VAL 121 -9.626 -4.145 -3.214 959 HA VAL 121 HA VAL 121 -11.597 -2.908 -4.928 960 HB VAL 121 HB VAL 121 -11.807 -4.791 -2.571 961 HG11 VAL 121 HG11 VAL 121 -14.088 -3.691 -4.276 962 HG12 VAL 121 HG12 VAL 121 -14.205 -5.098 -3.196 963 HG13 VAL 121 HG13 VAL 121 -13.894 -3.502 -2.518 964 HG21 VAL 121 HG21 VAL 121 -12.532 -6.367 -4.326 965 HG22 VAL 121 HG22 VAL 121 -12.404 -5.090 -5.556 966 HG23 VAL 121 HG23 VAL 121 -10.955 -5.696 -4.735 967 H SER 122 H SER 122 -10.718 -2.410 -1.487 968 HA SER 122 HA SER 122 -12.755 -0.466 -0.958 969 HB2 SER 122 HB2 SER 122 -11.375 0.139 0.971 970 HB3 SER 122 HB3 SER 122 -11.563 -1.615 0.819 971 HG SER 122 HG SER 122 -9.516 -1.801 0.115 972 H LEU 123 H LEU 123 -9.541 -0.112 -2.428 973 HA LEU 123 HA LEU 123 -9.633 2.787 -2.592 974 HB2 LEU 123 HB2 LEU 123 -8.031 0.653 -4.038 975 HB3 LEU 123 HB3 LEU 123 -7.842 2.374 -4.372 976 HG LEU 123 HG LEU 123 -7.399 1.137 -1.620 977 HD11 LEU 123 HD11 LEU 123 -5.378 1.978 -3.745 978 HD12 LEU 123 HD12 LEU 123 -5.005 1.373 -2.111 979 HD13 LEU 123 HD13 LEU 123 -5.767 0.305 -3.290 980 HD21 LEU 123 HD21 LEU 123 -7.918 3.547 -1.503 981 HD22 LEU 123 HD22 LEU 123 -6.217 3.259 -1.153 982 HD23 LEU 123 HD23 LEU 123 -6.691 3.883 -2.747 983 H GLN 124 H GLN 124 -10.268 0.251 -5.124 984 HA GLN 124 HA GLN 124 -11.042 2.237 -7.021 985 HB2 GLN 124 HB2 GLN 124 -11.532 0.494 -8.499 986 HB3 GLN 124 HB3 GLN 124 -10.227 -0.107 -7.477 987 HG2 GLN 124 HG2 GLN 124 -12.026 -1.246 -6.084 988 HG3 GLN 124 HG3 GLN 124 -13.160 -0.877 -7.384 989 HE21 GLN 124 HE21 GLN 124 -10.181 -3.678 -8.002 990 HE22 GLN 124 HE22 GLN 124 -9.992 -2.461 -6.730 991 H ASP 125 H ASP 125 -13.002 0.622 -4.556 992 HA ASP 125 HA ASP 125 -15.490 1.699 -5.664 993 HB2 ASP 125 HB2 ASP 125 -15.385 -0.543 -4.591 994 HB3 ASP 125 HB3 ASP 125 -14.956 0.226 -3.059 995 H HIS 126 H HIS 126 -12.970 3.075 -3.869 996 HA HIS 126 HA HIS 126 -14.818 5.212 -2.914 997 HB2 HIS 126 HB2 HIS 126 -12.908 4.610 -1.430 998 HB3 HIS 126 HB3 HIS 126 -11.782 5.088 -2.708 999 HD2 HIS 126 HD2 HIS 126 -11.634 7.756 -3.294 1000 HE1 HIS 126 HE1 HIS 126 -14.041 9.158 -0.063 1001 HE2 HIS 126 HE2 HIS 126 -12.521 9.871 -1.972 1002 H PHE 127 H PHE 127 -12.328 4.572 -5.382 1003 HA PHE 127 HA PHE 127 -12.639 7.284 -6.417 1004 HB2 PHE 127 HB2 PHE 127 -10.830 4.951 -7.095 1005 HB3 PHE 127 HB3 PHE 127 -10.839 6.424 -8.044 1006 HD1 PHE 127 HD1 PHE 127 -9.209 4.871 -5.352 1007 HD2 PHE 127 HD2 PHE 127 -10.736 8.699 -6.604 1008 HE1 PHE 127 HE1 PHE 127 -7.474 5.998 -4.004 1009 HE2 PHE 127 HE2 PHE 127 -9.034 9.832 -5.205 1010 HZ PHE 127 HZ PHE 127 -7.388 8.489 -3.924 1011 H LYS 128 H LYS 128 -14.509 4.566 -7.149 1012 HA LYS 128 HA LYS 128 -14.585 4.588 -9.881 1013 HB2 LYS 128 HB2 LYS 128 -16.673 3.568 -9.917 1014 HB3 LYS 128 HB3 LYS 128 -15.818 2.957 -8.520 1015 HG2 LYS 128 HG2 LYS 128 -17.839 5.223 -8.199 1016 HG3 LYS 128 HG3 LYS 128 -18.380 3.571 -8.444 1017 HD2 LYS 128 HD2 LYS 128 -17.195 2.786 -6.507 1018 HD3 LYS 128 HD3 LYS 128 -16.503 4.398 -6.194 1019 HE2 LYS 128 HE2 LYS 128 -18.601 5.325 -5.643 1020 HE3 LYS 128 HE3 LYS 128 -19.497 4.002 -6.419 1021 HZ1 LYS 128 HZ1 LYS 128 -19.531 3.736 -4.005 1022 HZ2 LYS 128 HZ2 LYS 128 -18.646 2.507 -4.668 1023 HZ3 LYS 128 HZ3 LYS 128 -17.881 3.727 -3.949 1024 H TRP 129 H TRP 129 -16.038 7.090 -7.923 1025 HA TRP 129 HA TRP 129 -17.445 8.335 -10.190 1026 HB2 TRP 129 HB2 TRP 129 -18.178 9.962 -8.602 1027 HB3 TRP 129 HB3 TRP 129 -18.390 8.358 -7.917 1028 HD1 TRP 129 HD1 TRP 129 -16.565 7.633 -5.987 1029 HE1 TRP 129 HE1 TRP 129 -15.187 8.992 -4.339 1030 HE3 TRP 129 HE3 TRP 129 -17.145 12.277 -8.089 1031 HZ2 TRP 129 HZ2 TRP 129 -14.663 11.794 -3.791 1032 HZ3 TRP 129 HZ3 TRP 129 -16.233 14.285 -6.942 1033 HH2 TRP 129 HH2 TRP 129 -15.020 14.060 -4.788 1034 H VAL 130 H VAL 130 -14.282 8.589 -8.786 1035 HA VAL 130 HA VAL 130 -13.667 11.228 -9.974 1036 HB VAL 130 HB VAL 130 -11.822 9.239 -8.598 1037 HG11 VAL 130 HG11 VAL 130 -11.474 12.205 -9.216 1038 HG12 VAL 130 HG12 VAL 130 -10.354 11.206 -8.263 1039 HG13 VAL 130 HG13 VAL 130 -10.585 10.865 -9.977 1040 HG21 VAL 130 HG21 VAL 130 -12.002 10.800 -6.632 1041 HG22 VAL 130 HG22 VAL 130 -13.323 11.642 -7.468 1042 HG23 VAL 130 HG23 VAL 130 -13.501 9.942 -6.983 1043 H LYS 131 H LYS 131 -13.076 7.778 -10.564 1044 HA LYS 131 HA LYS 131 -11.437 8.329 -12.946 1045 HB2 LYS 131 HB2 LYS 131 -10.668 6.752 -11.224 1046 HB3 LYS 131 HB3 LYS 131 -12.067 5.725 -11.501 1047 HG2 LYS 131 HG2 LYS 131 -9.885 4.959 -12.516 1048 HG3 LYS 131 HG3 LYS 131 -11.245 5.008 -13.624 1049 HD2 LYS 131 HD2 LYS 131 -10.437 7.152 -14.563 1050 HD3 LYS 131 HD3 LYS 131 -9.062 7.136 -13.435 1051 HE2 LYS 131 HE2 LYS 131 -8.187 5.105 -14.464 1052 HE3 LYS 131 HE3 LYS 131 -9.663 4.906 -15.423 1053 HZ1 LYS 131 HZ1 LYS 131 -9.148 6.978 -16.571 1054 HZ2 LYS 131 HZ2 LYS 131 -7.747 7.150 -15.735 1055 HZ3 LYS 131 HZ3 LYS 131 -7.931 5.899 -16.775 1056 H GLN 132 H GLN 132 -13.834 9.311 -13.361 1057 HA GLN 132 HA GLN 132 -15.429 7.436 -14.952 1058 HB2 GLN 132 HB2 GLN 132 -15.762 10.330 -14.111 1059 HB3 GLN 132 HB3 GLN 132 -16.853 9.610 -15.288 1060 HG2 GLN 132 HG2 GLN 132 -16.413 8.472 -12.503 1061 HG3 GLN 132 HG3 GLN 132 -17.720 9.569 -12.934 1062 HE21 GLN 132 HE21 GLN 132 -18.325 5.675 -13.565 1063 HE22 GLN 132 HE22 GLN 132 -17.077 6.321 -12.495 1064 H GLU 133 H GLU 133 -12.692 8.515 -15.708 1065 HA GLU 133 HA GLU 133 -13.244 9.009 -18.599 1066 HB2 GLU 133 HB2 GLU 133 -11.257 10.588 -16.916 1067 HB3 GLU 133 HB3 GLU 133 -11.394 10.646 -18.676 1068 HG2 GLU 133 HG2 GLU 133 -13.771 11.432 -18.426 1069 HG3 GLU 133 HG3 GLU 133 -13.527 11.509 -16.678 Start of MODEL 11 1 H1 GLY -4 H1 GLY -4 -14.824 35.715 5.838 2 H2 GLY -4 H2 GLY -4 -15.899 35.014 6.856 3 H3 GLY -4 H3 GLY -4 -16.309 35.289 5.292 4 HA2 GLY -4 HA2 GLY -4 -15.844 32.956 5.597 5 HA3 GLY -4 HA3 GLY -4 -14.663 33.715 4.517 6 H SER -3 H SER -3 -13.068 32.191 4.971 7 HA SER -3 HA SER -3 -11.392 31.099 6.051 8 HB2 SER -3 HB2 SER -3 -11.012 33.857 7.243 9 HB3 SER -3 HB3 SER -3 -9.782 32.583 7.123 10 HG SER -3 HG SER -3 -9.660 34.081 5.380 11 HA PRO -2 HA PRO -2 -13.462 30.381 10.187 12 HB2 PRO -2 HB2 PRO -2 -14.555 27.926 9.818 13 HB3 PRO -2 HB3 PRO -2 -15.321 29.404 9.161 14 HG2 PRO -2 HG2 PRO -2 -13.458 27.485 7.706 15 HG3 PRO -2 HG3 PRO -2 -15.085 28.038 7.191 16 HD2 PRO -2 HD2 PRO -2 -12.808 29.251 6.309 17 HD3 PRO -2 HD3 PRO -2 -14.295 30.185 6.659 18 H ASN -1 H ASN -1 -10.818 29.238 8.559 19 HA ASN -1 HA ASN -1 -10.088 26.831 9.887 20 HB2 ASN -1 HB2 ASN -1 -8.353 28.912 8.485 21 HB3 ASN -1 HB3 ASN -1 -7.898 27.244 8.820 22 HD21 ASN -1 HD21 ASN -1 -9.967 25.882 6.213 23 HD22 ASN -1 HD22 ASN -1 -9.277 25.509 7.801 24 H SER 0 H SER 0 -8.234 26.454 11.239 25 HA SER 0 HA SER 0 -7.937 28.463 13.452 26 HB2 SER 0 HB2 SER 0 -7.718 25.433 13.510 27 HB3 SER 0 HB3 SER 0 -7.456 26.521 14.885 28 HG SER 0 HG SER 0 -9.592 25.666 14.847 29 H MET 1 H MET 1 -6.179 26.495 11.132 30 HA MET 1 HA MET 1 -4.007 26.212 10.640 31 HB2 MET 1 HB2 MET 1 -4.369 28.681 10.235 32 HB3 MET 1 HB3 MET 1 -3.521 28.989 11.753 33 HG2 MET 1 HG2 MET 1 -1.512 27.830 10.833 34 HG3 MET 1 HG3 MET 1 -2.413 27.445 9.370 35 HE1 MET 1 HE1 MET 1 -0.591 30.169 11.478 36 HE2 MET 1 HE2 MET 1 -0.887 31.663 10.563 37 HE3 MET 1 HE3 MET 1 -2.216 30.897 11.454 38 H ALA 2 H ALA 2 -4.553 24.771 12.721 39 HA ALA 2 HA ALA 2 -2.209 24.853 14.536 40 HB1 ALA 2 HB1 ALA 2 -3.674 24.647 16.503 41 HB2 ALA 2 HB2 ALA 2 -4.023 26.148 15.628 42 HB3 ALA 2 HB3 ALA 2 -5.115 24.755 15.467 43 H THR 3 H THR 3 -2.731 23.218 12.309 44 HA THR 3 HA THR 3 -2.960 21.143 11.481 45 HB THR 3 HB THR 3 -2.412 20.007 14.223 46 HG1 THR 3 HG1 THR 3 -0.598 20.826 12.187 47 HG21 THR 3 HG21 THR 3 -3.120 18.379 12.524 48 HG22 THR 3 HG22 THR 3 -1.939 19.030 11.371 49 HG23 THR 3 HG23 THR 3 -1.387 18.194 12.849 50 H GLU 4 H GLU 4 -5.053 21.622 11.013 51 HA GLU 4 HA GLU 4 -7.208 20.670 12.798 52 HB2 GLU 4 HB2 GLU 4 -8.630 22.212 11.627 53 HB3 GLU 4 HB3 GLU 4 -7.140 23.001 12.151 54 HG2 GLU 4 HG2 GLU 4 -6.226 22.756 9.817 55 HG3 GLU 4 HG3 GLU 4 -7.775 22.076 9.312 56 H LEU 5 H LEU 5 -5.613 18.930 10.882 57 HA LEU 5 HA LEU 5 -7.524 17.847 9.004 58 HB2 LEU 5 HB2 LEU 5 -4.877 18.008 9.011 59 HB3 LEU 5 HB3 LEU 5 -4.961 16.451 9.817 60 HG LEU 5 HG LEU 5 -6.212 17.187 7.137 61 HD11 LEU 5 HD11 LEU 5 -4.401 15.843 6.134 62 HD12 LEU 5 HD12 LEU 5 -3.748 17.194 7.070 63 HD13 LEU 5 HD13 LEU 5 -3.713 15.552 7.749 64 HD21 LEU 5 HD21 LEU 5 -5.904 14.443 8.437 65 HD22 LEU 5 HD22 LEU 5 -7.430 15.285 8.099 66 HD23 LEU 5 HD23 LEU 5 -6.425 14.728 6.763 67 H GLU 6 H GLU 6 -8.995 17.802 11.089 68 HA GLU 6 HA GLU 6 -8.798 15.314 12.651 69 HB2 GLU 6 HB2 GLU 6 -9.312 17.623 13.586 70 HB3 GLU 6 HB3 GLU 6 -10.919 17.471 12.876 71 HG2 GLU 6 HG2 GLU 6 -11.271 15.384 14.244 72 HG3 GLU 6 HG3 GLU 6 -9.641 15.553 14.889 73 H TYR 7 H TYR 7 -9.052 14.454 10.173 74 HA TYR 7 HA TYR 7 -11.693 13.202 10.057 75 HB2 TYR 7 HB2 TYR 7 -12.106 13.807 7.762 76 HB3 TYR 7 HB3 TYR 7 -12.038 15.236 8.762 77 HD1 TYR 7 HD1 TYR 7 -10.606 17.054 8.186 78 HD2 TYR 7 HD2 TYR 7 -10.006 13.210 6.304 79 HE1 TYR 7 HE1 TYR 7 -9.136 18.102 6.475 80 HE2 TYR 7 HE2 TYR 7 -8.675 14.261 4.540 81 HH TYR 7 HH TYR 7 -7.922 17.792 4.555 82 H GLU 8 H GLU 8 -11.701 11.259 8.995 83 HA GLU 8 HA GLU 8 -9.738 10.179 7.236 84 HB2 GLU 8 HB2 GLU 8 -9.124 10.017 10.134 85 HB3 GLU 8 HB3 GLU 8 -9.288 8.411 9.427 86 HG2 GLU 8 HG2 GLU 8 -7.568 8.816 7.817 87 HG3 GLU 8 HG3 GLU 8 -7.465 10.513 8.224 88 H SER 9 H SER 9 -11.570 9.449 6.102 89 HA SER 9 HA SER 9 -13.570 7.707 7.429 90 HB2 SER 9 HB2 SER 9 -13.217 8.921 4.706 91 HB3 SER 9 HB3 SER 9 -14.137 7.414 4.836 92 HG SER 9 HG SER 9 -15.555 8.368 6.239 93 H VAL 10 H VAL 10 -12.910 5.711 7.953 94 HA VAL 10 HA VAL 10 -10.694 4.369 6.714 95 HB VAL 10 HB VAL 10 -11.428 4.045 9.040 96 HG11 VAL 10 HG11 VAL 10 -13.612 2.247 7.908 97 HG12 VAL 10 HG12 VAL 10 -13.188 2.468 9.616 98 HG13 VAL 10 HG13 VAL 10 -13.880 3.814 8.699 99 HG21 VAL 10 HG21 VAL 10 -10.849 1.725 9.201 100 HG22 VAL 10 HG22 VAL 10 -11.263 1.430 7.504 101 HG23 VAL 10 HG23 VAL 10 -9.877 2.470 7.923 102 H LEU 11 H LEU 11 -10.513 2.617 5.391 103 HA LEU 11 HA LEU 11 -12.847 1.954 3.620 104 HB2 LEU 11 HB2 LEU 11 -9.977 2.656 2.884 105 HB3 LEU 11 HB3 LEU 11 -11.087 1.875 1.778 106 HG LEU 11 HG LEU 11 -11.420 4.665 2.939 107 HD11 LEU 11 HD11 LEU 11 -9.683 4.563 1.244 108 HD12 LEU 11 HD12 LEU 11 -10.720 3.600 0.165 109 HD13 LEU 11 HD13 LEU 11 -11.121 5.286 0.516 110 HD21 LEU 11 HD21 LEU 11 -13.293 4.863 1.296 111 HD22 LEU 11 HD22 LEU 11 -13.152 3.126 0.944 112 HD23 LEU 11 HD23 LEU 11 -13.648 3.691 2.561 113 H CYS 12 H CYS 12 -9.631 0.872 4.784 114 HA CYS 12 HA CYS 12 -10.645 -1.874 5.028 115 HB2 CYS 12 HB2 CYS 12 -9.782 -1.776 2.684 116 HB3 CYS 12 HB3 CYS 12 -8.202 -1.254 3.317 117 HG CYS 12 HG CYS 12 -8.074 -3.768 2.600 118 H VAL 13 H VAL 13 -9.790 -2.811 6.781 119 HA VAL 13 HA VAL 13 -7.135 -1.924 7.791 120 HB VAL 13 HB VAL 13 -9.595 -2.443 9.485 121 HG11 VAL 13 HG11 VAL 13 -6.709 -1.974 10.372 122 HG12 VAL 13 HG12 VAL 13 -8.128 -1.977 11.440 123 HG13 VAL 13 HG13 VAL 13 -7.654 -3.463 10.617 124 HG21 VAL 13 HG21 VAL 13 -7.789 -0.006 9.233 125 HG22 VAL 13 HG22 VAL 13 -9.415 -0.148 8.538 126 HG23 VAL 13 HG23 VAL 13 -9.207 -0.153 10.295 127 H LYS 14 H LYS 14 -5.756 -3.513 7.950 128 HA LYS 14 HA LYS 14 -6.697 -6.302 8.374 129 HB2 LYS 14 HB2 LYS 14 -4.476 -5.552 6.438 130 HB3 LYS 14 HB3 LYS 14 -4.933 -7.181 6.890 131 HG2 LYS 14 HG2 LYS 14 -6.772 -5.220 5.451 132 HG3 LYS 14 HG3 LYS 14 -5.793 -6.461 4.667 133 HD2 LYS 14 HD2 LYS 14 -7.007 -8.232 5.863 134 HD3 LYS 14 HD3 LYS 14 -8.000 -7.018 6.697 135 HE2 LYS 14 HE2 LYS 14 -8.885 -6.224 4.549 136 HE3 LYS 14 HE3 LYS 14 -7.878 -7.397 3.686 137 HZ1 LYS 14 HZ1 LYS 14 -10.023 -8.096 5.622 138 HZ2 LYS 14 HZ2 LYS 14 -10.119 -8.255 3.990 139 HZ3 LYS 14 HZ3 LYS 14 -9.062 -9.178 4.844 140 HA PRO 15 HA PRO 15 -3.955 -5.748 11.756 141 HB2 PRO 15 HB2 PRO 15 -3.918 -8.236 12.862 142 HB3 PRO 15 HB3 PRO 15 -5.376 -7.189 12.864 143 HG2 PRO 15 HG2 PRO 15 -4.673 -9.417 10.916 144 HG3 PRO 15 HG3 PRO 15 -6.220 -9.168 11.793 145 HD2 PRO 15 HD2 PRO 15 -5.881 -8.328 9.237 146 HD3 PRO 15 HD3 PRO 15 -6.816 -7.357 10.416 147 H ASP 16 H ASP 16 -3.042 -7.912 9.195 148 HA ASP 16 HA ASP 16 -0.218 -7.978 10.164 149 HB2 ASP 16 HB2 ASP 16 -1.355 -10.120 10.656 150 HB3 ASP 16 HB3 ASP 16 -1.780 -10.281 8.948 151 H VAL 17 H VAL 17 0.731 -6.642 8.846 152 HA VAL 17 HA VAL 17 0.937 -7.400 6.001 153 HB VAL 17 HB VAL 17 -0.778 -5.566 6.202 154 HG11 VAL 17 HG11 VAL 17 1.614 -3.773 6.807 155 HG12 VAL 17 HG12 VAL 17 -0.048 -3.257 6.484 156 HG13 VAL 17 HG13 VAL 17 0.318 -4.184 7.947 157 HG21 VAL 17 HG21 VAL 17 0.389 -6.034 4.094 158 HG22 VAL 17 HG22 VAL 17 0.033 -4.314 4.278 159 HG23 VAL 17 HG23 VAL 17 1.685 -4.900 4.552 160 H SER 18 H SER 18 2.916 -6.968 5.076 161 HA SER 18 HA SER 18 5.117 -6.239 6.992 162 HB2 SER 18 HB2 SER 18 5.093 -8.445 4.908 163 HB3 SER 18 HB3 SER 18 6.424 -8.041 6.012 164 HG SER 18 HG SER 18 5.091 -9.823 6.727 165 H VAL 19 H VAL 19 6.634 -4.871 6.301 166 HA VAL 19 HA VAL 19 6.558 -3.863 3.496 167 HB VAL 19 HB VAL 19 7.681 -2.644 6.023 168 HG11 VAL 19 HG11 VAL 19 7.792 -1.647 3.134 169 HG12 VAL 19 HG12 VAL 19 8.089 -0.622 4.562 170 HG13 VAL 19 HG13 VAL 19 9.167 -1.973 4.213 171 HG21 VAL 19 HG21 VAL 19 5.540 -1.562 4.157 172 HG22 VAL 19 HG22 VAL 19 5.141 -2.559 5.571 173 HG23 VAL 19 HG23 VAL 19 5.967 -1.012 5.783 174 H TYR 20 H TYR 20 7.988 -4.228 2.105 175 HA TYR 20 HA TYR 20 10.796 -4.740 2.921 176 HB2 TYR 20 HB2 TYR 20 10.169 -6.088 0.430 177 HB3 TYR 20 HB3 TYR 20 11.008 -6.676 1.846 178 HD1 TYR 20 HD1 TYR 20 9.856 -8.071 3.498 179 HD2 TYR 20 HD2 TYR 20 7.726 -6.343 0.178 180 HE1 TYR 20 HE1 TYR 20 7.939 -9.602 3.934 181 HE2 TYR 20 HE2 TYR 20 5.792 -7.859 0.637 182 HH TYR 20 HH TYR 20 5.870 -10.281 3.285 183 H ARG 21 H ARG 21 12.136 -3.443 2.044 184 HA ARG 21 HA ARG 21 11.548 -1.491 -0.022 185 HB2 ARG 21 HB2 ARG 21 14.244 -2.633 0.833 186 HB3 ARG 21 HB3 ARG 21 14.022 -1.232 -0.212 187 HG2 ARG 21 HG2 ARG 21 13.179 -1.433 2.706 188 HG3 ARG 21 HG3 ARG 21 14.584 -0.581 2.076 189 HD2 ARG 21 HD2 ARG 21 13.108 0.959 0.804 190 HD3 ARG 21 HD3 ARG 21 11.682 0.154 1.463 191 HE ARG 21 HE ARG 21 13.465 2.030 2.833 192 HH11 ARG 21 HH11 ARG 21 13.326 2.356 5.081 193 HH12 ARG 21 HH12 ARG 21 12.264 1.294 5.995 194 HH21 ARG 21 HH21 ARG 21 10.969 -0.390 3.414 195 HH22 ARG 21 HH22 ARG 21 11.042 -0.084 5.155 196 H ILE 22 H ILE 22 11.813 -1.480 -2.117 197 HA ILE 22 HA ILE 22 12.035 -4.103 -3.504 198 HB ILE 22 HB ILE 22 10.647 -3.150 -5.249 199 HG12 ILE 22 HG12 ILE 22 10.603 -0.583 -3.601 200 HG13 ILE 22 HG13 ILE 22 11.344 -0.806 -5.189 201 HG21 ILE 22 HG21 ILE 22 9.327 -2.586 -2.578 202 HG22 ILE 22 HG22 ILE 22 8.584 -3.192 -4.079 203 HG23 ILE 22 HG23 ILE 22 9.684 -4.221 -3.157 204 HD11 ILE 22 HD11 ILE 22 8.402 -0.833 -4.507 205 HD12 ILE 22 HD12 ILE 22 9.277 0.255 -5.599 206 HD13 ILE 22 HD13 ILE 22 9.033 -1.447 -6.054 207 HA PRO 23 HA PRO 23 15.398 -2.530 -6.132 208 HB2 PRO 23 HB2 PRO 23 15.090 -4.056 -8.371 209 HB3 PRO 23 HB3 PRO 23 15.685 -4.740 -6.827 210 HG2 PRO 23 HG2 PRO 23 12.846 -4.774 -7.910 211 HG3 PRO 23 HG3 PRO 23 13.809 -6.151 -7.288 212 HD2 PRO 23 HD2 PRO 23 12.025 -4.806 -5.734 213 HD3 PRO 23 HD3 PRO 23 13.548 -5.447 -5.052 214 HA PRO 24 HA PRO 24 13.380 0.513 -8.721 215 HB2 PRO 24 HB2 PRO 24 15.080 0.844 -10.860 216 HB3 PRO 24 HB3 PRO 24 15.422 1.448 -9.209 217 HG2 PRO 24 HG2 PRO 24 16.371 -1.144 -10.476 218 HG3 PRO 24 HG3 PRO 24 17.346 0.080 -9.597 219 HD2 PRO 24 HD2 PRO 24 16.453 -2.147 -8.353 220 HD3 PRO 24 HD3 PRO 24 16.439 -0.574 -7.503 221 H ARG 25 H ARG 25 11.926 0.662 -10.383 222 HA ARG 25 HA ARG 25 11.002 -1.834 -11.556 223 HB2 ARG 25 HB2 ARG 25 9.671 0.252 -10.633 224 HB3 ARG 25 HB3 ARG 25 9.920 0.909 -12.235 225 HG2 ARG 25 HG2 ARG 25 8.855 -1.788 -12.521 226 HG3 ARG 25 HG3 ARG 25 7.953 -0.972 -11.260 227 HD2 ARG 25 HD2 ARG 25 7.815 1.016 -12.977 228 HD3 ARG 25 HD3 ARG 25 8.173 -0.230 -14.172 229 HE ARG 25 HE ARG 25 5.764 0.034 -12.404 230 HH11 ARG 25 HH11 ARG 25 4.011 -0.892 -12.816 231 HH12 ARG 25 HH12 ARG 25 3.828 -2.119 -14.075 232 HH21 ARG 25 HH21 ARG 25 7.196 -2.010 -14.919 233 HH22 ARG 25 HH22 ARG 25 5.632 -2.704 -15.271 234 H ALA 26 H ALA 26 10.479 -2.165 -13.725 235 HA ALA 26 HA ALA 26 11.074 -0.116 -15.678 236 HB1 ALA 26 HB1 ALA 26 12.232 -1.567 -17.282 237 HB2 ALA 26 HB2 ALA 26 13.160 -1.421 -15.778 238 HB3 ALA 26 HB3 ALA 26 12.236 -2.898 -16.107 239 H SER 27 H SER 27 10.018 -0.636 -17.744 240 HA SER 27 HA SER 27 7.273 -1.522 -17.293 241 HB2 SER 27 HB2 SER 27 8.611 -0.426 -19.791 242 HB3 SER 27 HB3 SER 27 6.865 -0.613 -19.526 243 HG SER 27 HG SER 27 7.589 1.527 -19.077 244 H ASN 28 H ASN 28 10.066 -2.702 -19.095 245 HA ASN 28 HA ASN 28 8.581 -5.093 -20.045 246 HB2 ASN 28 HB2 ASN 28 11.402 -4.108 -20.648 247 HB3 ASN 28 HB3 ASN 28 10.663 -5.551 -21.333 248 HD21 ASN 28 HD21 ASN 28 9.996 -2.115 -23.209 249 HD22 ASN 28 HD22 ASN 28 11.279 -2.346 -22.031 250 H ARG 29 H ARG 29 9.296 -4.473 -17.182 251 HA ARG 29 HA ARG 29 10.302 -7.191 -16.512 252 HB2 ARG 29 HB2 ARG 29 11.266 -4.620 -15.165 253 HB3 ARG 29 HB3 ARG 29 11.561 -6.239 -14.560 254 HG2 ARG 29 HG2 ARG 29 12.572 -5.208 -17.249 255 HG3 ARG 29 HG3 ARG 29 13.517 -5.304 -15.756 256 HD2 ARG 29 HD2 ARG 29 13.100 -7.734 -15.630 257 HD3 ARG 29 HD3 ARG 29 12.193 -7.680 -17.132 258 HE ARG 29 HE ARG 29 15.122 -7.473 -16.804 259 HH11 ARG 29 HH11 ARG 29 16.412 -7.678 -18.587 260 HH12 ARG 29 HH12 ARG 29 15.720 -7.616 -20.181 261 HH21 ARG 29 HH21 ARG 29 12.482 -7.164 -19.126 262 HH22 ARG 29 HH22 ARG 29 13.568 -7.354 -20.479 263 H GLY 30 H GLY 30 9.071 -4.241 -14.796 264 HA2 GLY 30 HA2 GLY 30 7.301 -4.089 -13.370 265 HA3 GLY 30 HA3 GLY 30 6.773 -5.718 -13.829 266 H TYR 31 H TYR 31 6.705 -4.704 -11.245 267 HA TYR 31 HA TYR 31 8.733 -6.001 -9.616 268 HB2 TYR 31 HB2 TYR 31 5.904 -5.149 -8.924 269 HB3 TYR 31 HB3 TYR 31 7.219 -5.502 -7.808 270 HD1 TYR 31 HD1 TYR 31 5.397 -2.988 -8.136 271 HD2 TYR 31 HD2 TYR 31 9.392 -3.883 -9.532 272 HE1 TYR 31 HE1 TYR 31 6.004 -0.595 -7.952 273 HE2 TYR 31 HE2 TYR 31 10.047 -1.533 -9.126 274 HH TYR 31 HH TYR 31 7.663 0.970 -8.135 275 H ARG 32 H ARG 32 8.625 -8.093 -8.814 276 HA ARG 32 HA ARG 32 6.313 -9.830 -9.613 277 HB2 ARG 32 HB2 ARG 32 7.945 -11.630 -10.181 278 HB3 ARG 32 HB3 ARG 32 7.877 -10.286 -11.300 279 HG2 ARG 32 HG2 ARG 32 9.993 -10.355 -9.130 280 HG3 ARG 32 HG3 ARG 32 10.168 -11.319 -10.604 281 HD2 ARG 32 HD2 ARG 32 9.931 -9.299 -12.001 282 HD3 ARG 32 HD3 ARG 32 9.791 -8.305 -10.543 283 HE ARG 32 HE ARG 32 12.173 -9.882 -10.414 284 HH11 ARG 32 HH11 ARG 32 14.129 -8.845 -10.450 285 HH12 ARG 32 HH12 ARG 32 14.310 -7.344 -11.328 286 HH21 ARG 32 HH21 ARG 32 10.948 -6.976 -11.988 287 HH22 ARG 32 HH22 ARG 32 12.544 -6.269 -12.090 288 H ALA 33 H ALA 33 6.951 -8.679 -7.059 289 HA ALA 33 HA ALA 33 7.074 -9.103 -4.859 290 HB1 ALA 33 HB1 ALA 33 5.859 -11.758 -5.684 291 HB2 ALA 33 HB2 ALA 33 5.705 -10.944 -4.106 292 HB3 ALA 33 HB3 ALA 33 4.997 -10.225 -5.578 293 H SER 34 H SER 34 8.289 -12.093 -6.445 294 HA SER 34 HA SER 34 9.825 -12.984 -4.252 295 HB2 SER 34 HB2 SER 34 10.128 -13.625 -7.207 296 HB3 SER 34 HB3 SER 34 10.823 -14.562 -5.870 297 HG SER 34 HG SER 34 8.817 -15.429 -6.600 298 H ASP 35 H ASP 35 10.667 -10.506 -6.524 299 HA ASP 35 HA ASP 35 13.568 -10.682 -5.945 300 HB2 ASP 35 HB2 ASP 35 11.841 -8.867 -7.632 301 HB3 ASP 35 HB3 ASP 35 13.476 -8.402 -7.191 302 H TRP 36 H TRP 36 10.912 -9.541 -4.159 303 HA TRP 36 HA TRP 36 12.326 -7.310 -2.870 304 HB2 TRP 36 HB2 TRP 36 9.677 -8.596 -2.163 305 HB3 TRP 36 HB3 TRP 36 10.285 -7.046 -1.636 306 HD1 TRP 36 HD1 TRP 36 10.985 -6.709 -5.112 307 HE1 TRP 36 HE1 TRP 36 9.072 -5.538 -6.382 308 HE3 TRP 36 HE3 TRP 36 7.202 -7.447 -1.745 309 HZ2 TRP 36 HZ2 TRP 36 6.342 -4.834 -5.892 310 HZ3 TRP 36 HZ3 TRP 36 4.942 -6.471 -2.164 311 HH2 TRP 36 HH2 TRP 36 4.518 -5.175 -4.228 312 H LYS 37 H LYS 37 12.344 -7.356 -0.479 313 HA LYS 37 HA LYS 37 13.735 -9.736 0.491 314 HB2 LYS 37 HB2 LYS 37 13.442 -6.896 1.417 315 HB3 LYS 37 HB3 LYS 37 13.804 -8.107 2.645 316 HG2 LYS 37 HG2 LYS 37 15.665 -8.978 1.240 317 HG3 LYS 37 HG3 LYS 37 15.426 -7.626 0.122 318 HD2 LYS 37 HD2 LYS 37 16.129 -6.030 1.735 319 HD3 LYS 37 HD3 LYS 37 15.862 -7.144 3.097 320 HE2 LYS 37 HE2 LYS 37 17.655 -8.612 2.331 321 HE3 LYS 37 HE3 LYS 37 17.943 -7.584 0.920 322 HZ1 LYS 37 HZ1 LYS 37 19.521 -7.089 2.708 323 HZ2 LYS 37 HZ2 LYS 37 18.584 -5.782 2.438 324 HZ3 LYS 37 HZ3 LYS 37 18.318 -6.724 3.748 325 H LEU 38 H LEU 38 11.448 -10.777 -0.005 326 HA LEU 38 HA LEU 38 9.369 -10.669 1.874 327 HB2 LEU 38 HB2 LEU 38 10.293 -13.112 0.315 328 HB3 LEU 38 HB3 LEU 38 8.698 -12.861 1.019 329 HG LEU 38 HG LEU 38 9.930 -11.325 -1.290 330 HD11 LEU 38 HD11 LEU 38 7.534 -13.211 -1.089 331 HD12 LEU 38 HD12 LEU 38 8.056 -12.370 -2.557 332 HD13 LEU 38 HD13 LEU 38 9.107 -13.595 -1.826 333 HD21 LEU 38 HD21 LEU 38 7.658 -10.251 -1.492 334 HD22 LEU 38 HD22 LEU 38 7.259 -10.928 0.104 335 HD23 LEU 38 HD23 LEU 38 8.566 -9.738 -0.068 336 H ASP 39 H ASP 39 12.437 -12.389 2.264 337 HA ASP 39 HA ASP 39 11.382 -13.937 4.555 338 HB2 ASP 39 HB2 ASP 39 12.850 -14.925 2.764 339 HB3 ASP 39 HB3 ASP 39 14.174 -13.939 3.377 340 H GLN 40 H GLN 40 12.561 -10.835 4.185 341 HA GLN 40 HA GLN 40 13.018 -10.563 7.065 342 HB2 GLN 40 HB2 GLN 40 15.173 -9.321 6.772 343 HB3 GLN 40 HB3 GLN 40 15.247 -11.062 6.676 344 HG2 GLN 40 HG2 GLN 40 15.147 -9.355 4.158 345 HG3 GLN 40 HG3 GLN 40 16.647 -9.644 5.020 346 HE21 GLN 40 HE21 GLN 40 15.720 -12.351 2.349 347 HE22 GLN 40 HE22 GLN 40 15.184 -10.677 2.327 348 HA PRO 41 HA PRO 41 10.677 -6.985 5.330 349 HB2 PRO 41 HB2 PRO 41 9.591 -7.170 8.137 350 HB3 PRO 41 HB3 PRO 41 8.715 -6.809 6.627 351 HG2 PRO 41 HG2 PRO 41 8.559 -9.277 7.752 352 HG3 PRO 41 HG3 PRO 41 8.737 -9.110 5.979 353 HD2 PRO 41 HD2 PRO 41 10.877 -9.735 8.023 354 HD3 PRO 41 HD3 PRO 41 10.573 -10.498 6.433 355 H ASP 42 H ASP 42 11.006 -4.824 5.744 356 HA ASP 42 HA ASP 42 13.116 -3.923 7.595 357 HB2 ASP 42 HB2 ASP 42 12.792 -2.814 5.440 358 HB3 ASP 42 HB3 ASP 42 11.101 -2.493 5.820 359 H TRP 43 H TRP 43 9.597 -4.102 7.477 360 HA TRP 43 HA TRP 43 9.311 -3.704 10.371 361 HB2 TRP 43 HB2 TRP 43 9.330 -1.399 9.641 362 HB3 TRP 43 HB3 TRP 43 8.259 -1.749 8.299 363 HD1 TRP 43 HD1 TRP 43 8.210 -0.929 11.992 364 HE1 TRP 43 HE1 TRP 43 5.805 -0.368 12.696 365 HE3 TRP 43 HE3 TRP 43 5.762 -2.562 7.821 366 HZ2 TRP 43 HZ2 TRP 43 3.180 -0.352 11.456 367 HZ3 TRP 43 HZ3 TRP 43 3.309 -2.157 7.563 368 HH2 TRP 43 HH2 TRP 43 2.013 -1.088 9.384 369 H THR 44 H THR 44 7.251 -4.390 11.141 370 HA THR 44 HA THR 44 5.253 -5.310 9.174 371 HB THR 44 HB THR 44 4.684 -7.289 10.453 372 HG1 THR 44 HG1 THR 44 7.121 -6.890 11.840 373 HG21 THR 44 HG21 THR 44 7.613 -7.429 9.669 374 HG22 THR 44 HG22 THR 44 6.423 -8.757 9.727 375 HG23 THR 44 HG23 THR 44 6.246 -7.458 8.537 376 H GLY 45 H GLY 45 3.140 -5.219 9.853 377 HA2 GLY 45 HA2 GLY 45 2.233 -4.561 12.482 378 HA3 GLY 45 HA3 GLY 45 2.520 -3.061 11.607 379 H ARG 46 H ARG 46 0.496 -2.358 11.334 380 HA ARG 46 HA ARG 46 -1.602 -4.136 10.158 381 HB2 ARG 46 HB2 ARG 46 -1.921 -1.566 11.750 382 HB3 ARG 46 HB3 ARG 46 -3.216 -2.623 11.176 383 HG2 ARG 46 HG2 ARG 46 -2.318 -4.456 12.634 384 HG3 ARG 46 HG3 ARG 46 -1.110 -3.335 13.270 385 HD2 ARG 46 HD2 ARG 46 -4.125 -2.887 13.448 386 HD3 ARG 46 HD3 ARG 46 -3.149 -3.628 14.712 387 HE ARG 46 HE ARG 46 -1.979 -1.568 15.084 388 HH11 ARG 46 HH11 ARG 46 -1.833 0.541 15.160 389 HH12 ARG 46 HH12 ARG 46 -2.961 1.552 14.226 390 HH21 ARG 46 HH21 ARG 46 -4.624 -0.956 12.778 391 HH22 ARG 46 HH22 ARG 46 -4.320 0.778 12.951 392 H LEU 47 H LEU 47 -2.808 -3.493 8.515 393 HA LEU 47 HA LEU 47 -2.076 -1.117 6.872 394 HB2 LEU 47 HB2 LEU 47 -2.490 -3.319 5.748 395 HB3 LEU 47 HB3 LEU 47 -4.074 -3.384 6.517 396 HG LEU 47 HG LEU 47 -4.693 -1.252 5.250 397 HD11 LEU 47 HD11 LEU 47 -2.147 -1.960 3.722 398 HD12 LEU 47 HD12 LEU 47 -3.379 -0.796 3.196 399 HD13 LEU 47 HD13 LEU 47 -2.430 -0.469 4.651 400 HD21 LEU 47 HD21 LEU 47 -5.498 -3.443 4.607 401 HD22 LEU 47 HD22 LEU 47 -5.123 -2.500 3.167 402 HD23 LEU 47 HD23 LEU 47 -3.992 -3.762 3.720 403 H ARG 48 H ARG 48 -3.317 0.723 6.971 404 HA ARG 48 HA ARG 48 -6.189 0.470 7.566 405 HB2 ARG 48 HB2 ARG 48 -5.303 0.986 9.754 406 HB3 ARG 48 HB3 ARG 48 -4.392 2.368 9.132 407 HG2 ARG 48 HG2 ARG 48 -6.306 3.671 8.822 408 HG3 ARG 48 HG3 ARG 48 -7.398 2.283 8.730 409 HD2 ARG 48 HD2 ARG 48 -7.287 1.886 11.085 410 HD3 ARG 48 HD3 ARG 48 -5.938 2.991 11.299 411 HE ARG 48 HE ARG 48 -8.769 3.691 11.068 412 HH11 ARG 48 HH11 ARG 48 -9.385 5.887 11.125 413 HH12 ARG 48 HH12 ARG 48 -8.095 7.091 11.022 414 HH21 ARG 48 HH21 ARG 48 -5.465 5.050 11.039 415 HH22 ARG 48 HH22 ARG 48 -6.157 6.679 10.920 416 H ILE 49 H ILE 49 -6.579 0.742 5.485 417 HA ILE 49 HA ILE 49 -5.704 3.132 4.003 418 HB ILE 49 HB ILE 49 -7.964 1.265 3.237 419 HG12 ILE 49 HG12 ILE 49 -4.998 1.026 2.569 420 HG13 ILE 49 HG13 ILE 49 -5.982 -0.110 3.504 421 HG21 ILE 49 HG21 ILE 49 -6.203 3.124 1.566 422 HG22 ILE 49 HG22 ILE 49 -7.595 2.181 0.989 423 HG23 ILE 49 HG23 ILE 49 -7.843 3.511 2.107 424 HD11 ILE 49 HD11 ILE 49 -7.454 -0.312 1.382 425 HD12 ILE 49 HD12 ILE 49 -6.055 0.397 0.535 426 HD13 ILE 49 HD13 ILE 49 -5.894 -1.120 1.439 427 H THR 50 H THR 50 -6.664 4.988 4.022 428 HA THR 50 HA THR 50 -9.385 5.394 5.127 429 HB THR 50 HB THR 50 -8.274 7.593 6.063 430 HG1 THR 50 HG1 THR 50 -6.092 5.821 6.081 431 HG21 THR 50 HG21 THR 50 -7.754 6.423 8.222 432 HG22 THR 50 HG22 THR 50 -9.345 6.041 7.548 433 HG23 THR 50 HG23 THR 50 -8.008 4.873 7.391 434 H SER 51 H SER 51 -10.158 7.726 4.541 435 HA SER 51 HA SER 51 -8.901 9.027 2.221 436 HB2 SER 51 HB2 SER 51 -10.825 8.742 0.780 437 HB3 SER 51 HB3 SER 51 -10.159 7.162 1.176 438 HG SER 51 HG SER 51 -12.486 7.308 1.331 439 H LYS 52 H LYS 52 -10.036 10.884 1.550 440 HA LYS 52 HA LYS 52 -12.588 11.494 2.563 441 HB2 LYS 52 HB2 LYS 52 -10.375 12.994 3.797 442 HB3 LYS 52 HB3 LYS 52 -11.757 13.979 3.283 443 HG2 LYS 52 HG2 LYS 52 -11.661 11.957 5.456 444 HG3 LYS 52 HG3 LYS 52 -12.195 13.625 5.433 445 HD2 LYS 52 HD2 LYS 52 -14.235 12.988 4.185 446 HD3 LYS 52 HD3 LYS 52 -13.744 11.270 4.319 447 HE2 LYS 52 HE2 LYS 52 -13.546 11.507 6.759 448 HE3 LYS 52 HE3 LYS 52 -14.079 13.197 6.647 449 HZ1 LYS 52 HZ1 LYS 52 -16.200 12.323 5.685 450 HZ2 LYS 52 HZ2 LYS 52 -15.659 10.787 5.937 451 HZ3 LYS 52 HZ3 LYS 52 -15.953 11.770 7.206 452 H GLY 53 H GLY 53 -11.105 14.365 1.608 453 HA2 GLY 53 HA2 GLY 53 -13.078 14.613 -0.425 454 HA3 GLY 53 HA3 GLY 53 -11.812 15.781 -0.071 455 H LYS 54 H LYS 54 -12.750 13.074 -2.023 456 HA LYS 54 HA LYS 54 -12.000 12.070 -3.920 457 HB2 LYS 54 HB2 LYS 54 -11.003 14.851 -4.637 458 HB3 LYS 54 HB3 LYS 54 -11.227 13.501 -5.760 459 HG2 LYS 54 HG2 LYS 54 -13.638 13.443 -5.273 460 HG3 LYS 54 HG3 LYS 54 -13.459 14.787 -4.129 461 HD2 LYS 54 HD2 LYS 54 -12.637 16.242 -5.965 462 HD3 LYS 54 HD3 LYS 54 -12.873 14.908 -7.117 463 HE2 LYS 54 HE2 LYS 54 -15.285 14.827 -6.524 464 HE3 LYS 54 HE3 LYS 54 -15.046 16.136 -5.358 465 HZ1 LYS 54 HZ1 LYS 54 -15.897 16.983 -7.473 466 HZ2 LYS 54 HZ2 LYS 54 -14.404 17.585 -7.214 467 HZ3 LYS 54 HZ3 LYS 54 -14.623 16.378 -8.294 468 H THR 55 H THR 55 -10.277 12.016 -1.610 469 HA THR 55 HA THR 55 -7.715 11.248 -2.887 470 HB THR 55 HB THR 55 -7.895 12.933 -0.355 471 HG1 THR 55 HG1 THR 55 -8.406 14.260 -2.052 472 HG21 THR 55 HG21 THR 55 -5.560 12.139 -2.147 473 HG22 THR 55 HG22 THR 55 -5.469 13.219 -0.738 474 HG23 THR 55 HG23 THR 55 -5.884 11.513 -0.513 475 H ALA 56 H ALA 56 -7.043 9.338 -2.167 476 HA ALA 56 HA ALA 56 -8.140 8.191 0.363 477 HB1 ALA 56 HB1 ALA 56 -6.931 6.727 -2.004 478 HB2 ALA 56 HB2 ALA 56 -7.564 6.000 -0.517 479 HB3 ALA 56 HB3 ALA 56 -8.666 6.841 -1.624 480 H TYR 57 H TYR 57 -6.615 6.958 1.635 481 HA TYR 57 HA TYR 57 -3.786 7.896 1.583 482 HB2 TYR 57 HB2 TYR 57 -5.662 7.991 3.979 483 HB3 TYR 57 HB3 TYR 57 -3.987 8.509 3.934 484 HD1 TYR 57 HD1 TYR 57 -3.450 10.478 2.242 485 HD2 TYR 57 HD2 TYR 57 -7.381 9.615 3.814 486 HE1 TYR 57 HE1 TYR 57 -4.189 12.800 1.715 487 HE2 TYR 57 HE2 TYR 57 -8.120 11.899 3.228 488 HH TYR 57 HH TYR 57 -5.922 14.310 1.764 489 H ILE 58 H ILE 58 -2.822 5.862 1.260 490 HA ILE 58 HA ILE 58 -3.696 3.532 2.904 491 HB ILE 58 HB ILE 58 -1.311 3.802 1.036 492 HG12 ILE 58 HG12 ILE 58 -2.592 1.975 -0.243 493 HG13 ILE 58 HG13 ILE 58 -4.024 2.465 0.657 494 HG21 ILE 58 HG21 ILE 58 -0.878 2.190 2.873 495 HG22 ILE 58 HG22 ILE 58 -2.414 1.372 2.516 496 HG23 ILE 58 HG23 ILE 58 -1.076 1.363 1.344 497 HD11 ILE 58 HD11 ILE 58 -3.735 3.436 -1.663 498 HD12 ILE 58 HD12 ILE 58 -3.959 4.664 -0.410 499 HD13 ILE 58 HD13 ILE 58 -2.332 4.334 -1.068 500 H LYS 59 H LYS 59 -3.478 4.205 5.035 501 HA LYS 59 HA LYS 59 -0.730 4.962 5.902 502 HB2 LYS 59 HB2 LYS 59 -3.251 4.897 7.585 503 HB3 LYS 59 HB3 LYS 59 -1.675 5.580 7.993 504 HG2 LYS 59 HG2 LYS 59 -2.014 7.022 5.808 505 HG3 LYS 59 HG3 LYS 59 -3.709 6.566 5.969 506 HD2 LYS 59 HD2 LYS 59 -3.696 7.555 8.288 507 HD3 LYS 59 HD3 LYS 59 -2.013 8.078 7.999 508 HE2 LYS 59 HE2 LYS 59 -2.796 9.336 5.973 509 HE3 LYS 59 HE3 LYS 59 -4.461 8.870 6.358 510 HZ1 LYS 59 HZ1 LYS 59 -2.708 10.503 8.121 511 HZ2 LYS 59 HZ2 LYS 59 -3.943 11.082 7.217 512 HZ3 LYS 59 HZ3 LYS 59 -4.252 10.067 8.461 513 H LEU 60 H LEU 60 0.576 3.792 7.052 514 HA LEU 60 HA LEU 60 -0.153 0.994 7.837 515 HB2 LEU 60 HB2 LEU 60 2.297 2.268 6.660 516 HB3 LEU 60 HB3 LEU 60 2.553 1.077 7.928 517 HG LEU 60 HG LEU 60 1.395 -0.639 6.735 518 HD11 LEU 60 HD11 LEU 60 0.677 -0.324 4.354 519 HD12 LEU 60 HD12 LEU 60 -0.329 0.579 5.487 520 HD13 LEU 60 HD13 LEU 60 0.912 1.429 4.539 521 HD21 LEU 60 HD21 LEU 60 3.311 0.815 4.857 522 HD22 LEU 60 HD22 LEU 60 3.805 -0.144 6.266 523 HD23 LEU 60 HD23 LEU 60 2.979 -0.932 4.920 524 H GLU 61 H GLU 61 -0.009 0.420 9.927 525 HA GLU 61 HA GLU 61 0.936 2.447 11.930 526 HB2 GLU 61 HB2 GLU 61 -1.731 1.026 11.947 527 HB3 GLU 61 HB3 GLU 61 -1.099 2.153 13.169 528 HG2 GLU 61 HG2 GLU 61 -1.193 3.994 11.551 529 HG3 GLU 61 HG3 GLU 61 -1.842 2.897 10.320 530 H ASP 62 H ASP 62 1.418 1.673 14.023 531 HA ASP 62 HA ASP 62 2.548 -0.965 14.017 532 HB2 ASP 62 HB2 ASP 62 3.388 1.181 15.128 533 HB3 ASP 62 HB3 ASP 62 2.166 0.868 16.380 534 H LYS 63 H LYS 63 2.067 -2.726 15.170 535 HA LYS 63 HA LYS 63 -0.744 -3.201 15.856 536 HB2 LYS 63 HB2 LYS 63 0.074 -5.631 15.969 537 HB3 LYS 63 HB3 LYS 63 0.214 -4.841 14.401 538 HG2 LYS 63 HG2 LYS 63 2.585 -4.423 14.727 539 HG3 LYS 63 HG3 LYS 63 2.528 -5.069 16.373 540 HD2 LYS 63 HD2 LYS 63 2.180 -7.293 15.592 541 HD3 LYS 63 HD3 LYS 63 1.759 -6.735 13.951 542 HE2 LYS 63 HE2 LYS 63 4.058 -5.814 13.687 543 HE3 LYS 63 HE3 LYS 63 4.499 -6.446 15.273 544 HZ1 LYS 63 HZ1 LYS 63 5.111 -7.868 13.314 545 HZ2 LYS 63 HZ2 LYS 63 4.240 -8.670 14.458 546 HZ3 LYS 63 HZ3 LYS 63 3.534 -8.182 13.064 547 H VAL 64 H VAL 64 1.849 -2.233 17.668 548 HA VAL 64 HA VAL 64 0.555 -3.250 20.168 549 HB VAL 64 HB VAL 64 3.481 -2.708 19.552 550 HG11 VAL 64 HG11 VAL 64 2.196 -3.546 22.193 551 HG12 VAL 64 HG12 VAL 64 3.943 -3.550 21.860 552 HG13 VAL 64 HG13 VAL 64 3.062 -2.024 21.871 553 HG21 VAL 64 HG21 VAL 64 2.023 -5.289 20.278 554 HG22 VAL 64 HG22 VAL 64 2.735 -4.884 18.700 555 HG23 VAL 64 HG23 VAL 64 3.784 -5.117 20.095 556 H SER 65 H SER 65 2.358 -0.503 18.691 557 HA SER 65 HA SER 65 1.661 1.180 21.025 558 HB2 SER 65 HB2 SER 65 3.339 1.731 18.558 559 HB3 SER 65 HB3 SER 65 3.115 2.855 19.912 560 HG SER 65 HG SER 65 5.026 1.608 20.124 561 H GLY 66 H GLY 66 0.521 0.731 17.749 562 HA2 GLY 66 HA2 GLY 66 -1.394 1.591 16.746 563 HA3 GLY 66 HA3 GLY 66 -1.681 2.629 18.141 564 H GLU 67 H GLU 67 1.503 2.960 17.030 565 HA GLU 67 HA GLU 67 0.997 5.686 16.153 566 HB2 GLU 67 HB2 GLU 67 3.324 6.012 16.410 567 HB3 GLU 67 HB3 GLU 67 2.756 5.031 17.769 568 HG2 GLU 67 HG2 GLU 67 3.657 2.995 16.690 569 HG3 GLU 67 HG3 GLU 67 4.237 3.958 15.329 570 H LEU 68 H LEU 68 1.890 6.634 14.214 571 HA LEU 68 HA LEU 68 1.352 5.033 11.850 572 HB2 LEU 68 HB2 LEU 68 0.760 7.473 12.136 573 HB3 LEU 68 HB3 LEU 68 2.482 7.846 12.101 574 HG LEU 68 HG LEU 68 2.538 6.742 9.768 575 HD11 LEU 68 HD11 LEU 68 0.336 5.556 9.939 576 HD12 LEU 68 HD12 LEU 68 -0.482 7.125 10.010 577 HD13 LEU 68 HD13 LEU 68 0.418 6.641 8.554 578 HD21 LEU 68 HD21 LEU 68 0.823 9.229 10.152 579 HD22 LEU 68 HD22 LEU 68 2.599 9.180 10.096 580 HD23 LEU 68 HD23 LEU 68 1.663 8.746 8.659 581 H PHE 69 H PHE 69 2.744 3.909 10.633 582 HA PHE 69 HA PHE 69 5.690 4.149 10.996 583 HB2 PHE 69 HB2 PHE 69 4.892 1.907 10.946 584 HB3 PHE 69 HB3 PHE 69 3.901 2.197 9.525 585 HD1 PHE 69 HD1 PHE 69 4.758 1.787 7.336 586 HD2 PHE 69 HD2 PHE 69 7.479 2.137 10.667 587 HE1 PHE 69 HE1 PHE 69 6.653 1.198 5.855 588 HE2 PHE 69 HE2 PHE 69 9.366 1.488 9.186 589 HZ PHE 69 HZ PHE 69 8.958 1.024 6.779 590 H ALA 70 H ALA 70 3.293 4.271 8.315 591 HA ALA 70 HA ALA 70 4.701 6.471 7.001 592 HB1 ALA 70 HB1 ALA 70 4.491 3.733 5.651 593 HB2 ALA 70 HB2 ALA 70 5.142 5.224 4.937 594 HB3 ALA 70 HB3 ALA 70 5.994 4.451 6.275 595 H GLN 71 H GLN 71 3.497 7.254 5.083 596 HA GLN 71 HA GLN 71 0.786 6.195 4.704 597 HB2 GLN 71 HB2 GLN 71 -0.324 8.335 5.034 598 HB3 GLN 71 HB3 GLN 71 0.440 7.744 6.494 599 HG2 GLN 71 HG2 GLN 71 0.958 9.980 6.606 600 HG3 GLN 71 HG3 GLN 71 2.426 9.349 5.881 601 HE21 GLN 71 HE21 GLN 71 2.039 11.745 3.293 602 HE22 GLN 71 HE22 GLN 71 3.135 10.852 4.348 603 H ALA 72 H ALA 72 -0.023 6.411 2.718 604 HA ALA 72 HA ALA 72 1.469 8.003 0.655 605 HB1 ALA 72 HB1 ALA 72 0.363 5.169 0.550 606 HB2 ALA 72 HB2 ALA 72 0.890 6.088 -0.872 607 HB3 ALA 72 HB3 ALA 72 2.047 5.683 0.400 608 HA PRO 73 HA PRO 73 -2.836 9.491 0.125 609 HB2 PRO 73 HB2 PRO 73 -1.371 11.745 -1.196 610 HB3 PRO 73 HB3 PRO 73 -2.722 11.806 -0.025 611 HG2 PRO 73 HG2 PRO 73 -0.183 12.382 0.752 612 HG3 PRO 73 HG3 PRO 73 -1.243 11.383 1.806 613 HD2 PRO 73 HD2 PRO 73 0.808 10.444 -0.217 614 HD3 PRO 73 HD3 PRO 73 0.681 9.978 1.513 615 H VAL 74 H VAL 74 -4.099 9.435 -1.713 616 HA VAL 74 HA VAL 74 -2.846 8.997 -4.389 617 HB VAL 74 HB VAL 74 -5.163 7.352 -3.286 618 HG11 VAL 74 HG11 VAL 74 -5.066 7.454 -5.713 619 HG12 VAL 74 HG12 VAL 74 -3.348 6.978 -5.705 620 HG13 VAL 74 HG13 VAL 74 -4.603 5.841 -5.174 621 HG21 VAL 74 HG21 VAL 74 -3.277 6.706 -1.918 622 HG22 VAL 74 HG22 VAL 74 -3.625 5.442 -3.095 623 HG23 VAL 74 HG23 VAL 74 -2.243 6.527 -3.350 624 H GLU 75 H GLU 75 -3.797 10.338 -5.892 625 HA GLU 75 HA GLU 75 -6.331 11.731 -5.173 626 HB2 GLU 75 HB2 GLU 75 -4.351 12.137 -7.446 627 HB3 GLU 75 HB3 GLU 75 -5.804 13.108 -7.179 628 HG2 GLU 75 HG2 GLU 75 -4.958 13.752 -4.924 629 HG3 GLU 75 HG3 GLU 75 -3.473 12.850 -5.230 630 H GLN 76 H GLN 76 -5.297 9.190 -7.284 631 HA GLN 76 HA GLN 76 -7.990 8.368 -7.724 632 HB2 GLN 76 HB2 GLN 76 -8.160 8.370 -10.079 633 HB3 GLN 76 HB3 GLN 76 -7.794 10.017 -9.616 634 HG2 GLN 76 HG2 GLN 76 -5.857 8.012 -10.856 635 HG3 GLN 76 HG3 GLN 76 -6.646 9.344 -11.671 636 HE21 GLN 76 HE21 GLN 76 -3.285 10.073 -9.466 637 HE22 GLN 76 HE22 GLN 76 -4.120 8.514 -9.323 638 H TYR 77 H TYR 77 -8.077 6.146 -8.299 639 HA TYR 77 HA TYR 77 -5.467 4.725 -8.438 640 HB2 TYR 77 HB2 TYR 77 -6.389 4.529 -6.211 641 HB3 TYR 77 HB3 TYR 77 -7.922 3.963 -6.869 642 HD1 TYR 77 HD1 TYR 77 -4.257 3.115 -6.999 643 HD2 TYR 77 HD2 TYR 77 -8.316 1.674 -6.987 644 HE1 TYR 77 HE1 TYR 77 -3.432 0.772 -7.147 645 HE2 TYR 77 HE2 TYR 77 -7.490 -0.672 -7.022 646 HH TYR 77 HH TYR 77 -3.984 -1.438 -7.200 647 HA PRO 78 HA PRO 78 -4.481 2.888 -9.505 648 HB2 PRO 78 HB2 PRO 78 -4.287 2.898 -12.504 649 HB3 PRO 78 HB3 PRO 78 -3.503 1.808 -11.317 650 HG2 PRO 78 HG2 PRO 78 -5.667 0.956 -12.691 651 HG3 PRO 78 HG3 PRO 78 -5.567 0.641 -10.925 652 HD2 PRO 78 HD2 PRO 78 -7.042 2.889 -12.346 653 HD3 PRO 78 HD3 PRO 78 -7.645 1.775 -11.081 654 H GLY 79 H GLY 79 -2.665 4.176 -9.480 655 HA2 GLY 79 HA2 GLY 79 -2.348 6.613 -11.079 656 HA3 GLY 79 HA3 GLY 79 -2.740 6.887 -9.380 657 H ILE 80 H ILE 80 -0.596 8.011 -9.505 658 HA ILE 80 HA ILE 80 1.820 6.511 -9.950 659 HB ILE 80 HB ILE 80 1.673 8.896 -10.370 660 HG12 ILE 80 HG12 ILE 80 3.701 9.749 -9.283 661 HG13 ILE 80 HG13 ILE 80 3.678 8.428 -8.120 662 HG21 ILE 80 HG21 ILE 80 1.570 10.587 -8.604 663 HG22 ILE 80 HG22 ILE 80 0.125 9.584 -8.546 664 HG23 ILE 80 HG23 ILE 80 1.427 9.339 -7.359 665 HD11 ILE 80 HD11 ILE 80 4.102 6.803 -9.927 666 HD12 ILE 80 HD12 ILE 80 4.005 8.109 -11.136 667 HD13 ILE 80 HD13 ILE 80 5.316 8.090 -9.938 668 H ALA 81 H ALA 81 -0.024 7.101 -7.024 669 HA ALA 81 HA ALA 81 2.210 6.414 -5.243 670 HB1 ALA 81 HB1 ALA 81 0.771 8.310 -4.756 671 HB2 ALA 81 HB2 ALA 81 -0.662 7.264 -4.753 672 HB3 ALA 81 HB3 ALA 81 0.587 7.076 -3.497 673 H VAL 82 H VAL 82 0.418 4.344 -6.991 674 HA VAL 82 HA VAL 82 0.631 2.192 -5.003 675 HB VAL 82 HB VAL 82 -2.021 2.643 -6.366 676 HG11 VAL 82 HG11 VAL 82 -1.151 0.771 -4.111 677 HG12 VAL 82 HG12 VAL 82 -2.812 0.935 -4.699 678 HG13 VAL 82 HG13 VAL 82 -1.559 0.289 -5.762 679 HG21 VAL 82 HG21 VAL 82 -1.910 4.436 -4.763 680 HG22 VAL 82 HG22 VAL 82 -3.035 3.204 -4.203 681 HG23 VAL 82 HG23 VAL 82 -1.422 3.316 -3.473 682 H GLU 83 H GLU 83 1.209 0.318 -5.979 683 HA GLU 83 HA GLU 83 0.489 -0.245 -8.807 684 HB2 GLU 83 HB2 GLU 83 3.350 -0.072 -7.786 685 HB3 GLU 83 HB3 GLU 83 2.902 -1.100 -9.145 686 HG2 GLU 83 HG2 GLU 83 1.859 0.936 -10.235 687 HG3 GLU 83 HG3 GLU 83 2.657 1.918 -8.994 688 H THR 84 H THR 84 0.878 -2.446 -9.464 689 HA THR 84 HA THR 84 0.567 -4.497 -7.286 690 HB THR 84 HB THR 84 -0.528 -5.833 -9.040 691 HG1 THR 84 HG1 THR 84 0.294 -5.092 -10.934 692 HG21 THR 84 HG21 THR 84 -1.751 -3.039 -8.890 693 HG22 THR 84 HG22 THR 84 -2.592 -4.560 -9.268 694 HG23 THR 84 HG23 THR 84 -1.909 -4.308 -7.656 695 H VAL 85 H VAL 85 1.549 -6.593 -7.679 696 HA VAL 85 HA VAL 85 4.047 -6.554 -9.252 697 HB VAL 85 HB VAL 85 4.507 -8.702 -8.234 698 HG11 VAL 85 HG11 VAL 85 3.561 -6.716 -6.127 699 HG12 VAL 85 HG12 VAL 85 4.790 -7.969 -5.928 700 HG13 VAL 85 HG13 VAL 85 5.088 -6.614 -7.027 701 HG21 VAL 85 HG21 VAL 85 2.169 -9.568 -8.081 702 HG22 VAL 85 HG22 VAL 85 3.061 -9.706 -6.572 703 HG23 VAL 85 HG23 VAL 85 1.851 -8.425 -6.765 704 H THR 86 H THR 86 4.446 -8.623 -10.550 705 HA THR 86 HA THR 86 2.197 -9.147 -12.391 706 HB THR 86 HB THR 86 3.916 -10.103 -13.831 707 HG1 THR 86 HG1 THR 86 6.059 -10.107 -13.143 708 HG21 THR 86 HG21 THR 86 5.300 -8.121 -14.198 709 HG22 THR 86 HG22 THR 86 3.643 -7.616 -13.782 710 HG23 THR 86 HG23 THR 86 4.934 -7.522 -12.569 711 H ASP 87 H ASP 87 4.125 -10.898 -10.030 712 HA ASP 87 HA ASP 87 3.378 -13.495 -11.141 713 HB2 ASP 87 HB2 ASP 87 5.687 -12.877 -10.440 714 HB3 ASP 87 HB3 ASP 87 5.127 -12.821 -8.764 715 H SER 88 H SER 88 2.762 -11.795 -8.051 716 HA SER 88 HA SER 88 0.729 -13.909 -7.360 717 HB2 SER 88 HB2 SER 88 2.861 -14.416 -6.235 718 HB3 SER 88 HB3 SER 88 2.844 -12.813 -5.488 719 HG SER 88 HG SER 88 1.104 -15.018 -5.065 720 H SER 89 H SER 89 -1.214 -13.052 -7.032 721 HA SER 89 HA SER 89 -1.590 -10.218 -6.844 722 HB2 SER 89 HB2 SER 89 -4.034 -10.870 -6.947 723 HB3 SER 89 HB3 SER 89 -2.996 -11.411 -8.271 724 HG SER 89 HG SER 89 -4.297 -13.120 -7.580 725 H ARG 90 H ARG 90 -0.330 -11.284 -4.480 726 HA ARG 90 HA ARG 90 -2.083 -10.047 -2.436 727 HB2 ARG 90 HB2 ARG 90 -1.215 -11.603 -0.704 728 HB3 ARG 90 HB3 ARG 90 -2.340 -12.261 -1.872 729 HG2 ARG 90 HG2 ARG 90 -0.621 -13.408 -3.076 730 HG3 ARG 90 HG3 ARG 90 0.667 -12.600 -2.170 731 HD2 ARG 90 HD2 ARG 90 -1.401 -14.360 -0.804 732 HD3 ARG 90 HD3 ARG 90 0.029 -15.042 -1.569 733 HE ARG 90 HE ARG 90 0.091 -13.062 0.702 734 HH11 ARG 90 HH11 ARG 90 1.650 -13.188 2.115 735 HH12 ARG 90 HH12 ARG 90 2.956 -14.352 1.960 736 HH21 ARG 90 HH21 ARG 90 1.675 -15.763 -0.907 737 HH22 ARG 90 HH22 ARG 90 2.913 -15.839 0.316 738 H TYR 91 H TYR 91 0.073 -8.911 -4.126 739 HA TYR 91 HA TYR 91 1.623 -7.669 -1.938 740 HB2 TYR 91 HB2 TYR 91 2.752 -8.837 -4.500 741 HB3 TYR 91 HB3 TYR 91 3.639 -7.807 -3.408 742 HD1 TYR 91 HD1 TYR 91 2.371 -11.183 -4.013 743 HD2 TYR 91 HD2 TYR 91 4.307 -8.618 -1.147 744 HE1 TYR 91 HE1 TYR 91 3.130 -13.181 -2.755 745 HE2 TYR 91 HE2 TYR 91 5.022 -10.625 0.154 746 HH TYR 91 HH TYR 91 4.324 -13.957 -0.957 747 H PHE 92 H PHE 92 2.008 -5.504 -2.231 748 HA PHE 92 HA PHE 92 1.408 -4.222 -4.850 749 HB2 PHE 92 HB2 PHE 92 0.303 -3.284 -2.172 750 HB3 PHE 92 HB3 PHE 92 0.151 -2.437 -3.700 751 HD1 PHE 92 HD1 PHE 92 -1.132 -5.125 -1.619 752 HD2 PHE 92 HD2 PHE 92 -1.271 -3.368 -5.540 753 HE1 PHE 92 HE1 PHE 92 -3.212 -6.360 -2.078 754 HE2 PHE 92 HE2 PHE 92 -3.343 -4.683 -6.040 755 HZ PHE 92 HZ PHE 92 -4.307 -6.181 -4.324 756 H VAL 93 H VAL 93 2.279 -2.073 -4.999 757 HA VAL 93 HA VAL 93 4.363 -1.369 -2.977 758 HB VAL 93 HB VAL 93 4.401 -0.904 -5.969 759 HG11 VAL 93 HG11 VAL 93 6.267 0.319 -3.895 760 HG12 VAL 93 HG12 VAL 93 6.493 0.357 -5.656 761 HG13 VAL 93 HG13 VAL 93 5.120 1.194 -4.939 762 HG21 VAL 93 HG21 VAL 93 5.248 -3.038 -5.266 763 HG22 VAL 93 HG22 VAL 93 6.629 -2.038 -5.723 764 HG23 VAL 93 HG23 VAL 93 6.273 -2.296 -4.014 765 H ILE 94 H ILE 94 4.295 0.741 -2.184 766 HA ILE 94 HA ILE 94 2.423 2.574 -3.529 767 HB ILE 94 HB ILE 94 1.554 3.503 -1.516 768 HG12 ILE 94 HG12 ILE 94 3.350 2.626 0.080 769 HG13 ILE 94 HG13 ILE 94 1.695 2.688 0.652 770 HG21 ILE 94 HG21 ILE 94 0.813 0.582 -1.834 771 HG22 ILE 94 HG22 ILE 94 -0.160 1.839 -1.032 772 HG23 ILE 94 HG23 ILE 94 0.212 1.962 -2.755 773 HD11 ILE 94 HD11 ILE 94 3.105 0.142 -0.268 774 HD12 ILE 94 HD12 ILE 94 2.847 0.666 1.405 775 HD13 ILE 94 HD13 ILE 94 1.459 0.263 0.390 776 H ARG 95 H ARG 95 2.862 4.729 -3.384 777 HA ARG 95 HA ARG 95 5.683 5.394 -2.623 778 HB2 ARG 95 HB2 ARG 95 4.730 6.048 -4.911 779 HB3 ARG 95 HB3 ARG 95 3.798 7.275 -4.049 780 HG2 ARG 95 HG2 ARG 95 5.950 8.131 -3.045 781 HG3 ARG 95 HG3 ARG 95 6.833 6.951 -4.030 782 HD2 ARG 95 HD2 ARG 95 5.884 7.982 -6.081 783 HD3 ARG 95 HD3 ARG 95 5.051 9.189 -5.088 784 HE ARG 95 HE ARG 95 7.658 9.477 -4.273 785 HH11 ARG 95 HH11 ARG 95 9.150 10.774 -5.038 786 HH12 ARG 95 HH12 ARG 95 9.167 11.277 -6.716 787 HH21 ARG 95 HH21 ARG 95 6.277 9.567 -7.500 788 HH22 ARG 95 HH22 ARG 95 7.550 10.600 -8.089 789 H ILE 96 H ILE 96 5.788 5.677 -0.528 790 HA ILE 96 HA ILE 96 3.720 7.196 0.953 791 HB ILE 96 HB ILE 96 4.827 6.582 2.985 792 HG12 ILE 96 HG12 ILE 96 6.659 4.649 2.709 793 HG13 ILE 96 HG13 ILE 96 7.040 5.504 1.230 794 HG21 ILE 96 HG21 ILE 96 4.449 4.192 1.171 795 HG22 ILE 96 HG22 ILE 96 4.454 4.153 2.938 796 HG23 ILE 96 HG23 ILE 96 3.188 5.038 2.111 797 HD11 ILE 96 HD11 ILE 96 7.032 6.661 4.055 798 HD12 ILE 96 HD12 ILE 96 8.460 6.175 3.126 799 HD13 ILE 96 HD13 ILE 96 7.500 7.560 2.586 800 H GLN 97 H GLN 97 4.205 9.014 2.261 801 HA GLN 97 HA GLN 97 6.654 10.550 1.503 802 HB2 GLN 97 HB2 GLN 97 3.806 11.625 1.664 803 HB3 GLN 97 HB3 GLN 97 5.256 12.619 1.630 804 HG2 GLN 97 HG2 GLN 97 4.481 12.642 -0.578 805 HG3 GLN 97 HG3 GLN 97 5.881 11.586 -0.570 806 HE21 GLN 97 HE21 GLN 97 3.631 9.587 -2.570 807 HE22 GLN 97 HE22 GLN 97 4.866 10.840 -2.725 808 H ASP 98 H ASP 98 7.569 11.838 3.006 809 HA ASP 98 HA ASP 98 6.901 11.216 5.823 810 HB2 ASP 98 HB2 ASP 98 9.163 10.814 4.777 811 HB3 ASP 98 HB3 ASP 98 9.349 12.562 4.665 812 H GLY 99 H GLY 99 5.581 13.392 4.026 813 HA2 GLY 99 HA2 GLY 99 4.338 15.263 4.550 814 HA3 GLY 99 HA3 GLY 99 5.009 15.235 6.179 815 H THR 100 H THR 100 7.559 15.338 4.021 816 HA THR 100 HA THR 100 7.769 18.327 4.077 817 HB THR 100 HB THR 100 8.992 17.130 5.878 818 HG1 THR 100 HG1 THR 100 10.830 18.353 5.649 819 HG21 THR 100 HG21 THR 100 9.764 15.139 4.640 820 HG22 THR 100 HG22 THR 100 10.832 16.165 3.647 821 HG23 THR 100 HG23 THR 100 11.103 16.008 5.394 822 H GLY 101 H GLY 101 7.327 16.013 1.900 823 HA2 GLY 101 HA2 GLY 101 7.479 16.283 -0.453 824 HA3 GLY 101 HA3 GLY 101 8.849 17.377 -0.267 825 H ARG 102 H ARG 102 9.579 14.969 1.775 826 HA ARG 102 HA ARG 102 11.305 13.348 0.072 827 HB2 ARG 102 HB2 ARG 102 12.090 14.003 2.251 828 HB3 ARG 102 HB3 ARG 102 10.576 13.518 3.018 829 HG2 ARG 102 HG2 ARG 102 11.064 11.151 2.534 830 HG3 ARG 102 HG3 ARG 102 12.617 11.634 1.801 831 HD2 ARG 102 HD2 ARG 102 13.247 12.685 3.996 832 HD3 ARG 102 HD3 ARG 102 11.705 12.139 4.664 833 HE ARG 102 HE ARG 102 13.582 10.125 3.522 834 HH11 ARG 102 HH11 ARG 102 14.361 8.523 4.811 835 HH12 ARG 102 HH12 ARG 102 13.991 8.504 6.509 836 HH21 ARG 102 HH21 ARG 102 12.039 11.327 6.491 837 HH22 ARG 102 HH22 ARG 102 12.773 10.056 7.427 838 H SER 103 H SER 103 10.792 11.471 -0.702 839 HA SER 103 HA SER 103 8.430 9.940 0.219 840 HB2 SER 103 HB2 SER 103 7.531 9.605 -1.988 841 HB3 SER 103 HB3 SER 103 7.670 11.347 -1.688 842 HG SER 103 HG SER 103 9.632 11.322 -2.878 843 H ALA 104 H ALA 104 8.288 7.749 -0.507 844 HA ALA 104 HA ALA 104 10.613 6.533 -1.842 845 HB1 ALA 104 HB1 ALA 104 9.716 5.665 0.945 846 HB2 ALA 104 HB2 ALA 104 10.918 4.836 -0.067 847 HB3 ALA 104 HB3 ALA 104 11.256 6.465 0.551 848 H PHE 105 H PHE 105 10.107 4.649 -2.926 849 HA PHE 105 HA PHE 105 7.275 3.711 -2.918 850 HB2 PHE 105 HB2 PHE 105 9.631 3.113 -4.727 851 HB3 PHE 105 HB3 PHE 105 8.148 2.182 -4.732 852 HD1 PHE 105 HD1 PHE 105 9.673 5.379 -5.734 853 HD2 PHE 105 HD2 PHE 105 6.007 3.129 -5.494 854 HE1 PHE 105 HE1 PHE 105 8.631 6.882 -7.417 855 HE2 PHE 105 HE2 PHE 105 4.971 4.609 -7.190 856 HZ PHE 105 HZ PHE 105 6.292 6.480 -8.169 857 H ILE 106 H ILE 106 6.746 2.178 -1.516 858 HA ILE 106 HA ILE 106 8.805 0.186 -0.638 859 HB ILE 106 HB ILE 106 7.846 0.066 1.523 860 HG12 ILE 106 HG12 ILE 106 5.893 2.290 0.787 861 HG13 ILE 106 HG13 ILE 106 5.459 0.590 0.967 862 HG21 ILE 106 HG21 ILE 106 8.283 3.001 0.865 863 HG22 ILE 106 HG22 ILE 106 8.643 2.171 2.396 864 HG23 ILE 106 HG23 ILE 106 9.590 1.794 0.947 865 HD11 ILE 106 HD11 ILE 106 4.853 1.732 2.983 866 HD12 ILE 106 HD12 ILE 106 6.190 0.625 3.332 867 HD13 ILE 106 HD13 ILE 106 6.490 2.371 3.197 868 H GLY 107 H GLY 107 8.215 -1.957 -0.393 869 HA2 GLY 107 HA2 GLY 107 5.782 -2.785 -1.902 870 HA3 GLY 107 HA3 GLY 107 7.191 -3.783 -1.547 871 H ILE 108 H ILE 108 4.157 -3.853 -0.915 872 HA ILE 108 HA ILE 108 4.497 -4.763 1.872 873 HB ILE 108 HB ILE 108 2.199 -4.201 2.399 874 HG12 ILE 108 HG12 ILE 108 2.142 -2.440 -0.090 875 HG13 ILE 108 HG13 ILE 108 1.317 -3.994 0.032 876 HG21 ILE 108 HG21 ILE 108 4.089 -2.834 3.088 877 HG22 ILE 108 HG22 ILE 108 3.920 -1.812 1.642 878 HG23 ILE 108 HG23 ILE 108 2.641 -1.847 2.873 879 HD11 ILE 108 HD11 ILE 108 -0.283 -2.249 0.475 880 HD12 ILE 108 HD12 ILE 108 0.000 -3.147 1.979 881 HD13 ILE 108 HD13 ILE 108 0.726 -1.546 1.747 882 H GLY 109 H GLY 109 3.724 -6.678 2.422 883 HA2 GLY 109 HA2 GLY 109 2.341 -8.330 0.328 884 HA3 GLY 109 HA3 GLY 109 3.552 -8.961 1.429 885 H PHE 110 H PHE 110 0.644 -9.503 0.839 886 HA PHE 110 HA PHE 110 -0.647 -9.135 3.491 887 HB2 PHE 110 HB2 PHE 110 -1.670 -9.797 0.706 888 HB3 PHE 110 HB3 PHE 110 -2.666 -9.955 2.138 889 HD1 PHE 110 HD1 PHE 110 -0.424 -7.367 0.495 890 HD2 PHE 110 HD2 PHE 110 -4.017 -8.174 2.752 891 HE1 PHE 110 HE1 PHE 110 -0.912 -4.951 0.592 892 HE2 PHE 110 HE2 PHE 110 -4.573 -5.763 2.706 893 HZ PHE 110 HZ PHE 110 -2.988 -4.143 1.665 894 H THR 111 H THR 111 -1.863 -10.913 4.415 895 HA THR 111 HA THR 111 -0.315 -13.352 4.533 896 HB THR 111 HB THR 111 -1.503 -12.319 6.450 897 HG1 THR 111 HG1 THR 111 -0.921 -14.419 6.678 898 HG21 THR 111 HG21 THR 111 -3.668 -11.738 5.374 899 HG22 THR 111 HG22 THR 111 -4.053 -13.469 5.254 900 HG23 THR 111 HG23 THR 111 -3.862 -12.705 6.840 901 H ASP 112 H ASP 112 -3.116 -12.396 2.642 902 HA ASP 112 HA ASP 112 -2.995 -14.863 1.129 903 HB2 ASP 112 HB2 ASP 112 -4.460 -15.446 3.129 904 HB3 ASP 112 HB3 ASP 112 -5.589 -14.204 2.591 905 H ARG 113 H ARG 113 -4.255 -14.799 -0.811 906 HA ARG 113 HA ARG 113 -4.483 -12.293 -2.171 907 HB2 ARG 113 HB2 ARG 113 -4.146 -14.548 -3.162 908 HB3 ARG 113 HB3 ARG 113 -5.807 -14.980 -2.771 909 HG2 ARG 113 HG2 ARG 113 -5.110 -12.544 -4.444 910 HG3 ARG 113 HG3 ARG 113 -5.151 -14.157 -5.162 911 HD2 ARG 113 HD2 ARG 113 -7.497 -12.661 -3.955 912 HD3 ARG 113 HD3 ARG 113 -7.192 -13.015 -5.655 913 HE ARG 113 HE ARG 113 -7.285 -15.502 -4.364 914 HH11 ARG 113 HH11 ARG 113 -9.121 -16.773 -4.277 915 HH12 ARG 113 HH12 ARG 113 -10.682 -16.063 -4.561 916 HH21 ARG 113 HH21 ARG 113 -9.500 -12.876 -5.049 917 HH22 ARG 113 HH22 ARG 113 -10.901 -13.912 -4.971 918 H GLY 114 H GLY 114 -6.932 -14.165 -0.374 919 HA2 GLY 114 HA2 GLY 114 -9.209 -12.586 -1.100 920 HA3 GLY 114 HA3 GLY 114 -9.040 -13.621 0.321 921 H ASP 115 H ASP 115 -6.535 -11.651 0.842 922 HA ASP 115 HA ASP 115 -8.139 -9.565 2.292 923 HB2 ASP 115 HB2 ASP 115 -5.401 -10.741 2.885 924 HB3 ASP 115 HB3 ASP 115 -6.068 -9.321 3.686 925 H ALA 116 H ALA 116 -5.308 -10.047 0.154 926 HA ALA 116 HA ALA 116 -4.816 -7.285 -0.452 927 HB1 ALA 116 HB1 ALA 116 -3.290 -9.019 -1.034 928 HB2 ALA 116 HB2 ALA 116 -4.518 -9.907 -1.973 929 HB3 ALA 116 HB3 ALA 116 -3.906 -8.367 -2.573 930 H PHE 117 H PHE 117 -7.258 -9.590 -1.595 931 HA PHE 117 HA PHE 117 -8.497 -7.825 -3.501 932 HB2 PHE 117 HB2 PHE 117 -9.131 -10.466 -2.307 933 HB3 PHE 117 HB3 PHE 117 -10.497 -9.526 -2.851 934 HD1 PHE 117 HD1 PHE 117 -11.254 -10.191 -4.933 935 HD2 PHE 117 HD2 PHE 117 -6.996 -9.993 -4.247 936 HE1 PHE 117 HE1 PHE 117 -10.837 -10.799 -7.304 937 HE2 PHE 117 HE2 PHE 117 -6.589 -10.554 -6.623 938 HZ PHE 117 HZ PHE 117 -8.505 -10.974 -8.155 939 H ASP 118 H ASP 118 -8.474 -7.415 -0.121 940 HA ASP 118 HA ASP 118 -10.876 -5.639 -0.341 941 HB2 ASP 118 HB2 ASP 118 -9.217 -6.526 2.037 942 HB3 ASP 118 HB3 ASP 118 -10.353 -5.183 2.098 943 H PHE 119 H PHE 119 -7.305 -5.496 -0.009 944 HA PHE 119 HA PHE 119 -7.010 -2.724 0.392 945 HB2 PHE 119 HB2 PHE 119 -5.164 -4.252 0.565 946 HB3 PHE 119 HB3 PHE 119 -5.296 -4.728 -1.116 947 HD1 PHE 119 HD1 PHE 119 -4.553 -3.224 -2.953 948 HD2 PHE 119 HD2 PHE 119 -3.990 -2.187 1.185 949 HE1 PHE 119 HE1 PHE 119 -2.978 -1.433 -3.615 950 HE2 PHE 119 HE2 PHE 119 -2.426 -0.394 0.525 951 HZ PHE 119 HZ PHE 119 -1.908 -0.007 -1.880 952 H ASN 120 H ASN 120 -7.029 -4.403 -2.786 953 HA ASN 120 HA ASN 120 -6.945 -1.838 -4.151 954 HB2 ASN 120 HB2 ASN 120 -6.713 -3.028 -6.142 955 HB3 ASN 120 HB3 ASN 120 -5.853 -4.003 -4.957 956 HD21 ASN 120 HD21 ASN 120 -8.183 -6.722 -5.357 957 HD22 ASN 120 HD22 ASN 120 -7.014 -6.062 -4.217 958 H VAL 121 H VAL 121 -9.588 -3.972 -3.262 959 HA VAL 121 HA VAL 121 -11.466 -2.747 -5.130 960 HB VAL 121 HB VAL 121 -11.895 -4.697 -2.854 961 HG11 VAL 121 HG11 VAL 121 -13.992 -3.467 -3.188 962 HG12 VAL 121 HG12 VAL 121 -13.874 -3.691 -4.949 963 HG13 VAL 121 HG13 VAL 121 -14.138 -5.083 -3.874 964 HG21 VAL 121 HG21 VAL 121 -11.914 -5.023 -5.898 965 HG22 VAL 121 HG22 VAL 121 -10.643 -5.604 -4.802 966 HG23 VAL 121 HG23 VAL 121 -12.258 -6.303 -4.712 967 H SER 122 H SER 122 -10.763 -2.404 -1.615 968 HA SER 122 HA SER 122 -12.845 -0.476 -1.140 969 HB2 SER 122 HB2 SER 122 -11.700 0.010 0.907 970 HB3 SER 122 HB3 SER 122 -11.684 -1.741 0.643 971 HG SER 122 HG SER 122 -9.590 -1.679 0.110 972 H LEU 123 H LEU 123 -9.488 -0.114 -2.293 973 HA LEU 123 HA LEU 123 -9.495 2.755 -2.401 974 HB2 LEU 123 HB2 LEU 123 -7.920 0.589 -3.825 975 HB3 LEU 123 HB3 LEU 123 -7.688 2.290 -4.219 976 HG LEU 123 HG LEU 123 -7.344 1.183 -1.405 977 HD11 LEU 123 HD11 LEU 123 -5.699 0.202 -2.977 978 HD12 LEU 123 HD12 LEU 123 -5.246 1.830 -3.526 979 HD13 LEU 123 HD13 LEU 123 -4.931 1.320 -1.848 980 HD21 LEU 123 HD21 LEU 123 -6.536 3.835 -2.693 981 HD22 LEU 123 HD22 LEU 123 -7.791 3.613 -1.455 982 HD23 LEU 123 HD23 LEU 123 -6.109 3.307 -1.048 983 H GLN 124 H GLN 124 -10.123 0.402 -5.106 984 HA GLN 124 HA GLN 124 -10.725 2.514 -6.917 985 HB2 GLN 124 HB2 GLN 124 -11.322 0.872 -8.484 986 HB3 GLN 124 HB3 GLN 124 -10.043 0.173 -7.492 987 HG2 GLN 124 HG2 GLN 124 -11.892 -0.964 -6.154 988 HG3 GLN 124 HG3 GLN 124 -13.009 -0.483 -7.429 989 HE21 GLN 124 HE21 GLN 124 -10.156 -3.400 -8.142 990 HE22 GLN 124 HE22 GLN 124 -9.919 -2.236 -6.846 991 H ASP 125 H ASP 125 -12.818 0.972 -4.543 992 HA ASP 125 HA ASP 125 -15.271 2.048 -5.669 993 HB2 ASP 125 HB2 ASP 125 -15.150 -0.095 -4.411 994 HB3 ASP 125 HB3 ASP 125 -14.692 0.796 -2.954 995 H HIS 126 H HIS 126 -12.717 3.493 -3.900 996 HA HIS 126 HA HIS 126 -14.479 5.630 -2.874 997 HB2 HIS 126 HB2 HIS 126 -12.428 4.903 -1.600 998 HB3 HIS 126 HB3 HIS 126 -11.446 5.611 -2.891 999 HD2 HIS 126 HD2 HIS 126 -11.011 8.213 -2.716 1000 HE1 HIS 126 HE1 HIS 126 -13.987 9.238 0.165 1001 HE2 HIS 126 HE2 HIS 126 -12.053 10.130 -1.193 1002 H PHE 127 H PHE 127 -12.916 4.807 -5.810 1003 HA PHE 127 HA PHE 127 -12.984 7.637 -6.741 1004 HB2 PHE 127 HB2 PHE 127 -11.251 5.312 -7.598 1005 HB3 PHE 127 HB3 PHE 127 -11.269 6.886 -8.386 1006 HD1 PHE 127 HD1 PHE 127 -9.600 5.002 -5.917 1007 HD2 PHE 127 HD2 PHE 127 -11.049 8.981 -6.702 1008 HE1 PHE 127 HE1 PHE 127 -7.933 5.917 -4.328 1009 HE2 PHE 127 HE2 PHE 127 -9.379 9.896 -5.116 1010 HZ PHE 127 HZ PHE 127 -7.825 8.372 -3.932 1011 H LYS 128 H LYS 128 -14.709 4.730 -7.304 1012 HA LYS 128 HA LYS 128 -15.189 4.874 -10.022 1013 HB2 LYS 128 HB2 LYS 128 -16.967 3.469 -9.823 1014 HB3 LYS 128 HB3 LYS 128 -15.952 3.057 -8.456 1015 HG2 LYS 128 HG2 LYS 128 -18.460 4.820 -8.295 1016 HG3 LYS 128 HG3 LYS 128 -18.429 3.077 -8.033 1017 HD2 LYS 128 HD2 LYS 128 -16.883 3.362 -6.149 1018 HD3 LYS 128 HD3 LYS 128 -16.872 5.109 -6.392 1019 HE2 LYS 128 HE2 LYS 128 -18.359 4.738 -4.618 1020 HE3 LYS 128 HE3 LYS 128 -19.374 5.101 -6.024 1021 HZ1 LYS 128 HZ1 LYS 128 -20.155 3.157 -4.711 1022 HZ2 LYS 128 HZ2 LYS 128 -19.791 2.706 -6.239 1023 HZ3 LYS 128 HZ3 LYS 128 -18.755 2.361 -5.018 1024 H TRP 129 H TRP 129 -16.446 7.116 -7.726 1025 HA TRP 129 HA TRP 129 -18.364 8.331 -9.640 1026 HB2 TRP 129 HB2 TRP 129 -19.104 9.630 -7.763 1027 HB3 TRP 129 HB3 TRP 129 -19.025 7.941 -7.289 1028 HD1 TRP 129 HD1 TRP 129 -16.878 7.249 -5.699 1029 HE1 TRP 129 HE1 TRP 129 -15.378 8.586 -4.148 1030 HE3 TRP 129 HE3 TRP 129 -18.341 11.984 -7.019 1031 HZ2 TRP 129 HZ2 TRP 129 -15.164 11.329 -3.233 1032 HZ3 TRP 129 HZ3 TRP 129 -17.511 13.943 -5.738 1033 HH2 TRP 129 HH2 TRP 129 -15.931 13.632 -3.843 1034 H VAL 130 H VAL 130 -15.095 8.821 -8.542 1035 HA VAL 130 HA VAL 130 -14.990 11.708 -8.962 1036 HB VAL 130 HB VAL 130 -12.747 9.683 -8.552 1037 HG11 VAL 130 HG11 VAL 130 -12.744 12.721 -8.297 1038 HG12 VAL 130 HG12 VAL 130 -11.428 11.647 -7.775 1039 HG13 VAL 130 HG13 VAL 130 -11.833 11.760 -9.484 1040 HG21 VAL 130 HG21 VAL 130 -14.236 9.692 -6.618 1041 HG22 VAL 130 HG22 VAL 130 -12.765 10.563 -6.196 1042 HG23 VAL 130 HG23 VAL 130 -14.243 11.467 -6.585 1043 H LYS 131 H LYS 131 -14.270 8.847 -10.889 1044 HA LYS 131 HA LYS 131 -13.098 10.486 -13.080 1045 HB2 LYS 131 HB2 LYS 131 -13.053 7.485 -12.568 1046 HB3 LYS 131 HB3 LYS 131 -12.309 8.269 -13.953 1047 HG2 LYS 131 HG2 LYS 131 -11.534 8.651 -11.028 1048 HG3 LYS 131 HG3 LYS 131 -10.635 7.758 -12.247 1049 HD2 LYS 131 HD2 LYS 131 -11.118 10.773 -12.252 1050 HD3 LYS 131 HD3 LYS 131 -9.628 9.964 -11.782 1051 HE2 LYS 131 HE2 LYS 131 -9.212 9.160 -14.003 1052 HE3 LYS 131 HE3 LYS 131 -10.835 9.594 -14.551 1053 HZ1 LYS 131 HZ1 LYS 131 -8.858 11.620 -13.680 1054 HZ2 LYS 131 HZ2 LYS 131 -9.124 11.207 -15.241 1055 HZ3 LYS 131 HZ3 LYS 131 -10.327 11.890 -14.381 1056 H GLN 132 H GLN 132 -15.957 10.409 -12.446 1057 HA GLN 132 HA GLN 132 -17.104 9.358 -14.960 1058 HB2 GLN 132 HB2 GLN 132 -18.421 10.816 -12.648 1059 HB3 GLN 132 HB3 GLN 132 -19.238 10.215 -14.095 1060 HG2 GLN 132 HG2 GLN 132 -17.746 8.504 -12.057 1061 HG3 GLN 132 HG3 GLN 132 -19.491 8.697 -12.124 1062 HE21 GLN 132 HE21 GLN 132 -18.389 5.522 -13.912 1063 HE22 GLN 132 HE22 GLN 132 -17.933 6.204 -12.345 1064 H GLU 133 H GLU 133 -16.117 10.530 -16.460 1065 HA GLU 133 HA GLU 133 -16.509 13.495 -16.642 1066 HB2 GLU 133 HB2 GLU 133 -13.885 11.990 -17.004 1067 HB3 GLU 133 HB3 GLU 133 -14.158 13.687 -17.411 1068 HG2 GLU 133 HG2 GLU 133 -14.718 14.154 -15.016 1069 HG3 GLU 133 HG3 GLU 133 -14.333 12.477 -14.616 Start of MODEL 12 1 H1 GLY -4 H1 GLY -4 -1.100 35.433 11.002 2 H2 GLY -4 H2 GLY -4 -0.643 35.127 12.546 3 H3 GLY -4 H3 GLY -4 -1.757 36.288 12.233 4 HA2 GLY -4 HA2 GLY -4 -2.127 33.400 11.771 5 HA3 GLY -4 HA3 GLY -4 -2.829 34.318 13.116 6 H SER -3 H SER -3 -4.380 32.824 11.304 7 HA SER -3 HA SER -3 -5.469 34.322 9.156 8 HB2 SER -3 HB2 SER -3 -6.749 32.092 10.769 9 HB3 SER -3 HB3 SER -3 -7.269 32.665 9.171 10 HG SER -3 HG SER -3 -5.900 30.823 9.023 11 HA PRO -2 HA PRO -2 -8.387 37.056 11.249 12 HB2 PRO -2 HB2 PRO -2 -10.118 36.662 8.816 13 HB3 PRO -2 HB3 PRO -2 -9.600 38.185 9.600 14 HG2 PRO -2 HG2 PRO -2 -8.423 37.368 7.304 15 HG3 PRO -2 HG3 PRO -2 -7.415 38.020 8.640 16 HD2 PRO -2 HD2 PRO -2 -7.953 35.112 7.945 17 HD3 PRO -2 HD3 PRO -2 -6.400 35.935 8.288 18 H ASN -1 H ASN -1 -9.422 33.970 9.943 19 HA ASN -1 HA ASN -1 -12.013 33.892 11.307 20 HB2 ASN -1 HB2 ASN -1 -10.466 31.815 9.699 21 HB3 ASN -1 HB3 ASN -1 -12.112 31.605 10.295 22 HD21 ASN -1 HD21 ASN -1 -11.587 33.552 6.833 23 HD22 ASN -1 HD22 ASN -1 -10.286 32.682 7.625 24 H SER 0 H SER 0 -12.618 32.050 12.709 25 HA SER 0 HA SER 0 -10.903 31.934 15.025 26 HB2 SER 0 HB2 SER 0 -12.799 30.649 15.995 27 HB3 SER 0 HB3 SER 0 -13.280 32.187 15.263 28 HG SER 0 HG SER 0 -14.672 30.446 14.660 29 H MET 1 H MET 1 -10.733 30.014 12.299 30 HA MET 1 HA MET 1 -10.347 27.400 13.310 31 HB2 MET 1 HB2 MET 1 -9.218 26.974 11.168 32 HB3 MET 1 HB3 MET 1 -10.743 27.834 10.966 33 HG2 MET 1 HG2 MET 1 -9.487 29.965 10.675 34 HG3 MET 1 HG3 MET 1 -7.973 29.101 10.916 35 HE1 MET 1 HE1 MET 1 -11.140 27.913 8.695 36 HE2 MET 1 HE2 MET 1 -11.057 29.684 8.547 37 HE3 MET 1 HE3 MET 1 -10.669 28.652 7.154 38 H ALA 2 H ALA 2 -8.528 26.203 13.680 39 HA ALA 2 HA ALA 2 -5.866 27.401 13.926 40 HB1 ALA 2 HB1 ALA 2 -5.598 26.884 16.343 41 HB2 ALA 2 HB2 ALA 2 -6.821 28.136 16.069 42 HB3 ALA 2 HB3 ALA 2 -7.325 26.477 16.450 43 H THR 3 H THR 3 -7.733 24.598 15.167 44 HA THR 3 HA THR 3 -6.482 22.773 13.284 45 HB THR 3 HB THR 3 -6.017 22.326 16.267 46 HG1 THR 3 HG1 THR 3 -4.549 23.574 14.631 47 HG21 THR 3 HG21 THR 3 -4.859 20.234 15.494 48 HG22 THR 3 HG22 THR 3 -6.605 20.186 15.230 49 HG23 THR 3 HG23 THR 3 -5.516 20.512 13.862 50 H GLU 4 H GLU 4 -8.236 21.850 12.523 51 HA GLU 4 HA GLU 4 -10.270 20.622 14.286 52 HB2 GLU 4 HB2 GLU 4 -12.110 21.772 13.106 53 HB3 GLU 4 HB3 GLU 4 -11.119 22.855 14.052 54 HG2 GLU 4 HG2 GLU 4 -10.869 22.512 11.032 55 HG3 GLU 4 HG3 GLU 4 -11.848 23.745 11.818 56 H LEU 5 H LEU 5 -8.204 19.786 12.226 57 HA LEU 5 HA LEU 5 -9.717 18.584 10.060 58 HB2 LEU 5 HB2 LEU 5 -7.279 19.651 10.211 59 HB3 LEU 5 HB3 LEU 5 -6.803 18.003 10.591 60 HG LEU 5 HG LEU 5 -8.389 18.903 8.151 61 HD11 LEU 5 HD11 LEU 5 -6.104 19.819 8.144 62 HD12 LEU 5 HD12 LEU 5 -5.434 18.193 8.399 63 HD13 LEU 5 HD13 LEU 5 -6.289 18.588 6.888 64 HD21 LEU 5 HD21 LEU 5 -7.732 16.698 7.179 65 HD22 LEU 5 HD22 LEU 5 -7.017 16.251 8.754 66 HD23 LEU 5 HD23 LEU 5 -8.768 16.511 8.597 67 H GLU 6 H GLU 6 -10.915 17.632 12.155 68 HA GLU 6 HA GLU 6 -9.711 15.203 13.246 69 HB2 GLU 6 HB2 GLU 6 -11.013 17.014 14.502 70 HB3 GLU 6 HB3 GLU 6 -12.479 16.285 13.844 71 HG2 GLU 6 HG2 GLU 6 -11.826 14.112 14.946 72 HG3 GLU 6 HG3 GLU 6 -10.357 14.877 15.539 73 H TYR 7 H TYR 7 -9.933 14.761 10.590 74 HA TYR 7 HA TYR 7 -11.820 12.511 10.427 75 HB2 TYR 7 HB2 TYR 7 -12.668 13.247 8.222 76 HB3 TYR 7 HB3 TYR 7 -13.172 14.265 9.560 77 HD1 TYR 7 HD1 TYR 7 -12.504 16.574 9.734 78 HD2 TYR 7 HD2 TYR 7 -10.943 14.060 6.581 79 HE1 TYR 7 HE1 TYR 7 -11.747 18.602 8.516 80 HE2 TYR 7 HE2 TYR 7 -10.156 16.126 5.384 81 HH TYR 7 HH TYR 7 -10.723 19.421 6.628 82 H GLU 8 H GLU 8 -11.439 11.088 8.868 83 HA GLU 8 HA GLU 8 -9.263 10.732 7.062 84 HB2 GLU 8 HB2 GLU 8 -8.176 10.864 9.508 85 HB3 GLU 8 HB3 GLU 8 -8.746 9.187 9.595 86 HG2 GLU 8 HG2 GLU 8 -7.468 8.641 7.623 87 HG3 GLU 8 HG3 GLU 8 -6.894 10.283 7.458 88 H SER 9 H SER 9 -11.273 9.985 6.065 89 HA SER 9 HA SER 9 -13.078 8.241 7.425 90 HB2 SER 9 HB2 SER 9 -13.332 10.024 5.454 91 HB3 SER 9 HB3 SER 9 -13.093 8.594 4.441 92 HG SER 9 HG SER 9 -15.328 8.955 4.966 93 H VAL 10 H VAL 10 -12.801 6.132 7.763 94 HA VAL 10 HA VAL 10 -10.619 4.654 6.581 95 HB VAL 10 HB VAL 10 -12.818 3.709 8.452 96 HG11 VAL 10 HG11 VAL 10 -10.112 2.471 7.765 97 HG12 VAL 10 HG12 VAL 10 -11.166 1.957 9.102 98 HG13 VAL 10 HG13 VAL 10 -11.717 1.764 7.443 99 HG21 VAL 10 HG21 VAL 10 -9.986 4.696 9.015 100 HG22 VAL 10 HG22 VAL 10 -11.483 5.555 9.432 101 HG23 VAL 10 HG23 VAL 10 -11.110 4.022 10.217 102 H LEU 11 H LEU 11 -10.574 2.879 5.288 103 HA LEU 11 HA LEU 11 -13.013 2.223 3.660 104 HB2 LEU 11 HB2 LEU 11 -10.179 2.782 2.698 105 HB3 LEU 11 HB3 LEU 11 -11.481 2.179 1.683 106 HG LEU 11 HG LEU 11 -11.458 4.899 3.061 107 HD11 LEU 11 HD11 LEU 11 -9.821 4.796 1.259 108 HD12 LEU 11 HD12 LEU 11 -11.029 4.092 0.157 109 HD13 LEU 11 HD13 LEU 11 -11.212 5.756 0.746 110 HD21 LEU 11 HD21 LEU 11 -13.769 4.090 2.739 111 HD22 LEU 11 HD22 LEU 11 -13.402 5.386 1.608 112 HD23 LEU 11 HD23 LEU 11 -13.409 3.703 1.041 113 H CYS 12 H CYS 12 -9.806 1.103 4.789 114 HA CYS 12 HA CYS 12 -10.858 -1.614 5.058 115 HB2 CYS 12 HB2 CYS 12 -9.996 -1.507 2.677 116 HB3 CYS 12 HB3 CYS 12 -8.389 -1.145 3.347 117 HG CYS 12 HG CYS 12 -8.528 -3.656 2.574 118 H VAL 13 H VAL 13 -9.986 -2.579 6.770 119 HA VAL 13 HA VAL 13 -7.298 -1.765 7.753 120 HB VAL 13 HB VAL 13 -9.745 -2.183 9.505 121 HG11 VAL 13 HG11 VAL 13 -6.843 -1.685 10.313 122 HG12 VAL 13 HG12 VAL 13 -8.242 -1.672 11.406 123 HG13 VAL 13 HG13 VAL 13 -7.772 -3.173 10.608 124 HG21 VAL 13 HG21 VAL 13 -7.948 0.252 9.084 125 HG22 VAL 13 HG22 VAL 13 -9.613 0.082 8.498 126 HG23 VAL 13 HG23 VAL 13 -9.299 0.141 10.235 127 H LYS 14 H LYS 14 -5.978 -3.411 7.959 128 HA LYS 14 HA LYS 14 -7.004 -6.169 8.367 129 HB2 LYS 14 HB2 LYS 14 -4.807 -5.433 6.393 130 HB3 LYS 14 HB3 LYS 14 -5.256 -7.062 6.839 131 HG2 LYS 14 HG2 LYS 14 -7.135 -5.094 5.462 132 HG3 LYS 14 HG3 LYS 14 -6.158 -6.313 4.644 133 HD2 LYS 14 HD2 LYS 14 -7.320 -8.107 5.897 134 HD3 LYS 14 HD3 LYS 14 -8.357 -6.887 6.673 135 HE2 LYS 14 HE2 LYS 14 -9.211 -6.185 4.480 136 HE3 LYS 14 HE3 LYS 14 -8.141 -7.345 3.676 137 HZ1 LYS 14 HZ1 LYS 14 -10.331 -8.063 5.551 138 HZ2 LYS 14 HZ2 LYS 14 -10.353 -8.269 3.922 139 HZ3 LYS 14 HZ3 LYS 14 -9.305 -9.137 4.849 140 HA PRO 15 HA PRO 15 -4.342 -5.919 11.756 141 HB2 PRO 15 HB2 PRO 15 -4.071 -8.535 12.519 142 HB3 PRO 15 HB3 PRO 15 -5.610 -7.614 12.649 143 HG2 PRO 15 HG2 PRO 15 -4.730 -9.507 10.440 144 HG3 PRO 15 HG3 PRO 15 -6.306 -9.475 11.305 145 HD2 PRO 15 HD2 PRO 15 -5.998 -8.311 8.886 146 HD3 PRO 15 HD3 PRO 15 -6.990 -7.539 10.162 147 H ASP 16 H ASP 16 -3.090 -8.048 9.184 148 HA ASP 16 HA ASP 16 -0.343 -7.554 10.200 149 HB2 ASP 16 HB2 ASP 16 -1.198 -9.748 11.067 150 HB3 ASP 16 HB3 ASP 16 -1.262 -10.306 9.390 151 H VAL 17 H VAL 17 0.672 -6.602 8.751 152 HA VAL 17 HA VAL 17 0.856 -7.582 5.967 153 HB VAL 17 HB VAL 17 -0.917 -5.826 6.070 154 HG11 VAL 17 HG11 VAL 17 1.366 -3.879 6.624 155 HG12 VAL 17 HG12 VAL 17 -0.310 -3.459 6.232 156 HG13 VAL 17 HG13 VAL 17 0.053 -4.294 7.745 157 HG21 VAL 17 HG21 VAL 17 0.235 -6.302 3.975 158 HG22 VAL 17 HG22 VAL 17 -0.163 -4.587 4.096 159 HG23 VAL 17 HG23 VAL 17 1.508 -5.120 4.380 160 H SER 18 H SER 18 2.821 -7.178 4.996 161 HA SER 18 HA SER 18 5.010 -6.387 6.894 162 HB2 SER 18 HB2 SER 18 4.942 -8.588 4.803 163 HB3 SER 18 HB3 SER 18 6.295 -8.212 5.892 164 HG SER 18 HG SER 18 4.925 -9.956 6.628 165 H VAL 19 H VAL 19 6.540 -4.997 6.239 166 HA VAL 19 HA VAL 19 6.448 -3.931 3.468 167 HB VAL 19 HB VAL 19 7.652 -2.823 6.006 168 HG11 VAL 19 HG11 VAL 19 7.783 -1.708 3.159 169 HG12 VAL 19 HG12 VAL 19 8.112 -0.759 4.629 170 HG13 VAL 19 HG13 VAL 19 9.154 -2.116 4.218 171 HG21 VAL 19 HG21 VAL 19 5.119 -2.647 5.578 172 HG22 VAL 19 HG22 VAL 19 5.990 -1.127 5.811 173 HG23 VAL 19 HG23 VAL 19 5.531 -1.637 4.178 174 H TYR 20 H TYR 20 7.941 -4.043 2.054 175 HA TYR 20 HA TYR 20 10.691 -4.816 2.848 176 HB2 TYR 20 HB2 TYR 20 9.829 -5.777 0.182 177 HB3 TYR 20 HB3 TYR 20 10.936 -6.477 1.349 178 HD1 TYR 20 HD1 TYR 20 10.087 -7.995 3.119 179 HD2 TYR 20 HD2 TYR 20 7.475 -6.315 0.147 180 HE1 TYR 20 HE1 TYR 20 8.335 -9.646 3.747 181 HE2 TYR 20 HE2 TYR 20 5.724 -7.988 0.746 182 HH TYR 20 HH TYR 20 6.225 -10.441 3.308 183 H ARG 21 H ARG 21 12.053 -3.330 2.269 184 HA ARG 21 HA ARG 21 11.737 -1.289 0.270 185 HB2 ARG 21 HB2 ARG 21 14.069 -2.621 1.672 186 HB3 ARG 21 HB3 ARG 21 14.401 -1.518 0.358 187 HG2 ARG 21 HG2 ARG 21 12.490 -0.586 2.512 188 HG3 ARG 21 HG3 ARG 21 14.196 -0.714 2.914 189 HD2 ARG 21 HD2 ARG 21 13.576 1.550 2.215 190 HD3 ARG 21 HD3 ARG 21 14.844 0.846 1.222 191 HE ARG 21 HE ARG 21 12.039 1.452 0.414 192 HH11 ARG 21 HH11 ARG 21 11.540 1.486 -1.801 193 HH12 ARG 21 HH12 ARG 21 12.767 0.926 -2.921 194 HH21 ARG 21 HH21 ARG 21 15.225 0.405 -0.683 195 HH22 ARG 21 HH22 ARG 21 14.674 0.313 -2.344 196 H ILE 22 H ILE 22 12.035 -1.220 -1.818 197 HA ILE 22 HA ILE 22 12.729 -3.687 -3.342 198 HB ILE 22 HB ILE 22 11.160 -2.956 -5.067 199 HG12 ILE 22 HG12 ILE 22 10.364 -0.711 -3.157 200 HG13 ILE 22 HG13 ILE 22 11.169 -0.528 -4.721 201 HG21 ILE 22 HG21 ILE 22 9.707 -3.104 -2.406 202 HG22 ILE 22 HG22 ILE 22 9.157 -3.660 -4.004 203 HG23 ILE 22 HG23 ILE 22 10.486 -4.495 -3.191 204 HD11 ILE 22 HD11 ILE 22 9.143 -1.667 -5.770 205 HD12 ILE 22 HD12 ILE 22 8.340 -1.449 -4.196 206 HD13 ILE 22 HD13 ILE 22 8.897 -0.036 -5.109 207 HA PRO 23 HA PRO 23 15.471 -1.005 -5.816 208 HB2 PRO 23 HB2 PRO 23 15.639 -2.436 -8.128 209 HB3 PRO 23 HB3 PRO 23 16.460 -2.961 -6.624 210 HG2 PRO 23 HG2 PRO 23 13.777 -3.892 -7.707 211 HG3 PRO 23 HG3 PRO 23 15.149 -4.895 -7.134 212 HD2 PRO 23 HD2 PRO 23 13.019 -4.270 -5.539 213 HD3 PRO 23 HD3 PRO 23 14.672 -4.425 -4.879 214 HA PRO 24 HA PRO 24 12.406 1.252 -8.217 215 HB2 PRO 24 HB2 PRO 24 13.878 2.428 -10.213 216 HB3 PRO 24 HB3 PRO 24 13.946 2.947 -8.499 217 HG2 PRO 24 HG2 PRO 24 15.837 1.062 -9.947 218 HG3 PRO 24 HG3 PRO 24 16.253 2.470 -8.917 219 HD2 PRO 24 HD2 PRO 24 16.267 -0.059 -7.935 220 HD3 PRO 24 HD3 PRO 24 15.680 1.304 -6.936 221 H ARG 25 H ARG 25 11.057 0.938 -9.967 222 HA ARG 25 HA ARG 25 11.122 -1.608 -11.261 223 HB2 ARG 25 HB2 ARG 25 9.127 0.102 -10.706 224 HB3 ARG 25 HB3 ARG 25 9.476 0.679 -12.323 225 HG2 ARG 25 HG2 ARG 25 9.246 -2.095 -12.682 226 HG3 ARG 25 HG3 ARG 25 8.099 -1.781 -11.389 227 HD2 ARG 25 HD2 ARG 25 8.206 -0.393 -14.090 228 HD3 ARG 25 HD3 ARG 25 7.053 -1.644 -13.618 229 HE ARG 25 HE ARG 25 6.120 -0.084 -11.908 230 HH11 ARG 25 HH11 ARG 25 5.536 1.948 -11.372 231 HH12 ARG 25 HH12 ARG 25 5.886 3.277 -12.457 232 HH21 ARG 25 HH21 ARG 25 7.521 1.394 -14.794 233 HH22 ARG 25 HH22 ARG 25 7.066 2.980 -14.266 234 H ALA 26 H ALA 26 11.168 -2.149 -13.427 235 HA ALA 26 HA ALA 26 11.457 0.039 -15.389 236 HB1 ALA 26 HB1 ALA 26 12.600 -1.490 -16.947 237 HB2 ALA 26 HB2 ALA 26 13.575 -1.176 -15.489 238 HB3 ALA 26 HB3 ALA 26 12.702 -2.717 -15.662 239 H SER 27 H SER 27 9.774 0.012 -16.776 240 HA SER 27 HA SER 27 7.443 -1.487 -16.187 241 HB2 SER 27 HB2 SER 27 8.073 0.235 -18.600 242 HB3 SER 27 HB3 SER 27 6.450 -0.221 -18.028 243 HG SER 27 HG SER 27 7.136 1.872 -17.290 244 H ASN 28 H ASN 28 9.946 -2.082 -18.546 245 HA ASN 28 HA ASN 28 8.436 -4.254 -19.871 246 HB2 ASN 28 HB2 ASN 28 11.302 -3.270 -20.219 247 HB3 ASN 28 HB3 ASN 28 10.534 -4.527 -21.184 248 HD21 ASN 28 HD21 ASN 28 9.958 -0.737 -22.297 249 HD22 ASN 28 HD22 ASN 28 11.171 -1.207 -21.118 250 H ARG 29 H ARG 29 9.485 -4.095 -16.879 251 HA ARG 29 HA ARG 29 10.331 -6.959 -16.724 252 HB2 ARG 29 HB2 ARG 29 11.473 -4.629 -15.094 253 HB3 ARG 29 HB3 ARG 29 11.835 -6.329 -14.835 254 HG2 ARG 29 HG2 ARG 29 12.492 -4.775 -17.384 255 HG3 ARG 29 HG3 ARG 29 13.627 -5.150 -16.077 256 HD2 ARG 29 HD2 ARG 29 13.212 -7.559 -16.376 257 HD3 ARG 29 HD3 ARG 29 12.098 -7.236 -17.687 258 HE ARG 29 HE ARG 29 15.055 -6.956 -17.747 259 HH11 ARG 29 HH11 ARG 29 16.067 -6.877 -19.709 260 HH12 ARG 29 HH12 ARG 29 15.138 -6.690 -21.167 261 HH21 ARG 29 HH21 ARG 29 12.079 -6.582 -19.609 262 HH22 ARG 29 HH22 ARG 29 12.956 -6.553 -21.118 263 H GLY 30 H GLY 30 9.230 -4.233 -14.611 264 HA2 GLY 30 HA2 GLY 30 7.426 -4.202 -13.223 265 HA3 GLY 30 HA3 GLY 30 6.957 -5.820 -13.783 266 H TYR 31 H TYR 31 6.885 -4.804 -11.106 267 HA TYR 31 HA TYR 31 8.890 -6.205 -9.541 268 HB2 TYR 31 HB2 TYR 31 6.127 -5.236 -8.762 269 HB3 TYR 31 HB3 TYR 31 7.456 -5.649 -7.687 270 HD1 TYR 31 HD1 TYR 31 5.710 -3.064 -8.060 271 HD2 TYR 31 HD2 TYR 31 9.686 -4.124 -9.355 272 HE1 TYR 31 HE1 TYR 31 6.404 -0.694 -7.864 273 HE2 TYR 31 HE2 TYR 31 10.429 -1.793 -8.938 274 HH TYR 31 HH TYR 31 8.167 0.791 -7.902 275 H ARG 32 H ARG 32 8.685 -8.284 -8.718 276 HA ARG 32 HA ARG 32 6.328 -9.933 -9.584 277 HB2 ARG 32 HB2 ARG 32 7.941 -11.770 -10.122 278 HB3 ARG 32 HB3 ARG 32 7.947 -10.412 -11.222 279 HG2 ARG 32 HG2 ARG 32 9.986 -10.561 -8.981 280 HG3 ARG 32 HG3 ARG 32 10.196 -11.509 -10.459 281 HD2 ARG 32 HD2 ARG 32 10.064 -9.492 -11.845 282 HD3 ARG 32 HD3 ARG 32 9.838 -8.494 -10.408 283 HE ARG 32 HE ARG 32 12.258 -9.961 -10.101 284 HH11 ARG 32 HH11 ARG 32 14.153 -8.821 -10.106 285 HH12 ARG 32 HH12 ARG 32 14.359 -7.494 -11.222 286 HH21 ARG 32 HH21 ARG 32 11.018 -7.280 -12.015 287 HH22 ARG 32 HH22 ARG 32 12.611 -6.590 -12.203 288 H ALA 33 H ALA 33 7.002 -8.832 -6.977 289 HA ALA 33 HA ALA 33 7.047 -9.294 -4.784 290 HB1 ALA 33 HB1 ALA 33 4.925 -10.276 -5.520 291 HB2 ALA 33 HB2 ALA 33 5.693 -11.855 -5.684 292 HB3 ALA 33 HB3 ALA 33 5.586 -11.088 -4.077 293 H SER 34 H SER 34 8.123 -12.325 -6.386 294 HA SER 34 HA SER 34 9.634 -13.322 -4.202 295 HB2 SER 34 HB2 SER 34 9.906 -13.905 -7.170 296 HB3 SER 34 HB3 SER 34 10.586 -14.886 -5.856 297 HG SER 34 HG SER 34 8.561 -15.696 -6.590 298 H ASP 35 H ASP 35 10.447 -10.792 -6.352 299 HA ASP 35 HA ASP 35 13.356 -10.966 -6.113 300 HB2 ASP 35 HB2 ASP 35 11.952 -9.911 -7.974 301 HB3 ASP 35 HB3 ASP 35 11.643 -8.571 -6.875 302 H TRP 36 H TRP 36 10.755 -9.785 -4.080 303 HA TRP 36 HA TRP 36 12.339 -7.802 -2.642 304 HB2 TRP 36 HB2 TRP 36 9.580 -8.877 -2.020 305 HB3 TRP 36 HB3 TRP 36 10.292 -7.377 -1.481 306 HD1 TRP 36 HD1 TRP 36 11.076 -6.959 -4.910 307 HE1 TRP 36 HE1 TRP 36 9.214 -5.740 -6.221 308 HE3 TRP 36 HE3 TRP 36 7.172 -7.695 -1.684 309 HZ2 TRP 36 HZ2 TRP 36 6.507 -4.930 -5.770 310 HZ3 TRP 36 HZ3 TRP 36 4.967 -6.611 -2.118 311 HH2 TRP 36 HH2 TRP 36 4.634 -5.250 -4.158 312 H LYS 37 H LYS 37 12.102 -7.914 -0.213 313 HA LYS 37 HA LYS 37 13.477 -10.315 0.739 314 HB2 LYS 37 HB2 LYS 37 12.780 -7.697 2.116 315 HB3 LYS 37 HB3 LYS 37 13.700 -9.007 2.850 316 HG2 LYS 37 HG2 LYS 37 15.335 -8.864 0.922 317 HG3 LYS 37 HG3 LYS 37 14.530 -7.347 0.461 318 HD2 LYS 37 HD2 LYS 37 16.041 -8.010 3.007 319 HD3 LYS 37 HD3 LYS 37 16.454 -6.803 1.777 320 HE2 LYS 37 HE2 LYS 37 14.334 -5.562 2.399 321 HE3 LYS 37 HE3 LYS 37 14.078 -6.740 3.694 322 HZ1 LYS 37 HZ1 LYS 37 16.142 -6.009 4.712 323 HZ2 LYS 37 HZ2 LYS 37 16.474 -4.989 3.472 324 HZ3 LYS 37 HZ3 LYS 37 15.204 -4.691 4.451 325 H LEU 38 H LEU 38 11.227 -11.370 0.141 326 HA LEU 38 HA LEU 38 9.060 -11.250 1.956 327 HB2 LEU 38 HB2 LEU 38 9.934 -13.642 0.298 328 HB3 LEU 38 HB3 LEU 38 8.330 -13.361 0.970 329 HG LEU 38 HG LEU 38 9.693 -11.756 -1.218 330 HD11 LEU 38 HD11 LEU 38 7.204 -13.533 -1.168 331 HD12 LEU 38 HD12 LEU 38 7.798 -12.646 -2.579 332 HD13 LEU 38 HD13 LEU 38 8.773 -13.956 -1.892 333 HD21 LEU 38 HD21 LEU 38 7.021 -11.294 0.143 334 HD22 LEU 38 HD22 LEU 38 8.386 -10.162 0.036 335 HD23 LEU 38 HD23 LEU 38 7.475 -10.572 -1.418 336 H ASP 39 H ASP 39 12.097 -12.742 2.561 337 HA ASP 39 HA ASP 39 11.001 -14.371 4.822 338 HB2 ASP 39 HB2 ASP 39 13.647 -14.473 3.345 339 HB3 ASP 39 HB3 ASP 39 13.310 -15.379 4.818 340 H GLN 40 H GLN 40 12.278 -11.316 4.285 341 HA GLN 40 HA GLN 40 12.820 -10.914 7.128 342 HB2 GLN 40 HB2 GLN 40 15.025 -9.801 6.727 343 HB3 GLN 40 HB3 GLN 40 15.001 -11.547 6.753 344 HG2 GLN 40 HG2 GLN 40 15.095 -9.917 4.193 345 HG3 GLN 40 HG3 GLN 40 16.518 -10.441 5.060 346 HE21 GLN 40 HE21 GLN 40 15.379 -12.940 2.339 347 HE22 GLN 40 HE22 GLN 40 15.287 -11.186 2.293 348 HA PRO 41 HA PRO 41 10.680 -7.333 5.052 349 HB2 PRO 41 HB2 PRO 41 8.840 -6.932 7.106 350 HB3 PRO 41 HB3 PRO 41 8.567 -7.965 5.680 351 HG2 PRO 41 HG2 PRO 41 9.538 -8.803 8.424 352 HG3 PRO 41 HG3 PRO 41 8.262 -9.564 7.421 353 HD2 PRO 41 HD2 PRO 41 10.756 -10.579 7.498 354 HD3 PRO 41 HD3 PRO 41 9.867 -10.515 5.948 355 H ASP 42 H ASP 42 10.951 -5.232 5.535 356 HA ASP 42 HA ASP 42 13.024 -4.466 7.449 357 HB2 ASP 42 HB2 ASP 42 11.182 -2.902 5.585 358 HB3 ASP 42 HB3 ASP 42 12.458 -2.166 6.567 359 H TRP 43 H TRP 43 9.526 -4.464 7.356 360 HA TRP 43 HA TRP 43 9.297 -4.013 10.238 361 HB2 TRP 43 HB2 TRP 43 9.415 -1.698 9.530 362 HB3 TRP 43 HB3 TRP 43 8.306 -1.983 8.204 363 HD1 TRP 43 HD1 TRP 43 8.373 -1.164 11.887 364 HE1 TRP 43 HE1 TRP 43 6.007 -0.526 12.656 365 HE3 TRP 43 HE3 TRP 43 5.752 -2.751 7.801 366 HZ2 TRP 43 HZ2 TRP 43 3.356 -0.419 11.488 367 HZ3 TRP 43 HZ3 TRP 43 3.303 -2.259 7.612 368 HH2 TRP 43 HH2 TRP 43 2.104 -1.131 9.456 369 H THR 44 H THR 44 7.166 -4.638 11.026 370 HA THR 44 HA THR 44 5.143 -5.327 9.001 371 HB THR 44 HB THR 44 4.460 -7.352 9.980 372 HG1 THR 44 HG1 THR 44 6.668 -7.187 11.745 373 HG21 THR 44 HG21 THR 44 6.266 -7.477 8.309 374 HG22 THR 44 HG22 THR 44 7.453 -7.624 9.621 375 HG23 THR 44 HG23 THR 44 6.189 -8.866 9.401 376 H GLY 45 H GLY 45 3.029 -5.276 9.686 377 HA2 GLY 45 HA2 GLY 45 2.128 -4.582 12.324 378 HA3 GLY 45 HA3 GLY 45 2.442 -3.105 11.432 379 H ARG 46 H ARG 46 0.376 -2.419 11.313 380 HA ARG 46 HA ARG 46 -1.778 -4.127 10.146 381 HB2 ARG 46 HB2 ARG 46 -1.933 -1.563 11.786 382 HB3 ARG 46 HB3 ARG 46 -3.313 -2.490 11.182 383 HG2 ARG 46 HG2 ARG 46 -2.614 -4.432 12.548 384 HG3 ARG 46 HG3 ARG 46 -1.255 -3.499 13.191 385 HD2 ARG 46 HD2 ARG 46 -4.186 -2.721 13.511 386 HD3 ARG 46 HD3 ARG 46 -3.266 -3.646 14.693 387 HE ARG 46 HE ARG 46 -1.831 -1.760 15.118 388 HH11 ARG 46 HH11 ARG 46 -1.478 0.318 15.341 389 HH12 ARG 46 HH12 ARG 46 -2.565 1.496 14.566 390 HH21 ARG 46 HH21 ARG 46 -4.526 -0.733 13.034 391 HH22 ARG 46 HH22 ARG 46 -4.055 0.949 13.313 392 H LEU 47 H LEU 47 -3.086 -3.387 8.586 393 HA LEU 47 HA LEU 47 -2.203 -1.138 6.843 394 HB2 LEU 47 HB2 LEU 47 -2.736 -3.352 5.810 395 HB3 LEU 47 HB3 LEU 47 -4.324 -3.292 6.569 396 HG LEU 47 HG LEU 47 -4.830 -1.204 5.199 397 HD11 LEU 47 HD11 LEU 47 -3.487 -0.845 3.176 398 HD12 LEU 47 HD12 LEU 47 -2.492 -0.588 4.612 399 HD13 LEU 47 HD13 LEU 47 -2.335 -2.098 3.688 400 HD21 LEU 47 HD21 LEU 47 -5.753 -3.354 4.639 401 HD22 LEU 47 HD22 LEU 47 -5.277 -2.534 3.155 402 HD23 LEU 47 HD23 LEU 47 -4.254 -3.833 3.819 403 H ARG 48 H ARG 48 -3.319 0.756 6.790 404 HA ARG 48 HA ARG 48 -6.202 0.832 7.512 405 HB2 ARG 48 HB2 ARG 48 -5.039 1.577 9.532 406 HB3 ARG 48 HB3 ARG 48 -4.017 2.671 8.599 407 HG2 ARG 48 HG2 ARG 48 -5.970 4.075 8.045 408 HG3 ARG 48 HG3 ARG 48 -7.040 2.964 8.930 409 HD2 ARG 48 HD2 ARG 48 -5.840 3.450 11.020 410 HD3 ARG 48 HD3 ARG 48 -4.642 4.404 10.141 411 HE ARG 48 HE ARG 48 -6.086 6.218 10.012 412 HH11 ARG 48 HH11 ARG 48 -7.589 7.435 10.642 413 HH12 ARG 48 HH12 ARG 48 -9.050 6.849 11.446 414 HH21 ARG 48 HH21 ARG 48 -7.933 3.565 11.411 415 HH22 ARG 48 HH22 ARG 48 -9.191 4.653 11.929 416 H ILE 49 H ILE 49 -6.849 0.988 5.475 417 HA ILE 49 HA ILE 49 -5.835 3.166 3.735 418 HB ILE 49 HB ILE 49 -8.132 1.285 3.150 419 HG12 ILE 49 HG12 ILE 49 -5.166 1.026 2.469 420 HG13 ILE 49 HG13 ILE 49 -6.137 -0.063 3.467 421 HG21 ILE 49 HG21 ILE 49 -6.420 3.040 1.324 422 HG22 ILE 49 HG22 ILE 49 -7.815 2.051 0.837 423 HG23 ILE 49 HG23 ILE 49 -8.055 3.448 1.872 424 HD11 ILE 49 HD11 ILE 49 -7.596 -0.442 1.397 425 HD12 ILE 49 HD12 ILE 49 -6.256 0.286 0.474 426 HD13 ILE 49 HD13 ILE 49 -5.998 -1.173 1.453 427 H THR 50 H THR 50 -6.749 5.017 3.585 428 HA THR 50 HA THR 50 -9.248 5.804 5.034 429 HB THR 50 HB THR 50 -7.699 7.746 5.799 430 HG1 THR 50 HG1 THR 50 -5.820 6.200 4.936 431 HG21 THR 50 HG21 THR 50 -7.416 6.438 7.958 432 HG22 THR 50 HG22 THR 50 -9.055 6.383 7.288 433 HG23 THR 50 HG23 THR 50 -7.968 4.995 7.096 434 H SER 51 H SER 51 -9.959 8.023 4.370 435 HA SER 51 HA SER 51 -8.556 9.437 2.249 436 HB2 SER 51 HB2 SER 51 -9.725 7.694 0.903 437 HB3 SER 51 HB3 SER 51 -11.260 8.135 1.671 438 HG SER 51 HG SER 51 -9.625 9.971 0.212 439 H LYS 52 H LYS 52 -9.411 11.589 1.980 440 HA LYS 52 HA LYS 52 -11.577 12.295 3.913 441 HB2 LYS 52 HB2 LYS 52 -9.057 13.806 3.250 442 HB3 LYS 52 HB3 LYS 52 -10.348 14.241 4.415 443 HG2 LYS 52 HG2 LYS 52 -9.753 12.383 5.832 444 HG3 LYS 52 HG3 LYS 52 -8.539 11.818 4.689 445 HD2 LYS 52 HD2 LYS 52 -7.398 14.127 4.945 446 HD3 LYS 52 HD3 LYS 52 -8.507 14.396 6.301 447 HE2 LYS 52 HE2 LYS 52 -7.669 12.051 7.095 448 HE3 LYS 52 HE3 LYS 52 -6.303 12.335 6.002 449 HZ1 LYS 52 HZ1 LYS 52 -7.171 13.992 8.305 450 HZ2 LYS 52 HZ2 LYS 52 -5.801 13.110 8.240 451 HZ3 LYS 52 HZ3 LYS 52 -5.942 14.441 7.292 452 H GLY 53 H GLY 53 -10.154 13.402 0.845 453 HA2 GLY 53 HA2 GLY 53 -12.744 14.470 -0.056 454 HA3 GLY 53 HA3 GLY 53 -11.577 15.714 0.405 455 H LYS 54 H LYS 54 -12.171 12.982 -1.705 456 HA LYS 54 HA LYS 54 -11.320 12.204 -3.656 457 HB2 LYS 54 HB2 LYS 54 -10.751 15.120 -4.282 458 HB3 LYS 54 HB3 LYS 54 -10.766 13.790 -5.447 459 HG2 LYS 54 HG2 LYS 54 -13.138 13.324 -4.908 460 HG3 LYS 54 HG3 LYS 54 -13.169 14.711 -3.809 461 HD2 LYS 54 HD2 LYS 54 -12.641 14.822 -6.805 462 HD3 LYS 54 HD3 LYS 54 -14.164 15.222 -5.992 463 HE2 LYS 54 HE2 LYS 54 -13.014 17.042 -4.736 464 HE3 LYS 54 HE3 LYS 54 -11.510 16.676 -5.592 465 HZ1 LYS 54 HZ1 LYS 54 -12.638 17.239 -7.680 466 HZ2 LYS 54 HZ2 LYS 54 -14.026 17.583 -6.888 467 HZ3 LYS 54 HZ3 LYS 54 -12.701 18.503 -6.651 468 H THR 55 H THR 55 -9.616 12.399 -1.307 469 HA THR 55 HA THR 55 -7.033 11.781 -2.625 470 HB THR 55 HB THR 55 -7.206 13.495 -0.105 471 HG1 THR 55 HG1 THR 55 -7.796 14.767 -1.839 472 HG21 THR 55 HG21 THR 55 -4.906 12.688 -1.936 473 HG22 THR 55 HG22 THR 55 -4.789 13.801 -0.549 474 HG23 THR 55 HG23 THR 55 -5.191 12.097 -0.281 475 H ALA 56 H ALA 56 -6.553 9.788 -2.015 476 HA ALA 56 HA ALA 56 -7.627 8.678 0.530 477 HB1 ALA 56 HB1 ALA 56 -7.190 6.479 -0.415 478 HB2 ALA 56 HB2 ALA 56 -8.256 7.419 -1.471 479 HB3 ALA 56 HB3 ALA 56 -6.535 7.216 -1.888 480 H TYR 57 H TYR 57 -6.242 7.380 1.779 481 HA TYR 57 HA TYR 57 -3.319 7.927 1.649 482 HB2 TYR 57 HB2 TYR 57 -5.050 8.182 4.137 483 HB3 TYR 57 HB3 TYR 57 -3.319 8.454 4.022 484 HD1 TYR 57 HD1 TYR 57 -2.480 10.442 2.675 485 HD2 TYR 57 HD2 TYR 57 -6.653 9.929 3.671 486 HE1 TYR 57 HE1 TYR 57 -2.896 12.859 2.227 487 HE2 TYR 57 HE2 TYR 57 -7.057 12.313 3.194 488 HH TYR 57 HH TYR 57 -4.452 14.553 2.193 489 H ILE 58 H ILE 58 -2.447 5.903 1.441 490 HA ILE 58 HA ILE 58 -3.552 3.617 3.040 491 HB ILE 58 HB ILE 58 -1.226 3.697 1.077 492 HG12 ILE 58 HG12 ILE 58 -2.653 1.954 -0.127 493 HG13 ILE 58 HG13 ILE 58 -4.011 2.464 0.871 494 HG21 ILE 58 HG21 ILE 58 -2.386 1.356 2.653 495 HG22 ILE 58 HG22 ILE 58 -1.101 1.264 1.424 496 HG23 ILE 58 HG23 ILE 58 -0.794 2.099 2.926 497 HD11 ILE 58 HD11 ILE 58 -3.899 3.436 -1.449 498 HD12 ILE 58 HD12 ILE 58 -3.980 4.670 -0.190 499 HD13 ILE 58 HD13 ILE 58 -2.421 4.296 -0.979 500 H LYS 59 H LYS 59 -3.220 4.026 5.121 501 HA LYS 59 HA LYS 59 -0.495 4.840 6.010 502 HB2 LYS 59 HB2 LYS 59 -3.115 4.853 7.553 503 HB3 LYS 59 HB3 LYS 59 -1.529 5.378 8.139 504 HG2 LYS 59 HG2 LYS 59 -1.528 6.944 6.035 505 HG3 LYS 59 HG3 LYS 59 -3.264 6.640 5.984 506 HD2 LYS 59 HD2 LYS 59 -3.532 7.581 8.236 507 HD3 LYS 59 HD3 LYS 59 -1.768 7.740 8.404 508 HE2 LYS 59 HE2 LYS 59 -1.767 9.239 6.371 509 HE3 LYS 59 HE3 LYS 59 -3.539 9.188 6.388 510 HZ1 LYS 59 HZ1 LYS 59 -1.853 10.191 8.621 511 HZ2 LYS 59 HZ2 LYS 59 -2.635 11.139 7.553 512 HZ3 LYS 59 HZ3 LYS 59 -3.501 10.192 8.582 513 H LEU 60 H LEU 60 0.729 3.695 7.230 514 HA LEU 60 HA LEU 60 -0.019 0.890 7.968 515 HB2 LEU 60 HB2 LEU 60 2.425 2.161 6.776 516 HB3 LEU 60 HB3 LEU 60 2.691 0.942 8.009 517 HG LEU 60 HG LEU 60 1.502 -0.740 6.797 518 HD11 LEU 60 HD11 LEU 60 0.951 1.389 4.680 519 HD12 LEU 60 HD12 LEU 60 0.754 -0.361 4.424 520 HD13 LEU 60 HD13 LEU 60 -0.252 0.464 5.612 521 HD21 LEU 60 HD21 LEU 60 3.379 0.767 4.922 522 HD22 LEU 60 HD22 LEU 60 3.896 -0.242 6.286 523 HD23 LEU 60 HD23 LEU 60 3.041 -0.979 4.926 524 H GLU 61 H GLU 61 0.055 0.339 10.062 525 HA GLU 61 HA GLU 61 1.283 2.210 12.062 526 HB2 GLU 61 HB2 GLU 61 -1.495 1.031 12.226 527 HB3 GLU 61 HB3 GLU 61 -0.667 2.012 13.457 528 HG2 GLU 61 HG2 GLU 61 -0.668 3.933 11.880 529 HG3 GLU 61 HG3 GLU 61 -1.652 2.978 10.757 530 H ASP 62 H ASP 62 1.803 1.291 14.114 531 HA ASP 62 HA ASP 62 2.705 -1.433 13.903 532 HB2 ASP 62 HB2 ASP 62 3.758 0.583 15.091 533 HB3 ASP 62 HB3 ASP 62 2.582 0.276 16.385 534 H LYS 63 H LYS 63 2.082 -3.234 14.948 535 HA LYS 63 HA LYS 63 -0.730 -3.444 15.787 536 HB2 LYS 63 HB2 LYS 63 -0.255 -5.939 15.647 537 HB3 LYS 63 HB3 LYS 63 -0.048 -5.055 14.142 538 HG2 LYS 63 HG2 LYS 63 2.385 -4.982 14.456 539 HG3 LYS 63 HG3 LYS 63 2.241 -5.856 15.984 540 HD2 LYS 63 HD2 LYS 63 1.593 -7.855 14.916 541 HD3 LYS 63 HD3 LYS 63 1.121 -7.020 13.412 542 HE2 LYS 63 HE2 LYS 63 3.482 -6.383 13.015 543 HE3 LYS 63 HE3 LYS 63 3.974 -7.252 14.468 544 HZ1 LYS 63 HZ1 LYS 63 4.251 -8.506 12.371 545 HZ2 LYS 63 HZ2 LYS 63 3.301 -9.312 13.442 546 HZ3 LYS 63 HZ3 LYS 63 2.623 -8.573 12.150 547 H VAL 64 H VAL 64 2.035 -2.858 17.455 548 HA VAL 64 HA VAL 64 0.841 -3.942 19.977 549 HB VAL 64 HB VAL 64 3.730 -3.711 19.077 550 HG11 VAL 64 HG11 VAL 64 4.361 -4.656 21.305 551 HG12 VAL 64 HG12 VAL 64 3.697 -3.029 21.432 552 HG13 VAL 64 HG13 VAL 64 2.684 -4.432 21.853 553 HG21 VAL 64 HG21 VAL 64 2.067 -6.104 19.967 554 HG22 VAL 64 HG22 VAL 64 2.603 -5.748 18.311 555 HG23 VAL 64 HG23 VAL 64 3.795 -6.144 19.547 556 H SER 65 H SER 65 2.808 -1.283 18.548 557 HA SER 65 HA SER 65 2.410 0.313 21.004 558 HB2 SER 65 HB2 SER 65 3.905 0.904 18.431 559 HB3 SER 65 HB3 SER 65 3.859 1.966 19.851 560 HG SER 65 HG SER 65 5.706 0.617 19.852 561 H GLY 66 H GLY 66 1.007 0.140 17.790 562 HA2 GLY 66 HA2 GLY 66 -0.959 1.137 17.033 563 HA3 GLY 66 HA3 GLY 66 -1.056 2.109 18.498 564 H GLU 67 H GLU 67 2.029 2.361 17.144 565 HA GLU 67 HA GLU 67 1.582 5.154 16.493 566 HB2 GLU 67 HB2 GLU 67 3.944 5.361 16.566 567 HB3 GLU 67 HB3 GLU 67 3.419 4.343 17.917 568 HG2 GLU 67 HG2 GLU 67 4.132 2.321 16.692 569 HG3 GLU 67 HG3 GLU 67 4.661 3.311 15.330 570 H LEU 68 H LEU 68 2.203 6.219 14.551 571 HA LEU 68 HA LEU 68 1.591 4.757 12.114 572 HB2 LEU 68 HB2 LEU 68 0.912 7.130 12.557 573 HB3 LEU 68 HB3 LEU 68 2.611 7.592 12.525 574 HG LEU 68 HG LEU 68 2.695 6.717 10.113 575 HD11 LEU 68 HD11 LEU 68 0.607 5.347 10.169 576 HD12 LEU 68 HD12 LEU 68 -0.342 6.820 10.417 577 HD13 LEU 68 HD13 LEU 68 0.564 6.575 8.904 578 HD21 LEU 68 HD21 LEU 68 0.799 9.015 10.747 579 HD22 LEU 68 HD22 LEU 68 2.570 9.112 10.642 580 HD23 LEU 68 HD23 LEU 68 1.621 8.737 9.195 581 H PHE 69 H PHE 69 2.957 3.708 10.817 582 HA PHE 69 HA PHE 69 5.904 3.984 11.089 583 HB2 PHE 69 HB2 PHE 69 5.114 1.741 11.006 584 HB3 PHE 69 HB3 PHE 69 4.089 2.058 9.615 585 HD1 PHE 69 HD1 PHE 69 7.699 2.022 10.659 586 HD2 PHE 69 HD2 PHE 69 4.885 1.644 7.410 587 HE1 PHE 69 HE1 PHE 69 9.547 1.393 9.124 588 HE2 PHE 69 HE2 PHE 69 6.740 1.076 5.874 589 HZ PHE 69 HZ PHE 69 9.071 0.929 6.725 590 H ALA 70 H ALA 70 3.426 4.169 8.481 591 HA ALA 70 HA ALA 70 4.802 6.404 7.188 592 HB1 ALA 70 HB1 ALA 70 4.585 3.708 5.765 593 HB2 ALA 70 HB2 ALA 70 5.237 5.223 5.100 594 HB3 ALA 70 HB3 ALA 70 6.093 4.401 6.404 595 H GLN 71 H GLN 71 3.629 7.175 5.266 596 HA GLN 71 HA GLN 71 0.829 6.260 4.947 597 HB2 GLN 71 HB2 GLN 71 0.094 8.671 5.006 598 HB3 GLN 71 HB3 GLN 71 0.500 7.956 6.570 599 HG2 GLN 71 HG2 GLN 71 2.414 9.245 6.857 600 HG3 GLN 71 HG3 GLN 71 2.673 9.464 5.141 601 HE21 GLN 71 HE21 GLN 71 1.389 12.702 5.346 602 HE22 GLN 71 HE22 GLN 71 2.663 11.605 4.787 603 H ALA 72 H ALA 72 0.202 6.232 2.856 604 HA ALA 72 HA ALA 72 1.769 7.785 0.820 605 HB1 ALA 72 HB1 ALA 72 1.140 5.961 -0.732 606 HB2 ALA 72 HB2 ALA 72 2.169 5.426 0.604 607 HB3 ALA 72 HB3 ALA 72 0.434 5.073 0.631 608 HA PRO 73 HA PRO 73 -2.289 9.851 0.262 609 HB2 PRO 73 HB2 PRO 73 -0.329 11.701 -1.074 610 HB3 PRO 73 HB3 PRO 73 -1.758 12.098 -0.074 611 HG2 PRO 73 HG2 PRO 73 0.764 12.251 0.929 612 HG3 PRO 73 HG3 PRO 73 -0.581 11.612 1.928 613 HD2 PRO 73 HD2 PRO 73 1.552 10.072 0.446 614 HD3 PRO 73 HD3 PRO 73 0.869 9.792 2.070 615 H VAL 74 H VAL 74 -3.511 9.672 -1.533 616 HA VAL 74 HA VAL 74 -2.326 9.192 -4.224 617 HB VAL 74 HB VAL 74 -4.729 7.642 -3.186 618 HG11 VAL 74 HG11 VAL 74 -2.796 7.118 -5.478 619 HG12 VAL 74 HG12 VAL 74 -4.188 6.109 -5.033 620 HG13 VAL 74 HG13 VAL 74 -4.454 7.751 -5.612 621 HG21 VAL 74 HG21 VAL 74 -2.988 6.910 -1.699 622 HG22 VAL 74 HG22 VAL 74 -3.324 5.656 -2.882 623 HG23 VAL 74 HG23 VAL 74 -1.864 6.657 -3.052 624 H GLU 75 H GLU 75 -3.335 10.476 -5.775 625 HA GLU 75 HA GLU 75 -5.722 12.044 -4.941 626 HB2 GLU 75 HB2 GLU 75 -3.923 12.206 -7.388 627 HB3 GLU 75 HB3 GLU 75 -5.286 13.283 -7.055 628 HG2 GLU 75 HG2 GLU 75 -4.210 13.976 -4.914 629 HG3 GLU 75 HG3 GLU 75 -2.814 12.968 -5.297 630 H GLN 76 H GLN 76 -5.047 9.345 -7.030 631 HA GLN 76 HA GLN 76 -7.837 8.763 -7.340 632 HB2 GLN 76 HB2 GLN 76 -8.099 8.823 -9.685 633 HB3 GLN 76 HB3 GLN 76 -7.558 10.418 -9.210 634 HG2 GLN 76 HG2 GLN 76 -5.883 8.266 -10.571 635 HG3 GLN 76 HG3 GLN 76 -6.562 9.695 -11.320 636 HE21 GLN 76 HE21 GLN 76 -3.055 10.009 -9.248 637 HE22 GLN 76 HE22 GLN 76 -4.042 8.539 -9.109 638 H TYR 77 H TYR 77 -8.192 6.589 -7.987 639 HA TYR 77 HA TYR 77 -5.760 4.908 -8.307 640 HB2 TYR 77 HB2 TYR 77 -6.875 4.642 -6.127 641 HB3 TYR 77 HB3 TYR 77 -8.351 4.150 -6.968 642 HD1 TYR 77 HD1 TYR 77 -4.713 3.301 -6.648 643 HD2 TYR 77 HD2 TYR 77 -8.695 1.870 -7.471 644 HE1 TYR 77 HE1 TYR 77 -3.846 0.976 -6.839 645 HE2 TYR 77 HE2 TYR 77 -7.832 -0.475 -7.555 646 HH TYR 77 HH TYR 77 -4.361 -1.235 -7.148 647 HA PRO 78 HA PRO 78 -4.950 3.125 -9.454 648 HB2 PRO 78 HB2 PRO 78 -4.637 3.180 -12.440 649 HB3 PRO 78 HB3 PRO 78 -4.062 1.963 -11.258 650 HG2 PRO 78 HG2 PRO 78 -6.245 1.448 -12.770 651 HG3 PRO 78 HG3 PRO 78 -6.269 1.053 -11.017 652 HD2 PRO 78 HD2 PRO 78 -7.377 3.531 -12.391 653 HD3 PRO 78 HD3 PRO 78 -8.182 2.447 -11.215 654 H GLY 79 H GLY 79 -2.994 4.248 -9.377 655 HA2 GLY 79 HA2 GLY 79 -2.512 6.717 -10.919 656 HA3 GLY 79 HA3 GLY 79 -2.716 6.894 -9.172 657 H ILE 80 H ILE 80 -0.453 7.750 -9.374 658 HA ILE 80 HA ILE 80 1.689 5.835 -9.931 659 HB ILE 80 HB ILE 80 1.966 8.170 -10.501 660 HG12 ILE 80 HG12 ILE 80 3.905 7.325 -8.300 661 HG13 ILE 80 HG13 ILE 80 3.922 6.731 -9.963 662 HG21 ILE 80 HG21 ILE 80 2.001 8.838 -7.521 663 HG22 ILE 80 HG22 ILE 80 2.192 9.960 -8.880 664 HG23 ILE 80 HG23 ILE 80 0.638 9.181 -8.609 665 HD11 ILE 80 HD11 ILE 80 4.357 9.080 -10.736 666 HD12 ILE 80 HD12 ILE 80 4.481 9.569 -9.024 667 HD13 ILE 80 HD13 ILE 80 5.626 8.394 -9.695 668 H ALA 81 H ALA 81 0.128 7.017 -6.977 669 HA ALA 81 HA ALA 81 2.293 6.086 -5.257 670 HB1 ALA 81 HB1 ALA 81 -0.402 7.344 -4.652 671 HB2 ALA 81 HB2 ALA 81 0.907 7.083 -3.478 672 HB3 ALA 81 HB3 ALA 81 1.143 8.197 -4.834 673 H VAL 82 H VAL 82 0.360 4.170 -6.810 674 HA VAL 82 HA VAL 82 0.405 2.074 -4.784 675 HB VAL 82 HB VAL 82 -2.199 2.710 -6.179 676 HG11 VAL 82 HG11 VAL 82 -1.437 0.705 -3.993 677 HG12 VAL 82 HG12 VAL 82 -3.098 0.984 -4.546 678 HG13 VAL 82 HG13 VAL 82 -1.900 0.304 -5.655 679 HG21 VAL 82 HG21 VAL 82 -1.977 4.421 -4.499 680 HG22 VAL 82 HG22 VAL 82 -3.194 3.252 -4.000 681 HG23 VAL 82 HG23 VAL 82 -1.582 3.212 -3.255 682 H GLU 83 H GLU 83 0.941 0.183 -5.766 683 HA GLU 83 HA GLU 83 0.398 -0.294 -8.647 684 HB2 GLU 83 HB2 GLU 83 2.977 0.575 -7.610 685 HB3 GLU 83 HB3 GLU 83 3.120 -1.093 -8.155 686 HG2 GLU 83 HG2 GLU 83 2.087 -0.449 -10.339 687 HG3 GLU 83 HG3 GLU 83 2.037 1.232 -9.796 688 H THR 84 H THR 84 0.809 -2.484 -9.345 689 HA THR 84 HA THR 84 0.581 -4.593 -7.212 690 HB THR 84 HB THR 84 -0.381 -5.946 -9.140 691 HG1 THR 84 HG1 THR 84 0.190 -4.711 -10.898 692 HG21 THR 84 HG21 THR 84 -2.621 -4.907 -9.011 693 HG22 THR 84 HG22 THR 84 -1.835 -5.069 -7.435 694 HG23 THR 84 HG23 THR 84 -1.908 -3.477 -8.229 695 H VAL 85 H VAL 85 1.677 -6.579 -7.526 696 HA VAL 85 HA VAL 85 4.132 -6.548 -9.139 697 HB VAL 85 HB VAL 85 4.529 -8.744 -8.183 698 HG11 VAL 85 HG11 VAL 85 4.814 -8.066 -5.861 699 HG12 VAL 85 HG12 VAL 85 5.142 -6.693 -6.927 700 HG13 VAL 85 HG13 VAL 85 3.607 -6.788 -6.038 701 HG21 VAL 85 HG21 VAL 85 2.169 -9.566 -8.082 702 HG22 VAL 85 HG22 VAL 85 3.040 -9.768 -6.569 703 HG23 VAL 85 HG23 VAL 85 1.860 -8.458 -6.737 704 H THR 86 H THR 86 4.496 -8.610 -10.497 705 HA THR 86 HA THR 86 2.259 -9.033 -12.381 706 HB THR 86 HB THR 86 3.975 -10.014 -13.812 707 HG1 THR 86 HG1 THR 86 6.106 -10.097 -13.090 708 HG21 THR 86 HG21 THR 86 5.406 -8.062 -14.120 709 HG22 THR 86 HG22 THR 86 3.763 -7.520 -13.695 710 HG23 THR 86 HG23 THR 86 5.049 -7.498 -12.474 711 H ASP 87 H ASP 87 4.108 -10.874 -10.037 712 HA ASP 87 HA ASP 87 3.337 -13.453 -11.141 713 HB2 ASP 87 HB2 ASP 87 5.590 -13.010 -10.302 714 HB3 ASP 87 HB3 ASP 87 4.938 -12.670 -8.695 715 H SER 88 H SER 88 2.743 -11.817 -8.018 716 HA SER 88 HA SER 88 0.587 -13.846 -7.399 717 HB2 SER 88 HB2 SER 88 2.935 -12.974 -5.698 718 HB3 SER 88 HB3 SER 88 1.464 -13.671 -5.003 719 HG SER 88 HG SER 88 3.231 -14.898 -6.877 720 H SER 89 H SER 89 -1.306 -12.920 -7.137 721 HA SER 89 HA SER 89 -1.673 -10.139 -6.802 722 HB2 SER 89 HB2 SER 89 -3.775 -12.297 -6.533 723 HB3 SER 89 HB3 SER 89 -4.023 -10.609 -7.016 724 HG SER 89 HG SER 89 -2.848 -11.032 -8.916 725 H ARG 90 H ARG 90 -0.361 -11.222 -4.437 726 HA ARG 90 HA ARG 90 -2.087 -10.010 -2.368 727 HB2 ARG 90 HB2 ARG 90 -1.322 -11.613 -0.652 728 HB3 ARG 90 HB3 ARG 90 -2.365 -12.288 -1.893 729 HG2 ARG 90 HG2 ARG 90 -0.488 -13.297 -3.040 730 HG3 ARG 90 HG3 ARG 90 0.654 -12.549 -1.914 731 HD2 ARG 90 HD2 ARG 90 -1.517 -14.441 -0.949 732 HD3 ARG 90 HD3 ARG 90 0.000 -15.036 -1.630 733 HE ARG 90 HE ARG 90 0.172 -13.078 0.610 734 HH11 ARG 90 HH11 ARG 90 1.378 -13.578 2.289 735 HH12 ARG 90 HH12 ARG 90 2.027 -15.193 2.519 736 HH21 ARG 90 HH21 ARG 90 0.550 -16.451 -0.324 737 HH22 ARG 90 HH22 ARG 90 1.544 -16.791 1.066 738 H TYR 91 H TYR 91 0.067 -8.958 -4.052 739 HA TYR 91 HA TYR 91 1.684 -7.738 -1.899 740 HB2 TYR 91 HB2 TYR 91 2.762 -8.972 -4.455 741 HB3 TYR 91 HB3 TYR 91 3.687 -7.966 -3.367 742 HD1 TYR 91 HD1 TYR 91 2.359 -11.310 -3.975 743 HD2 TYR 91 HD2 TYR 91 4.257 -8.766 -1.068 744 HE1 TYR 91 HE1 TYR 91 3.006 -13.315 -2.656 745 HE2 TYR 91 HE2 TYR 91 4.825 -10.769 0.308 746 HH TYR 91 HH TYR 91 4.020 -14.096 -0.751 747 H PHE 92 H PHE 92 2.062 -5.586 -2.195 748 HA PHE 92 HA PHE 92 1.433 -4.302 -4.808 749 HB2 PHE 92 HB2 PHE 92 0.386 -3.334 -2.121 750 HB3 PHE 92 HB3 PHE 92 0.141 -2.555 -3.668 751 HD1 PHE 92 HD1 PHE 92 -1.295 -3.669 -5.434 752 HD2 PHE 92 HD2 PHE 92 -0.998 -5.120 -1.400 753 HE1 PHE 92 HE1 PHE 92 -3.363 -5.032 -5.761 754 HE2 PHE 92 HE2 PHE 92 -3.099 -6.385 -1.678 755 HZ PHE 92 HZ PHE 92 -4.271 -6.383 -3.885 756 H VAL 93 H VAL 93 2.166 -2.047 -4.856 757 HA VAL 93 HA VAL 93 4.342 -1.375 -2.922 758 HB VAL 93 HB VAL 93 4.334 -0.884 -5.922 759 HG11 VAL 93 HG11 VAL 93 6.356 0.105 -3.869 760 HG12 VAL 93 HG12 VAL 93 6.493 0.237 -5.631 761 HG13 VAL 93 HG13 VAL 93 5.222 1.118 -4.794 762 HG21 VAL 93 HG21 VAL 93 5.083 -3.101 -5.402 763 HG22 VAL 93 HG22 VAL 93 6.540 -2.148 -5.703 764 HG23 VAL 93 HG23 VAL 93 6.084 -2.529 -4.050 765 H ILE 94 H ILE 94 4.291 0.752 -2.141 766 HA ILE 94 HA ILE 94 2.346 2.573 -3.411 767 HB ILE 94 HB ILE 94 1.468 3.405 -1.371 768 HG12 ILE 94 HG12 ILE 94 3.279 2.631 0.216 769 HG13 ILE 94 HG13 ILE 94 1.626 2.488 0.776 770 HG21 ILE 94 HG21 ILE 94 0.842 0.464 -1.754 771 HG22 ILE 94 HG22 ILE 94 -0.159 1.647 -0.880 772 HG23 ILE 94 HG23 ILE 94 0.145 1.846 -2.607 773 HD11 ILE 94 HD11 ILE 94 1.659 0.050 0.354 774 HD12 ILE 94 HD12 ILE 94 3.334 0.159 -0.211 775 HD13 ILE 94 HD13 ILE 94 2.932 0.558 1.466 776 H ARG 95 H ARG 95 2.714 4.756 -3.170 777 HA ARG 95 HA ARG 95 5.570 5.391 -2.552 778 HB2 ARG 95 HB2 ARG 95 4.580 6.027 -4.783 779 HB3 ARG 95 HB3 ARG 95 3.622 7.251 -3.931 780 HG2 ARG 95 HG2 ARG 95 5.724 8.240 -3.028 781 HG3 ARG 95 HG3 ARG 95 6.666 7.011 -3.895 782 HD2 ARG 95 HD2 ARG 95 5.723 7.856 -6.041 783 HD3 ARG 95 HD3 ARG 95 4.875 9.133 -5.152 784 HE ARG 95 HE ARG 95 7.367 9.626 -4.304 785 HH11 ARG 95 HH11 ARG 95 9.004 10.675 -5.119 786 HH12 ARG 95 HH12 ARG 95 9.236 10.833 -6.849 787 HH21 ARG 95 HH21 ARG 95 6.400 9.032 -7.617 788 HH22 ARG 95 HH22 ARG 95 7.770 9.911 -8.245 789 H ILE 96 H ILE 96 5.647 5.481 -0.377 790 HA ILE 96 HA ILE 96 3.730 7.059 1.155 791 HB ILE 96 HB ILE 96 4.957 6.561 3.126 792 HG12 ILE 96 HG12 ILE 96 6.830 4.628 2.699 793 HG13 ILE 96 HG13 ILE 96 7.130 5.613 1.280 794 HG21 ILE 96 HG21 ILE 96 4.503 4.133 1.379 795 HG22 ILE 96 HG22 ILE 96 4.646 4.115 3.140 796 HG23 ILE 96 HG23 ILE 96 3.309 4.974 2.404 797 HD11 ILE 96 HD11 ILE 96 7.468 7.594 2.795 798 HD12 ILE 96 HD12 ILE 96 7.177 6.520 4.190 799 HD13 ILE 96 HD13 ILE 96 8.580 6.254 3.139 800 H GLN 97 H GLN 97 4.013 9.018 2.168 801 HA GLN 97 HA GLN 97 6.222 10.782 1.212 802 HB2 GLN 97 HB2 GLN 97 3.250 11.297 0.909 803 HB3 GLN 97 HB3 GLN 97 4.479 12.533 0.723 804 HG2 GLN 97 HG2 GLN 97 5.141 11.841 -1.334 805 HG3 GLN 97 HG3 GLN 97 4.858 10.130 -1.012 806 HE21 GLN 97 HE21 GLN 97 1.614 10.103 -2.381 807 HE22 GLN 97 HE22 GLN 97 2.951 9.199 -1.675 808 H ASP 98 H ASP 98 6.680 12.477 2.480 809 HA ASP 98 HA ASP 98 5.609 12.444 5.255 810 HB2 ASP 98 HB2 ASP 98 8.092 12.467 4.636 811 HB3 ASP 98 HB3 ASP 98 7.834 14.145 4.146 812 H GLY 99 H GLY 99 4.652 13.956 2.493 813 HA2 GLY 99 HA2 GLY 99 2.957 15.527 2.206 814 HA3 GLY 99 HA3 GLY 99 3.075 15.987 3.904 815 H THR 100 H THR 100 6.084 16.039 2.298 816 HA THR 100 HA THR 100 5.973 18.962 1.703 817 HB THR 100 HB THR 100 6.629 18.567 4.049 818 HG1 THR 100 HG1 THR 100 8.622 19.621 2.352 819 HG21 THR 100 HG21 THR 100 8.811 17.669 4.623 820 HG22 THR 100 HG22 THR 100 7.843 16.432 3.810 821 HG23 THR 100 HG23 THR 100 9.142 17.265 2.927 822 H GLY 101 H GLY 101 6.284 16.402 0.030 823 HA2 GLY 101 HA2 GLY 101 7.247 16.167 -2.092 824 HA3 GLY 101 HA3 GLY 101 8.457 17.390 -1.712 825 H ARG 102 H ARG 102 8.642 15.438 0.891 826 HA ARG 102 HA ARG 102 10.796 13.646 -0.001 827 HB2 ARG 102 HB2 ARG 102 9.189 13.806 2.574 828 HB3 ARG 102 HB3 ARG 102 10.558 12.725 2.322 829 HG2 ARG 102 HG2 ARG 102 12.085 14.553 2.157 830 HG3 ARG 102 HG3 ARG 102 10.758 15.742 2.142 831 HD2 ARG 102 HD2 ARG 102 10.071 14.998 4.405 832 HD3 ARG 102 HD3 ARG 102 11.457 13.897 4.469 833 HE ARG 102 HE ARG 102 12.748 16.188 4.016 834 HH11 ARG 102 HH11 ARG 102 13.415 17.760 5.410 835 HH12 ARG 102 HH12 ARG 102 12.518 18.083 6.864 836 HH21 ARG 102 HH21 ARG 102 10.079 15.721 6.326 837 HH22 ARG 102 HH22 ARG 102 10.718 16.963 7.365 838 H SER 103 H SER 103 10.450 11.713 -0.780 839 HA SER 103 HA SER 103 8.203 10.138 0.148 840 HB2 SER 103 HB2 SER 103 7.264 9.589 -2.055 841 HB3 SER 103 HB3 SER 103 7.187 11.328 -1.751 842 HG SER 103 HG SER 103 9.067 11.585 -3.009 843 H ALA 104 H ALA 104 8.168 7.895 -0.505 844 HA ALA 104 HA ALA 104 10.480 6.767 -1.938 845 HB1 ALA 104 HB1 ALA 104 11.239 6.792 0.425 846 HB2 ALA 104 HB2 ALA 104 9.763 5.926 0.908 847 HB3 ALA 104 HB3 ALA 104 10.957 5.136 -0.143 848 H PHE 105 H PHE 105 10.052 4.808 -2.914 849 HA PHE 105 HA PHE 105 7.249 3.797 -2.835 850 HB2 PHE 105 HB2 PHE 105 9.609 3.176 -4.631 851 HB3 PHE 105 HB3 PHE 105 8.138 2.223 -4.600 852 HD1 PHE 105 HD1 PHE 105 9.641 5.348 -5.808 853 HD2 PHE 105 HD2 PHE 105 5.945 3.186 -5.302 854 HE1 PHE 105 HE1 PHE 105 8.576 6.746 -7.553 855 HE2 PHE 105 HE2 PHE 105 4.891 4.564 -7.061 856 HZ PHE 105 HZ PHE 105 6.212 6.334 -8.212 857 H ILE 106 H ILE 106 6.736 2.245 -1.464 858 HA ILE 106 HA ILE 106 8.822 0.279 -0.584 859 HB ILE 106 HB ILE 106 7.892 0.100 1.571 860 HG12 ILE 106 HG12 ILE 106 5.798 2.195 0.855 861 HG13 ILE 106 HG13 ILE 106 5.491 0.468 1.060 862 HG21 ILE 106 HG21 ILE 106 8.162 3.071 0.984 863 HG22 ILE 106 HG22 ILE 106 8.554 2.230 2.500 864 HG23 ILE 106 HG23 ILE 106 9.533 1.942 1.059 865 HD11 ILE 106 HD11 ILE 106 6.400 2.346 3.263 866 HD12 ILE 106 HD12 ILE 106 4.811 1.596 3.061 867 HD13 ILE 106 HD13 ILE 106 6.223 0.585 3.418 868 H GLY 107 H GLY 107 8.244 -1.883 -0.381 869 HA2 GLY 107 HA2 GLY 107 5.814 -2.709 -1.891 870 HA3 GLY 107 HA3 GLY 107 7.199 -3.725 -1.494 871 H ILE 108 H ILE 108 4.230 -3.941 -0.946 872 HA ILE 108 HA ILE 108 4.519 -4.740 1.873 873 HB ILE 108 HB ILE 108 2.164 -4.255 2.330 874 HG12 ILE 108 HG12 ILE 108 2.176 -2.485 -0.148 875 HG13 ILE 108 HG13 ILE 108 1.362 -4.047 -0.040 876 HG21 ILE 108 HG21 ILE 108 3.997 -2.867 3.128 877 HG22 ILE 108 HG22 ILE 108 3.879 -1.829 1.690 878 HG23 ILE 108 HG23 ILE 108 2.546 -1.900 2.861 879 HD11 ILE 108 HD11 ILE 108 -0.274 -2.329 0.345 880 HD12 ILE 108 HD12 ILE 108 -0.010 -3.196 1.872 881 HD13 ILE 108 HD13 ILE 108 0.693 -1.591 1.630 882 H GLY 109 H GLY 109 3.752 -6.662 2.439 883 HA2 GLY 109 HA2 GLY 109 2.406 -8.373 0.372 884 HA3 GLY 109 HA3 GLY 109 3.639 -8.958 1.487 885 H PHE 110 H PHE 110 0.711 -9.521 0.899 886 HA PHE 110 HA PHE 110 -0.538 -9.219 3.589 887 HB2 PHE 110 HB2 PHE 110 -1.606 -9.791 0.806 888 HB3 PHE 110 HB3 PHE 110 -2.575 -10.031 2.241 889 HD1 PHE 110 HD1 PHE 110 -0.435 -7.304 0.693 890 HD2 PHE 110 HD2 PHE 110 -4.010 -8.338 2.885 891 HE1 PHE 110 HE1 PHE 110 -1.098 -4.923 0.757 892 HE2 PHE 110 HE2 PHE 110 -4.717 -5.966 2.829 893 HZ PHE 110 HZ PHE 110 -3.239 -4.253 1.784 894 H THR 111 H THR 111 -1.798 -11.059 4.395 895 HA THR 111 HA THR 111 -0.240 -13.510 4.401 896 HB THR 111 HB THR 111 -1.357 -12.534 6.380 897 HG1 THR 111 HG1 THR 111 -1.977 -14.521 7.194 898 HG21 THR 111 HG21 THR 111 -3.951 -13.656 5.236 899 HG22 THR 111 HG22 THR 111 -3.709 -12.922 6.833 900 HG23 THR 111 HG23 THR 111 -3.566 -11.926 5.381 901 H ASP 112 H ASP 112 -3.095 -12.457 2.635 902 HA ASP 112 HA ASP 112 -3.103 -14.915 1.072 903 HB2 ASP 112 HB2 ASP 112 -4.490 -15.463 3.120 904 HB3 ASP 112 HB3 ASP 112 -5.583 -14.154 2.675 905 H ARG 113 H ARG 113 -4.366 -14.777 -0.850 906 HA ARG 113 HA ARG 113 -4.535 -12.212 -2.119 907 HB2 ARG 113 HB2 ARG 113 -4.162 -14.364 -3.275 908 HB3 ARG 113 HB3 ARG 113 -5.808 -14.877 -2.864 909 HG2 ARG 113 HG2 ARG 113 -6.742 -13.032 -4.212 910 HG3 ARG 113 HG3 ARG 113 -5.105 -12.436 -4.559 911 HD2 ARG 113 HD2 ARG 113 -4.569 -14.503 -5.746 912 HD3 ARG 113 HD3 ARG 113 -6.133 -15.213 -5.303 913 HE ARG 113 HE ARG 113 -6.976 -13.014 -6.601 914 HH11 ARG 113 HH11 ARG 113 -7.387 -12.772 -8.771 915 HH12 ARG 113 HH12 ARG 113 -6.483 -13.692 -9.935 916 HH21 ARG 113 HH21 ARG 113 -4.617 -15.398 -7.628 917 HH22 ARG 113 HH22 ARG 113 -4.959 -15.138 -9.315 918 H GLY 114 H GLY 114 -7.032 -14.069 -0.364 919 HA2 GLY 114 HA2 GLY 114 -9.286 -12.499 -1.214 920 HA3 GLY 114 HA3 GLY 114 -9.166 -13.478 0.255 921 H ASP 115 H ASP 115 -6.845 -11.973 1.319 922 HA ASP 115 HA ASP 115 -8.281 -9.646 2.449 923 HB2 ASP 115 HB2 ASP 115 -5.617 -10.964 3.093 924 HB3 ASP 115 HB3 ASP 115 -6.178 -9.471 3.849 925 H ALA 116 H ALA 116 -5.454 -10.261 0.306 926 HA ALA 116 HA ALA 116 -4.776 -7.502 -0.078 927 HB1 ALA 116 HB1 ALA 116 -4.511 -9.960 -1.848 928 HB2 ALA 116 HB2 ALA 116 -3.723 -8.411 -2.153 929 HB3 ALA 116 HB3 ALA 116 -3.317 -9.331 -0.685 930 H PHE 117 H PHE 117 -7.237 -9.572 -1.719 931 HA PHE 117 HA PHE 117 -7.939 -7.641 -3.678 932 HB2 PHE 117 HB2 PHE 117 -9.160 -10.114 -2.607 933 HB3 PHE 117 HB3 PHE 117 -10.312 -8.936 -3.209 934 HD1 PHE 117 HD1 PHE 117 -10.972 -9.264 -5.416 935 HD2 PHE 117 HD2 PHE 117 -6.885 -10.123 -4.326 936 HE1 PHE 117 HE1 PHE 117 -10.450 -9.804 -7.779 937 HE2 PHE 117 HE2 PHE 117 -6.364 -10.636 -6.693 938 HZ PHE 117 HZ PHE 117 -8.145 -10.468 -8.430 939 H ASP 118 H ASP 118 -8.913 -7.723 -0.252 940 HA ASP 118 HA ASP 118 -10.880 -5.612 -0.535 941 HB2 ASP 118 HB2 ASP 118 -9.292 -6.629 1.851 942 HB3 ASP 118 HB3 ASP 118 -10.453 -5.314 1.957 943 H PHE 119 H PHE 119 -7.335 -5.526 -0.279 944 HA PHE 119 HA PHE 119 -7.099 -2.696 0.266 945 HB2 PHE 119 HB2 PHE 119 -5.263 -4.132 0.685 946 HB3 PHE 119 HB3 PHE 119 -5.222 -4.731 -0.955 947 HD1 PHE 119 HD1 PHE 119 -4.473 -3.320 -2.861 948 HD2 PHE 119 HD2 PHE 119 -4.027 -2.128 1.249 949 HE1 PHE 119 HE1 PHE 119 -2.865 -1.563 -3.543 950 HE2 PHE 119 HE2 PHE 119 -2.439 -0.373 0.575 951 HZ PHE 119 HZ PHE 119 -1.841 -0.075 -1.825 952 H ASN 120 H ASN 120 -7.097 -4.520 -2.847 953 HA ASN 120 HA ASN 120 -7.016 -1.970 -4.298 954 HB2 ASN 120 HB2 ASN 120 -6.891 -3.277 -6.321 955 HB3 ASN 120 HB3 ASN 120 -5.712 -3.812 -5.133 956 HD21 ASN 120 HD21 ASN 120 -8.688 -6.390 -6.274 957 HD22 ASN 120 HD22 ASN 120 -8.943 -4.675 -6.530 958 H VAL 121 H VAL 121 -9.643 -4.150 -3.391 959 HA VAL 121 HA VAL 121 -11.531 -2.892 -5.234 960 HB VAL 121 HB VAL 121 -11.901 -4.777 -2.900 961 HG11 VAL 121 HG11 VAL 121 -14.031 -3.659 -4.778 962 HG12 VAL 121 HG12 VAL 121 -14.253 -5.053 -3.697 963 HG13 VAL 121 HG13 VAL 121 -13.963 -3.456 -3.012 964 HG21 VAL 121 HG21 VAL 121 -12.296 -5.108 -5.917 965 HG22 VAL 121 HG22 VAL 121 -10.914 -5.725 -4.995 966 HG23 VAL 121 HG23 VAL 121 -12.525 -6.368 -4.684 967 H SER 122 H SER 122 -10.763 -2.435 -1.726 968 HA SER 122 HA SER 122 -12.870 -0.551 -1.281 969 HB2 SER 122 HB2 SER 122 -11.661 0.093 0.722 970 HB3 SER 122 HB3 SER 122 -11.691 -1.673 0.548 971 HG SER 122 HG SER 122 -9.622 -1.703 0.043 972 H LEU 123 H LEU 123 -9.616 -0.075 -2.599 973 HA LEU 123 HA LEU 123 -9.772 2.819 -2.709 974 HB2 LEU 123 HB2 LEU 123 -8.102 0.737 -4.159 975 HB3 LEU 123 HB3 LEU 123 -7.934 2.465 -4.462 976 HG LEU 123 HG LEU 123 -7.525 1.207 -1.715 977 HD11 LEU 123 HD11 LEU 123 -5.125 1.461 -2.162 978 HD12 LEU 123 HD12 LEU 123 -5.860 0.387 -3.354 979 HD13 LEU 123 HD13 LEU 123 -5.473 2.062 -3.803 980 HD21 LEU 123 HD21 LEU 123 -8.063 3.613 -1.604 981 HD22 LEU 123 HD22 LEU 123 -6.363 3.340 -1.228 982 HD23 LEU 123 HD23 LEU 123 -6.819 3.960 -2.828 983 H GLN 124 H GLN 124 -10.318 0.319 -5.302 984 HA GLN 124 HA GLN 124 -11.054 2.343 -7.181 985 HB2 GLN 124 HB2 GLN 124 -11.417 0.643 -8.725 986 HB3 GLN 124 HB3 GLN 124 -10.165 0.019 -7.652 987 HG2 GLN 124 HG2 GLN 124 -11.996 -1.223 -6.418 988 HG3 GLN 124 HG3 GLN 124 -13.096 -0.774 -7.722 989 HE21 GLN 124 HE21 GLN 124 -10.045 -3.442 -8.535 990 HE22 GLN 124 HE22 GLN 124 -9.890 -2.329 -7.159 991 H ASP 125 H ASP 125 -13.086 0.507 -4.913 992 HA ASP 125 HA ASP 125 -15.544 1.599 -6.074 993 HB2 ASP 125 HB2 ASP 125 -15.426 -0.714 -5.168 994 HB3 ASP 125 HB3 ASP 125 -15.096 -0.056 -3.563 995 H HIS 126 H HIS 126 -13.165 2.925 -4.132 996 HA HIS 126 HA HIS 126 -15.096 4.880 -2.970 997 HB2 HIS 126 HB2 HIS 126 -13.373 4.065 -1.442 998 HB3 HIS 126 HB3 HIS 126 -12.103 4.582 -2.558 999 HD2 HIS 126 HD2 HIS 126 -11.208 6.984 -2.221 1000 HE1 HIS 126 HE1 HIS 126 -14.304 8.573 0.242 1001 HE2 HIS 126 HE2 HIS 126 -11.989 8.995 -0.726 1002 H PHE 127 H PHE 127 -12.514 4.586 -5.395 1003 HA PHE 127 HA PHE 127 -12.861 7.407 -6.177 1004 HB2 PHE 127 HB2 PHE 127 -10.950 5.188 -6.963 1005 HB3 PHE 127 HB3 PHE 127 -11.013 6.694 -7.847 1006 HD1 PHE 127 HD1 PHE 127 -10.939 8.918 -6.350 1007 HD2 PHE 127 HD2 PHE 127 -9.333 5.086 -5.219 1008 HE1 PHE 127 HE1 PHE 127 -9.216 10.047 -4.965 1009 HE2 PHE 127 HE2 PHE 127 -7.573 6.206 -3.895 1010 HZ PHE 127 HZ PHE 127 -7.508 8.698 -3.766 1011 H LYS 128 H LYS 128 -14.579 4.639 -7.206 1012 HA LYS 128 HA LYS 128 -14.590 4.940 -9.931 1013 HB2 LYS 128 HB2 LYS 128 -16.589 3.803 -10.136 1014 HB3 LYS 128 HB3 LYS 128 -15.775 3.122 -8.748 1015 HG2 LYS 128 HG2 LYS 128 -17.965 5.230 -8.400 1016 HG3 LYS 128 HG3 LYS 128 -18.354 3.552 -8.738 1017 HD2 LYS 128 HD2 LYS 128 -17.218 2.775 -6.784 1018 HD3 LYS 128 HD3 LYS 128 -16.641 4.408 -6.370 1019 HE2 LYS 128 HE2 LYS 128 -18.781 5.171 -5.815 1020 HE3 LYS 128 HE3 LYS 128 -19.595 3.899 -6.752 1021 HZ1 LYS 128 HZ1 LYS 128 -19.732 3.409 -4.376 1022 HZ2 LYS 128 HZ2 LYS 128 -18.781 2.271 -5.109 1023 HZ3 LYS 128 HZ3 LYS 128 -18.086 3.436 -4.244 1024 H TRP 129 H TRP 129 -16.261 7.135 -7.787 1025 HA TRP 129 HA TRP 129 -17.702 8.512 -9.927 1026 HB2 TRP 129 HB2 TRP 129 -18.489 9.969 -8.198 1027 HB3 TRP 129 HB3 TRP 129 -18.611 8.306 -7.648 1028 HD1 TRP 129 HD1 TRP 129 -16.683 7.513 -5.830 1029 HE1 TRP 129 HE1 TRP 129 -15.392 8.801 -4.065 1030 HE3 TRP 129 HE3 TRP 129 -17.613 12.285 -7.474 1031 HZ2 TRP 129 HZ2 TRP 129 -15.085 11.571 -3.237 1032 HZ3 TRP 129 HZ3 TRP 129 -16.862 14.232 -6.128 1033 HH2 TRP 129 HH2 TRP 129 -15.624 13.889 -4.001 1034 H VAL 130 H VAL 130 -14.539 8.791 -8.534 1035 HA VAL 130 HA VAL 130 -13.994 11.472 -9.655 1036 HB VAL 130 HB VAL 130 -12.103 9.482 -8.353 1037 HG11 VAL 130 HG11 VAL 130 -11.774 12.450 -8.969 1038 HG12 VAL 130 HG12 VAL 130 -10.633 11.452 -8.040 1039 HG13 VAL 130 HG13 VAL 130 -10.898 11.113 -9.749 1040 HG21 VAL 130 HG21 VAL 130 -12.248 11.021 -6.373 1041 HG22 VAL 130 HG22 VAL 130 -13.572 11.886 -7.181 1042 HG23 VAL 130 HG23 VAL 130 -13.766 10.187 -6.704 1043 H LYS 131 H LYS 131 -13.429 8.057 -10.332 1044 HA LYS 131 HA LYS 131 -11.878 8.575 -12.780 1045 HB2 LYS 131 HB2 LYS 131 -11.142 6.977 -11.008 1046 HB3 LYS 131 HB3 LYS 131 -12.556 5.984 -11.324 1047 HG2 LYS 131 HG2 LYS 131 -10.467 5.106 -12.302 1048 HG3 LYS 131 HG3 LYS 131 -11.705 5.368 -13.517 1049 HD2 LYS 131 HD2 LYS 131 -10.595 7.464 -14.235 1050 HD3 LYS 131 HD3 LYS 131 -9.363 7.248 -12.965 1051 HE2 LYS 131 HE2 LYS 131 -8.689 5.101 -13.994 1052 HE3 LYS 131 HE3 LYS 131 -9.967 5.274 -15.208 1053 HZ1 LYS 131 HZ1 LYS 131 -7.685 7.154 -14.916 1054 HZ2 LYS 131 HZ2 LYS 131 -7.811 6.001 -16.071 1055 HZ3 LYS 131 HZ3 LYS 131 -8.870 7.245 -16.052 1056 H GLN 132 H GLN 132 -14.295 9.580 -13.132 1057 HA GLN 132 HA GLN 132 -16.055 7.680 -14.533 1058 HB2 GLN 132 HB2 GLN 132 -16.270 10.636 -13.916 1059 HB3 GLN 132 HB3 GLN 132 -17.388 9.796 -14.995 1060 HG2 GLN 132 HG2 GLN 132 -16.897 8.937 -12.123 1061 HG3 GLN 132 HG3 GLN 132 -18.179 10.046 -12.601 1062 HE21 GLN 132 HE21 GLN 132 -18.784 6.071 -13.075 1063 HE22 GLN 132 HE22 GLN 132 -17.355 6.707 -12.257 1064 H GLU 133 H GLU 133 -14.972 7.001 -16.218 1065 HA GLU 133 HA GLU 133 -14.666 8.798 -18.579 1066 HB2 GLU 133 HB2 GLU 133 -12.570 6.792 -17.653 1067 HB3 GLU 133 HB3 GLU 133 -12.624 7.532 -19.256 1068 HG2 GLU 133 HG2 GLU 133 -12.474 9.801 -18.173 1069 HG3 GLU 133 HG3 GLU 133 -12.242 9.000 -16.614 Start of MODEL 13 1 H1 GLY -4 H1 GLY -4 9.422 21.345 11.047 2 H2 GLY -4 H2 GLY -4 9.470 19.921 10.240 3 H3 GLY -4 H3 GLY -4 9.656 19.949 11.869 4 HA2 GLY -4 HA2 GLY -4 7.196 20.687 10.422 5 HA3 GLY -4 HA3 GLY -4 7.450 19.163 11.292 6 H SER -3 H SER -3 5.417 21.264 11.742 7 HA SER -3 HA SER -3 6.115 22.752 14.118 8 HB2 SER -3 HB2 SER -3 4.449 23.552 12.539 9 HB3 SER -3 HB3 SER -3 3.415 22.152 12.879 10 HG SER -3 HG SER -3 2.854 24.072 14.035 11 HA PRO -2 HA PRO -2 4.988 19.458 17.053 12 HB2 PRO -2 HB2 PRO -2 5.384 20.751 19.399 13 HB3 PRO -2 HB3 PRO -2 6.746 20.344 18.311 14 HG2 PRO -2 HG2 PRO -2 5.255 22.987 18.509 15 HG3 PRO -2 HG3 PRO -2 7.027 22.715 18.570 16 HD2 PRO -2 HD2 PRO -2 5.732 23.402 16.260 17 HD3 PRO -2 HD3 PRO -2 7.142 22.301 16.259 18 H ASN -1 H ASN -1 3.148 22.163 16.253 19 HA ASN -1 HA ASN -1 1.258 22.112 18.469 20 HB2 ASN -1 HB2 ASN -1 1.307 23.743 15.901 21 HB3 ASN -1 HB3 ASN -1 0.212 23.998 17.247 22 HD21 ASN -1 HD21 ASN -1 3.984 25.456 17.521 23 HD22 ASN -1 HD22 ASN -1 3.500 24.498 16.122 24 H SER 0 H SER 0 1.335 19.599 16.921 25 HA SER 0 HA SER 0 -0.847 19.336 15.118 26 HB2 SER 0 HB2 SER 0 -0.664 16.909 15.633 27 HB3 SER 0 HB3 SER 0 0.889 17.673 15.250 28 HG SER 0 HG SER 0 1.032 16.315 17.099 29 H MET 1 H MET 1 -0.796 19.158 18.657 30 HA MET 1 HA MET 1 -3.632 18.441 18.853 31 HB2 MET 1 HB2 MET 1 -1.626 19.193 21.009 32 HB3 MET 1 HB3 MET 1 -3.241 18.530 21.285 33 HG2 MET 1 HG2 MET 1 -0.962 17.113 19.857 34 HG3 MET 1 HG3 MET 1 -1.514 16.815 21.501 35 HE1 MET 1 HE1 MET 1 -1.568 14.226 20.913 36 HE2 MET 1 HE2 MET 1 -2.485 13.541 19.552 37 HE3 MET 1 HE3 MET 1 -1.079 14.583 19.240 38 H ALA 2 H ALA 2 -2.613 21.150 17.719 39 HA ALA 2 HA ALA 2 -4.703 22.823 19.032 40 HB1 ALA 2 HB1 ALA 2 -2.518 23.498 19.952 41 HB2 ALA 2 HB2 ALA 2 -1.892 23.751 18.307 42 HB3 ALA 2 HB3 ALA 2 -3.207 24.771 18.925 43 H THR 3 H THR 3 -2.576 22.462 16.119 44 HA THR 3 HA THR 3 -4.404 23.754 14.291 45 HB THR 3 HB THR 3 -2.366 21.560 13.757 46 HG1 THR 3 HG1 THR 3 -1.011 23.286 13.259 47 HG21 THR 3 HG21 THR 3 -2.280 22.548 11.469 48 HG22 THR 3 HG22 THR 3 -3.870 21.867 11.828 49 HG23 THR 3 HG23 THR 3 -3.629 23.628 11.896 50 H GLU 4 H GLU 4 -3.986 20.468 15.401 51 HA GLU 4 HA GLU 4 -5.353 18.653 15.521 52 HB2 GLU 4 HB2 GLU 4 -5.776 20.420 17.299 53 HB3 GLU 4 HB3 GLU 4 -7.285 20.785 16.460 54 HG2 GLU 4 HG2 GLU 4 -7.878 18.307 16.695 55 HG3 GLU 4 HG3 GLU 4 -6.370 18.110 17.599 56 H LEU 5 H LEU 5 -5.477 18.227 13.170 57 HA LEU 5 HA LEU 5 -8.136 18.493 11.967 58 HB2 LEU 5 HB2 LEU 5 -7.408 17.291 10.166 59 HB3 LEU 5 HB3 LEU 5 -6.101 18.356 10.627 60 HG LEU 5 HG LEU 5 -5.184 16.211 11.894 61 HD11 LEU 5 HD11 LEU 5 -7.145 14.732 11.419 62 HD12 LEU 5 HD12 LEU 5 -6.895 14.969 9.684 63 HD13 LEU 5 HD13 LEU 5 -5.679 14.118 10.659 64 HD21 LEU 5 HD21 LEU 5 -5.109 16.503 8.865 65 HD22 LEU 5 HD22 LEU 5 -4.064 17.351 10.027 66 HD23 LEU 5 HD23 LEU 5 -3.941 15.593 9.853 67 H GLU 6 H GLU 6 -9.784 17.162 11.988 68 HA GLU 6 HA GLU 6 -9.687 14.648 13.582 69 HB2 GLU 6 HB2 GLU 6 -10.458 16.686 14.916 70 HB3 GLU 6 HB3 GLU 6 -11.888 16.724 13.883 71 HG2 GLU 6 HG2 GLU 6 -12.416 14.368 14.632 72 HG3 GLU 6 HG3 GLU 6 -10.965 14.386 15.627 73 H TYR 7 H TYR 7 -9.426 14.423 10.990 74 HA TYR 7 HA TYR 7 -12.026 13.350 10.068 75 HB2 TYR 7 HB2 TYR 7 -11.862 14.244 7.908 76 HB3 TYR 7 HB3 TYR 7 -11.635 15.600 8.986 77 HD1 TYR 7 HD1 TYR 7 -9.543 16.867 8.964 78 HD2 TYR 7 HD2 TYR 7 -9.914 13.253 6.629 79 HE1 TYR 7 HE1 TYR 7 -7.451 17.429 7.731 80 HE2 TYR 7 HE2 TYR 7 -7.930 13.870 5.321 81 HH TYR 7 HH TYR 7 -6.027 16.850 6.029 82 H GLU 8 H GLU 8 -11.866 11.362 9.181 83 HA GLU 8 HA GLU 8 -9.975 10.558 7.313 84 HB2 GLU 8 HB2 GLU 8 -9.117 10.034 10.107 85 HB3 GLU 8 HB3 GLU 8 -9.356 8.514 9.248 86 HG2 GLU 8 HG2 GLU 8 -7.763 9.090 7.554 87 HG3 GLU 8 HG3 GLU 8 -7.664 10.756 8.090 88 H SER 9 H SER 9 -11.222 9.300 6.051 89 HA SER 9 HA SER 9 -13.348 7.666 7.366 90 HB2 SER 9 HB2 SER 9 -14.467 7.535 5.338 91 HB3 SER 9 HB3 SER 9 -14.051 9.237 5.691 92 HG SER 9 HG SER 9 -12.305 8.972 4.172 93 H VAL 10 H VAL 10 -12.716 5.765 7.958 94 HA VAL 10 HA VAL 10 -10.522 4.315 6.757 95 HB VAL 10 HB VAL 10 -12.639 3.398 8.742 96 HG11 VAL 10 HG11 VAL 10 -9.993 2.101 7.938 97 HG12 VAL 10 HG12 VAL 10 -10.984 1.634 9.341 98 HG13 VAL 10 HG13 VAL 10 -11.624 1.415 7.717 99 HG21 VAL 10 HG21 VAL 10 -9.762 4.341 9.119 100 HG22 VAL 10 HG22 VAL 10 -11.214 5.252 9.588 101 HG23 VAL 10 HG23 VAL 10 -10.830 3.735 10.404 102 H LEU 11 H LEU 11 -10.461 2.563 5.467 103 HA LEU 11 HA LEU 11 -12.916 1.880 3.864 104 HB2 LEU 11 HB2 LEU 11 -10.098 2.449 2.856 105 HB3 LEU 11 HB3 LEU 11 -11.442 1.897 1.868 106 HG LEU 11 HG LEU 11 -11.273 4.585 3.280 107 HD11 LEU 11 HD11 LEU 11 -9.776 4.468 1.373 108 HD12 LEU 11 HD12 LEU 11 -11.053 3.765 0.357 109 HD13 LEU 11 HD13 LEU 11 -11.190 5.434 0.930 110 HD21 LEU 11 HD21 LEU 11 -13.395 3.523 1.361 111 HD22 LEU 11 HD22 LEU 11 -13.636 3.831 3.097 112 HD23 LEU 11 HD23 LEU 11 -13.289 5.176 2.019 113 H CYS 12 H CYS 12 -9.670 0.803 4.874 114 HA CYS 12 HA CYS 12 -10.639 -1.975 5.071 115 HB2 CYS 12 HB2 CYS 12 -9.642 -1.862 2.788 116 HB3 CYS 12 HB3 CYS 12 -8.151 -1.208 3.500 117 HG CYS 12 HG CYS 12 -9.564 -4.175 3.914 118 H VAL 13 H VAL 13 -9.823 -2.912 6.832 119 HA VAL 13 HA VAL 13 -7.255 -1.938 7.976 120 HB VAL 13 HB VAL 13 -9.754 -2.610 9.549 121 HG11 VAL 13 HG11 VAL 13 -6.911 -2.112 10.557 122 HG12 VAL 13 HG12 VAL 13 -8.364 -2.175 11.578 123 HG13 VAL 13 HG13 VAL 13 -7.838 -3.624 10.721 124 HG21 VAL 13 HG21 VAL 13 -9.574 -0.266 8.681 125 HG22 VAL 13 HG22 VAL 13 -9.476 -0.340 10.447 126 HG23 VAL 13 HG23 VAL 13 -7.998 -0.126 9.485 127 H LYS 14 H LYS 14 -5.816 -3.470 8.211 128 HA LYS 14 HA LYS 14 -6.663 -6.319 8.287 129 HB2 LYS 14 HB2 LYS 14 -5.751 -5.225 5.971 130 HB3 LYS 14 HB3 LYS 14 -4.213 -5.670 6.681 131 HG2 LYS 14 HG2 LYS 14 -4.992 -7.403 5.199 132 HG3 LYS 14 HG3 LYS 14 -4.951 -8.017 6.848 133 HD2 LYS 14 HD2 LYS 14 -6.934 -8.755 5.531 134 HD3 LYS 14 HD3 LYS 14 -7.374 -7.928 7.016 135 HE2 LYS 14 HE2 LYS 14 -7.798 -5.845 5.672 136 HE3 LYS 14 HE3 LYS 14 -7.413 -6.759 4.202 137 HZ1 LYS 14 HZ1 LYS 14 -9.240 -8.287 4.792 138 HZ2 LYS 14 HZ2 LYS 14 -9.619 -7.359 6.092 139 HZ3 LYS 14 HZ3 LYS 14 -9.793 -6.733 4.592 140 HA PRO 15 HA PRO 15 -3.937 -6.020 11.746 141 HB2 PRO 15 HB2 PRO 15 -4.084 -8.530 12.774 142 HB3 PRO 15 HB3 PRO 15 -5.478 -7.398 12.775 143 HG2 PRO 15 HG2 PRO 15 -4.864 -9.613 10.782 144 HG3 PRO 15 HG3 PRO 15 -6.412 -9.295 11.633 145 HD2 PRO 15 HD2 PRO 15 -5.950 -8.406 9.105 146 HD3 PRO 15 HD3 PRO 15 -6.878 -7.427 10.284 147 H ASP 16 H ASP 16 -3.104 -8.072 9.086 148 HA ASP 16 HA ASP 16 -0.312 -8.379 10.108 149 HB2 ASP 16 HB2 ASP 16 -1.560 -10.485 10.435 150 HB3 ASP 16 HB3 ASP 16 -1.996 -10.496 8.722 151 H VAL 17 H VAL 17 0.696 -6.946 8.894 152 HA VAL 17 HA VAL 17 0.917 -7.550 6.015 153 HB VAL 17 HB VAL 17 -0.769 -5.765 6.150 154 HG11 VAL 17 HG11 VAL 17 1.446 -4.038 7.332 155 HG12 VAL 17 HG12 VAL 17 -0.112 -3.454 6.729 156 HG13 VAL 17 HG13 VAL 17 -0.065 -4.537 8.123 157 HG21 VAL 17 HG21 VAL 17 0.706 -5.959 4.170 158 HG22 VAL 17 HG22 VAL 17 0.161 -4.304 4.469 159 HG23 VAL 17 HG23 VAL 17 1.817 -4.768 4.896 160 H SER 18 H SER 18 2.880 -7.149 5.129 161 HA SER 18 HA SER 18 5.103 -6.401 7.008 162 HB2 SER 18 HB2 SER 18 5.116 -8.542 4.856 163 HB3 SER 18 HB3 SER 18 6.451 -8.117 5.947 164 HG SER 18 HG SER 18 5.216 -9.980 6.626 165 H VAL 19 H VAL 19 6.522 -4.930 6.294 166 HA VAL 19 HA VAL 19 6.282 -3.904 3.511 167 HB VAL 19 HB VAL 19 7.446 -2.662 6.006 168 HG11 VAL 19 HG11 VAL 19 7.553 -1.655 3.125 169 HG12 VAL 19 HG12 VAL 19 7.847 -0.635 4.555 170 HG13 VAL 19 HG13 VAL 19 8.930 -1.973 4.202 171 HG21 VAL 19 HG21 VAL 19 4.900 -2.606 5.545 172 HG22 VAL 19 HG22 VAL 19 5.698 -1.048 5.782 173 HG23 VAL 19 HG23 VAL 19 5.294 -1.586 4.147 174 H TYR 20 H TYR 20 7.766 -4.095 2.072 175 HA TYR 20 HA TYR 20 10.571 -4.696 2.860 176 HB2 TYR 20 HB2 TYR 20 9.812 -5.762 0.219 177 HB3 TYR 20 HB3 TYR 20 10.821 -6.444 1.468 178 HD1 TYR 20 HD1 TYR 20 9.804 -7.884 3.259 179 HD2 TYR 20 HD2 TYR 20 7.491 -6.296 -0.004 180 HE1 TYR 20 HE1 TYR 20 7.994 -9.523 3.751 181 HE2 TYR 20 HE2 TYR 20 5.673 -7.937 0.490 182 HH TYR 20 HH TYR 20 5.946 -10.333 3.142 183 H ARG 21 H ARG 21 11.750 -2.988 2.293 184 HA ARG 21 HA ARG 21 11.107 -1.126 0.128 185 HB2 ARG 21 HB2 ARG 21 13.698 -1.717 1.615 186 HB3 ARG 21 HB3 ARG 21 13.558 -0.508 0.329 187 HG2 ARG 21 HG2 ARG 21 11.793 0.678 1.587 188 HG3 ARG 21 HG3 ARG 21 11.925 -0.487 2.914 189 HD2 ARG 21 HD2 ARG 21 14.221 1.237 1.897 190 HD3 ARG 21 HD3 ARG 21 13.168 1.683 3.253 191 HE ARG 21 HE ARG 21 14.131 -0.892 3.861 192 HH11 ARG 21 HH11 ARG 21 15.610 -1.331 5.206 193 HH12 ARG 21 HH12 ARG 21 16.917 -0.208 5.597 194 HH21 ARG 21 HH21 ARG 21 15.658 2.251 3.493 195 HH22 ARG 21 HH22 ARG 21 16.920 1.828 4.620 196 H ILE 22 H ILE 22 11.518 -1.240 -1.950 197 HA ILE 22 HA ILE 22 12.065 -3.937 -2.976 198 HB ILE 22 HB ILE 22 10.968 -3.148 -5.041 199 HG12 ILE 22 HG12 ILE 22 10.546 -0.517 -3.553 200 HG13 ILE 22 HG13 ILE 22 11.553 -0.767 -4.984 201 HG21 ILE 22 HG21 ILE 22 9.271 -2.567 -2.590 202 HG22 ILE 22 HG22 ILE 22 8.745 -3.201 -4.168 203 HG23 ILE 22 HG23 ILE 22 9.744 -4.197 -3.108 204 HD11 ILE 22 HD11 ILE 22 8.531 -0.966 -4.807 205 HD12 ILE 22 HD12 ILE 22 9.503 0.186 -5.737 206 HD13 ILE 22 HD13 ILE 22 9.467 -1.529 -6.209 207 HA PRO 23 HA PRO 23 15.798 -2.829 -5.290 208 HB2 PRO 23 HB2 PRO 23 15.622 -4.526 -7.435 209 HB3 PRO 23 HB3 PRO 23 16.043 -5.087 -5.786 210 HG2 PRO 23 HG2 PRO 23 13.311 -5.109 -7.121 211 HG3 PRO 23 HG3 PRO 23 14.148 -6.461 -6.288 212 HD2 PRO 23 HD2 PRO 23 12.303 -4.935 -5.018 213 HD3 PRO 23 HD3 PRO 23 13.761 -5.506 -4.157 214 HA PRO 24 HA PRO 24 14.338 0.159 -8.230 215 HB2 PRO 24 HB2 PRO 24 16.308 0.284 -10.152 216 HB3 PRO 24 HB3 PRO 24 16.481 0.936 -8.493 217 HG2 PRO 24 HG2 PRO 24 17.403 -1.762 -9.537 218 HG3 PRO 24 HG3 PRO 24 18.337 -0.567 -8.579 219 HD2 PRO 24 HD2 PRO 24 17.140 -2.681 -7.392 220 HD3 PRO 24 HD3 PRO 24 17.129 -1.077 -6.601 221 H ARG 25 H ARG 25 13.033 0.295 -9.982 222 HA ARG 25 HA ARG 25 12.100 -2.151 -11.222 223 HB2 ARG 25 HB2 ARG 25 10.772 0.006 -10.548 224 HB3 ARG 25 HB3 ARG 25 11.396 0.676 -12.047 225 HG2 ARG 25 HG2 ARG 25 10.247 -1.767 -12.867 226 HG3 ARG 25 HG3 ARG 25 9.198 -1.262 -11.576 227 HD2 ARG 25 HD2 ARG 25 9.994 0.473 -13.948 228 HD3 ARG 25 HD3 ARG 25 8.499 -0.445 -13.841 229 HE ARG 25 HE ARG 25 9.125 2.068 -12.467 230 HH11 ARG 25 HH11 ARG 25 7.602 3.017 -11.104 231 HH12 ARG 25 HH12 ARG 25 6.189 2.089 -10.631 232 HH21 ARG 25 HH21 ARG 25 6.937 -0.684 -12.418 233 HH22 ARG 25 HH22 ARG 25 5.757 0.186 -11.454 234 H ALA 26 H ALA 26 12.001 -2.672 -13.370 235 HA ALA 26 HA ALA 26 12.615 -0.546 -15.261 236 HB1 ALA 26 HB1 ALA 26 13.561 -3.392 -15.749 237 HB2 ALA 26 HB2 ALA 26 13.537 -2.077 -16.955 238 HB3 ALA 26 HB3 ALA 26 14.584 -1.952 -15.521 239 H SER 27 H SER 27 10.934 -0.313 -16.647 240 HA SER 27 HA SER 27 8.437 -1.380 -15.945 241 HB2 SER 27 HB2 SER 27 9.254 0.104 -18.460 242 HB3 SER 27 HB3 SER 27 7.598 -0.039 -17.823 243 HG SER 27 HG SER 27 8.607 1.938 -17.186 244 H ASN 28 H ASN 28 10.580 -2.357 -18.581 245 HA ASN 28 HA ASN 28 8.639 -4.196 -19.778 246 HB2 ASN 28 HB2 ASN 28 10.504 -4.883 -21.193 247 HB3 ASN 28 HB3 ASN 28 10.368 -3.131 -21.145 248 HD21 ASN 28 HD21 ASN 28 13.670 -2.747 -19.940 249 HD22 ASN 28 HD22 ASN 28 12.247 -1.986 -20.632 250 H ARG 29 H ARG 29 10.366 -4.308 -16.898 251 HA ARG 29 HA ARG 29 10.353 -7.299 -16.768 252 HB2 ARG 29 HB2 ARG 29 11.782 -5.296 -14.947 253 HB3 ARG 29 HB3 ARG 29 11.825 -7.049 -14.819 254 HG2 ARG 29 HG2 ARG 29 12.979 -5.369 -17.081 255 HG3 ARG 29 HG3 ARG 29 13.864 -6.268 -15.835 256 HD2 ARG 29 HD2 ARG 29 12.371 -8.291 -16.770 257 HD3 ARG 29 HD3 ARG 29 12.338 -7.307 -18.225 258 HE ARG 29 HE ARG 29 14.593 -8.799 -17.069 259 HH11 ARG 29 HH11 ARG 29 16.492 -9.012 -18.154 260 HH12 ARG 29 HH12 ARG 29 16.853 -7.973 -19.500 261 HH21 ARG 29 HH21 ARG 29 13.922 -6.192 -19.354 262 HH22 ARG 29 HH22 ARG 29 15.446 -6.442 -20.165 263 H GLY 30 H GLY 30 9.521 -4.408 -14.733 264 HA2 GLY 30 HA2 GLY 30 7.612 -4.113 -13.501 265 HA3 GLY 30 HA3 GLY 30 7.043 -5.729 -13.957 266 H TYR 31 H TYR 31 6.860 -4.685 -11.381 267 HA TYR 31 HA TYR 31 8.789 -5.990 -9.630 268 HB2 TYR 31 HB2 TYR 31 5.964 -5.014 -9.081 269 HB3 TYR 31 HB3 TYR 31 7.198 -5.421 -7.893 270 HD1 TYR 31 HD1 TYR 31 5.539 -2.812 -8.279 271 HD2 TYR 31 HD2 TYR 31 9.532 -3.946 -9.515 272 HE1 TYR 31 HE1 TYR 31 6.273 -0.461 -8.096 273 HE2 TYR 31 HE2 TYR 31 10.286 -1.629 -9.176 274 HH TYR 31 HH TYR 31 8.021 1.025 -8.307 275 H ARG 32 H ARG 32 8.653 -8.092 -8.900 276 HA ARG 32 HA ARG 32 6.298 -9.757 -9.730 277 HB2 ARG 32 HB2 ARG 32 7.893 -11.590 -10.274 278 HB3 ARG 32 HB3 ARG 32 7.903 -10.233 -11.372 279 HG2 ARG 32 HG2 ARG 32 9.970 -10.448 -9.156 280 HG3 ARG 32 HG3 ARG 32 10.140 -11.337 -10.675 281 HD2 ARG 32 HD2 ARG 32 9.950 -9.218 -11.957 282 HD3 ARG 32 HD3 ARG 32 9.903 -8.316 -10.437 283 HE ARG 32 HE ARG 32 12.236 -9.915 -10.369 284 HH11 ARG 32 HH11 ARG 32 14.149 -9.139 -10.662 285 HH12 ARG 32 HH12 ARG 32 14.455 -7.670 -11.585 286 HH21 ARG 32 HH21 ARG 32 11.070 -7.058 -12.067 287 HH22 ARG 32 HH22 ARG 32 12.703 -6.482 -12.323 288 H ALA 33 H ALA 33 6.927 -8.643 -7.140 289 HA ALA 33 HA ALA 33 7.046 -9.076 -4.942 290 HB1 ALA 33 HB1 ALA 33 5.670 -11.637 -5.807 291 HB2 ALA 33 HB2 ALA 33 5.621 -10.896 -4.185 292 HB3 ALA 33 HB3 ALA 33 4.915 -10.058 -5.588 293 H SER 34 H SER 34 8.116 -12.117 -6.532 294 HA SER 34 HA SER 34 9.640 -13.080 -4.354 295 HB2 SER 34 HB2 SER 34 9.897 -13.704 -7.315 296 HB3 SER 34 HB3 SER 34 10.571 -14.675 -5.990 297 HG SER 34 HG SER 34 8.530 -15.468 -6.714 298 H ASP 35 H ASP 35 10.514 -10.570 -6.552 299 HA ASP 35 HA ASP 35 13.411 -10.850 -6.038 300 HB2 ASP 35 HB2 ASP 35 11.797 -9.500 -7.998 301 HB3 ASP 35 HB3 ASP 35 12.719 -8.281 -7.151 302 H TRP 36 H TRP 36 10.772 -9.628 -4.241 303 HA TRP 36 HA TRP 36 12.282 -7.509 -2.885 304 HB2 TRP 36 HB2 TRP 36 9.561 -8.655 -2.224 305 HB3 TRP 36 HB3 TRP 36 10.244 -7.141 -1.688 306 HD1 TRP 36 HD1 TRP 36 10.993 -6.779 -5.146 307 HE1 TRP 36 HE1 TRP 36 9.125 -5.548 -6.434 308 HE3 TRP 36 HE3 TRP 36 7.123 -7.504 -1.879 309 HZ2 TRP 36 HZ2 TRP 36 6.433 -4.720 -5.950 310 HZ3 TRP 36 HZ3 TRP 36 4.905 -6.442 -2.305 311 HH2 TRP 36 HH2 TRP 36 4.563 -5.064 -4.334 312 H LYS 37 H LYS 37 12.135 -7.593 -0.472 313 HA LYS 37 HA LYS 37 13.531 -9.973 0.505 314 HB2 LYS 37 HB2 LYS 37 12.864 -7.326 1.832 315 HB3 LYS 37 HB3 LYS 37 13.837 -8.600 2.549 316 HG2 LYS 37 HG2 LYS 37 15.347 -8.451 0.472 317 HG3 LYS 37 HG3 LYS 37 14.519 -6.921 0.126 318 HD2 LYS 37 HD2 LYS 37 16.219 -7.697 2.508 319 HD3 LYS 37 HD3 LYS 37 16.523 -6.396 1.360 320 HE2 LYS 37 HE2 LYS 37 14.171 -6.490 3.310 321 HE3 LYS 37 HE3 LYS 37 15.703 -5.705 3.683 322 HZ1 LYS 37 HZ1 LYS 37 15.363 -4.148 1.909 323 HZ2 LYS 37 HZ2 LYS 37 14.029 -4.916 1.352 324 HZ3 LYS 37 HZ3 LYS 37 13.988 -4.171 2.807 325 H LEU 38 H LEU 38 11.235 -10.986 -0.058 326 HA LEU 38 HA LEU 38 9.060 -10.840 1.715 327 HB2 LEU 38 HB2 LEU 38 10.074 -13.254 0.168 328 HB3 LEU 38 HB3 LEU 38 8.446 -13.065 0.825 329 HG LEU 38 HG LEU 38 9.712 -11.468 -1.422 330 HD11 LEU 38 HD11 LEU 38 7.307 -13.352 -1.297 331 HD12 LEU 38 HD12 LEU 38 7.863 -12.494 -2.742 332 HD13 LEU 38 HD13 LEU 38 8.894 -13.732 -2.003 333 HD21 LEU 38 HD21 LEU 38 7.013 -11.078 -0.077 334 HD22 LEU 38 HD22 LEU 38 8.327 -9.890 -0.220 335 HD23 LEU 38 HD23 LEU 38 7.443 -10.394 -1.661 336 H ASP 39 H ASP 39 12.079 -12.444 2.327 337 HA ASP 39 HA ASP 39 10.946 -14.095 4.540 338 HB2 ASP 39 HB2 ASP 39 12.418 -15.106 2.779 339 HB3 ASP 39 HB3 ASP 39 13.733 -14.073 3.335 340 H GLN 40 H GLN 40 12.137 -11.017 4.149 341 HA GLN 40 HA GLN 40 13.068 -10.704 6.931 342 HB2 GLN 40 HB2 GLN 40 15.284 -9.836 6.226 343 HB3 GLN 40 HB3 GLN 40 15.041 -11.549 5.929 344 HG2 GLN 40 HG2 GLN 40 14.338 -10.557 3.473 345 HG3 GLN 40 HG3 GLN 40 15.495 -9.338 3.998 346 HE21 GLN 40 HE21 GLN 40 16.846 -12.817 2.545 347 HE22 GLN 40 HE22 GLN 40 15.183 -12.281 2.374 348 HA PRO 41 HA PRO 41 10.629 -7.142 5.176 349 HB2 PRO 41 HB2 PRO 41 9.584 -7.218 8.002 350 HB3 PRO 41 HB3 PRO 41 8.686 -6.916 6.491 351 HG2 PRO 41 HG2 PRO 41 8.531 -9.332 7.701 352 HG3 PRO 41 HG3 PRO 41 8.717 -9.239 5.921 353 HD2 PRO 41 HD2 PRO 41 10.860 -9.735 8.004 354 HD3 PRO 41 HD3 PRO 41 10.537 -10.611 6.479 355 H ASP 42 H ASP 42 10.880 -4.951 5.525 356 HA ASP 42 HA ASP 42 13.060 -3.973 7.255 357 HB2 ASP 42 HB2 ASP 42 11.013 -2.607 5.458 358 HB3 ASP 42 HB3 ASP 42 12.243 -1.745 6.387 359 H TRP 43 H TRP 43 9.553 -4.212 7.313 360 HA TRP 43 HA TRP 43 9.383 -3.668 10.177 361 HB2 TRP 43 HB2 TRP 43 9.321 -1.385 9.392 362 HB3 TRP 43 HB3 TRP 43 8.221 -1.791 8.091 363 HD1 TRP 43 HD1 TRP 43 8.261 -0.799 11.726 364 HE1 TRP 43 HE1 TRP 43 5.863 -0.292 12.495 365 HE3 TRP 43 HE3 TRP 43 5.723 -2.719 7.736 366 HZ2 TRP 43 HZ2 TRP 43 3.185 -0.473 11.367 367 HZ3 TRP 43 HZ3 TRP 43 3.251 -2.446 7.568 368 HH2 TRP 43 HH2 TRP 43 1.973 -1.409 9.418 369 H THR 44 H THR 44 7.366 -4.374 11.050 370 HA THR 44 HA THR 44 5.331 -5.483 9.202 371 HB THR 44 HB THR 44 4.952 -7.406 10.742 372 HG1 THR 44 HG1 THR 44 6.685 -8.033 12.063 373 HG21 THR 44 HG21 THR 44 7.701 -7.435 9.457 374 HG22 THR 44 HG22 THR 44 6.656 -8.834 9.819 375 HG23 THR 44 HG23 THR 44 6.154 -7.653 8.604 376 H GLY 45 H GLY 45 3.238 -5.390 9.906 377 HA2 GLY 45 HA2 GLY 45 2.345 -4.877 12.524 378 HA3 GLY 45 HA3 GLY 45 2.611 -3.299 11.778 379 H ARG 46 H ARG 46 0.627 -2.556 11.470 380 HA ARG 46 HA ARG 46 -1.500 -4.296 10.287 381 HB2 ARG 46 HB2 ARG 46 -1.777 -1.964 12.231 382 HB3 ARG 46 HB3 ARG 46 -3.091 -2.938 11.557 383 HG2 ARG 46 HG2 ARG 46 -2.063 -4.973 12.609 384 HG3 ARG 46 HG3 ARG 46 -0.870 -3.952 13.411 385 HD2 ARG 46 HD2 ARG 46 -3.879 -3.586 13.731 386 HD3 ARG 46 HD3 ARG 46 -2.911 -4.648 14.766 387 HE ARG 46 HE ARG 46 -1.629 -2.131 14.802 388 HH11 ARG 46 HH11 ARG 46 -1.671 -0.933 16.564 389 HH12 ARG 46 HH12 ARG 46 -3.061 -0.913 17.640 390 HH21 ARG 46 HH21 ARG 46 -4.729 -3.374 15.895 391 HH22 ARG 46 HH22 ARG 46 -4.753 -2.309 17.274 392 H LEU 47 H LEU 47 -2.836 -3.519 8.791 393 HA LEU 47 HA LEU 47 -2.017 -1.114 7.232 394 HB2 LEU 47 HB2 LEU 47 -2.315 -3.293 6.042 395 HB3 LEU 47 HB3 LEU 47 -3.946 -3.397 6.690 396 HG LEU 47 HG LEU 47 -4.535 -1.285 5.406 397 HD11 LEU 47 HD11 LEU 47 -2.275 -0.376 5.026 398 HD12 LEU 47 HD12 LEU 47 -1.830 -1.831 4.104 399 HD13 LEU 47 HD13 LEU 47 -3.071 -0.724 3.486 400 HD21 LEU 47 HD21 LEU 47 -5.194 -3.467 4.623 401 HD22 LEU 47 HD22 LEU 47 -4.674 -2.500 3.250 402 HD23 LEU 47 HD23 LEU 47 -3.586 -3.744 3.919 403 H ARG 48 H ARG 48 -3.256 0.691 7.223 404 HA ARG 48 HA ARG 48 -6.168 0.403 7.627 405 HB2 ARG 48 HB2 ARG 48 -5.308 1.146 9.810 406 HB3 ARG 48 HB3 ARG 48 -4.587 2.578 9.060 407 HG2 ARG 48 HG2 ARG 48 -6.747 3.489 8.512 408 HG3 ARG 48 HG3 ARG 48 -7.556 1.946 8.774 409 HD2 ARG 48 HD2 ARG 48 -8.088 3.281 10.675 410 HD3 ARG 48 HD3 ARG 48 -6.928 2.077 11.217 411 HE ARG 48 HE ARG 48 -5.249 3.725 11.453 412 HH11 ARG 48 HH11 ARG 48 -4.482 5.824 11.543 413 HH12 ARG 48 HH12 ARG 48 -5.582 7.152 11.071 414 HH21 ARG 48 HH21 ARG 48 -8.261 5.276 10.409 415 HH22 ARG 48 HH22 ARG 48 -7.479 6.864 10.482 416 H ILE 49 H ILE 49 -6.752 0.718 5.640 417 HA ILE 49 HA ILE 49 -5.658 2.937 4.001 418 HB ILE 49 HB ILE 49 -7.961 1.096 3.303 419 HG12 ILE 49 HG12 ILE 49 -4.993 0.849 2.615 420 HG13 ILE 49 HG13 ILE 49 -5.954 -0.259 3.602 421 HG21 ILE 49 HG21 ILE 49 -6.227 2.932 1.582 422 HG22 ILE 49 HG22 ILE 49 -7.577 1.924 1.013 423 HG23 ILE 49 HG23 ILE 49 -7.894 3.275 2.079 424 HD11 ILE 49 HD11 ILE 49 -7.452 -0.516 1.474 425 HD12 ILE 49 HD12 ILE 49 -6.027 0.116 0.616 426 HD13 ILE 49 HD13 ILE 49 -5.917 -1.365 1.597 427 H THR 50 H THR 50 -6.562 4.815 3.846 428 HA THR 50 HA THR 50 -9.205 5.411 5.033 429 HB THR 50 HB THR 50 -7.743 7.620 5.748 430 HG1 THR 50 HG1 THR 50 -5.812 6.135 5.244 431 HG21 THR 50 HG21 THR 50 -8.204 5.102 7.375 432 HG22 THR 50 HG22 THR 50 -7.771 6.691 8.041 433 HG23 THR 50 HG23 THR 50 -9.319 6.486 7.209 434 H SER 51 H SER 51 -9.914 7.754 4.425 435 HA SER 51 HA SER 51 -8.518 9.059 2.218 436 HB2 SER 51 HB2 SER 51 -9.848 7.251 1.069 437 HB3 SER 51 HB3 SER 51 -11.318 7.906 1.807 438 HG SER 51 HG SER 51 -10.989 8.655 -0.317 439 H LYS 52 H LYS 52 -9.396 11.143 1.748 440 HA LYS 52 HA LYS 52 -11.948 11.748 2.889 441 HB2 LYS 52 HB2 LYS 52 -10.506 12.295 4.784 442 HB3 LYS 52 HB3 LYS 52 -9.708 13.539 3.822 443 HG2 LYS 52 HG2 LYS 52 -11.425 14.441 5.315 444 HG3 LYS 52 HG3 LYS 52 -11.766 14.781 3.626 445 HD2 LYS 52 HD2 LYS 52 -13.812 14.263 4.796 446 HD3 LYS 52 HD3 LYS 52 -13.496 12.975 3.634 447 HE2 LYS 52 HE2 LYS 52 -12.679 11.499 5.403 448 HE3 LYS 52 HE3 LYS 52 -12.787 12.809 6.591 449 HZ1 LYS 52 HZ1 LYS 52 -15.111 11.629 5.158 450 HZ2 LYS 52 HZ2 LYS 52 -14.744 11.379 6.734 451 HZ3 LYS 52 HZ3 LYS 52 -15.202 12.856 6.227 452 H GLY 53 H GLY 53 -9.572 14.183 1.832 453 HA2 GLY 53 HA2 GLY 53 -11.641 15.489 0.279 454 HA3 GLY 53 HA3 GLY 53 -9.980 16.032 0.504 455 H LYS 54 H LYS 54 -11.841 13.519 -1.211 456 HA LYS 54 HA LYS 54 -11.539 12.386 -3.180 457 HB2 LYS 54 HB2 LYS 54 -10.577 15.079 -4.211 458 HB3 LYS 54 HB3 LYS 54 -11.067 13.709 -5.212 459 HG2 LYS 54 HG2 LYS 54 -13.349 13.805 -4.350 460 HG3 LYS 54 HG3 LYS 54 -12.910 15.126 -3.244 461 HD2 LYS 54 HD2 LYS 54 -12.270 16.522 -5.230 462 HD3 LYS 54 HD3 LYS 54 -12.872 15.225 -6.290 463 HE2 LYS 54 HE2 LYS 54 -15.106 15.403 -5.223 464 HE3 LYS 54 HE3 LYS 54 -14.499 16.666 -4.144 465 HZ1 LYS 54 HZ1 LYS 54 -14.093 18.057 -6.109 466 HZ2 LYS 54 HZ2 LYS 54 -14.655 16.890 -7.108 467 HZ3 LYS 54 HZ3 LYS 54 -15.663 17.621 -6.055 468 H THR 55 H THR 55 -9.488 12.234 -1.284 469 HA THR 55 HA THR 55 -7.196 11.268 -2.886 470 HB THR 55 HB THR 55 -6.863 13.146 -0.506 471 HG1 THR 55 HG1 THR 55 -7.477 14.377 -2.230 472 HG21 THR 55 HG21 THR 55 -4.850 12.005 -2.488 473 HG22 THR 55 HG22 THR 55 -4.496 13.160 -1.181 474 HG23 THR 55 HG23 THR 55 -5.021 11.516 -0.786 475 H ALA 56 H ALA 56 -6.749 9.300 -2.184 476 HA ALA 56 HA ALA 56 -7.747 8.329 0.425 477 HB1 ALA 56 HB1 ALA 56 -7.209 6.102 -0.441 478 HB2 ALA 56 HB2 ALA 56 -8.312 6.981 -1.511 479 HB3 ALA 56 HB3 ALA 56 -6.592 6.827 -1.940 480 H TYR 57 H TYR 57 -6.359 7.120 1.794 481 HA TYR 57 HA TYR 57 -3.484 7.917 1.815 482 HB2 TYR 57 HB2 TYR 57 -5.386 8.060 4.188 483 HB3 TYR 57 HB3 TYR 57 -3.704 8.564 4.127 484 HD1 TYR 57 HD1 TYR 57 -3.231 10.412 2.196 485 HD2 TYR 57 HD2 TYR 57 -7.007 9.782 4.205 486 HE1 TYR 57 HE1 TYR 57 -3.954 12.718 1.585 487 HE2 TYR 57 HE2 TYR 57 -7.707 12.075 3.600 488 HH TYR 57 HH TYR 57 -5.623 14.296 1.729 489 H ILE 58 H ILE 58 -2.634 5.865 1.446 490 HA ILE 58 HA ILE 58 -3.594 3.532 3.039 491 HB ILE 58 HB ILE 58 -1.253 3.781 1.104 492 HG12 ILE 58 HG12 ILE 58 -2.608 2.020 -0.175 493 HG13 ILE 58 HG13 ILE 58 -3.991 2.460 0.819 494 HG21 ILE 58 HG21 ILE 58 -1.054 1.328 1.352 495 HG22 ILE 58 HG22 ILE 58 -0.764 2.126 2.881 496 HG23 ILE 58 HG23 ILE 58 -2.334 1.344 2.586 497 HD11 ILE 58 HD11 ILE 58 -3.999 4.706 -0.175 498 HD12 ILE 58 HD12 ILE 58 -2.422 4.387 -0.953 499 HD13 ILE 58 HD13 ILE 58 -3.874 3.510 -1.469 500 H LYS 59 H LYS 59 -3.247 3.856 5.175 501 HA LYS 59 HA LYS 59 -0.526 4.738 6.017 502 HB2 LYS 59 HB2 LYS 59 -3.063 4.642 7.682 503 HB3 LYS 59 HB3 LYS 59 -1.495 5.324 8.122 504 HG2 LYS 59 HG2 LYS 59 -1.819 6.765 5.925 505 HG3 LYS 59 HG3 LYS 59 -3.514 6.343 6.097 506 HD2 LYS 59 HD2 LYS 59 -3.543 7.380 8.355 507 HD3 LYS 59 HD3 LYS 59 -1.811 7.768 8.186 508 HE2 LYS 59 HE2 LYS 59 -2.323 9.097 6.139 509 HE3 LYS 59 HE3 LYS 59 -4.048 8.764 6.372 510 HZ1 LYS 59 HZ1 LYS 59 -3.997 9.971 8.434 511 HZ2 LYS 59 HZ2 LYS 59 -2.370 10.199 8.362 512 HZ3 LYS 59 HZ3 LYS 59 -3.360 10.933 7.284 513 H LEU 60 H LEU 60 0.826 3.558 7.065 514 HA LEU 60 HA LEU 60 0.107 0.794 7.973 515 HB2 LEU 60 HB2 LEU 60 2.740 2.143 7.254 516 HB3 LEU 60 HB3 LEU 60 2.672 0.703 8.224 517 HG LEU 60 HG LEU 60 3.162 -0.164 6.234 518 HD11 LEU 60 HD11 LEU 60 1.099 -1.283 7.101 519 HD12 LEU 60 HD12 LEU 60 0.134 -0.291 5.984 520 HD13 LEU 60 HD13 LEU 60 1.324 -1.442 5.351 521 HD21 LEU 60 HD21 LEU 60 1.148 1.647 4.825 522 HD22 LEU 60 HD22 LEU 60 2.906 1.893 4.877 523 HD23 LEU 60 HD23 LEU 60 2.237 0.481 4.044 524 H GLU 61 H GLU 61 0.129 0.279 10.076 525 HA GLU 61 HA GLU 61 1.058 2.306 12.056 526 HB2 GLU 61 HB2 GLU 61 -1.733 1.117 11.899 527 HB3 GLU 61 HB3 GLU 61 -1.098 2.031 13.275 528 HG2 GLU 61 HG2 GLU 61 -0.674 3.980 11.770 529 HG3 GLU 61 HG3 GLU 61 -1.432 3.102 10.436 530 H ASP 62 H ASP 62 1.551 1.554 14.136 531 HA ASP 62 HA ASP 62 2.798 -0.984 14.102 532 HB2 ASP 62 HB2 ASP 62 3.556 1.012 15.344 533 HB3 ASP 62 HB3 ASP 62 2.165 0.801 16.441 534 H LYS 63 H LYS 63 2.567 -2.797 15.281 535 HA LYS 63 HA LYS 63 -0.141 -3.688 15.790 536 HB2 LYS 63 HB2 LYS 63 1.221 -5.926 16.312 537 HB3 LYS 63 HB3 LYS 63 0.912 -5.359 14.688 538 HG2 LYS 63 HG2 LYS 63 3.199 -6.168 14.925 539 HG3 LYS 63 HG3 LYS 63 3.132 -4.478 14.450 540 HD2 LYS 63 HD2 LYS 63 3.588 -3.843 16.857 541 HD3 LYS 63 HD3 LYS 63 3.872 -5.559 17.197 542 HE2 LYS 63 HE2 LYS 63 5.829 -5.618 15.917 543 HE3 LYS 63 HE3 LYS 63 5.282 -4.334 14.832 544 HZ1 LYS 63 HZ1 LYS 63 7.042 -3.542 16.292 545 HZ2 LYS 63 HZ2 LYS 63 5.656 -2.710 16.550 546 HZ3 LYS 63 HZ3 LYS 63 6.149 -3.855 17.627 547 H VAL 64 H VAL 64 1.872 -2.132 17.901 548 HA VAL 64 HA VAL 64 0.366 -3.321 20.198 549 HB VAL 64 HB VAL 64 3.141 -2.081 20.338 550 HG11 VAL 64 HG11 VAL 64 3.165 -3.061 22.612 551 HG12 VAL 64 HG12 VAL 64 1.869 -1.877 22.441 552 HG13 VAL 64 HG13 VAL 64 1.490 -3.615 22.394 553 HG21 VAL 64 HG21 VAL 64 3.341 -4.211 19.173 554 HG22 VAL 64 HG22 VAL 64 3.936 -4.398 20.820 555 HG23 VAL 64 HG23 VAL 64 2.325 -5.019 20.389 556 H SER 65 H SER 65 1.900 -0.269 18.979 557 HA SER 65 HA SER 65 0.247 1.252 20.920 558 HB2 SER 65 HB2 SER 65 1.615 3.174 20.184 559 HB3 SER 65 HB3 SER 65 2.607 1.807 20.746 560 HG SER 65 HG SER 65 3.436 2.585 18.818 561 H GLY 66 H GLY 66 0.290 0.557 17.506 562 HA2 GLY 66 HA2 GLY 66 -1.156 1.191 15.778 563 HA3 GLY 66 HA3 GLY 66 -2.121 2.134 16.919 564 H GLU 67 H GLU 67 1.301 2.827 17.030 565 HA GLU 67 HA GLU 67 0.868 5.505 16.078 566 HB2 GLU 67 HB2 GLU 67 3.072 5.959 16.665 567 HB3 GLU 67 HB3 GLU 67 2.479 4.807 17.862 568 HG2 GLU 67 HG2 GLU 67 3.655 2.980 16.497 569 HG3 GLU 67 HG3 GLU 67 4.380 4.267 15.537 570 H LEU 68 H LEU 68 1.790 6.536 14.246 571 HA LEU 68 HA LEU 68 1.444 4.996 11.848 572 HB2 LEU 68 HB2 LEU 68 0.781 7.401 12.167 573 HB3 LEU 68 HB3 LEU 68 2.489 7.832 12.199 574 HG LEU 68 HG LEU 68 2.681 6.841 9.843 575 HD11 LEU 68 HD11 LEU 68 0.601 5.472 9.864 576 HD12 LEU 68 HD12 LEU 68 -0.366 6.945 10.022 577 HD13 LEU 68 HD13 LEU 68 0.592 6.643 8.551 578 HD21 LEU 68 HD21 LEU 68 2.531 9.266 10.243 579 HD22 LEU 68 HD22 LEU 68 1.683 8.808 8.759 580 HD23 LEU 68 HD23 LEU 68 0.757 9.170 10.237 581 H PHE 69 H PHE 69 2.866 3.824 10.752 582 HA PHE 69 HA PHE 69 5.791 4.149 11.104 583 HB2 PHE 69 HB2 PHE 69 5.014 1.889 11.019 584 HB3 PHE 69 HB3 PHE 69 4.056 2.186 9.578 585 HD1 PHE 69 HD1 PHE 69 7.649 2.513 10.692 586 HD2 PHE 69 HD2 PHE 69 4.932 1.410 7.521 587 HE1 PHE 69 HE1 PHE 69 9.573 1.896 9.249 588 HE2 PHE 69 HE2 PHE 69 6.859 0.878 6.067 589 HZ PHE 69 HZ PHE 69 9.180 1.086 6.929 590 H ALA 70 H ALA 70 3.393 4.293 8.430 591 HA ALA 70 HA ALA 70 4.788 6.494 7.108 592 HB1 ALA 70 HB1 ALA 70 4.648 3.729 5.803 593 HB2 ALA 70 HB2 ALA 70 5.274 5.219 5.065 594 HB3 ALA 70 HB3 ALA 70 6.129 4.489 6.424 595 H GLN 71 H GLN 71 3.554 7.345 5.268 596 HA GLN 71 HA GLN 71 0.907 6.133 4.786 597 HB2 GLN 71 HB2 GLN 71 -0.331 8.115 5.111 598 HB3 GLN 71 HB3 GLN 71 0.602 7.817 6.561 599 HG2 GLN 71 HG2 GLN 71 0.951 10.065 6.386 600 HG3 GLN 71 HG3 GLN 71 2.324 9.529 5.433 601 HE21 GLN 71 HE21 GLN 71 1.112 11.796 2.960 602 HE22 GLN 71 HE22 GLN 71 2.489 11.209 3.897 603 H ALA 72 H ALA 72 0.187 6.231 2.731 604 HA ALA 72 HA ALA 72 1.773 7.801 0.735 605 HB1 ALA 72 HB1 ALA 72 1.250 5.982 -0.840 606 HB2 ALA 72 HB2 ALA 72 2.228 5.459 0.540 607 HB3 ALA 72 HB3 ALA 72 0.497 5.071 0.487 608 HA PRO 73 HA PRO 73 -2.384 9.504 0.033 609 HB2 PRO 73 HB2 PRO 73 -1.700 11.919 -0.987 610 HB3 PRO 73 HB3 PRO 73 -1.544 11.526 0.753 611 HG2 PRO 73 HG2 PRO 73 0.624 11.481 -1.366 612 HG3 PRO 73 HG3 PRO 73 0.692 12.185 0.278 613 HD2 PRO 73 HD2 PRO 73 1.652 9.673 -0.347 614 HD3 PRO 73 HD3 PRO 73 1.008 10.088 1.264 615 H VAL 74 H VAL 74 -3.574 8.878 -1.631 616 HA VAL 74 HA VAL 74 -2.477 8.695 -4.423 617 HB VAL 74 HB VAL 74 -4.623 7.046 -3.043 618 HG11 VAL 74 HG11 VAL 74 -4.596 5.648 -5.084 619 HG12 VAL 74 HG12 VAL 74 -5.222 7.266 -5.354 620 HG13 VAL 74 HG13 VAL 74 -3.564 6.858 -5.878 621 HG21 VAL 74 HG21 VAL 74 -2.263 6.410 -2.390 622 HG22 VAL 74 HG22 VAL 74 -3.166 5.144 -3.234 623 HG23 VAL 74 HG23 VAL 74 -1.949 6.071 -4.109 624 H GLU 75 H GLU 75 -3.324 10.222 -5.752 625 HA GLU 75 HA GLU 75 -5.679 11.747 -4.950 626 HB2 GLU 75 HB2 GLU 75 -3.922 11.897 -7.422 627 HB3 GLU 75 HB3 GLU 75 -5.208 13.041 -7.020 628 HG2 GLU 75 HG2 GLU 75 -4.047 13.584 -4.877 629 HG3 GLU 75 HG3 GLU 75 -2.716 12.524 -5.344 630 H GLN 76 H GLN 76 -5.269 9.010 -6.953 631 HA GLN 76 HA GLN 76 -8.029 8.548 -7.187 632 HB2 GLN 76 HB2 GLN 76 -8.152 8.499 -9.770 633 HB3 GLN 76 HB3 GLN 76 -8.428 9.991 -8.908 634 HG2 GLN 76 HG2 GLN 76 -7.213 10.610 -10.784 635 HG3 GLN 76 HG3 GLN 76 -6.040 10.697 -9.485 636 HE21 GLN 76 HE21 GLN 76 -4.381 7.658 -10.702 637 HE22 GLN 76 HE22 GLN 76 -4.718 8.524 -9.219 638 H TYR 77 H TYR 77 -8.452 6.431 -8.393 639 HA TYR 77 HA TYR 77 -6.014 4.752 -8.116 640 HB2 TYR 77 HB2 TYR 77 -7.648 4.618 -6.278 641 HB3 TYR 77 HB3 TYR 77 -8.828 3.938 -7.407 642 HD1 TYR 77 HD1 TYR 77 -5.494 3.540 -5.885 643 HD2 TYR 77 HD2 TYR 77 -8.661 1.575 -8.001 644 HE1 TYR 77 HE1 TYR 77 -4.291 1.370 -5.607 645 HE2 TYR 77 HE2 TYR 77 -7.575 -0.639 -7.576 646 HH TYR 77 HH TYR 77 -4.404 -0.912 -5.930 647 HA PRO 78 HA PRO 78 -4.835 3.116 -8.890 648 HB2 PRO 78 HB2 PRO 78 -3.833 2.818 -11.699 649 HB3 PRO 78 HB3 PRO 78 -3.521 1.793 -10.264 650 HG2 PRO 78 HG2 PRO 78 -5.247 0.961 -12.179 651 HG3 PRO 78 HG3 PRO 78 -5.676 0.760 -10.445 652 HD2 PRO 78 HD2 PRO 78 -6.520 2.993 -12.332 653 HD3 PRO 78 HD3 PRO 78 -7.544 1.983 -11.264 654 H GLY 79 H GLY 79 -2.950 4.402 -8.627 655 HA2 GLY 79 HA2 GLY 79 -2.487 6.746 -10.406 656 HA3 GLY 79 HA3 GLY 79 -2.865 7.055 -8.711 657 H ILE 80 H ILE 80 -0.580 8.088 -9.529 658 HA ILE 80 HA ILE 80 1.742 6.597 -9.740 659 HB ILE 80 HB ILE 80 1.606 8.984 -10.179 660 HG12 ILE 80 HG12 ILE 80 3.692 9.811 -9.195 661 HG13 ILE 80 HG13 ILE 80 3.696 8.506 -8.011 662 HG21 ILE 80 HG21 ILE 80 1.510 9.462 -7.163 663 HG22 ILE 80 HG22 ILE 80 1.595 10.691 -8.433 664 HG23 ILE 80 HG23 ILE 80 0.149 9.699 -8.283 665 HD11 ILE 80 HD11 ILE 80 5.251 8.113 -9.885 666 HD12 ILE 80 HD12 ILE 80 4.017 6.849 -9.801 667 HD13 ILE 80 HD13 ILE 80 3.891 8.135 -11.029 668 H ALA 81 H ALA 81 0.019 7.229 -6.748 669 HA ALA 81 HA ALA 81 2.283 6.365 -5.081 670 HB1 ALA 81 HB1 ALA 81 -0.422 7.590 -4.481 671 HB2 ALA 81 HB2 ALA 81 0.774 7.144 -3.236 672 HB3 ALA 81 HB3 ALA 81 1.155 8.383 -4.447 673 H VAL 82 H VAL 82 0.383 4.488 -6.832 674 HA VAL 82 HA VAL 82 0.591 2.297 -4.930 675 HB VAL 82 HB VAL 82 -1.556 3.240 -4.251 676 HG11 VAL 82 HG11 VAL 82 -2.699 2.652 -6.967 677 HG12 VAL 82 HG12 VAL 82 -3.412 3.478 -5.549 678 HG13 VAL 82 HG13 VAL 82 -2.148 4.267 -6.463 679 HG21 VAL 82 HG21 VAL 82 -1.044 0.760 -4.223 680 HG22 VAL 82 HG22 VAL 82 -2.732 1.242 -4.115 681 HG23 VAL 82 HG23 VAL 82 -2.073 0.626 -5.657 682 H GLU 83 H GLU 83 0.747 0.351 -5.805 683 HA GLU 83 HA GLU 83 0.299 -0.175 -8.689 684 HB2 GLU 83 HB2 GLU 83 3.038 0.155 -7.417 685 HB3 GLU 83 HB3 GLU 83 2.803 -0.968 -8.757 686 HG2 GLU 83 HG2 GLU 83 1.753 0.945 -10.044 687 HG3 GLU 83 HG3 GLU 83 2.379 2.031 -8.782 688 H THR 84 H THR 84 0.792 -2.332 -9.347 689 HA THR 84 HA THR 84 0.538 -4.449 -7.233 690 HB THR 84 HB THR 84 -0.559 -5.762 -9.018 691 HG1 THR 84 HG1 THR 84 -1.176 -4.713 -10.915 692 HG21 THR 84 HG21 THR 84 -1.873 -3.034 -8.602 693 HG22 THR 84 HG22 THR 84 -2.690 -4.531 -9.118 694 HG23 THR 84 HG23 THR 84 -1.976 -4.434 -7.508 695 H VAL 85 H VAL 85 1.554 -6.504 -7.731 696 HA VAL 85 HA VAL 85 4.037 -6.354 -9.323 697 HB VAL 85 HB VAL 85 4.548 -8.519 -8.363 698 HG11 VAL 85 HG11 VAL 85 3.552 -6.624 -6.199 699 HG12 VAL 85 HG12 VAL 85 4.824 -7.840 -6.047 700 HG13 VAL 85 HG13 VAL 85 5.067 -6.441 -7.104 701 HG21 VAL 85 HG21 VAL 85 2.230 -9.442 -8.249 702 HG22 VAL 85 HG22 VAL 85 3.124 -9.612 -6.748 703 HG23 VAL 85 HG23 VAL 85 1.888 -8.352 -6.896 704 H THR 86 H THR 86 4.459 -8.467 -10.620 705 HA THR 86 HA THR 86 2.259 -8.926 -12.535 706 HB THR 86 HB THR 86 4.003 -9.896 -13.935 707 HG1 THR 86 HG1 THR 86 6.122 -9.959 -13.183 708 HG21 THR 86 HG21 THR 86 5.454 -7.941 -14.224 709 HG22 THR 86 HG22 THR 86 3.791 -7.407 -13.872 710 HG23 THR 86 HG23 THR 86 5.033 -7.353 -12.608 711 H ASP 87 H ASP 87 4.117 -10.759 -10.165 712 HA ASP 87 HA ASP 87 3.339 -13.316 -11.322 713 HB2 ASP 87 HB2 ASP 87 5.628 -12.772 -10.510 714 HB3 ASP 87 HB3 ASP 87 4.993 -12.723 -8.860 715 H SER 88 H SER 88 2.675 -11.672 -8.207 716 HA SER 88 HA SER 88 0.398 -13.581 -7.754 717 HB2 SER 88 HB2 SER 88 2.307 -14.542 -6.593 718 HB3 SER 88 HB3 SER 88 2.560 -13.028 -5.705 719 HG SER 88 HG SER 88 1.255 -14.748 -4.645 720 H SER 89 H SER 89 -1.432 -12.513 -7.354 721 HA SER 89 HA SER 89 -1.405 -9.707 -7.092 722 HB2 SER 89 HB2 SER 89 -3.901 -11.216 -6.439 723 HB3 SER 89 HB3 SER 89 -3.687 -9.753 -7.393 724 HG SER 89 HG SER 89 -2.738 -11.071 -9.041 725 H ARG 90 H ARG 90 -0.700 -11.643 -4.502 726 HA ARG 90 HA ARG 90 -2.162 -10.023 -2.539 727 HB2 ARG 90 HB2 ARG 90 -1.752 -11.540 -0.888 728 HB3 ARG 90 HB3 ARG 90 -2.135 -12.491 -2.313 729 HG2 ARG 90 HG2 ARG 90 0.268 -12.952 -2.668 730 HG3 ARG 90 HG3 ARG 90 0.670 -11.942 -1.263 731 HD2 ARG 90 HD2 ARG 90 -0.714 -13.491 0.166 732 HD3 ARG 90 HD3 ARG 90 -0.835 -14.574 -1.235 733 HE ARG 90 HE ARG 90 1.906 -13.905 -0.841 734 HH11 ARG 90 HH11 ARG 90 3.356 -15.241 -0.008 735 HH12 ARG 90 HH12 ARG 90 2.886 -16.525 1.081 736 HH21 ARG 90 HH21 ARG 90 -0.442 -15.674 1.111 737 HH22 ARG 90 HH22 ARG 90 0.776 -16.779 1.661 738 H TYR 91 H TYR 91 0.087 -8.930 -4.239 739 HA TYR 91 HA TYR 91 1.648 -7.698 -2.042 740 HB2 TYR 91 HB2 TYR 91 2.746 -8.900 -4.602 741 HB3 TYR 91 HB3 TYR 91 3.667 -7.953 -3.457 742 HD1 TYR 91 HD1 TYR 91 4.182 -8.841 -1.189 743 HD2 TYR 91 HD2 TYR 91 2.272 -11.259 -4.202 744 HE1 TYR 91 HE1 TYR 91 4.708 -10.894 0.122 745 HE2 TYR 91 HE2 TYR 91 2.887 -13.315 -2.944 746 HH TYR 91 HH TYR 91 4.603 -13.171 0.197 747 H PHE 92 H PHE 92 2.039 -5.562 -2.298 748 HA PHE 92 HA PHE 92 1.376 -4.196 -4.868 749 HB2 PHE 92 HB2 PHE 92 0.376 -3.353 -2.119 750 HB3 PHE 92 HB3 PHE 92 0.116 -2.487 -3.620 751 HD1 PHE 92 HD1 PHE 92 -1.258 -3.596 -5.475 752 HD2 PHE 92 HD2 PHE 92 -1.102 -5.067 -1.441 753 HE1 PHE 92 HE1 PHE 92 -3.322 -4.952 -5.878 754 HE2 PHE 92 HE2 PHE 92 -3.190 -6.332 -1.807 755 HZ PHE 92 HZ PHE 92 -4.272 -6.321 -4.070 756 H VAL 93 H VAL 93 2.188 -2.009 -4.964 757 HA VAL 93 HA VAL 93 4.308 -1.320 -2.976 758 HB VAL 93 HB VAL 93 4.370 -0.755 -5.953 759 HG11 VAL 93 HG11 VAL 93 5.229 1.209 -4.725 760 HG12 VAL 93 HG12 VAL 93 6.359 0.158 -3.840 761 HG13 VAL 93 HG13 VAL 93 6.506 0.365 -5.594 762 HG21 VAL 93 HG21 VAL 93 5.109 -2.974 -5.465 763 HG22 VAL 93 HG22 VAL 93 6.546 -2.002 -5.797 764 HG23 VAL 93 HG23 VAL 93 6.140 -2.415 -4.125 765 H ILE 94 H ILE 94 4.230 0.772 -2.160 766 HA ILE 94 HA ILE 94 2.336 2.646 -3.429 767 HB ILE 94 HB ILE 94 1.491 3.477 -1.361 768 HG12 ILE 94 HG12 ILE 94 3.273 2.538 0.193 769 HG13 ILE 94 HG13 ILE 94 1.615 2.523 0.756 770 HG21 ILE 94 HG21 ILE 94 0.728 0.600 -1.886 771 HG22 ILE 94 HG22 ILE 94 -0.214 1.770 -0.934 772 HG23 ILE 94 HG23 ILE 94 0.088 2.071 -2.645 773 HD11 ILE 94 HD11 ILE 94 3.107 0.076 -0.288 774 HD12 ILE 94 HD12 ILE 94 2.783 0.482 1.402 775 HD13 ILE 94 HD13 ILE 94 1.439 0.104 0.321 776 H ARG 95 H ARG 95 2.766 4.833 -3.119 777 HA ARG 95 HA ARG 95 5.646 5.364 -2.553 778 HB2 ARG 95 HB2 ARG 95 4.553 6.039 -4.768 779 HB3 ARG 95 HB3 ARG 95 3.748 7.328 -3.858 780 HG2 ARG 95 HG2 ARG 95 6.011 8.093 -3.056 781 HG3 ARG 95 HG3 ARG 95 6.747 6.837 -4.058 782 HD2 ARG 95 HD2 ARG 95 6.934 8.767 -5.353 783 HD3 ARG 95 HD3 ARG 95 5.554 7.912 -6.060 784 HE ARG 95 HE ARG 95 4.504 9.701 -4.138 785 HH11 ARG 95 HH11 ARG 95 3.922 11.854 -4.515 786 HH12 ARG 95 HH12 ARG 95 4.268 12.551 -6.070 787 HH21 ARG 95 HH21 ARG 95 6.168 9.945 -7.207 788 HH22 ARG 95 HH22 ARG 95 5.563 11.548 -7.518 789 H ILE 96 H ILE 96 5.686 5.387 -0.340 790 HA ILE 96 HA ILE 96 3.819 7.050 1.164 791 HB ILE 96 HB ILE 96 4.997 6.500 3.147 792 HG12 ILE 96 HG12 ILE 96 6.753 4.460 2.764 793 HG13 ILE 96 HG13 ILE 96 7.116 5.381 1.319 794 HG21 ILE 96 HG21 ILE 96 4.393 4.103 1.403 795 HG22 ILE 96 HG22 ILE 96 4.531 4.075 3.167 796 HG23 ILE 96 HG23 ILE 96 3.259 5.023 2.424 797 HD11 ILE 96 HD11 ILE 96 7.228 6.370 4.205 798 HD12 ILE 96 HD12 ILE 96 8.608 5.959 3.175 799 HD13 ILE 96 HD13 ILE 96 7.610 7.372 2.779 800 H GLN 97 H GLN 97 4.123 8.983 2.116 801 HA GLN 97 HA GLN 97 6.397 10.680 1.177 802 HB2 GLN 97 HB2 GLN 97 3.446 10.998 0.542 803 HB3 GLN 97 HB3 GLN 97 4.571 12.360 0.489 804 HG2 GLN 97 HG2 GLN 97 5.795 11.506 -1.299 805 HG3 GLN 97 HG3 GLN 97 5.240 9.854 -1.074 806 HE21 GLN 97 HE21 GLN 97 2.348 10.218 -3.074 807 HE22 GLN 97 HE22 GLN 97 3.261 9.169 -1.994 808 H ASP 98 H ASP 98 6.720 12.544 2.287 809 HA ASP 98 HA ASP 98 5.630 12.572 5.056 810 HB2 ASP 98 HB2 ASP 98 8.111 12.472 4.494 811 HB3 ASP 98 HB3 ASP 98 7.948 14.135 3.928 812 H GLY 99 H GLY 99 4.669 13.983 2.289 813 HA2 GLY 99 HA2 GLY 99 3.034 15.600 1.947 814 HA3 GLY 99 HA3 GLY 99 3.165 16.102 3.633 815 H THR 100 H THR 100 6.162 16.047 2.026 816 HA THR 100 HA THR 100 6.141 18.983 1.455 817 HB THR 100 HB THR 100 6.883 18.360 3.764 818 HG1 THR 100 HG1 THR 100 8.603 19.770 3.736 819 HG21 THR 100 HG21 THR 100 9.056 17.417 4.156 820 HG22 THR 100 HG22 THR 100 8.159 16.286 3.133 821 HG23 THR 100 HG23 THR 100 9.409 17.330 2.418 822 H GLY 101 H GLY 101 6.415 16.274 -0.177 823 HA2 GLY 101 HA2 GLY 101 7.247 16.064 -2.374 824 HA3 GLY 101 HA3 GLY 101 8.486 17.276 -2.058 825 H ARG 102 H ARG 102 8.723 15.348 0.565 826 HA ARG 102 HA ARG 102 10.848 13.542 -0.308 827 HB2 ARG 102 HB2 ARG 102 9.149 13.714 2.214 828 HB3 ARG 102 HB3 ARG 102 10.453 12.544 1.991 829 HG2 ARG 102 HG2 ARG 102 12.096 14.272 1.826 830 HG3 ARG 102 HG3 ARG 102 10.848 15.543 1.841 831 HD2 ARG 102 HD2 ARG 102 10.158 14.865 4.107 832 HD3 ARG 102 HD3 ARG 102 11.413 13.614 4.137 833 HE ARG 102 HE ARG 102 12.948 15.744 3.676 834 HH11 ARG 102 HH11 ARG 102 13.828 17.208 5.063 835 HH12 ARG 102 HH12 ARG 102 13.008 17.624 6.538 836 HH21 ARG 102 HH21 ARG 102 10.291 15.577 6.042 837 HH22 ARG 102 HH22 ARG 102 11.097 16.726 7.071 838 H SER 103 H SER 103 10.565 11.620 -1.105 839 HA SER 103 HA SER 103 8.161 10.086 -0.467 840 HB2 SER 103 HB2 SER 103 7.619 9.509 -2.777 841 HB3 SER 103 HB3 SER 103 7.555 11.261 -2.566 842 HG SER 103 HG SER 103 9.564 11.433 -3.573 843 H ALA 104 H ALA 104 8.241 7.850 -0.705 844 HA ALA 104 HA ALA 104 10.595 6.577 -1.953 845 HB1 ALA 104 HB1 ALA 104 11.233 6.787 0.431 846 HB2 ALA 104 HB2 ALA 104 9.716 5.996 0.912 847 HB3 ALA 104 HB3 ALA 104 10.939 5.091 -0.003 848 H PHE 105 H PHE 105 10.108 4.645 -2.925 849 HA PHE 105 HA PHE 105 7.283 3.703 -2.866 850 HB2 PHE 105 HB2 PHE 105 9.636 3.045 -4.656 851 HB3 PHE 105 HB3 PHE 105 8.142 2.129 -4.652 852 HD1 PHE 105 HD1 PHE 105 5.962 3.209 -5.285 853 HD2 PHE 105 HD2 PHE 105 9.750 5.192 -5.823 854 HE1 PHE 105 HE1 PHE 105 4.930 4.692 -6.978 855 HE2 PHE 105 HE2 PHE 105 8.710 6.706 -7.497 856 HZ PHE 105 HZ PHE 105 6.306 6.443 -8.095 857 H ILE 106 H ILE 106 6.724 2.231 -1.438 858 HA ILE 106 HA ILE 106 8.721 0.187 -0.540 859 HB ILE 106 HB ILE 106 7.751 0.065 1.596 860 HG12 ILE 106 HG12 ILE 106 5.771 2.265 0.876 861 HG13 ILE 106 HG13 ILE 106 5.362 0.555 1.007 862 HG21 ILE 106 HG21 ILE 106 8.153 3.013 0.973 863 HG22 ILE 106 HG22 ILE 106 8.476 2.184 2.513 864 HG23 ILE 106 HG23 ILE 106 9.471 1.827 1.097 865 HD11 ILE 106 HD11 ILE 106 6.330 2.275 3.308 866 HD12 ILE 106 HD12 ILE 106 4.700 1.637 3.034 867 HD13 ILE 106 HD13 ILE 106 6.034 0.528 3.375 868 H GLY 107 H GLY 107 8.092 -1.940 -0.391 869 HA2 GLY 107 HA2 GLY 107 5.637 -2.699 -1.881 870 HA3 GLY 107 HA3 GLY 107 7.004 -3.744 -1.503 871 H ILE 108 H ILE 108 4.031 -3.905 -0.905 872 HA ILE 108 HA ILE 108 4.424 -4.844 1.856 873 HB ILE 108 HB ILE 108 2.066 -4.411 2.417 874 HG12 ILE 108 HG12 ILE 108 2.037 -2.477 0.060 875 HG13 ILE 108 HG13 ILE 108 1.186 -4.022 0.109 876 HG21 ILE 108 HG21 ILE 108 3.751 -1.931 1.934 877 HG22 ILE 108 HG22 ILE 108 2.474 -2.129 3.157 878 HG23 ILE 108 HG23 ILE 108 3.936 -3.104 3.259 879 HD11 ILE 108 HD11 ILE 108 0.641 -1.627 1.917 880 HD12 ILE 108 HD12 ILE 108 -0.394 -2.288 0.643 881 HD13 ILE 108 HD13 ILE 108 -0.100 -3.227 2.119 882 H GLY 109 H GLY 109 3.631 -6.772 2.372 883 HA2 GLY 109 HA2 GLY 109 2.262 -8.376 0.236 884 HA3 GLY 109 HA3 GLY 109 3.502 -9.028 1.299 885 H PHE 110 H PHE 110 0.620 -9.658 0.752 886 HA PHE 110 HA PHE 110 -0.598 -9.416 3.468 887 HB2 PHE 110 HB2 PHE 110 -1.731 -9.882 0.693 888 HB3 PHE 110 HB3 PHE 110 -2.677 -10.106 2.146 889 HD1 PHE 110 HD1 PHE 110 -4.054 -8.365 2.811 890 HD2 PHE 110 HD2 PHE 110 -0.455 -7.432 0.610 891 HE1 PHE 110 HE1 PHE 110 -4.659 -5.960 2.814 892 HE2 PHE 110 HE2 PHE 110 -1.002 -5.034 0.744 893 HZ PHE 110 HZ PHE 110 -3.126 -4.293 1.770 894 H THR 111 H THR 111 -1.930 -11.262 4.184 895 HA THR 111 HA THR 111 -0.423 -13.751 4.105 896 HB THR 111 HB THR 111 -1.504 -12.895 6.129 897 HG1 THR 111 HG1 THR 111 -2.249 -14.886 6.790 898 HG21 THR 111 HG21 THR 111 -3.661 -12.058 5.180 899 HG22 THR 111 HG22 THR 111 -4.164 -13.741 4.904 900 HG23 THR 111 HG23 THR 111 -3.878 -13.150 6.551 901 H ASP 112 H ASP 112 -3.301 -12.544 2.427 902 HA ASP 112 HA ASP 112 -3.485 -15.027 0.867 903 HB2 ASP 112 HB2 ASP 112 -4.841 -15.393 2.958 904 HB3 ASP 112 HB3 ASP 112 -5.839 -14.009 2.512 905 H ARG 113 H ARG 113 -4.556 -14.818 -1.081 906 HA ARG 113 HA ARG 113 -4.490 -12.261 -2.337 907 HB2 ARG 113 HB2 ARG 113 -4.171 -14.553 -3.373 908 HB3 ARG 113 HB3 ARG 113 -5.927 -14.776 -3.297 909 HG2 ARG 113 HG2 ARG 113 -6.231 -12.782 -4.752 910 HG3 ARG 113 HG3 ARG 113 -4.474 -12.519 -4.741 911 HD2 ARG 113 HD2 ARG 113 -4.151 -14.747 -5.808 912 HD3 ARG 113 HD3 ARG 113 -5.897 -14.982 -5.859 913 HE ARG 113 HE ARG 113 -4.268 -13.077 -7.483 914 HH11 ARG 113 HH11 ARG 113 -5.070 -12.142 -9.191 915 HH12 ARG 113 HH12 ARG 113 -6.735 -12.386 -9.683 916 HH21 ARG 113 HH21 ARG 113 -7.510 -14.318 -6.928 917 HH22 ARG 113 HH22 ARG 113 -8.111 -13.564 -8.378 918 H GLY 114 H GLY 114 -7.218 -13.969 -0.816 919 HA2 GLY 114 HA2 GLY 114 -9.311 -12.271 -1.883 920 HA3 GLY 114 HA3 GLY 114 -9.401 -13.327 -0.468 921 H ASP 115 H ASP 115 -7.038 -11.900 0.789 922 HA ASP 115 HA ASP 115 -8.524 -9.557 1.883 923 HB2 ASP 115 HB2 ASP 115 -6.309 -11.323 2.910 924 HB3 ASP 115 HB3 ASP 115 -6.458 -9.677 3.511 925 H ALA 116 H ALA 116 -5.584 -10.276 0.005 926 HA ALA 116 HA ALA 116 -4.763 -7.511 -0.231 927 HB1 ALA 116 HB1 ALA 116 -3.347 -9.357 -0.861 928 HB2 ALA 116 HB2 ALA 116 -4.528 -9.922 -2.070 929 HB3 ALA 116 HB3 ALA 116 -3.699 -8.382 -2.310 930 H PHE 117 H PHE 117 -7.188 -9.511 -2.018 931 HA PHE 117 HA PHE 117 -8.037 -7.411 -3.754 932 HB2 PHE 117 HB2 PHE 117 -9.172 -9.989 -2.845 933 HB3 PHE 117 HB3 PHE 117 -10.355 -8.776 -3.294 934 HD1 PHE 117 HD1 PHE 117 -11.065 -8.772 -5.514 935 HD2 PHE 117 HD2 PHE 117 -7.026 -10.005 -4.627 936 HE1 PHE 117 HE1 PHE 117 -10.655 -9.186 -7.926 937 HE2 PHE 117 HE2 PHE 117 -6.621 -10.412 -7.037 938 HZ PHE 117 HZ PHE 117 -8.435 -10.005 -8.694 939 H ASP 118 H ASP 118 -8.768 -7.860 -0.294 940 HA ASP 118 HA ASP 118 -10.773 -5.804 -0.236 941 HB2 ASP 118 HB2 ASP 118 -10.267 -7.649 1.511 942 HB3 ASP 118 HB3 ASP 118 -9.002 -6.588 2.115 943 H PHE 119 H PHE 119 -7.255 -5.615 -0.313 944 HA PHE 119 HA PHE 119 -7.067 -2.775 0.360 945 HB2 PHE 119 HB2 PHE 119 -5.170 -4.110 0.716 946 HB3 PHE 119 HB3 PHE 119 -5.170 -4.756 -0.903 947 HD1 PHE 119 HD1 PHE 119 -3.906 -2.116 1.192 948 HD2 PHE 119 HD2 PHE 119 -4.590 -3.309 -2.885 949 HE1 PHE 119 HE1 PHE 119 -2.408 -0.331 0.427 950 HE2 PHE 119 HE2 PHE 119 -3.059 -1.526 -3.659 951 HZ PHE 119 HZ PHE 119 -1.959 -0.018 -2.007 952 H ASN 120 H ASN 120 -7.074 -4.567 -2.784 953 HA ASN 120 HA ASN 120 -7.085 -2.004 -4.178 954 HB2 ASN 120 HB2 ASN 120 -7.025 -3.247 -6.239 955 HB3 ASN 120 HB3 ASN 120 -5.803 -3.793 -5.102 956 HD21 ASN 120 HD21 ASN 120 -8.780 -6.406 -6.177 957 HD22 ASN 120 HD22 ASN 120 -9.138 -4.691 -6.268 958 H VAL 121 H VAL 121 -9.713 -4.163 -3.268 959 HA VAL 121 HA VAL 121 -11.646 -2.875 -5.046 960 HB VAL 121 HB VAL 121 -11.949 -4.746 -2.688 961 HG11 VAL 121 HG11 VAL 121 -14.125 -3.660 -4.527 962 HG12 VAL 121 HG12 VAL 121 -14.316 -5.037 -3.418 963 HG13 VAL 121 HG13 VAL 121 -14.009 -3.431 -2.766 964 HG21 VAL 121 HG21 VAL 121 -11.008 -5.739 -4.776 965 HG22 VAL 121 HG22 VAL 121 -12.615 -6.368 -4.420 966 HG23 VAL 121 HG23 VAL 121 -12.407 -5.134 -5.686 967 H SER 122 H SER 122 -10.762 -2.496 -1.566 968 HA SER 122 HA SER 122 -12.843 -0.604 -1.017 969 HB2 SER 122 HB2 SER 122 -11.648 -0.120 1.018 970 HB3 SER 122 HB3 SER 122 -11.660 -1.870 0.731 971 HG SER 122 HG SER 122 -9.597 -1.872 0.387 972 H LEU 123 H LEU 123 -9.559 -0.148 -2.295 973 HA LEU 123 HA LEU 123 -9.661 2.744 -2.293 974 HB2 LEU 123 HB2 LEU 123 -8.009 0.677 -3.783 975 HB3 LEU 123 HB3 LEU 123 -7.827 2.403 -4.085 976 HG LEU 123 HG LEU 123 -7.471 1.161 -1.324 977 HD11 LEU 123 HD11 LEU 123 -5.079 1.327 -1.687 978 HD12 LEU 123 HD12 LEU 123 -5.785 0.309 -2.945 979 HD13 LEU 123 HD13 LEU 123 -5.329 1.988 -3.320 980 HD21 LEU 123 HD21 LEU 123 -7.964 3.573 -1.239 981 HD22 LEU 123 HD22 LEU 123 -6.266 3.292 -0.864 982 HD23 LEU 123 HD23 LEU 123 -6.720 3.890 -2.472 983 H GLN 124 H GLN 124 -10.210 0.387 -5.015 984 HA GLN 124 HA GLN 124 -10.864 2.451 -6.827 985 HB2 GLN 124 HB2 GLN 124 -11.364 0.807 -8.386 986 HB3 GLN 124 HB3 GLN 124 -10.177 0.059 -7.317 987 HG2 GLN 124 HG2 GLN 124 -12.093 -1.067 -6.123 988 HG3 GLN 124 HG3 GLN 124 -13.167 -0.477 -7.395 989 HE21 GLN 124 HE21 GLN 124 -10.355 -3.358 -8.345 990 HE22 GLN 124 HE22 GLN 124 -10.069 -2.277 -6.966 991 H ASP 125 H ASP 125 -13.014 0.743 -4.575 992 HA ASP 125 HA ASP 125 -15.426 1.900 -5.756 993 HB2 ASP 125 HB2 ASP 125 -15.306 -0.417 -4.813 994 HB3 ASP 125 HB3 ASP 125 -15.041 0.276 -3.210 995 H HIS 126 H HIS 126 -13.048 3.226 -3.786 996 HA HIS 126 HA HIS 126 -14.999 5.146 -2.639 997 HB2 HIS 126 HB2 HIS 126 -13.068 4.237 -1.239 998 HB3 HIS 126 HB3 HIS 126 -12.012 5.264 -2.217 999 HD2 HIS 126 HD2 HIS 126 -15.219 5.550 -0.000 1000 HE1 HIS 126 HE1 HIS 126 -13.219 9.304 0.253 1001 HE2 HIS 126 HE2 HIS 126 -15.188 7.941 1.109 1002 H PHE 127 H PHE 127 -13.073 4.746 -5.439 1003 HA PHE 127 HA PHE 127 -13.158 7.669 -6.044 1004 HB2 PHE 127 HB2 PHE 127 -11.443 5.402 -7.081 1005 HB3 PHE 127 HB3 PHE 127 -11.512 6.969 -7.868 1006 HD1 PHE 127 HD1 PHE 127 -9.739 5.119 -5.464 1007 HD2 PHE 127 HD2 PHE 127 -11.205 9.090 -6.268 1008 HE1 PHE 127 HE1 PHE 127 -7.948 6.066 -4.035 1009 HE2 PHE 127 HE2 PHE 127 -9.410 10.037 -4.842 1010 HZ PHE 127 HZ PHE 127 -7.776 8.527 -3.739 1011 H LYS 128 H LYS 128 -15.042 4.951 -6.915 1012 HA LYS 128 HA LYS 128 -15.354 5.352 -9.638 1013 HB2 LYS 128 HB2 LYS 128 -17.269 4.080 -9.656 1014 HB3 LYS 128 HB3 LYS 128 -16.255 3.426 -8.388 1015 HG2 LYS 128 HG2 LYS 128 -18.650 5.280 -7.907 1016 HG3 LYS 128 HG3 LYS 128 -18.716 3.518 -7.909 1017 HD2 LYS 128 HD2 LYS 128 -17.032 3.479 -6.063 1018 HD3 LYS 128 HD3 LYS 128 -17.090 5.247 -6.003 1019 HE2 LYS 128 HE2 LYS 128 -18.496 4.515 -4.283 1020 HE3 LYS 128 HE3 LYS 128 -19.555 5.103 -5.577 1021 HZ1 LYS 128 HZ1 LYS 128 -18.872 2.233 -5.117 1022 HZ2 LYS 128 HZ2 LYS 128 -20.262 2.933 -4.600 1023 HZ3 LYS 128 HZ3 LYS 128 -19.967 2.791 -6.200 1024 H TRP 129 H TRP 129 -16.616 7.477 -7.247 1025 HA TRP 129 HA TRP 129 -18.395 8.922 -9.116 1026 HB2 TRP 129 HB2 TRP 129 -18.986 10.248 -7.208 1027 HB3 TRP 129 HB3 TRP 129 -19.093 8.541 -6.794 1028 HD1 TRP 129 HD1 TRP 129 -17.009 7.561 -5.265 1029 HE1 TRP 129 HE1 TRP 129 -15.438 8.660 -3.601 1030 HE3 TRP 129 HE3 TRP 129 -17.984 12.482 -6.348 1031 HZ2 TRP 129 HZ2 TRP 129 -14.958 11.328 -2.561 1032 HZ3 TRP 129 HZ3 TRP 129 -17.023 14.278 -4.935 1033 HH2 TRP 129 HH2 TRP 129 -15.513 13.718 -3.038 1034 H VAL 130 H VAL 130 -15.093 9.051 -8.209 1035 HA VAL 130 HA VAL 130 -14.729 11.872 -9.097 1036 HB VAL 130 HB VAL 130 -12.661 9.866 -8.120 1037 HG11 VAL 130 HG11 VAL 130 -11.215 11.857 -7.865 1038 HG12 VAL 130 HG12 VAL 130 -11.675 11.617 -9.551 1039 HG13 VAL 130 HG13 VAL 130 -12.481 12.875 -8.586 1040 HG21 VAL 130 HG21 VAL 130 -14.164 10.427 -6.272 1041 HG22 VAL 130 HG22 VAL 130 -12.627 11.261 -6.046 1042 HG23 VAL 130 HG23 VAL 130 -14.038 12.158 -6.649 1043 H LYS 131 H LYS 131 -13.755 8.541 -9.924 1044 HA LYS 131 HA LYS 131 -13.097 9.296 -12.722 1045 HB2 LYS 131 HB2 LYS 131 -11.548 7.864 -11.250 1046 HB3 LYS 131 HB3 LYS 131 -12.764 6.599 -11.355 1047 HG2 LYS 131 HG2 LYS 131 -11.330 6.027 -13.094 1048 HG3 LYS 131 HG3 LYS 131 -12.554 6.955 -13.966 1049 HD2 LYS 131 HD2 LYS 131 -10.998 9.006 -13.621 1050 HD3 LYS 131 HD3 LYS 131 -9.776 7.850 -13.095 1051 HE2 LYS 131 HE2 LYS 131 -11.109 8.067 -15.827 1052 HE3 LYS 131 HE3 LYS 131 -9.424 8.400 -15.423 1053 HZ1 LYS 131 HZ1 LYS 131 -10.770 5.761 -15.506 1054 HZ2 LYS 131 HZ2 LYS 131 -9.525 6.259 -16.423 1055 HZ3 LYS 131 HZ3 LYS 131 -9.270 5.960 -14.835 1056 H GLN 132 H GLN 132 -15.473 9.858 -12.754 1057 HA GLN 132 HA GLN 132 -17.506 7.883 -12.883 1058 HB2 GLN 132 HB2 GLN 132 -17.419 10.641 -14.161 1059 HB3 GLN 132 HB3 GLN 132 -18.852 9.621 -13.939 1060 HG2 GLN 132 HG2 GLN 132 -18.501 9.710 -11.465 1061 HG3 GLN 132 HG3 GLN 132 -17.108 10.768 -11.719 1062 HE21 GLN 132 HE21 GLN 132 -19.613 13.221 -10.922 1063 HE22 GLN 132 HE22 GLN 132 -18.420 12.134 -10.193 1064 H GLU 133 H GLU 133 -16.986 6.238 -14.089 1065 HA GLU 133 HA GLU 133 -17.104 6.472 -17.083 1066 HB2 GLU 133 HB2 GLU 133 -15.448 4.526 -15.430 1067 HB3 GLU 133 HB3 GLU 133 -15.760 4.367 -17.161 1068 HG2 GLU 133 HG2 GLU 133 -14.707 6.616 -17.530 1069 HG3 GLU 133 HG3 GLU 133 -14.282 6.672 -15.819 Start of MODEL 14 1 H1 GLY -4 H1 GLY -4 -18.883 24.352 10.557 2 H2 GLY -4 H2 GLY -4 -20.132 25.401 10.708 3 H3 GLY -4 H3 GLY -4 -19.904 24.234 11.835 4 HA2 GLY -4 HA2 GLY -4 -19.178 26.363 12.694 5 HA3 GLY -4 HA3 GLY -4 -17.836 25.214 12.553 6 H SER -3 H SER -3 -17.974 28.244 12.453 7 HA SER -3 HA SER -3 -17.448 29.134 9.802 8 HB2 SER -3 HB2 SER -3 -16.654 30.397 12.446 9 HB3 SER -3 HB3 SER -3 -16.692 31.207 10.864 10 HG SER -3 HG SER -3 -18.617 31.568 12.083 11 HA PRO -2 HA PRO -2 -13.177 28.010 9.140 12 HB2 PRO -2 HB2 PRO -2 -12.900 30.761 7.914 13 HB3 PRO -2 HB3 PRO -2 -12.353 29.180 7.272 14 HG2 PRO -2 HG2 PRO -2 -14.615 30.303 6.316 15 HG3 PRO -2 HG3 PRO -2 -14.600 28.553 6.716 16 HD2 PRO -2 HD2 PRO -2 -15.670 30.850 8.381 17 HD3 PRO -2 HD3 PRO -2 -16.412 29.261 8.015 18 H ASN -1 H ASN -1 -13.853 31.148 10.631 19 HA ASN -1 HA ASN -1 -11.245 31.769 11.604 20 HB2 ASN -1 HB2 ASN -1 -14.001 32.518 12.682 21 HB3 ASN -1 HB3 ASN -1 -12.490 33.289 13.148 22 HD21 ASN -1 HD21 ASN -1 -14.335 34.736 9.953 23 HD22 ASN -1 HD22 ASN -1 -15.114 33.754 11.182 24 H SER 0 H SER 0 -13.445 29.311 12.726 25 HA SER 0 HA SER 0 -12.309 29.088 15.413 26 HB2 SER 0 HB2 SER 0 -14.074 27.177 13.844 27 HB3 SER 0 HB3 SER 0 -13.695 27.079 15.573 28 HG SER 0 HG SER 0 -15.702 28.111 15.227 29 H MET 1 H MET 1 -11.057 28.248 12.385 30 HA MET 1 HA MET 1 -9.537 25.899 13.431 31 HB2 MET 1 HB2 MET 1 -10.199 26.663 10.564 32 HB3 MET 1 HB3 MET 1 -9.247 25.267 11.072 33 HG2 MET 1 HG2 MET 1 -12.176 25.741 11.729 34 HG3 MET 1 HG3 MET 1 -11.546 24.651 10.499 35 HE1 MET 1 HE1 MET 1 -13.040 22.700 11.440 36 HE2 MET 1 HE2 MET 1 -13.051 22.193 13.144 37 HE3 MET 1 HE3 MET 1 -13.672 23.796 12.692 38 H ALA 2 H ALA 2 -7.376 25.667 12.892 39 HA ALA 2 HA ALA 2 -5.824 27.837 11.680 40 HB1 ALA 2 HB1 ALA 2 -6.021 28.662 13.998 41 HB2 ALA 2 HB2 ALA 2 -5.412 27.113 14.624 42 HB3 ALA 2 HB3 ALA 2 -4.356 28.162 13.653 43 H THR 3 H THR 3 -5.609 24.838 13.633 44 HA THR 3 HA THR 3 -4.150 23.508 11.418 45 HB THR 3 HB THR 3 -3.358 23.154 14.341 46 HG1 THR 3 HG1 THR 3 -2.092 24.540 12.217 47 HG21 THR 3 HG21 THR 3 -2.997 21.130 12.993 48 HG22 THR 3 HG22 THR 3 -2.150 22.078 11.749 49 HG23 THR 3 HG23 THR 3 -1.449 21.893 13.373 50 H GLU 4 H GLU 4 -5.536 22.018 10.790 51 HA GLU 4 HA GLU 4 -7.439 20.806 12.740 52 HB2 GLU 4 HB2 GLU 4 -9.260 21.462 11.334 53 HB3 GLU 4 HB3 GLU 4 -8.313 22.877 11.745 54 HG2 GLU 4 HG2 GLU 4 -8.167 21.408 9.071 55 HG3 GLU 4 HG3 GLU 4 -9.151 22.826 9.398 56 H LEU 5 H LEU 5 -5.132 19.631 11.120 57 HA LEU 5 HA LEU 5 -6.431 17.688 9.408 58 HB2 LEU 5 HB2 LEU 5 -4.001 18.793 9.329 59 HB3 LEU 5 HB3 LEU 5 -3.562 17.357 10.240 60 HG LEU 5 HG LEU 5 -4.928 17.528 7.527 61 HD11 LEU 5 HD11 LEU 5 -2.182 16.472 8.315 62 HD12 LEU 5 HD12 LEU 5 -2.855 16.522 6.668 63 HD13 LEU 5 HD13 LEU 5 -2.516 18.032 7.528 64 HD21 LEU 5 HD21 LEU 5 -5.796 15.497 8.606 65 HD22 LEU 5 HD22 LEU 5 -4.660 15.066 7.332 66 HD23 LEU 5 HD23 LEU 5 -4.142 14.995 9.031 67 H GLU 6 H GLU 6 -7.842 17.311 11.402 68 HA GLU 6 HA GLU 6 -7.025 14.715 12.650 69 HB2 GLU 6 HB2 GLU 6 -7.099 16.647 14.272 70 HB3 GLU 6 HB3 GLU 6 -8.829 16.793 13.951 71 HG2 GLU 6 HG2 GLU 6 -9.131 14.424 14.743 72 HG3 GLU 6 HG3 GLU 6 -7.395 14.311 15.019 73 H TYR 7 H TYR 7 -7.846 14.163 10.392 74 HA TYR 7 HA TYR 7 -10.689 13.452 10.427 75 HB2 TYR 7 HB2 TYR 7 -11.171 14.468 8.306 76 HB3 TYR 7 HB3 TYR 7 -10.696 15.703 9.442 77 HD1 TYR 7 HD1 TYR 7 -9.055 17.291 8.823 78 HD2 TYR 7 HD2 TYR 7 -9.332 13.586 6.609 79 HE1 TYR 7 HE1 TYR 7 -7.462 18.168 7.129 80 HE2 TYR 7 HE2 TYR 7 -7.748 14.451 4.949 81 HH TYR 7 HH TYR 7 -6.333 17.753 5.171 82 H GLU 8 H GLU 8 -11.100 11.624 9.265 83 HA GLU 8 HA GLU 8 -9.761 10.765 6.992 84 HB2 GLU 8 HB2 GLU 8 -8.666 8.687 7.860 85 HB3 GLU 8 HB3 GLU 8 -7.818 10.162 8.273 86 HG2 GLU 8 HG2 GLU 8 -8.766 10.032 10.589 87 HG3 GLU 8 HG3 GLU 8 -9.560 8.516 10.139 88 H SER 9 H SER 9 -11.327 9.688 5.983 89 HA SER 9 HA SER 9 -13.405 8.192 7.494 90 HB2 SER 9 HB2 SER 9 -13.061 8.965 4.582 91 HB3 SER 9 HB3 SER 9 -14.299 7.815 5.118 92 HG SER 9 HG SER 9 -15.315 9.369 6.257 93 H VAL 10 H VAL 10 -12.695 6.199 8.124 94 HA VAL 10 HA VAL 10 -10.665 4.698 6.741 95 HB VAL 10 HB VAL 10 -11.092 4.600 9.165 96 HG11 VAL 10 HG11 VAL 10 -13.417 2.757 8.476 97 HG12 VAL 10 HG12 VAL 10 -12.778 3.112 10.092 98 HG13 VAL 10 HG13 VAL 10 -13.567 4.391 9.158 99 HG21 VAL 10 HG21 VAL 10 -9.705 2.902 8.008 100 HG22 VAL 10 HG22 VAL 10 -10.516 2.286 9.455 101 HG23 VAL 10 HG23 VAL 10 -11.143 1.859 7.857 102 H LEU 11 H LEU 11 -10.690 2.776 5.619 103 HA LEU 11 HA LEU 11 -13.224 2.091 4.159 104 HB2 LEU 11 HB2 LEU 11 -10.439 2.570 3.016 105 HB3 LEU 11 HB3 LEU 11 -11.785 1.889 2.115 106 HG LEU 11 HG LEU 11 -11.704 4.707 3.277 107 HD11 LEU 11 HD11 LEU 11 -11.578 5.343 0.869 108 HD12 LEU 11 HD12 LEU 11 -10.152 4.476 1.429 109 HD13 LEU 11 HD13 LEU 11 -11.371 3.632 0.446 110 HD21 LEU 11 HD21 LEU 11 -13.709 5.087 1.861 111 HD22 LEU 11 HD22 LEU 11 -13.737 3.362 1.432 112 HD23 LEU 11 HD23 LEU 11 -14.033 3.883 3.107 113 H CYS 12 H CYS 12 -9.912 1.020 5.031 114 HA CYS 12 HA CYS 12 -10.904 -1.726 5.419 115 HB2 CYS 12 HB2 CYS 12 -10.219 -1.539 2.994 116 HB3 CYS 12 HB3 CYS 12 -8.568 -1.174 3.551 117 HG CYS 12 HG CYS 12 -9.020 -3.702 2.659 118 H VAL 13 H VAL 13 -9.929 -2.651 7.084 119 HA VAL 13 HA VAL 13 -7.211 -1.771 7.917 120 HB VAL 13 HB VAL 13 -9.562 -2.248 9.770 121 HG11 VAL 13 HG11 VAL 13 -7.986 -1.704 11.612 122 HG12 VAL 13 HG12 VAL 13 -7.525 -3.197 10.797 123 HG13 VAL 13 HG13 VAL 13 -6.637 -1.693 10.457 124 HG21 VAL 13 HG21 VAL 13 -9.142 0.074 10.494 125 HG22 VAL 13 HG22 VAL 13 -7.839 0.215 9.289 126 HG23 VAL 13 HG23 VAL 13 -9.526 0.017 8.772 127 H LYS 14 H LYS 14 -5.840 -3.365 8.047 128 HA LYS 14 HA LYS 14 -6.770 -6.141 8.610 129 HB2 LYS 14 HB2 LYS 14 -4.592 -5.486 6.595 130 HB3 LYS 14 HB3 LYS 14 -5.107 -7.088 7.078 131 HG2 LYS 14 HG2 LYS 14 -6.932 -5.075 5.694 132 HG3 LYS 14 HG3 LYS 14 -5.979 -6.292 4.851 133 HD2 LYS 14 HD2 LYS 14 -7.201 -8.102 5.850 134 HD3 LYS 14 HD3 LYS 14 -8.035 -7.010 6.981 135 HE2 LYS 14 HE2 LYS 14 -9.100 -5.850 5.088 136 HE3 LYS 14 HE3 LYS 14 -8.284 -6.936 3.952 137 HZ1 LYS 14 HZ1 LYS 14 -10.566 -7.610 4.463 138 HZ2 LYS 14 HZ2 LYS 14 -9.484 -8.789 4.924 139 HZ3 LYS 14 HZ3 LYS 14 -10.198 -7.818 6.043 140 HA PRO 15 HA PRO 15 -3.894 -5.395 11.856 141 HB2 PRO 15 HB2 PRO 15 -3.869 -7.794 13.147 142 HB3 PRO 15 HB3 PRO 15 -5.302 -6.713 13.123 143 HG2 PRO 15 HG2 PRO 15 -4.726 -9.102 11.330 144 HG3 PRO 15 HG3 PRO 15 -6.233 -8.745 12.240 145 HD2 PRO 15 HD2 PRO 15 -5.968 -8.115 9.613 146 HD3 PRO 15 HD3 PRO 15 -6.838 -7.032 10.744 147 H ASP 16 H ASP 16 -3.081 -7.720 9.411 148 HA ASP 16 HA ASP 16 -0.241 -7.751 10.328 149 HB2 ASP 16 HB2 ASP 16 -1.389 -9.852 10.979 150 HB3 ASP 16 HB3 ASP 16 -1.794 -10.137 9.283 151 H VAL 17 H VAL 17 0.720 -6.557 8.925 152 HA VAL 17 HA VAL 17 0.874 -7.452 6.117 153 HB VAL 17 HB VAL 17 -0.827 -5.615 6.219 154 HG11 VAL 17 HG11 VAL 17 1.539 -3.786 6.819 155 HG12 VAL 17 HG12 VAL 17 -0.119 -3.291 6.439 156 HG13 VAL 17 HG13 VAL 17 0.216 -4.169 7.936 157 HG21 VAL 17 HG21 VAL 17 1.653 -4.962 4.588 158 HG22 VAL 17 HG22 VAL 17 0.386 -6.134 4.144 159 HG23 VAL 17 HG23 VAL 17 -0.006 -4.417 4.271 160 H SER 18 H SER 18 2.862 -7.068 5.155 161 HA SER 18 HA SER 18 5.065 -6.283 7.042 162 HB2 SER 18 HB2 SER 18 5.006 -8.584 5.061 163 HB3 SER 18 HB3 SER 18 6.355 -8.145 6.132 164 HG SER 18 HG SER 18 5.002 -9.867 6.946 165 H VAL 19 H VAL 19 6.594 -4.953 6.313 166 HA VAL 19 HA VAL 19 6.466 -4.005 3.503 167 HB VAL 19 HB VAL 19 7.632 -2.769 6.004 168 HG11 VAL 19 HG11 VAL 19 7.783 -1.760 3.126 169 HG12 VAL 19 HG12 VAL 19 8.089 -0.758 4.564 170 HG13 VAL 19 HG13 VAL 19 9.149 -2.118 4.210 171 HG21 VAL 19 HG21 VAL 19 5.513 -1.689 4.108 172 HG22 VAL 19 HG22 VAL 19 5.107 -2.639 5.552 173 HG23 VAL 19 HG23 VAL 19 5.952 -1.096 5.716 174 H TYR 20 H TYR 20 7.938 -4.347 2.074 175 HA TYR 20 HA TYR 20 10.748 -4.814 2.904 176 HB2 TYR 20 HB2 TYR 20 10.133 -6.162 0.383 177 HB3 TYR 20 HB3 TYR 20 11.079 -6.690 1.761 178 HD1 TYR 20 HD1 TYR 20 7.764 -6.697 0.165 179 HD2 TYR 20 HD2 TYR 20 10.076 -8.067 3.522 180 HE1 TYR 20 HE1 TYR 20 5.903 -8.227 0.819 181 HE2 TYR 20 HE2 TYR 20 8.216 -9.587 4.194 182 HH TYR 20 HH TYR 20 5.181 -9.820 2.336 183 H ARG 21 H ARG 21 11.929 -3.218 2.165 184 HA ARG 21 HA ARG 21 10.933 -1.330 0.179 185 HB2 ARG 21 HB2 ARG 21 13.693 -1.516 1.445 186 HB3 ARG 21 HB3 ARG 21 13.073 -0.172 0.468 187 HG2 ARG 21 HG2 ARG 21 11.200 0.117 2.146 188 HG3 ARG 21 HG3 ARG 21 11.963 -1.131 3.146 189 HD2 ARG 21 HD2 ARG 21 14.066 0.301 3.128 190 HD3 ARG 21 HD3 ARG 21 13.096 1.587 2.401 191 HE ARG 21 HE ARG 21 12.718 0.351 5.127 192 HH11 ARG 21 HH11 ARG 21 11.744 1.293 6.615 193 HH12 ARG 21 HH12 ARG 21 11.024 2.899 6.441 194 HH21 ARG 21 HH21 ARG 21 11.918 3.107 3.092 195 HH22 ARG 21 HH22 ARG 21 11.109 3.900 4.418 196 H ILE 22 H ILE 22 11.291 -1.196 -1.895 197 HA ILE 22 HA ILE 22 12.142 -3.707 -3.122 198 HB ILE 22 HB ILE 22 10.889 -2.958 -5.088 199 HG12 ILE 22 HG12 ILE 22 10.388 -0.393 -3.514 200 HG13 ILE 22 HG13 ILE 22 11.270 -0.556 -5.034 201 HG21 ILE 22 HG21 ILE 22 9.248 -2.574 -2.565 202 HG22 ILE 22 HG22 ILE 22 8.716 -3.221 -4.135 203 HG23 ILE 22 HG23 ILE 22 9.835 -4.146 -3.132 204 HD11 ILE 22 HD11 ILE 22 9.131 0.268 -5.614 205 HD12 ILE 22 HD12 ILE 22 9.100 -1.454 -6.052 206 HD13 ILE 22 HD13 ILE 22 8.307 -0.893 -4.560 207 HA PRO 23 HA PRO 23 15.548 -1.997 -5.629 208 HB2 PRO 23 HB2 PRO 23 15.447 -3.663 -7.793 209 HB3 PRO 23 HB3 PRO 23 16.091 -4.188 -6.207 210 HG2 PRO 23 HG2 PRO 23 13.294 -4.616 -7.317 211 HG3 PRO 23 HG3 PRO 23 14.391 -5.832 -6.586 212 HD2 PRO 23 HD2 PRO 23 12.435 -4.611 -5.152 213 HD3 PRO 23 HD3 PRO 23 14.011 -5.008 -4.411 214 HA PRO 24 HA PRO 24 13.272 0.720 -8.359 215 HB2 PRO 24 HB2 PRO 24 15.003 1.199 -10.447 216 HB3 PRO 24 HB3 PRO 24 15.211 1.878 -8.802 217 HG2 PRO 24 HG2 PRO 24 16.503 -0.614 -9.963 218 HG3 PRO 24 HG3 PRO 24 17.295 0.736 -9.086 219 HD2 PRO 24 HD2 PRO 24 16.619 -1.552 -7.813 220 HD3 PRO 24 HD3 PRO 24 16.396 0.028 -7.006 221 H ARG 25 H ARG 25 11.930 0.693 -10.172 222 HA ARG 25 HA ARG 25 11.151 -1.892 -11.110 223 HB2 ARG 25 HB2 ARG 25 9.738 0.272 -10.812 224 HB3 ARG 25 HB3 ARG 25 10.341 0.715 -12.414 225 HG2 ARG 25 HG2 ARG 25 9.347 -1.572 -13.189 226 HG3 ARG 25 HG3 ARG 25 8.530 -1.607 -11.638 227 HD2 ARG 25 HD2 ARG 25 8.256 0.479 -13.835 228 HD3 ARG 25 HD3 ARG 25 7.089 -0.757 -13.400 229 HE ARG 25 HE ARG 25 6.394 0.466 -11.507 230 HH11 ARG 25 HH11 ARG 25 6.193 2.233 -10.251 231 HH12 ARG 25 HH12 ARG 25 7.113 3.680 -10.605 232 HH21 ARG 25 HH21 ARG 25 8.881 2.289 -13.195 233 HH22 ARG 25 HH22 ARG 25 8.600 3.707 -12.223 234 H ALA 26 H ALA 26 11.228 -2.863 -13.032 235 HA ALA 26 HA ALA 26 13.203 -2.350 -15.081 236 HB1 ALA 26 HB1 ALA 26 11.910 -4.158 -16.230 237 HB2 ALA 26 HB2 ALA 26 12.207 -4.571 -14.535 238 HB3 ALA 26 HB3 ALA 26 10.616 -3.941 -15.032 239 H SER 27 H SER 27 12.245 -2.349 -17.392 240 HA SER 27 HA SER 27 10.570 0.098 -17.809 241 HB2 SER 27 HB2 SER 27 11.655 0.199 -20.007 242 HB3 SER 27 HB3 SER 27 12.843 0.194 -18.690 243 HG SER 27 HG SER 27 13.563 -1.271 -20.185 244 H ASN 28 H ASN 28 10.966 -3.266 -18.789 245 HA ASN 28 HA ASN 28 8.224 -3.343 -19.970 246 HB2 ASN 28 HB2 ASN 28 10.837 -4.481 -21.072 247 HB3 ASN 28 HB3 ASN 28 9.244 -4.893 -21.697 248 HD21 ASN 28 HD21 ASN 28 10.836 -1.276 -22.691 249 HD22 ASN 28 HD22 ASN 28 11.556 -2.177 -21.362 250 H ARG 29 H ARG 29 9.162 -4.136 -17.263 251 HA ARG 29 HA ARG 29 8.101 -6.928 -17.313 252 HB2 ARG 29 HB2 ARG 29 10.434 -6.103 -15.531 253 HB3 ARG 29 HB3 ARG 29 9.606 -7.632 -15.498 254 HG2 ARG 29 HG2 ARG 29 11.174 -6.594 -17.908 255 HG3 ARG 29 HG3 ARG 29 11.800 -7.702 -16.675 256 HD2 ARG 29 HD2 ARG 29 10.000 -9.292 -17.137 257 HD3 ARG 29 HD3 ARG 29 9.329 -8.231 -18.362 258 HE ARG 29 HE ARG 29 11.821 -9.842 -18.555 259 HH11 ARG 29 HH11 ARG 29 12.667 -10.240 -20.556 260 HH12 ARG 29 HH12 ARG 29 12.062 -9.393 -21.948 261 HH21 ARG 29 HH21 ARG 29 9.734 -7.542 -20.230 262 HH22 ARG 29 HH22 ARG 29 10.441 -7.934 -21.777 263 H GLY 30 H GLY 30 8.962 -4.436 -14.815 264 HA2 GLY 30 HA2 GLY 30 7.392 -3.534 -13.283 265 HA3 GLY 30 HA3 GLY 30 6.265 -4.840 -13.676 266 H TYR 31 H TYR 31 6.536 -4.559 -11.210 267 HA TYR 31 HA TYR 31 8.669 -6.012 -9.902 268 HB2 TYR 31 HB2 TYR 31 5.936 -5.289 -8.822 269 HB3 TYR 31 HB3 TYR 31 7.395 -5.633 -7.904 270 HD1 TYR 31 HD1 TYR 31 5.364 -3.179 -8.050 271 HD2 TYR 31 HD2 TYR 31 9.349 -3.854 -9.581 272 HE1 TYR 31 HE1 TYR 31 5.825 -0.744 -7.934 273 HE2 TYR 31 HE2 TYR 31 9.875 -1.448 -9.202 274 HH TYR 31 HH TYR 31 7.358 0.911 -8.239 275 H ARG 32 H ARG 32 8.527 -8.084 -9.000 276 HA ARG 32 HA ARG 32 6.244 -9.848 -9.830 277 HB2 ARG 32 HB2 ARG 32 7.908 -11.607 -10.450 278 HB3 ARG 32 HB3 ARG 32 7.765 -10.255 -11.541 279 HG2 ARG 32 HG2 ARG 32 9.962 -10.258 -9.450 280 HG3 ARG 32 HG3 ARG 32 10.122 -11.215 -10.929 281 HD2 ARG 32 HD2 ARG 32 9.745 -9.229 -12.322 282 HD3 ARG 32 HD3 ARG 32 9.588 -8.219 -10.883 283 HE ARG 32 HE ARG 32 12.094 -9.508 -10.689 284 HH11 ARG 32 HH11 ARG 32 13.905 -8.563 -11.113 285 HH12 ARG 32 HH12 ARG 32 14.037 -7.195 -12.215 286 HH21 ARG 32 HH21 ARG 32 10.595 -6.969 -12.629 287 HH22 ARG 32 HH22 ARG 32 12.161 -6.316 -13.057 288 H ALA 33 H ALA 33 6.986 -8.722 -7.252 289 HA ALA 33 HA ALA 33 7.139 -9.165 -5.062 290 HB1 ALA 33 HB1 ALA 33 5.073 -10.347 -5.774 291 HB2 ALA 33 HB2 ALA 33 5.977 -11.854 -5.844 292 HB3 ALA 33 HB3 ALA 33 5.801 -11.006 -4.285 293 H SER 34 H SER 34 8.402 -12.050 -6.768 294 HA SER 34 HA SER 34 10.050 -13.038 -4.690 295 HB2 SER 34 HB2 SER 34 10.977 -14.456 -6.458 296 HB3 SER 34 HB3 SER 34 9.208 -14.343 -6.581 297 HG SER 34 HG SER 34 10.246 -14.088 -8.621 298 H ASP 35 H ASP 35 10.637 -10.402 -6.873 299 HA ASP 35 HA ASP 35 13.541 -10.411 -6.570 300 HB2 ASP 35 HB2 ASP 35 11.671 -9.125 -8.270 301 HB3 ASP 35 HB3 ASP 35 12.393 -7.831 -7.339 302 H TRP 36 H TRP 36 10.960 -9.442 -4.467 303 HA TRP 36 HA TRP 36 12.580 -7.462 -3.010 304 HB2 TRP 36 HB2 TRP 36 9.873 -8.513 -2.238 305 HB3 TRP 36 HB3 TRP 36 10.634 -6.998 -1.802 306 HD1 TRP 36 HD1 TRP 36 11.129 -6.508 -5.210 307 HE1 TRP 36 HE1 TRP 36 9.116 -5.481 -6.462 308 HE3 TRP 36 HE3 TRP 36 7.410 -7.597 -1.855 309 HZ2 TRP 36 HZ2 TRP 36 6.372 -4.946 -5.938 310 HZ3 TRP 36 HZ3 TRP 36 5.093 -6.741 -2.240 311 HH2 TRP 36 HH2 TRP 36 4.594 -5.398 -4.261 312 H LYS 37 H LYS 37 12.657 -7.750 -0.646 313 HA LYS 37 HA LYS 37 13.630 -10.462 0.011 314 HB2 LYS 37 HB2 LYS 37 13.855 -7.966 1.716 315 HB3 LYS 37 HB3 LYS 37 14.676 -9.529 1.889 316 HG2 LYS 37 HG2 LYS 37 15.453 -8.968 -0.629 317 HG3 LYS 37 HG3 LYS 37 15.222 -7.312 -0.046 318 HD2 LYS 37 HD2 LYS 37 16.986 -9.494 1.112 319 HD3 LYS 37 HD3 LYS 37 17.530 -8.033 0.277 320 HE2 LYS 37 HE2 LYS 37 16.836 -6.616 2.106 321 HE3 LYS 37 HE3 LYS 37 15.946 -7.933 2.882 322 HZ1 LYS 37 HZ1 LYS 37 18.016 -9.074 3.304 323 HZ2 LYS 37 HZ2 LYS 37 18.894 -7.912 2.544 324 HZ3 LYS 37 HZ3 LYS 37 18.111 -7.568 3.936 325 H LEU 38 H LEU 38 11.339 -11.128 -0.239 326 HA LEU 38 HA LEU 38 9.240 -10.537 1.481 327 HB2 LEU 38 HB2 LEU 38 9.932 -13.207 0.200 328 HB3 LEU 38 HB3 LEU 38 8.338 -12.750 0.805 329 HG LEU 38 HG LEU 38 9.806 -11.515 -1.553 330 HD11 LEU 38 HD11 LEU 38 7.221 -13.122 -1.362 331 HD12 LEU 38 HD12 LEU 38 7.925 -12.454 -2.846 332 HD13 LEU 38 HD13 LEU 38 8.781 -13.728 -1.963 333 HD21 LEU 38 HD21 LEU 38 7.659 -10.246 -1.926 334 HD22 LEU 38 HD22 LEU 38 7.145 -10.749 -0.300 335 HD23 LEU 38 HD23 LEU 38 8.571 -9.715 -0.510 336 H ASP 39 H ASP 39 11.932 -12.672 2.243 337 HA ASP 39 HA ASP 39 10.609 -13.804 4.622 338 HB2 ASP 39 HB2 ASP 39 12.098 -15.105 3.100 339 HB3 ASP 39 HB3 ASP 39 13.451 -14.091 3.592 340 H GLN 40 H GLN 40 12.094 -10.866 4.015 341 HA GLN 40 HA GLN 40 13.368 -10.585 6.724 342 HB2 GLN 40 HB2 GLN 40 14.420 -9.755 4.002 343 HB3 GLN 40 HB3 GLN 40 15.226 -9.421 5.534 344 HG2 GLN 40 HG2 GLN 40 15.876 -11.613 5.845 345 HG3 GLN 40 HG3 GLN 40 14.628 -12.263 4.787 346 HE21 GLN 40 HE21 GLN 40 16.585 -12.146 1.863 347 HE22 GLN 40 HE22 GLN 40 15.088 -12.661 2.623 348 HA PRO 41 HA PRO 41 10.731 -7.090 5.290 349 HB2 PRO 41 HB2 PRO 41 8.896 -6.750 7.395 350 HB3 PRO 41 HB3 PRO 41 8.638 -7.809 5.982 351 HG2 PRO 41 HG2 PRO 41 9.749 -8.571 8.702 352 HG3 PRO 41 HG3 PRO 41 8.491 -9.418 7.746 353 HD2 PRO 41 HD2 PRO 41 11.084 -10.250 7.741 354 HD3 PRO 41 HD3 PRO 41 10.094 -10.300 6.249 355 H ASP 42 H ASP 42 11.041 -4.958 5.712 356 HA ASP 42 HA ASP 42 13.084 -4.176 7.655 357 HB2 ASP 42 HB2 ASP 42 12.857 -3.172 5.384 358 HB3 ASP 42 HB3 ASP 42 11.283 -2.519 5.840 359 H TRP 43 H TRP 43 9.598 -4.208 7.489 360 HA TRP 43 HA TRP 43 9.301 -3.648 10.343 361 HB2 TRP 43 HB2 TRP 43 9.375 -1.368 9.524 362 HB3 TRP 43 HB3 TRP 43 8.286 -1.747 8.202 363 HD1 TRP 43 HD1 TRP 43 8.294 -0.795 11.860 364 HE1 TRP 43 HE1 TRP 43 5.904 -0.180 12.573 365 HE3 TRP 43 HE3 TRP 43 5.768 -2.563 7.789 366 HZ2 TRP 43 HZ2 TRP 43 3.273 -0.184 11.372 367 HZ3 TRP 43 HZ3 TRP 43 3.312 -2.136 7.549 368 HH2 TRP 43 HH2 TRP 43 2.058 -0.993 9.351 369 H THR 44 H THR 44 7.233 -4.316 11.130 370 HA THR 44 HA THR 44 5.221 -5.200 9.162 371 HB THR 44 HB THR 44 4.624 -7.181 10.372 372 HG1 THR 44 HG1 THR 44 6.984 -6.805 11.896 373 HG21 THR 44 HG21 THR 44 6.373 -8.661 9.724 374 HG22 THR 44 HG22 THR 44 6.279 -7.348 8.542 375 HG23 THR 44 HG23 THR 44 7.586 -7.352 9.744 376 H GLY 45 H GLY 45 3.110 -5.125 9.846 377 HA2 GLY 45 HA2 GLY 45 2.211 -4.355 12.457 378 HA3 GLY 45 HA3 GLY 45 2.494 -2.904 11.506 379 H ARG 46 H ARG 46 0.450 -2.239 11.279 380 HA ARG 46 HA ARG 46 -1.642 -4.035 10.134 381 HB2 ARG 46 HB2 ARG 46 -2.122 -1.391 11.531 382 HB3 ARG 46 HB3 ARG 46 -3.276 -2.678 11.187 383 HG2 ARG 46 HG2 ARG 46 -1.927 -4.133 12.823 384 HG3 ARG 46 HG3 ARG 46 -1.055 -2.667 13.278 385 HD2 ARG 46 HD2 ARG 46 -4.060 -3.135 13.503 386 HD3 ARG 46 HD3 ARG 46 -2.893 -3.166 14.825 387 HE ARG 46 HE ARG 46 -3.189 -0.654 13.231 388 HH11 ARG 46 HH11 ARG 46 -3.888 1.178 14.215 389 HH12 ARG 46 HH12 ARG 46 -4.305 1.144 15.912 390 HH21 ARG 46 HH21 ARG 46 -3.798 -2.221 16.312 391 HH22 ARG 46 HH22 ARG 46 -4.267 -0.724 17.065 392 H LEU 47 H LEU 47 -2.888 -3.392 8.495 393 HA LEU 47 HA LEU 47 -2.138 -1.086 6.770 394 HB2 LEU 47 HB2 LEU 47 -2.622 -3.298 5.716 395 HB3 LEU 47 HB3 LEU 47 -4.179 -3.332 6.542 396 HG LEU 47 HG LEU 47 -4.858 -1.262 5.237 397 HD11 LEU 47 HD11 LEU 47 -2.604 -0.462 4.584 398 HD12 LEU 47 HD12 LEU 47 -2.355 -1.942 3.632 399 HD13 LEU 47 HD13 LEU 47 -3.613 -0.777 3.170 400 HD21 LEU 47 HD21 LEU 47 -5.621 -3.492 4.654 401 HD22 LEU 47 HD22 LEU 47 -5.349 -2.534 3.207 402 HD23 LEU 47 HD23 LEU 47 -4.155 -3.765 3.692 403 H ARG 48 H ARG 48 -3.350 0.770 6.766 404 HA ARG 48 HA ARG 48 -6.202 0.680 7.564 405 HB2 ARG 48 HB2 ARG 48 -4.986 1.347 9.600 406 HB3 ARG 48 HB3 ARG 48 -4.177 2.654 8.728 407 HG2 ARG 48 HG2 ARG 48 -6.307 3.813 8.388 408 HG3 ARG 48 HG3 ARG 48 -7.208 2.444 9.069 409 HD2 ARG 48 HD2 ARG 48 -6.016 2.790 11.246 410 HD3 ARG 48 HD3 ARG 48 -5.163 4.163 10.531 411 HE ARG 48 HE ARG 48 -7.055 5.495 10.728 412 HH11 ARG 48 HH11 ARG 48 -8.828 6.111 11.486 413 HH12 ARG 48 HH12 ARG 48 -10.051 5.016 12.149 414 HH21 ARG 48 HH21 ARG 48 -8.068 2.229 11.557 415 HH22 ARG 48 HH22 ARG 48 -9.591 2.805 12.181 416 H ILE 49 H ILE 49 -6.823 0.866 5.515 417 HA ILE 49 HA ILE 49 -5.930 3.122 3.821 418 HB ILE 49 HB ILE 49 -8.247 1.243 3.289 419 HG12 ILE 49 HG12 ILE 49 -5.319 0.985 2.454 420 HG13 ILE 49 HG13 ILE 49 -6.228 -0.107 3.508 421 HG21 ILE 49 HG21 ILE 49 -6.594 3.027 1.433 422 HG22 ILE 49 HG22 ILE 49 -8.011 2.054 0.978 423 HG23 ILE 49 HG23 ILE 49 -8.206 3.431 2.043 424 HD11 ILE 49 HD11 ILE 49 -6.555 0.259 0.528 425 HD12 ILE 49 HD12 ILE 49 -6.197 -1.205 1.460 426 HD13 ILE 49 HD13 ILE 49 -7.809 -0.500 1.541 427 H THR 50 H THR 50 -6.774 5.029 3.891 428 HA THR 50 HA THR 50 -9.462 5.590 5.010 429 HB THR 50 HB THR 50 -8.257 7.660 6.061 430 HG1 THR 50 HG1 THR 50 -6.125 5.859 5.828 431 HG21 THR 50 HG21 THR 50 -9.300 6.197 7.573 432 HG22 THR 50 HG22 THR 50 -8.138 4.882 7.258 433 HG23 THR 50 HG23 THR 50 -7.635 6.336 8.145 434 H SER 51 H SER 51 -10.218 7.809 4.379 435 HA SER 51 HA SER 51 -8.715 9.199 2.211 436 HB2 SER 51 HB2 SER 51 -11.577 8.178 1.988 437 HB3 SER 51 HB3 SER 51 -10.833 9.377 0.914 438 HG SER 51 HG SER 51 -10.667 7.401 -0.041 439 H LYS 52 H LYS 52 -9.367 11.326 1.791 440 HA LYS 52 HA LYS 52 -11.864 12.158 2.958 441 HB2 LYS 52 HB2 LYS 52 -10.104 12.701 4.709 442 HB3 LYS 52 HB3 LYS 52 -9.481 13.904 3.582 443 HG2 LYS 52 HG2 LYS 52 -10.963 14.883 5.249 444 HG3 LYS 52 HG3 LYS 52 -11.596 15.097 3.617 445 HD2 LYS 52 HD2 LYS 52 -13.381 14.635 5.193 446 HD3 LYS 52 HD3 LYS 52 -13.264 13.291 4.062 447 HE2 LYS 52 HE2 LYS 52 -11.980 11.982 5.748 448 HE3 LYS 52 HE3 LYS 52 -12.044 13.365 6.853 449 HZ1 LYS 52 HZ1 LYS 52 -14.545 13.129 6.719 450 HZ2 LYS 52 HZ2 LYS 52 -14.315 11.689 5.951 451 HZ3 LYS 52 HZ3 LYS 52 -13.794 11.884 7.466 452 H GLY 53 H GLY 53 -12.958 13.036 1.381 453 HA2 GLY 53 HA2 GLY 53 -13.608 14.498 -0.300 454 HA3 GLY 53 HA3 GLY 53 -11.980 15.183 -0.341 455 H LYS 54 H LYS 54 -11.087 14.847 -2.211 456 HA LYS 54 HA LYS 54 -11.511 12.345 -3.792 457 HB2 LYS 54 HB2 LYS 54 -10.622 15.149 -4.448 458 HB3 LYS 54 HB3 LYS 54 -10.532 13.811 -5.626 459 HG2 LYS 54 HG2 LYS 54 -12.980 13.439 -5.350 460 HG3 LYS 54 HG3 LYS 54 -13.073 14.857 -4.299 461 HD2 LYS 54 HD2 LYS 54 -12.193 14.865 -7.216 462 HD3 LYS 54 HD3 LYS 54 -13.795 15.322 -6.612 463 HE2 LYS 54 HE2 LYS 54 -12.761 17.147 -5.266 464 HE3 LYS 54 HE3 LYS 54 -11.171 16.719 -5.913 465 HZ1 LYS 54 HZ1 LYS 54 -12.167 18.546 -7.159 466 HZ2 LYS 54 HZ2 LYS 54 -12.008 17.254 -8.140 467 HZ3 LYS 54 HZ3 LYS 54 -13.476 17.653 -7.541 468 H THR 55 H THR 55 -9.618 12.831 -1.426 469 HA THR 55 HA THR 55 -7.208 11.659 -2.749 470 HB THR 55 HB THR 55 -7.171 13.327 -0.218 471 HG1 THR 55 HG1 THR 55 -6.353 14.960 -1.526 472 HG21 THR 55 HG21 THR 55 -5.268 11.755 -0.545 473 HG22 THR 55 HG22 THR 55 -4.999 12.425 -2.168 474 HG23 THR 55 HG23 THR 55 -4.745 13.435 -0.724 475 H ALA 56 H ALA 56 -6.708 9.699 -2.127 476 HA ALA 56 HA ALA 56 -7.822 8.568 0.395 477 HB1 ALA 56 HB1 ALA 56 -6.712 7.082 -1.999 478 HB2 ALA 56 HB2 ALA 56 -7.449 6.382 -0.548 479 HB3 ALA 56 HB3 ALA 56 -8.437 7.344 -1.659 480 H TYR 57 H TYR 57 -6.436 7.211 1.621 481 HA TYR 57 HA TYR 57 -3.545 7.917 1.671 482 HB2 TYR 57 HB2 TYR 57 -5.503 8.127 3.994 483 HB3 TYR 57 HB3 TYR 57 -3.784 8.476 4.041 484 HD1 TYR 57 HD1 TYR 57 -7.018 9.941 3.826 485 HD2 TYR 57 HD2 TYR 57 -2.979 10.370 2.338 486 HE1 TYR 57 HE1 TYR 57 -7.473 12.312 3.283 487 HE2 TYR 57 HE2 TYR 57 -3.452 12.755 1.791 488 HH TYR 57 HH TYR 57 -6.636 14.269 2.408 489 H ILE 58 H ILE 58 -2.735 5.852 1.328 490 HA ILE 58 HA ILE 58 -3.746 3.566 2.970 491 HB ILE 58 HB ILE 58 -1.451 3.695 0.977 492 HG12 ILE 58 HG12 ILE 58 -2.963 1.898 -0.159 493 HG13 ILE 58 HG13 ILE 58 -4.274 2.567 0.804 494 HG21 ILE 58 HG21 ILE 58 -2.575 1.322 2.525 495 HG22 ILE 58 HG22 ILE 58 -1.296 1.265 1.287 496 HG23 ILE 58 HG23 ILE 58 -0.990 2.071 2.806 497 HD11 ILE 58 HD11 ILE 58 -4.175 3.441 -1.521 498 HD12 ILE 58 HD12 ILE 58 -3.966 4.749 -0.360 499 HD13 ILE 58 HD13 ILE 58 -2.547 4.077 -1.212 500 H LYS 59 H LYS 59 -3.485 4.261 5.054 501 HA LYS 59 HA LYS 59 -0.762 5.009 5.954 502 HB2 LYS 59 HB2 LYS 59 -3.256 4.729 7.656 503 HB3 LYS 59 HB3 LYS 59 -1.740 5.540 8.050 504 HG2 LYS 59 HG2 LYS 59 -2.263 7.068 5.991 505 HG3 LYS 59 HG3 LYS 59 -3.881 6.388 6.072 506 HD2 LYS 59 HD2 LYS 59 -3.985 7.164 8.493 507 HD3 LYS 59 HD3 LYS 59 -2.428 7.995 8.209 508 HE2 LYS 59 HE2 LYS 59 -3.454 9.306 6.381 509 HE3 LYS 59 HE3 LYS 59 -4.987 8.450 6.609 510 HZ1 LYS 59 HZ1 LYS 59 -5.002 10.591 7.752 511 HZ2 LYS 59 HZ2 LYS 59 -5.128 9.381 8.846 512 HZ3 LYS 59 HZ3 LYS 59 -3.706 10.176 8.661 513 H LEU 60 H LEU 60 0.543 3.838 7.158 514 HA LEU 60 HA LEU 60 -0.145 1.013 7.876 515 HB2 LEU 60 HB2 LEU 60 2.305 2.353 6.766 516 HB3 LEU 60 HB3 LEU 60 2.552 1.109 7.978 517 HG LEU 60 HG LEU 60 1.447 -0.567 6.681 518 HD11 LEU 60 HD11 LEU 60 -0.294 0.630 5.476 519 HD12 LEU 60 HD12 LEU 60 0.913 1.611 4.609 520 HD13 LEU 60 HD13 LEU 60 0.766 -0.134 4.297 521 HD21 LEU 60 HD21 LEU 60 3.036 -0.689 4.807 522 HD22 LEU 60 HD22 LEU 60 3.374 1.050 4.952 523 HD23 LEU 60 HD23 LEU 60 3.839 -0.066 6.251 524 H GLU 61 H GLU 61 -0.010 0.407 9.974 525 HA GLU 61 HA GLU 61 0.942 2.423 11.990 526 HB2 GLU 61 HB2 GLU 61 -1.618 0.807 12.107 527 HB3 GLU 61 HB3 GLU 61 -0.989 1.850 13.385 528 HG2 GLU 61 HG2 GLU 61 -1.171 3.804 11.821 529 HG3 GLU 61 HG3 GLU 61 -1.984 2.746 10.653 530 H ASP 62 H ASP 62 1.729 1.645 13.975 531 HA ASP 62 HA ASP 62 2.868 -1.008 13.983 532 HB2 ASP 62 HB2 ASP 62 3.762 1.103 15.095 533 HB3 ASP 62 HB3 ASP 62 2.468 0.895 16.297 534 H LYS 63 H LYS 63 2.141 -2.830 14.841 535 HA LYS 63 HA LYS 63 -0.648 -3.024 15.599 536 HB2 LYS 63 HB2 LYS 63 -0.133 -5.532 15.592 537 HB3 LYS 63 HB3 LYS 63 0.214 -4.691 14.080 538 HG2 LYS 63 HG2 LYS 63 2.589 -4.552 14.624 539 HG3 LYS 63 HG3 LYS 63 2.321 -5.299 16.202 540 HD2 LYS 63 HD2 LYS 63 1.876 -7.410 15.257 541 HD3 LYS 63 HD3 LYS 63 1.548 -6.724 13.640 542 HE2 LYS 63 HE2 LYS 63 3.916 -5.975 13.488 543 HE3 LYS 63 HE3 LYS 63 4.261 -6.724 15.046 544 HZ1 LYS 63 HZ1 LYS 63 4.833 -8.076 13.043 545 HZ2 LYS 63 HZ2 LYS 63 3.854 -8.876 14.099 546 HZ3 LYS 63 HZ3 LYS 63 3.245 -8.256 12.710 547 H VAL 64 H VAL 64 1.907 -2.322 17.519 548 HA VAL 64 HA VAL 64 0.507 -3.417 19.930 549 HB VAL 64 HB VAL 64 3.450 -2.980 19.355 550 HG11 VAL 64 HG11 VAL 64 3.096 -2.239 21.669 551 HG12 VAL 64 HG12 VAL 64 2.150 -3.707 22.021 552 HG13 VAL 64 HG13 VAL 64 3.892 -3.812 21.673 553 HG21 VAL 64 HG21 VAL 64 1.879 -5.468 20.148 554 HG22 VAL 64 HG22 VAL 64 2.564 -5.121 18.545 555 HG23 VAL 64 HG23 VAL 64 3.640 -5.387 19.916 556 H SER 65 H SER 65 2.362 -0.624 18.623 557 HA SER 65 HA SER 65 1.533 0.997 20.961 558 HB2 SER 65 HB2 SER 65 3.300 1.635 18.579 559 HB3 SER 65 HB3 SER 65 2.981 2.732 19.936 560 HG SER 65 HG SER 65 4.918 1.546 20.221 561 H GLY 66 H GLY 66 0.479 0.517 17.682 562 HA2 GLY 66 HA2 GLY 66 -1.357 1.366 16.555 563 HA3 GLY 66 HA3 GLY 66 -1.774 2.344 17.966 564 H GLU 67 H GLU 67 1.459 2.767 16.897 565 HA GLU 67 HA GLU 67 0.879 5.538 16.156 566 HB2 GLU 67 HB2 GLU 67 3.155 5.965 16.574 567 HB3 GLU 67 HB3 GLU 67 2.568 4.887 17.851 568 HG2 GLU 67 HG2 GLU 67 3.652 2.964 16.753 569 HG3 GLU 67 HG3 GLU 67 4.234 4.008 15.453 570 H LEU 68 H LEU 68 1.741 6.591 14.271 571 HA LEU 68 HA LEU 68 1.341 5.032 11.876 572 HB2 LEU 68 HB2 LEU 68 0.675 7.450 12.204 573 HB3 LEU 68 HB3 LEU 68 2.387 7.872 12.177 574 HG LEU 68 HG LEU 68 2.474 6.796 9.829 575 HD11 LEU 68 HD11 LEU 68 0.302 5.552 9.983 576 HD12 LEU 68 HD12 LEU 68 -0.555 7.101 10.070 577 HD13 LEU 68 HD13 LEU 68 0.360 6.656 8.611 578 HD21 LEU 68 HD21 LEU 68 1.545 8.790 8.741 579 HD22 LEU 68 HD22 LEU 68 0.698 9.234 10.242 580 HD23 LEU 68 HD23 LEU 68 2.475 9.230 10.181 581 H PHE 69 H PHE 69 2.766 3.939 10.688 582 HA PHE 69 HA PHE 69 5.702 4.240 11.071 583 HB2 PHE 69 HB2 PHE 69 4.961 1.991 10.987 584 HB3 PHE 69 HB3 PHE 69 3.934 2.277 9.593 585 HD1 PHE 69 HD1 PHE 69 7.553 2.301 10.621 586 HD2 PHE 69 HD2 PHE 69 4.723 1.822 7.401 587 HE1 PHE 69 HE1 PHE 69 9.390 1.598 9.105 588 HE2 PHE 69 HE2 PHE 69 6.563 1.160 5.884 589 HZ PHE 69 HZ PHE 69 8.894 1.018 6.733 590 H ALA 70 H ALA 70 3.346 4.308 8.368 591 HA ALA 70 HA ALA 70 4.662 6.571 7.070 592 HB1 ALA 70 HB1 ALA 70 4.577 3.816 5.737 593 HB2 ALA 70 HB2 ALA 70 5.151 5.327 5.002 594 HB3 ALA 70 HB3 ALA 70 6.047 4.611 6.345 595 H GLN 71 H GLN 71 3.399 7.263 5.114 596 HA GLN 71 HA GLN 71 0.836 5.932 4.687 597 HB2 GLN 71 HB2 GLN 71 -0.535 7.927 4.937 598 HB3 GLN 71 HB3 GLN 71 0.213 7.432 6.444 599 HG2 GLN 71 HG2 GLN 71 0.462 9.710 6.569 600 HG3 GLN 71 HG3 GLN 71 2.024 9.260 5.911 601 HE21 GLN 71 HE21 GLN 71 1.461 11.631 3.334 602 HE22 GLN 71 HE22 GLN 71 2.615 10.828 4.401 603 H ALA 72 H ALA 72 0.038 6.087 2.671 604 HA ALA 72 HA ALA 72 1.591 7.676 0.661 605 HB1 ALA 72 HB1 ALA 72 0.271 4.956 0.495 606 HB2 ALA 72 HB2 ALA 72 0.922 5.845 -0.894 607 HB3 ALA 72 HB3 ALA 72 1.999 5.340 0.420 608 HA PRO 73 HA PRO 73 -2.455 9.689 0.043 609 HB2 PRO 73 HB2 PRO 73 -0.634 11.548 -1.453 610 HB3 PRO 73 HB3 PRO 73 -1.974 11.933 -0.332 611 HG2 PRO 73 HG2 PRO 73 0.618 12.157 0.452 612 HG3 PRO 73 HG3 PRO 73 -0.619 11.480 1.562 613 HD2 PRO 73 HD2 PRO 73 1.366 9.977 -0.175 614 HD3 PRO 73 HD3 PRO 73 0.956 9.726 1.547 615 H VAL 74 H VAL 74 -3.753 9.504 -1.748 616 HA VAL 74 HA VAL 74 -2.604 8.944 -4.449 617 HB VAL 74 HB VAL 74 -5.007 7.471 -3.320 618 HG11 VAL 74 HG11 VAL 74 -3.222 6.907 -5.711 619 HG12 VAL 74 HG12 VAL 74 -4.559 5.879 -5.155 620 HG13 VAL 74 HG13 VAL 74 -4.900 7.508 -5.732 621 HG21 VAL 74 HG21 VAL 74 -3.183 6.707 -1.918 622 HG22 VAL 74 HG22 VAL 74 -3.627 5.451 -3.071 623 HG23 VAL 74 HG23 VAL 74 -2.160 6.419 -3.343 624 H GLU 75 H GLU 75 -3.628 10.171 -6.024 625 HA GLU 75 HA GLU 75 -6.132 11.646 -5.239 626 HB2 GLU 75 HB2 GLU 75 -4.081 12.190 -7.410 627 HB3 GLU 75 HB3 GLU 75 -5.558 13.126 -7.147 628 HG2 GLU 75 HG2 GLU 75 -4.808 13.670 -4.837 629 HG3 GLU 75 HG3 GLU 75 -3.300 12.798 -5.124 630 H GLN 76 H GLN 76 -5.095 9.096 -7.285 631 HA GLN 76 HA GLN 76 -7.759 8.452 -8.077 632 HB2 GLN 76 HB2 GLN 76 -6.940 8.294 -10.620 633 HB3 GLN 76 HB3 GLN 76 -7.817 9.660 -9.974 634 HG2 GLN 76 HG2 GLN 76 -6.022 10.375 -11.449 635 HG3 GLN 76 HG3 GLN 76 -5.829 11.021 -9.835 636 HE21 GLN 76 HE21 GLN 76 -2.566 9.677 -9.516 637 HE22 GLN 76 HE22 GLN 76 -3.791 10.754 -8.871 638 H TYR 77 H TYR 77 -7.913 6.279 -8.741 639 HA TYR 77 HA TYR 77 -5.409 4.685 -8.689 640 HB2 TYR 77 HB2 TYR 77 -6.371 4.699 -6.454 641 HB3 TYR 77 HB3 TYR 77 -7.913 4.141 -7.104 642 HD1 TYR 77 HD1 TYR 77 -4.277 3.148 -7.360 643 HD2 TYR 77 HD2 TYR 77 -8.348 1.878 -6.757 644 HE1 TYR 77 HE1 TYR 77 -3.529 0.784 -7.297 645 HE2 TYR 77 HE2 TYR 77 -7.580 -0.491 -6.592 646 HH TYR 77 HH TYR 77 -4.143 -1.405 -7.009 647 HA PRO 78 HA PRO 78 -4.488 2.788 -9.749 648 HB2 PRO 78 HB2 PRO 78 -4.395 2.783 -12.755 649 HB3 PRO 78 HB3 PRO 78 -3.573 1.696 -11.590 650 HG2 PRO 78 HG2 PRO 78 -5.796 0.848 -12.867 651 HG3 PRO 78 HG3 PRO 78 -5.634 0.558 -11.101 652 HD2 PRO 78 HD2 PRO 78 -7.144 2.791 -12.502 653 HD3 PRO 78 HD3 PRO 78 -7.701 1.710 -11.188 654 H GLY 79 H GLY 79 -2.627 4.013 -9.809 655 HA2 GLY 79 HA2 GLY 79 -2.263 6.444 -11.377 656 HA3 GLY 79 HA3 GLY 79 -2.636 6.733 -9.674 657 H ILE 80 H ILE 80 -0.439 7.706 -9.572 658 HA ILE 80 HA ILE 80 1.874 5.997 -10.050 659 HB ILE 80 HB ILE 80 2.059 8.344 -10.488 660 HG12 ILE 80 HG12 ILE 80 3.828 7.613 -8.110 661 HG13 ILE 80 HG13 ILE 80 4.035 6.965 -9.740 662 HG21 ILE 80 HG21 ILE 80 1.774 8.908 -7.498 663 HG22 ILE 80 HG22 ILE 80 2.024 10.085 -8.797 664 HG23 ILE 80 HG23 ILE 80 0.502 9.211 -8.702 665 HD11 ILE 80 HD11 ILE 80 4.302 9.888 -8.943 666 HD12 ILE 80 HD12 ILE 80 5.614 8.753 -9.292 667 HD13 ILE 80 HD13 ILE 80 4.495 9.237 -10.589 668 H ALA 81 H ALA 81 0.110 6.944 -7.109 669 HA ALA 81 HA ALA 81 2.280 6.053 -5.366 670 HB1 ALA 81 HB1 ALA 81 0.845 6.965 -3.602 671 HB2 ALA 81 HB2 ALA 81 1.017 8.110 -4.942 672 HB3 ALA 81 HB3 ALA 81 -0.478 7.166 -4.771 673 H VAL 82 H VAL 82 0.385 4.091 -6.982 674 HA VAL 82 HA VAL 82 0.444 1.991 -4.944 675 HB VAL 82 HB VAL 82 -2.161 2.603 -6.345 676 HG11 VAL 82 HG11 VAL 82 -3.079 0.935 -4.706 677 HG12 VAL 82 HG12 VAL 82 -1.831 0.210 -5.724 678 HG13 VAL 82 HG13 VAL 82 -1.445 0.688 -4.063 679 HG21 VAL 82 HG21 VAL 82 -1.513 3.226 -3.453 680 HG22 VAL 82 HG22 VAL 82 -1.943 4.376 -4.742 681 HG23 VAL 82 HG23 VAL 82 -3.127 3.218 -4.172 682 H GLU 83 H GLU 83 1.051 0.149 -5.897 683 HA GLU 83 HA GLU 83 0.506 -0.424 -8.772 684 HB2 GLU 83 HB2 GLU 83 3.207 -0.042 -7.470 685 HB3 GLU 83 HB3 GLU 83 3.030 -1.272 -8.723 686 HG2 GLU 83 HG2 GLU 83 2.120 0.417 -10.276 687 HG3 GLU 83 HG3 GLU 83 2.379 1.673 -9.056 688 H THR 84 H THR 84 0.848 -2.596 -9.400 689 HA THR 84 HA THR 84 0.563 -4.675 -7.250 690 HB THR 84 HB THR 84 -0.500 -6.009 -9.040 691 HG1 THR 84 HG1 THR 84 -1.065 -4.983 -10.966 692 HG21 THR 84 HG21 THR 84 -1.917 -4.617 -7.571 693 HG22 THR 84 HG22 THR 84 -1.807 -3.268 -8.722 694 HG23 THR 84 HG23 THR 84 -2.618 -4.784 -9.184 695 H VAL 85 H VAL 85 1.545 -6.730 -7.666 696 HA VAL 85 HA VAL 85 4.036 -6.697 -9.271 697 HB VAL 85 HB VAL 85 4.515 -8.833 -8.268 698 HG11 VAL 85 HG11 VAL 85 4.819 -8.105 -5.952 699 HG12 VAL 85 HG12 VAL 85 5.116 -6.756 -7.058 700 HG13 VAL 85 HG13 VAL 85 3.596 -6.848 -6.146 701 HG21 VAL 85 HG21 VAL 85 2.190 -9.719 -8.074 702 HG22 VAL 85 HG22 VAL 85 3.100 -9.843 -6.577 703 HG23 VAL 85 HG23 VAL 85 1.880 -8.573 -6.760 704 H THR 86 H THR 86 4.397 -8.679 -10.680 705 HA THR 86 HA THR 86 2.049 -9.269 -12.365 706 HB THR 86 HB THR 86 3.692 -10.203 -13.906 707 HG1 THR 86 HG1 THR 86 5.873 -10.160 -13.357 708 HG21 THR 86 HG21 THR 86 3.358 -7.723 -13.845 709 HG22 THR 86 HG22 THR 86 4.728 -7.591 -12.727 710 HG23 THR 86 HG23 THR 86 4.991 -8.192 -14.373 711 H ASP 87 H ASP 87 4.122 -10.982 -10.103 712 HA ASP 87 HA ASP 87 3.415 -13.592 -11.184 713 HB2 ASP 87 HB2 ASP 87 5.709 -12.942 -10.459 714 HB3 ASP 87 HB3 ASP 87 5.120 -12.879 -8.791 715 H SER 88 H SER 88 2.795 -11.889 -8.098 716 HA SER 88 HA SER 88 0.599 -13.857 -7.533 717 HB2 SER 88 HB2 SER 88 2.623 -14.676 -6.413 718 HB3 SER 88 HB3 SER 88 2.728 -13.158 -5.499 719 HG SER 88 HG SER 88 1.570 -14.981 -4.471 720 H SER 89 H SER 89 -1.210 -12.733 -7.392 721 HA SER 89 HA SER 89 -1.307 -9.953 -6.786 722 HB2 SER 89 HB2 SER 89 -3.810 -10.342 -7.110 723 HB3 SER 89 HB3 SER 89 -2.719 -10.733 -8.443 724 HG SER 89 HG SER 89 -4.154 -12.419 -8.178 725 H ARG 90 H ARG 90 -0.342 -11.442 -4.515 726 HA ARG 90 HA ARG 90 -2.090 -10.188 -2.486 727 HB2 ARG 90 HB2 ARG 90 -1.252 -11.795 -0.767 728 HB3 ARG 90 HB3 ARG 90 -2.421 -12.378 -1.935 729 HG2 ARG 90 HG2 ARG 90 -0.804 -13.572 -3.180 730 HG3 ARG 90 HG3 ARG 90 0.547 -12.852 -2.283 731 HD2 ARG 90 HD2 ARG 90 -1.590 -14.564 -0.954 732 HD3 ARG 90 HD3 ARG 90 -0.164 -15.261 -1.714 733 HE ARG 90 HE ARG 90 -0.030 -13.278 0.554 734 HH11 ARG 90 HH11 ARG 90 1.453 -13.533 2.036 735 HH12 ARG 90 HH12 ARG 90 2.603 -14.859 1.982 736 HH21 ARG 90 HH21 ARG 90 1.298 -16.194 -0.908 737 HH22 ARG 90 HH22 ARG 90 2.511 -16.330 0.334 738 H TYR 91 H TYR 91 0.143 -9.101 -4.123 739 HA TYR 91 HA TYR 91 1.693 -7.898 -1.913 740 HB2 TYR 91 HB2 TYR 91 2.826 -9.104 -4.461 741 HB3 TYR 91 HB3 TYR 91 3.728 -8.098 -3.357 742 HD1 TYR 91 HD1 TYR 91 4.329 -8.920 -1.082 743 HD2 TYR 91 HD2 TYR 91 2.401 -11.456 -3.983 744 HE1 TYR 91 HE1 TYR 91 4.922 -10.934 0.271 745 HE2 TYR 91 HE2 TYR 91 3.027 -13.459 -2.656 746 HH TYR 91 HH TYR 91 4.837 -13.212 0.430 747 H PHE 92 H PHE 92 2.084 -5.727 -2.202 748 HA PHE 92 HA PHE 92 1.465 -4.436 -4.820 749 HB2 PHE 92 HB2 PHE 92 0.399 -3.513 -2.122 750 HB3 PHE 92 HB3 PHE 92 0.206 -2.670 -3.645 751 HD1 PHE 92 HD1 PHE 92 -1.222 -3.653 -5.476 752 HD2 PHE 92 HD2 PHE 92 -1.037 -5.317 -1.515 753 HE1 PHE 92 HE1 PHE 92 -3.312 -4.955 -5.910 754 HE2 PHE 92 HE2 PHE 92 -3.150 -6.525 -1.907 755 HZ PHE 92 HZ PHE 92 -4.271 -6.389 -4.144 756 H VAL 93 H VAL 93 2.219 -2.225 -4.917 757 HA VAL 93 HA VAL 93 4.327 -1.462 -2.942 758 HB VAL 93 HB VAL 93 4.375 -1.164 -5.948 759 HG11 VAL 93 HG11 VAL 93 6.114 0.367 -3.968 760 HG12 VAL 93 HG12 VAL 93 6.390 0.251 -5.718 761 HG13 VAL 93 HG13 VAL 93 4.945 1.060 -5.120 762 HG21 VAL 93 HG21 VAL 93 6.611 -2.169 -5.665 763 HG22 VAL 93 HG22 VAL 93 6.384 -2.197 -3.911 764 HG23 VAL 93 HG23 VAL 93 5.342 -3.174 -4.965 765 H ILE 94 H ILE 94 4.247 0.660 -2.202 766 HA ILE 94 HA ILE 94 2.301 2.450 -3.506 767 HB ILE 94 HB ILE 94 1.453 3.340 -1.474 768 HG12 ILE 94 HG12 ILE 94 3.243 2.508 0.122 769 HG13 ILE 94 HG13 ILE 94 1.585 2.431 0.680 770 HG21 ILE 94 HG21 ILE 94 0.750 0.413 -1.842 771 HG22 ILE 94 HG22 ILE 94 -0.232 1.632 -0.995 772 HG23 ILE 94 HG23 ILE 94 0.107 1.804 -2.720 773 HD11 ILE 94 HD11 ILE 94 2.828 0.458 1.383 774 HD12 ILE 94 HD12 ILE 94 1.524 -0.008 0.288 775 HD13 ILE 94 HD13 ILE 94 3.198 0.027 -0.292 776 H ARG 95 H ARG 95 2.707 4.636 -3.323 777 HA ARG 95 HA ARG 95 5.529 5.318 -2.598 778 HB2 ARG 95 HB2 ARG 95 4.548 5.988 -4.866 779 HB3 ARG 95 HB3 ARG 95 3.597 7.185 -3.980 780 HG2 ARG 95 HG2 ARG 95 5.881 7.936 -2.950 781 HG3 ARG 95 HG3 ARG 95 6.621 6.933 -4.191 782 HD2 ARG 95 HD2 ARG 95 6.600 9.144 -5.055 783 HD3 ARG 95 HD3 ARG 95 5.320 8.275 -5.920 784 HE ARG 95 HE ARG 95 4.359 9.659 -3.530 785 HH11 ARG 95 HH11 ARG 95 2.977 11.376 -3.697 786 HH12 ARG 95 HH12 ARG 95 2.920 12.286 -5.182 787 HH21 ARG 95 HH21 ARG 95 5.261 10.391 -6.820 788 HH22 ARG 95 HH22 ARG 95 4.180 11.755 -6.907 789 H ILE 96 H ILE 96 5.640 5.568 -0.466 790 HA ILE 96 HA ILE 96 3.566 7.041 1.021 791 HB ILE 96 HB ILE 96 4.705 6.535 3.032 792 HG12 ILE 96 HG12 ILE 96 6.621 4.680 2.785 793 HG13 ILE 96 HG13 ILE 96 6.954 5.514 1.281 794 HG21 ILE 96 HG21 ILE 96 4.390 4.101 1.266 795 HG22 ILE 96 HG22 ILE 96 4.434 4.096 3.037 796 HG23 ILE 96 HG23 ILE 96 3.126 4.922 2.220 797 HD11 ILE 96 HD11 ILE 96 8.357 6.300 3.148 798 HD12 ILE 96 HD12 ILE 96 7.328 7.625 2.580 799 HD13 ILE 96 HD13 ILE 96 6.917 6.742 4.076 800 H GLN 97 H GLN 97 3.912 8.941 2.245 801 HA GLN 97 HA GLN 97 6.216 10.658 1.421 802 HB2 GLN 97 HB2 GLN 97 3.260 11.381 1.386 803 HB3 GLN 97 HB3 GLN 97 4.499 12.580 1.714 804 HG2 GLN 97 HG2 GLN 97 4.193 12.928 -0.498 805 HG3 GLN 97 HG3 GLN 97 5.600 11.882 -0.506 806 HE21 GLN 97 HE21 GLN 97 3.603 9.073 -1.763 807 HE22 GLN 97 HE22 GLN 97 5.107 9.490 -0.974 808 H ASP 98 H ASP 98 7.047 11.975 2.950 809 HA ASP 98 HA ASP 98 6.323 11.461 5.767 810 HB2 ASP 98 HB2 ASP 98 8.683 11.455 4.800 811 HB3 ASP 98 HB3 ASP 98 8.514 13.205 4.637 812 H GLY 99 H GLY 99 5.082 13.530 3.545 813 HA2 GLY 99 HA2 GLY 99 3.515 15.224 3.831 814 HA3 GLY 99 HA3 GLY 99 3.913 15.320 5.546 815 H THR 100 H THR 100 6.654 15.545 3.531 816 HA THR 100 HA THR 100 6.708 18.529 3.561 817 HB THR 100 HB THR 100 7.618 17.525 5.651 818 HG1 THR 100 HG1 THR 100 9.391 18.863 5.701 819 HG21 THR 100 HG21 THR 100 9.968 16.621 3.946 820 HG22 THR 100 HG22 THR 100 9.777 16.472 5.703 821 HG23 THR 100 HG23 THR 100 8.735 15.533 4.625 822 H GLY 101 H GLY 101 6.562 16.371 1.383 823 HA2 GLY 101 HA2 GLY 101 7.178 16.516 -0.862 824 HA3 GLY 101 HA3 GLY 101 8.497 17.610 -0.461 825 H ARG 102 H ARG 102 8.837 15.043 1.610 826 HA ARG 102 HA ARG 102 10.810 13.517 0.039 827 HB2 ARG 102 HB2 ARG 102 9.633 13.100 2.816 828 HB3 ARG 102 HB3 ARG 102 10.924 12.126 2.116 829 HG2 ARG 102 HG2 ARG 102 12.441 13.979 2.112 830 HG3 ARG 102 HG3 ARG 102 11.152 15.113 2.588 831 HD2 ARG 102 HD2 ARG 102 10.844 13.888 4.710 832 HD3 ARG 102 HD3 ARG 102 12.168 12.791 4.285 833 HE ARG 102 HE ARG 102 13.485 15.094 4.131 834 HH11 ARG 102 HH11 ARG 102 14.468 16.296 5.693 835 HH12 ARG 102 HH12 ARG 102 13.831 16.324 7.311 836 HH21 ARG 102 HH21 ARG 102 11.176 14.228 6.701 837 HH22 ARG 102 HH22 ARG 102 12.059 15.183 7.857 838 H SER 103 H SER 103 10.397 11.624 -0.839 839 HA SER 103 HA SER 103 8.100 10.072 0.033 840 HB2 SER 103 HB2 SER 103 7.160 9.619 -2.164 841 HB3 SER 103 HB3 SER 103 7.185 11.367 -1.893 842 HG SER 103 HG SER 103 9.018 11.514 -3.209 843 H ALA 104 H ALA 104 8.045 7.847 -0.583 844 HA ALA 104 HA ALA 104 10.406 6.678 -1.912 845 HB1 ALA 104 HB1 ALA 104 9.582 5.922 0.929 846 HB2 ALA 104 HB2 ALA 104 10.814 5.101 -0.053 847 HB3 ALA 104 HB3 ALA 104 11.075 6.775 0.473 848 H PHE 105 H PHE 105 9.990 4.727 -2.894 849 HA PHE 105 HA PHE 105 7.187 3.713 -2.872 850 HB2 PHE 105 HB2 PHE 105 9.552 3.184 -4.688 851 HB3 PHE 105 HB3 PHE 105 8.095 2.209 -4.690 852 HD1 PHE 105 HD1 PHE 105 9.452 5.573 -5.530 853 HD2 PHE 105 HD2 PHE 105 5.996 2.995 -5.596 854 HE1 PHE 105 HE1 PHE 105 8.351 7.079 -7.161 855 HE2 PHE 105 HE2 PHE 105 4.912 4.481 -7.242 856 HZ PHE 105 HZ PHE 105 6.087 6.532 -8.035 857 H ILE 106 H ILE 106 6.687 2.177 -1.484 858 HA ILE 106 HA ILE 106 8.770 0.214 -0.598 859 HB ILE 106 HB ILE 106 7.819 0.069 1.556 860 HG12 ILE 106 HG12 ILE 106 5.744 2.165 0.785 861 HG13 ILE 106 HG13 ILE 106 5.420 0.445 1.013 862 HG21 ILE 106 HG21 ILE 106 8.100 3.029 0.921 863 HG22 ILE 106 HG22 ILE 106 8.492 2.208 2.449 864 HG23 ILE 106 HG23 ILE 106 9.471 1.899 1.009 865 HD11 ILE 106 HD11 ILE 106 6.139 0.599 3.380 866 HD12 ILE 106 HD12 ILE 106 6.321 2.356 3.192 867 HD13 ILE 106 HD13 ILE 106 4.733 1.607 2.992 868 H GLY 107 H GLY 107 8.200 -1.954 -0.385 869 HA2 GLY 107 HA2 GLY 107 5.759 -2.797 -1.862 870 HA3 GLY 107 HA3 GLY 107 7.174 -3.788 -1.523 871 H ILE 108 H ILE 108 4.215 -4.049 -0.910 872 HA ILE 108 HA ILE 108 4.577 -4.942 1.874 873 HB ILE 108 HB ILE 108 2.201 -4.492 2.364 874 HG12 ILE 108 HG12 ILE 108 2.246 -2.616 -0.039 875 HG13 ILE 108 HG13 ILE 108 1.387 -4.156 0.024 876 HG21 ILE 108 HG21 ILE 108 2.593 -2.198 3.057 877 HG22 ILE 108 HG22 ILE 108 4.059 -3.160 3.224 878 HG23 ILE 108 HG23 ILE 108 3.901 -2.025 1.863 879 HD11 ILE 108 HD11 ILE 108 0.802 -1.721 1.762 880 HD12 ILE 108 HD12 ILE 108 -0.193 -2.386 0.461 881 HD13 ILE 108 HD13 ILE 108 0.036 -3.307 1.960 882 H GLY 109 H GLY 109 3.734 -6.855 2.443 883 HA2 GLY 109 HA2 GLY 109 2.355 -8.482 0.323 884 HA3 GLY 109 HA3 GLY 109 3.538 -9.151 1.434 885 H PHE 110 H PHE 110 0.693 -9.736 0.844 886 HA PHE 110 HA PHE 110 -0.621 -9.359 3.499 887 HB2 PHE 110 HB2 PHE 110 -1.665 -9.901 0.701 888 HB3 PHE 110 HB3 PHE 110 -2.658 -10.107 2.127 889 HD1 PHE 110 HD1 PHE 110 -4.010 -8.349 2.805 890 HD2 PHE 110 HD2 PHE 110 -0.424 -7.466 0.566 891 HE1 PHE 110 HE1 PHE 110 -4.603 -5.946 2.787 892 HE2 PHE 110 HE2 PHE 110 -0.963 -5.057 0.671 893 HZ PHE 110 HZ PHE 110 -3.064 -4.293 1.726 894 H THR 111 H THR 111 -1.846 -11.149 4.369 895 HA THR 111 HA THR 111 -0.340 -13.624 4.362 896 HB THR 111 HB THR 111 -1.431 -12.614 6.351 897 HG1 THR 111 HG1 THR 111 -0.875 -14.741 6.473 898 HG21 THR 111 HG21 THR 111 -3.780 -12.966 6.822 899 HG22 THR 111 HG22 THR 111 -3.628 -11.970 5.369 900 HG23 THR 111 HG23 THR 111 -4.050 -13.692 5.228 901 H ASP 112 H ASP 112 -3.158 -12.527 2.592 902 HA ASP 112 HA ASP 112 -3.288 -15.015 1.097 903 HB2 ASP 112 HB2 ASP 112 -4.673 -15.471 3.167 904 HB3 ASP 112 HB3 ASP 112 -5.719 -14.127 2.713 905 H ARG 113 H ARG 113 -4.522 -14.846 -0.827 906 HA ARG 113 HA ARG 113 -4.577 -12.279 -2.099 907 HB2 ARG 113 HB2 ARG 113 -4.245 -14.469 -3.206 908 HB3 ARG 113 HB3 ARG 113 -5.942 -14.880 -2.901 909 HG2 ARG 113 HG2 ARG 113 -6.669 -12.955 -4.271 910 HG3 ARG 113 HG3 ARG 113 -4.985 -12.477 -4.532 911 HD2 ARG 113 HD2 ARG 113 -6.269 -15.090 -5.443 912 HD3 ARG 113 HD3 ARG 113 -5.987 -13.668 -6.447 913 HE ARG 113 HE ARG 113 -3.658 -13.977 -6.379 914 HH11 ARG 113 HH11 ARG 113 -1.885 -15.320 -6.435 915 HH12 ARG 113 HH12 ARG 113 -2.013 -16.964 -5.890 916 HH21 ARG 113 HH21 ARG 113 -5.299 -16.736 -4.951 917 HH22 ARG 113 HH22 ARG 113 -3.887 -17.748 -5.060 918 H GLY 114 H GLY 114 -7.158 -14.034 -0.366 919 HA2 GLY 114 HA2 GLY 114 -9.363 -12.433 -1.281 920 HA3 GLY 114 HA3 GLY 114 -9.277 -13.357 0.226 921 H ASP 115 H ASP 115 -6.924 -11.876 1.255 922 HA ASP 115 HA ASP 115 -8.312 -9.448 2.239 923 HB2 ASP 115 HB2 ASP 115 -5.756 -10.856 3.070 924 HB3 ASP 115 HB3 ASP 115 -6.274 -9.302 3.729 925 H ALA 116 H ALA 116 -5.510 -10.264 0.151 926 HA ALA 116 HA ALA 116 -4.695 -7.548 -0.307 927 HB1 ALA 116 HB1 ALA 116 -3.679 -8.573 -2.341 928 HB2 ALA 116 HB2 ALA 116 -3.350 -9.495 -0.855 929 HB3 ALA 116 HB3 ALA 116 -4.569 -10.058 -2.024 930 H PHE 117 H PHE 117 -7.186 -9.598 -1.934 931 HA PHE 117 HA PHE 117 -8.031 -7.621 -3.826 932 HB2 PHE 117 HB2 PHE 117 -9.295 -10.055 -2.588 933 HB3 PHE 117 HB3 PHE 117 -10.303 -8.906 -3.444 934 HD1 PHE 117 HD1 PHE 117 -10.972 -10.020 -5.375 935 HD2 PHE 117 HD2 PHE 117 -6.776 -9.983 -4.352 936 HE1 PHE 117 HE1 PHE 117 -10.417 -11.040 -7.566 937 HE2 PHE 117 HE2 PHE 117 -6.234 -10.987 -6.540 938 HZ PHE 117 HZ PHE 117 -8.049 -11.525 -8.156 939 H ASP 118 H ASP 118 -8.897 -8.064 -0.384 940 HA ASP 118 HA ASP 118 -10.828 -5.941 -0.393 941 HB2 ASP 118 HB2 ASP 118 -10.415 -7.964 1.263 942 HB3 ASP 118 HB3 ASP 118 -9.346 -6.841 2.091 943 H PHE 119 H PHE 119 -7.388 -5.784 -0.473 944 HA PHE 119 HA PHE 119 -7.202 -2.989 0.482 945 HB2 PHE 119 HB2 PHE 119 -5.289 -4.271 0.844 946 HB3 PHE 119 HB3 PHE 119 -5.257 -4.928 -0.769 947 HD1 PHE 119 HD1 PHE 119 -4.586 -3.528 -2.745 948 HD2 PHE 119 HD2 PHE 119 -4.184 -2.178 1.320 949 HE1 PHE 119 HE1 PHE 119 -3.077 -1.716 -3.496 950 HE2 PHE 119 HE2 PHE 119 -2.693 -0.372 0.579 951 HZ PHE 119 HZ PHE 119 -2.119 -0.120 -1.838 952 H ASN 120 H ASN 120 -7.113 -4.656 -2.730 953 HA ASN 120 HA ASN 120 -7.066 -2.049 -4.034 954 HB2 ASN 120 HB2 ASN 120 -6.911 -3.201 -6.119 955 HB3 ASN 120 HB3 ASN 120 -5.769 -3.853 -4.955 956 HD21 ASN 120 HD21 ASN 120 -8.774 -6.265 -6.364 957 HD22 ASN 120 HD22 ASN 120 -9.025 -4.532 -6.416 958 H VAL 121 H VAL 121 -9.715 -4.272 -3.316 959 HA VAL 121 HA VAL 121 -11.584 -2.920 -5.111 960 HB VAL 121 HB VAL 121 -11.970 -4.902 -2.846 961 HG11 VAL 121 HG11 VAL 121 -14.065 -3.787 -4.764 962 HG12 VAL 121 HG12 VAL 121 -14.289 -5.206 -3.714 963 HG13 VAL 121 HG13 VAL 121 -14.051 -3.617 -2.993 964 HG21 VAL 121 HG21 VAL 121 -12.520 -6.461 -4.678 965 HG22 VAL 121 HG22 VAL 121 -12.235 -5.178 -5.878 966 HG23 VAL 121 HG23 VAL 121 -10.899 -5.808 -4.893 967 H SER 122 H SER 122 -10.888 -2.693 -1.580 968 HA SER 122 HA SER 122 -13.017 -0.854 -1.029 969 HB2 SER 122 HB2 SER 122 -11.856 -0.449 1.078 970 HB3 SER 122 HB3 SER 122 -11.902 -2.186 0.706 971 HG SER 122 HG SER 122 -9.835 -2.223 0.592 972 H LEU 123 H LEU 123 -9.630 -0.301 -2.054 973 HA LEU 123 HA LEU 123 -9.710 2.532 -1.839 974 HB2 LEU 123 HB2 LEU 123 -7.701 1.034 -1.802 975 HB3 LEU 123 HB3 LEU 123 -7.980 0.659 -3.506 976 HG LEU 123 HG LEU 123 -7.671 3.071 -4.026 977 HD11 LEU 123 HD11 LEU 123 -6.793 3.264 -1.120 978 HD12 LEU 123 HD12 LEU 123 -6.496 4.501 -2.358 979 HD13 LEU 123 HD13 LEU 123 -8.153 4.131 -1.870 980 HD21 LEU 123 HD21 LEU 123 -5.252 3.033 -3.805 981 HD22 LEU 123 HD22 LEU 123 -5.359 1.728 -2.589 982 HD23 LEU 123 HD23 LEU 123 -5.852 1.439 -4.267 983 H GLN 124 H GLN 124 -10.220 0.332 -4.696 984 HA GLN 124 HA GLN 124 -10.661 2.549 -6.477 985 HB2 GLN 124 HB2 GLN 124 -11.022 1.006 -8.157 986 HB3 GLN 124 HB3 GLN 124 -9.923 0.175 -7.058 987 HG2 GLN 124 HG2 GLN 124 -11.919 -1.018 -6.093 988 HG3 GLN 124 HG3 GLN 124 -12.911 -0.308 -7.370 989 HE21 GLN 124 HE21 GLN 124 -10.080 -3.138 -8.406 990 HE22 GLN 124 HE22 GLN 124 -9.867 -2.180 -6.924 991 H ASP 125 H ASP 125 -12.887 0.782 -4.378 992 HA ASP 125 HA ASP 125 -15.264 1.900 -5.624 993 HB2 ASP 125 HB2 ASP 125 -15.195 -0.341 -4.539 994 HB3 ASP 125 HB3 ASP 125 -14.902 0.437 -2.979 995 H HIS 126 H HIS 126 -12.900 3.262 -3.622 996 HA HIS 126 HA HIS 126 -14.786 5.344 -2.685 997 HB2 HIS 126 HB2 HIS 126 -12.983 4.608 -1.157 998 HB3 HIS 126 HB3 HIS 126 -11.778 5.196 -2.313 999 HD2 HIS 126 HD2 HIS 126 -14.812 6.583 -0.269 1000 HE1 HIS 126 HE1 HIS 126 -12.162 9.847 -0.965 1001 HE2 HIS 126 HE2 HIS 126 -14.343 9.142 0.147 1002 H PHE 127 H PHE 127 -12.660 4.693 -5.370 1003 HA PHE 127 HA PHE 127 -12.693 7.537 -6.211 1004 HB2 PHE 127 HB2 PHE 127 -11.087 5.113 -7.045 1005 HB3 PHE 127 HB3 PHE 127 -11.110 6.579 -8.010 1006 HD1 PHE 127 HD1 PHE 127 -10.810 8.855 -6.580 1007 HD2 PHE 127 HD2 PHE 127 -9.298 4.971 -5.482 1008 HE1 PHE 127 HE1 PHE 127 -8.998 9.927 -5.270 1009 HE2 PHE 127 HE2 PHE 127 -7.490 6.045 -4.168 1010 HZ PHE 127 HZ PHE 127 -7.345 8.531 -4.064 1011 H LYS 128 H LYS 128 -14.534 4.722 -7.054 1012 HA LYS 128 HA LYS 128 -14.801 4.991 -9.756 1013 HB2 LYS 128 HB2 LYS 128 -16.698 3.704 -9.764 1014 HB3 LYS 128 HB3 LYS 128 -15.774 3.166 -8.376 1015 HG2 LYS 128 HG2 LYS 128 -18.192 5.050 -8.234 1016 HG3 LYS 128 HG3 LYS 128 -18.257 3.297 -8.064 1017 HD2 LYS 128 HD2 LYS 128 -16.730 3.440 -6.113 1018 HD3 LYS 128 HD3 LYS 128 -16.738 5.203 -6.241 1019 HE2 LYS 128 HE2 LYS 128 -18.281 4.687 -4.555 1020 HE3 LYS 128 HE3 LYS 128 -19.235 5.155 -5.972 1021 HZ1 LYS 128 HZ1 LYS 128 -20.067 3.119 -4.834 1022 HZ2 LYS 128 HZ2 LYS 128 -19.655 2.793 -6.380 1023 HZ3 LYS 128 HZ3 LYS 128 -18.663 2.340 -5.159 1024 H TRP 129 H TRP 129 -16.338 7.205 -7.548 1025 HA TRP 129 HA TRP 129 -18.004 8.460 -9.623 1026 HB2 TRP 129 HB2 TRP 129 -18.699 9.953 -7.858 1027 HB3 TRP 129 HB3 TRP 129 -18.769 8.294 -7.286 1028 HD1 TRP 129 HD1 TRP 129 -16.730 7.524 -5.600 1029 HE1 TRP 129 HE1 TRP 129 -15.181 8.812 -4.071 1030 HE3 TRP 129 HE3 TRP 129 -17.772 12.281 -7.215 1031 HZ2 TRP 129 HZ2 TRP 129 -14.772 11.593 -3.291 1032 HZ3 TRP 129 HZ3 TRP 129 -16.821 14.239 -6.011 1033 HH2 TRP 129 HH2 TRP 129 -15.343 13.908 -4.043 1034 H VAL 130 H VAL 130 -14.777 8.913 -8.336 1035 HA VAL 130 HA VAL 130 -14.412 11.652 -9.290 1036 HB VAL 130 HB VAL 130 -12.279 9.645 -8.461 1037 HG11 VAL 130 HG11 VAL 130 -10.960 11.676 -7.949 1038 HG12 VAL 130 HG12 VAL 130 -11.381 11.604 -9.660 1039 HG13 VAL 130 HG13 VAL 130 -12.277 12.692 -8.576 1040 HG21 VAL 130 HG21 VAL 130 -13.796 9.880 -6.576 1041 HG22 VAL 130 HG22 VAL 130 -12.348 10.828 -6.244 1042 HG23 VAL 130 HG23 VAL 130 -13.833 11.647 -6.773 1043 H LYS 131 H LYS 131 -13.455 8.383 -10.365 1044 HA LYS 131 HA LYS 131 -12.620 9.440 -13.005 1045 HB2 LYS 131 HB2 LYS 131 -11.631 7.290 -13.442 1046 HB3 LYS 131 HB3 LYS 131 -11.086 7.925 -11.888 1047 HG2 LYS 131 HG2 LYS 131 -12.712 6.463 -10.717 1048 HG3 LYS 131 HG3 LYS 131 -13.272 5.822 -12.267 1049 HD2 LYS 131 HD2 LYS 131 -11.059 4.881 -12.715 1050 HD3 LYS 131 HD3 LYS 131 -10.404 5.620 -11.229 1051 HE2 LYS 131 HE2 LYS 131 -11.950 4.337 -9.848 1052 HE3 LYS 131 HE3 LYS 131 -12.753 3.689 -11.285 1053 HZ1 LYS 131 HZ1 LYS 131 -11.159 2.092 -10.392 1054 HZ2 LYS 131 HZ2 LYS 131 -10.686 2.571 -11.875 1055 HZ3 LYS 131 HZ3 LYS 131 -9.921 3.168 -10.545 1056 H GLN 132 H GLN 132 -15.399 8.979 -11.913 1057 HA GLN 132 HA GLN 132 -17.494 8.354 -12.555 1058 HB2 GLN 132 HB2 GLN 132 -16.465 9.622 -15.094 1059 HB3 GLN 132 HB3 GLN 132 -18.165 9.364 -14.643 1060 HG2 GLN 132 HG2 GLN 132 -17.862 10.796 -12.640 1061 HG3 GLN 132 HG3 GLN 132 -16.178 11.087 -13.088 1062 HE21 GLN 132 HE21 GLN 132 -17.930 14.069 -14.281 1063 HE22 GLN 132 HE22 GLN 132 -17.411 13.359 -12.757 1064 H GLU 133 H GLU 133 -17.353 6.194 -12.346 1065 HA GLU 133 HA GLU 133 -17.890 4.629 -14.850 1066 HB2 GLU 133 HB2 GLU 133 -16.470 3.622 -12.358 1067 HB3 GLU 133 HB3 GLU 133 -17.090 2.606 -13.664 1068 HG2 GLU 133 HG2 GLU 133 -15.630 3.921 -15.275 1069 HG3 GLU 133 HG3 GLU 133 -14.881 4.689 -13.874 Start of MODEL 15 1 H1 GLY -4 H1 GLY -4 -10.755 26.437 6.459 2 H2 GLY -4 H2 GLY -4 -9.500 27.097 5.640 3 H3 GLY -4 H3 GLY -4 -10.176 27.909 6.892 4 HA2 GLY -4 HA2 GLY -4 -8.071 26.951 7.568 5 HA3 GLY -4 HA3 GLY -4 -9.433 26.264 8.471 6 H SER -3 H SER -3 -6.739 25.179 7.792 7 HA SER -3 HA SER -3 -7.581 22.480 6.904 8 HB2 SER -3 HB2 SER -3 -5.935 22.312 5.174 9 HB3 SER -3 HB3 SER -3 -6.812 23.801 4.860 10 HG SER -3 HG SER -3 -5.120 24.982 5.673 11 HA PRO -2 HA PRO -2 -4.403 21.144 9.807 12 HB2 PRO -2 HB2 PRO -2 -2.850 19.847 7.557 13 HB3 PRO -2 HB3 PRO -2 -3.273 19.177 9.166 14 HG2 PRO -2 HG2 PRO -2 -4.718 18.424 7.032 15 HG3 PRO -2 HG3 PRO -2 -5.579 18.930 8.530 16 HD2 PRO -2 HD2 PRO -2 -5.008 20.588 6.064 17 HD3 PRO -2 HD3 PRO -2 -6.565 20.364 6.923 18 H ASN -1 H ASN -1 -3.323 22.814 6.899 19 HA ASN -1 HA ASN -1 -0.698 23.600 7.844 20 HB2 ASN -1 HB2 ASN -1 -2.441 25.003 5.775 21 HB3 ASN -1 HB3 ASN -1 -0.697 25.094 5.943 22 HD21 ASN -1 HD21 ASN -1 -2.365 22.058 3.826 23 HD22 ASN -1 HD22 ASN -1 -3.364 23.250 4.664 24 H SER 0 H SER 0 -3.959 24.827 8.401 25 HA SER 0 HA SER 0 -3.193 27.385 9.563 26 HB2 SER 0 HB2 SER 0 -5.717 25.793 10.116 27 HB3 SER 0 HB3 SER 0 -5.479 27.536 10.251 28 HG SER 0 HG SER 0 -5.231 27.606 7.963 29 H MET 1 H MET 1 -2.991 24.135 10.612 30 HA MET 1 HA MET 1 -2.837 24.830 13.507 31 HB2 MET 1 HB2 MET 1 -3.150 22.089 12.235 32 HB3 MET 1 HB3 MET 1 -3.234 22.500 13.955 33 HG2 MET 1 HG2 MET 1 -5.194 23.323 11.784 34 HG3 MET 1 HG3 MET 1 -5.440 22.096 13.016 35 HE1 MET 1 HE1 MET 1 -7.474 24.453 12.303 36 HE2 MET 1 HE2 MET 1 -7.792 23.190 13.514 37 HE3 MET 1 HE3 MET 1 -8.022 24.902 13.934 38 H ALA 2 H ALA 2 -1.259 21.949 13.035 39 HA ALA 2 HA ALA 2 1.393 23.114 12.361 40 HB1 ALA 2 HB1 ALA 2 1.170 23.033 14.828 41 HB2 ALA 2 HB2 ALA 2 0.810 21.294 14.737 42 HB3 ALA 2 HB3 ALA 2 2.405 21.905 14.243 43 H THR 3 H THR 3 -0.480 21.663 10.746 44 HA THR 3 HA THR 3 -0.903 19.897 9.480 45 HB THR 3 HB THR 3 1.784 18.626 9.953 46 HG1 THR 3 HG1 THR 3 2.405 19.724 8.093 47 HG21 THR 3 HG21 THR 3 -0.041 17.249 8.876 48 HG22 THR 3 HG22 THR 3 -0.280 18.526 7.681 49 HG23 THR 3 HG23 THR 3 1.259 17.629 7.733 50 H GLU 4 H GLU 4 -2.224 19.934 11.349 51 HA GLU 4 HA GLU 4 -2.303 17.362 12.814 52 HB2 GLU 4 HB2 GLU 4 -1.568 18.861 14.486 53 HB3 GLU 4 HB3 GLU 4 -2.582 20.184 13.899 54 HG2 GLU 4 HG2 GLU 4 -4.593 19.112 14.625 55 HG3 GLU 4 HG3 GLU 4 -3.740 17.610 14.999 56 H LEU 5 H LEU 5 -4.062 16.371 12.280 57 HA LEU 5 HA LEU 5 -6.406 17.852 11.214 58 HB2 LEU 5 HB2 LEU 5 -6.878 15.961 9.768 59 HB3 LEU 5 HB3 LEU 5 -5.397 16.848 9.401 60 HG LEU 5 HG LEU 5 -4.027 15.117 10.203 61 HD11 LEU 5 HD11 LEU 5 -6.572 13.645 10.974 62 HD12 LEU 5 HD12 LEU 5 -4.992 12.848 10.804 63 HD13 LEU 5 HD13 LEU 5 -5.209 14.094 12.032 64 HD21 LEU 5 HD21 LEU 5 -6.219 14.001 8.422 65 HD22 LEU 5 HD22 LEU 5 -4.868 15.026 7.889 66 HD23 LEU 5 HD23 LEU 5 -4.550 13.402 8.524 67 H GLU 6 H GLU 6 -8.438 16.936 11.396 68 HA GLU 6 HA GLU 6 -8.922 15.015 13.610 69 HB2 GLU 6 HB2 GLU 6 -9.101 17.466 14.338 70 HB3 GLU 6 HB3 GLU 6 -10.495 17.596 13.278 71 HG2 GLU 6 HG2 GLU 6 -11.224 17.264 15.554 72 HG3 GLU 6 HG3 GLU 6 -11.655 15.832 14.643 73 H TYR 7 H TYR 7 -8.823 14.312 10.955 74 HA TYR 7 HA TYR 7 -11.537 13.398 10.378 75 HB2 TYR 7 HB2 TYR 7 -11.572 14.215 8.115 76 HB3 TYR 7 HB3 TYR 7 -11.390 15.586 9.183 77 HD1 TYR 7 HD1 TYR 7 -9.573 13.363 6.764 78 HD2 TYR 7 HD2 TYR 7 -9.450 17.046 9.017 79 HE1 TYR 7 HE1 TYR 7 -7.696 14.130 5.377 80 HE2 TYR 7 HE2 TYR 7 -7.503 17.790 7.652 81 HH TYR 7 HH TYR 7 -6.155 15.810 4.993 82 H GLU 8 H GLU 8 -11.493 11.458 9.274 83 HA GLU 8 HA GLU 8 -9.940 10.831 7.132 84 HB2 GLU 8 HB2 GLU 8 -8.482 10.059 9.602 85 HB3 GLU 8 HB3 GLU 8 -8.811 8.677 8.565 86 HG2 GLU 8 HG2 GLU 8 -7.804 9.784 6.633 87 HG3 GLU 8 HG3 GLU 8 -7.498 11.237 7.558 88 H SER 9 H SER 9 -11.484 9.709 6.068 89 HA SER 9 HA SER 9 -13.369 7.993 7.587 90 HB2 SER 9 HB2 SER 9 -13.259 8.998 4.741 91 HB3 SER 9 HB3 SER 9 -14.431 7.776 5.282 92 HG SER 9 HG SER 9 -15.299 9.208 6.720 93 H VAL 10 H VAL 10 -12.778 5.990 8.019 94 HA VAL 10 HA VAL 10 -10.702 4.577 6.638 95 HB VAL 10 HB VAL 10 -11.240 4.362 9.035 96 HG11 VAL 10 HG11 VAL 10 -13.711 4.134 8.901 97 HG12 VAL 10 HG12 VAL 10 -13.513 2.534 8.155 98 HG13 VAL 10 HG13 VAL 10 -12.952 2.822 9.813 99 HG21 VAL 10 HG21 VAL 10 -9.788 2.727 7.858 100 HG22 VAL 10 HG22 VAL 10 -10.649 2.051 9.250 101 HG23 VAL 10 HG23 VAL 10 -11.207 1.679 7.612 102 H LEU 11 H LEU 11 -10.707 2.660 5.475 103 HA LEU 11 HA LEU 11 -13.145 2.067 3.828 104 HB2 LEU 11 HB2 LEU 11 -10.327 2.705 2.848 105 HB3 LEU 11 HB3 LEU 11 -11.626 2.097 1.835 106 HG LEU 11 HG LEU 11 -11.638 4.794 3.246 107 HD11 LEU 11 HD11 LEU 11 -11.179 3.989 0.346 108 HD12 LEU 11 HD12 LEU 11 -11.436 5.650 0.905 109 HD13 LEU 11 HD13 LEU 11 -10.010 4.752 1.447 110 HD21 LEU 11 HD21 LEU 11 -13.942 3.918 2.902 111 HD22 LEU 11 HD22 LEU 11 -13.596 5.278 1.841 112 HD23 LEU 11 HD23 LEU 11 -13.568 3.622 1.189 113 H CYS 12 H CYS 12 -9.890 1.030 4.855 114 HA CYS 12 HA CYS 12 -10.796 -1.779 4.949 115 HB2 CYS 12 HB2 CYS 12 -9.755 -1.486 2.683 116 HB3 CYS 12 HB3 CYS 12 -8.272 -0.926 3.484 117 HG CYS 12 HG CYS 12 -9.783 -3.856 3.642 118 H VAL 13 H VAL 13 -9.925 -2.830 6.627 119 HA VAL 13 HA VAL 13 -7.392 -1.863 7.824 120 HB VAL 13 HB VAL 13 -9.828 -2.644 9.460 121 HG11 VAL 13 HG11 VAL 13 -7.007 -1.877 10.348 122 HG12 VAL 13 HG12 VAL 13 -8.403 -2.101 11.423 123 HG13 VAL 13 HG13 VAL 13 -7.763 -3.479 10.530 124 HG21 VAL 13 HG21 VAL 13 -9.980 -0.321 8.650 125 HG22 VAL 13 HG22 VAL 13 -9.631 -0.339 10.381 126 HG23 VAL 13 HG23 VAL 13 -8.330 -0.002 9.216 127 H LYS 14 H LYS 14 -5.975 -3.436 8.058 128 HA LYS 14 HA LYS 14 -6.862 -6.261 8.171 129 HB2 LYS 14 HB2 LYS 14 -5.910 -5.175 5.796 130 HB3 LYS 14 HB3 LYS 14 -4.449 -5.838 6.478 131 HG2 LYS 14 HG2 LYS 14 -5.495 -7.436 4.985 132 HG3 LYS 14 HG3 LYS 14 -5.492 -8.068 6.624 133 HD2 LYS 14 HD2 LYS 14 -7.602 -8.558 5.431 134 HD3 LYS 14 HD3 LYS 14 -7.885 -7.584 6.864 135 HE2 LYS 14 HE2 LYS 14 -7.840 -5.541 5.248 136 HE3 LYS 14 HE3 LYS 14 -7.944 -6.733 3.944 137 HZ1 LYS 14 HZ1 LYS 14 -9.886 -6.322 6.155 138 HZ2 LYS 14 HZ2 LYS 14 -10.149 -6.001 4.570 139 HZ3 LYS 14 HZ3 LYS 14 -10.004 -7.554 5.072 140 HA PRO 15 HA PRO 15 -4.022 -6.012 11.497 141 HB2 PRO 15 HB2 PRO 15 -4.082 -8.542 12.489 142 HB3 PRO 15 HB3 PRO 15 -5.496 -7.440 12.544 143 HG2 PRO 15 HG2 PRO 15 -4.895 -9.609 10.499 144 HG3 PRO 15 HG3 PRO 15 -6.425 -9.334 11.398 145 HD2 PRO 15 HD2 PRO 15 -6.056 -8.400 8.875 146 HD3 PRO 15 HD3 PRO 15 -6.958 -7.453 10.097 147 H ASP 16 H ASP 16 -3.181 -8.084 8.826 148 HA ASP 16 HA ASP 16 -0.363 -8.310 9.818 149 HB2 ASP 16 HB2 ASP 16 -2.099 -10.442 8.524 150 HB3 ASP 16 HB3 ASP 16 -0.340 -10.525 8.582 151 H VAL 17 H VAL 17 0.679 -6.884 8.652 152 HA VAL 17 HA VAL 17 0.911 -7.398 5.766 153 HB VAL 17 HB VAL 17 -0.760 -5.581 5.934 154 HG11 VAL 17 HG11 VAL 17 0.039 -4.404 7.934 155 HG12 VAL 17 HG12 VAL 17 1.495 -3.876 7.068 156 HG13 VAL 17 HG13 VAL 17 -0.102 -3.311 6.552 157 HG21 VAL 17 HG21 VAL 17 0.219 -4.123 4.275 158 HG22 VAL 17 HG22 VAL 17 1.855 -4.671 4.685 159 HG23 VAL 17 HG23 VAL 17 0.684 -5.796 3.950 160 H SER 18 H SER 18 2.914 -7.090 4.964 161 HA SER 18 HA SER 18 5.093 -6.388 6.906 162 HB2 SER 18 HB2 SER 18 5.043 -8.544 4.765 163 HB3 SER 18 HB3 SER 18 6.395 -8.181 5.857 164 HG SER 18 HG SER 18 5.053 -9.962 6.555 165 H VAL 19 H VAL 19 6.638 -4.996 6.244 166 HA VAL 19 HA VAL 19 6.470 -3.907 3.480 167 HB VAL 19 HB VAL 19 7.714 -2.794 6.004 168 HG11 VAL 19 HG11 VAL 19 7.790 -1.684 3.155 169 HG12 VAL 19 HG12 VAL 19 8.141 -0.729 4.617 170 HG13 VAL 19 HG13 VAL 19 9.181 -2.083 4.189 171 HG21 VAL 19 HG21 VAL 19 5.564 -1.596 4.224 172 HG22 VAL 19 HG22 VAL 19 5.168 -2.640 5.604 173 HG23 VAL 19 HG23 VAL 19 6.035 -1.121 5.862 174 H TYR 20 H TYR 20 7.922 -4.253 2.021 175 HA TYR 20 HA TYR 20 10.734 -4.797 2.799 176 HB2 TYR 20 HB2 TYR 20 10.107 -6.129 0.296 177 HB3 TYR 20 HB3 TYR 20 10.940 -6.719 1.715 178 HD1 TYR 20 HD1 TYR 20 9.803 -8.110 3.362 179 HD2 TYR 20 HD2 TYR 20 7.669 -6.428 0.027 180 HE1 TYR 20 HE1 TYR 20 7.897 -9.633 3.835 181 HE2 TYR 20 HE2 TYR 20 5.749 -7.960 0.493 182 HH TYR 20 HH TYR 20 5.841 -10.361 3.159 183 H ARG 21 H ARG 21 11.887 -3.151 2.091 184 HA ARG 21 HA ARG 21 10.826 -1.246 0.160 185 HB2 ARG 21 HB2 ARG 21 13.606 -1.384 1.387 186 HB3 ARG 21 HB3 ARG 21 12.920 -0.028 0.475 187 HG2 ARG 21 HG2 ARG 21 11.065 0.114 2.206 188 HG3 ARG 21 HG3 ARG 21 11.920 -1.123 3.143 189 HD2 ARG 21 HD2 ARG 21 13.952 0.414 3.094 190 HD3 ARG 21 HD3 ARG 21 12.890 1.665 2.438 191 HE ARG 21 HE ARG 21 12.610 0.311 5.127 192 HH11 ARG 21 HH11 ARG 21 11.761 1.232 6.704 193 HH12 ARG 21 HH12 ARG 21 11.110 2.873 6.636 194 HH21 ARG 21 HH21 ARG 21 11.877 3.206 3.266 195 HH22 ARG 21 HH22 ARG 21 11.166 3.970 4.663 196 H ILE 22 H ILE 22 11.144 -1.074 -1.927 197 HA ILE 22 HA ILE 22 12.012 -3.554 -3.160 198 HB ILE 22 HB ILE 22 10.871 -2.779 -5.177 199 HG12 ILE 22 HG12 ILE 22 10.236 -0.232 -3.621 200 HG13 ILE 22 HG13 ILE 22 11.307 -0.355 -5.022 201 HG21 ILE 22 HG21 ILE 22 9.160 -2.396 -2.697 202 HG22 ILE 22 HG22 ILE 22 8.646 -2.996 -4.287 203 HG23 ILE 22 HG23 ILE 22 9.723 -3.968 -3.287 204 HD11 ILE 22 HD11 ILE 22 9.212 0.470 -5.813 205 HD12 ILE 22 HD12 ILE 22 9.343 -1.216 -6.362 206 HD13 ILE 22 HD13 ILE 22 8.312 -0.802 -4.972 207 HA PRO 23 HA PRO 23 15.652 -2.027 -5.380 208 HB2 PRO 23 HB2 PRO 23 15.708 -3.758 -7.495 209 HB3 PRO 23 HB3 PRO 23 16.131 -4.266 -5.831 210 HG2 PRO 23 HG2 PRO 23 13.455 -4.565 -7.248 211 HG3 PRO 23 HG3 PRO 23 14.398 -5.823 -6.377 212 HD2 PRO 23 HD2 PRO 23 12.372 -4.473 -5.188 213 HD3 PRO 23 HD3 PRO 23 13.839 -4.924 -4.275 214 HA PRO 24 HA PRO 24 13.886 0.575 -8.643 215 HB2 PRO 24 HB2 PRO 24 15.875 0.676 -10.542 216 HB3 PRO 24 HB3 PRO 24 15.940 1.560 -8.987 217 HG2 PRO 24 HG2 PRO 24 17.185 -1.129 -9.649 218 HG3 PRO 24 HG3 PRO 24 17.960 0.284 -8.863 219 HD2 PRO 24 HD2 PRO 24 16.992 -1.772 -7.400 220 HD3 PRO 24 HD3 PRO 24 16.787 -0.089 -6.834 221 H ARG 25 H ARG 25 12.727 0.320 -10.554 222 HA ARG 25 HA ARG 25 11.891 -2.339 -11.131 223 HB2 ARG 25 HB2 ARG 25 10.559 -0.149 -11.288 224 HB3 ARG 25 HB3 ARG 25 11.343 0.093 -12.857 225 HG2 ARG 25 HG2 ARG 25 10.318 -2.258 -13.451 226 HG3 ARG 25 HG3 ARG 25 9.325 -2.020 -12.022 227 HD2 ARG 25 HD2 ARG 25 9.528 -0.199 -14.453 228 HD3 ARG 25 HD3 ARG 25 8.206 -1.300 -14.111 229 HE ARG 25 HE ARG 25 8.768 1.308 -12.823 230 HH11 ARG 25 HH11 ARG 25 7.223 2.227 -11.503 231 HH12 ARG 25 HH12 ARG 25 5.829 1.283 -11.015 232 HH21 ARG 25 HH21 ARG 25 6.716 -1.541 -12.686 233 HH22 ARG 25 HH22 ARG 25 5.530 -0.717 -11.685 234 H ALA 26 H ALA 26 12.042 -3.625 -12.842 235 HA ALA 26 HA ALA 26 14.174 -3.617 -14.786 236 HB1 ALA 26 HB1 ALA 26 11.475 -5.007 -14.613 237 HB2 ALA 26 HB2 ALA 26 12.803 -5.495 -15.702 238 HB3 ALA 26 HB3 ALA 26 13.010 -5.627 -13.950 239 H SER 27 H SER 27 13.382 -3.955 -17.168 240 HA SER 27 HA SER 27 12.217 -1.375 -18.074 241 HB2 SER 27 HB2 SER 27 13.299 -1.917 -20.209 242 HB3 SER 27 HB3 SER 27 14.443 -1.955 -18.856 243 HG SER 27 HG SER 27 14.818 -3.790 -20.030 244 H ASN 28 H ASN 28 11.860 -4.854 -18.655 245 HA ASN 28 HA ASN 28 9.198 -4.415 -19.965 246 HB2 ASN 28 HB2 ASN 28 11.451 -6.385 -20.546 247 HB3 ASN 28 HB3 ASN 28 9.833 -6.536 -21.220 248 HD21 ASN 28 HD21 ASN 28 12.296 -3.639 -22.720 249 HD22 ASN 28 HD22 ASN 28 12.701 -4.371 -21.171 250 H ARG 29 H ARG 29 10.530 -5.721 -17.154 251 HA ARG 29 HA ARG 29 8.551 -7.942 -16.909 252 HB2 ARG 29 HB2 ARG 29 10.748 -7.149 -14.985 253 HB3 ARG 29 HB3 ARG 29 9.661 -8.527 -14.861 254 HG2 ARG 29 HG2 ARG 29 10.602 -9.428 -17.008 255 HG3 ARG 29 HG3 ARG 29 11.765 -8.075 -17.027 256 HD2 ARG 29 HD2 ARG 29 12.520 -8.721 -14.754 257 HD3 ARG 29 HD3 ARG 29 11.413 -10.090 -14.769 258 HE ARG 29 HE ARG 29 13.988 -9.830 -16.189 259 HH11 ARG 29 HH11 ARG 29 14.864 -11.580 -17.220 260 HH12 ARG 29 HH12 ARG 29 13.898 -12.997 -17.509 261 HH21 ARG 29 HH21 ARG 29 11.054 -11.753 -16.056 262 HH22 ARG 29 HH22 ARG 29 11.801 -13.098 -16.870 263 H GLY 30 H GLY 30 9.608 -5.219 -14.776 264 HA2 GLY 30 HA2 GLY 30 8.245 -3.848 -13.457 265 HA3 GLY 30 HA3 GLY 30 6.859 -4.909 -13.760 266 H TYR 31 H TYR 31 6.849 -4.651 -11.414 267 HA TYR 31 HA TYR 31 8.725 -6.133 -9.768 268 HB2 TYR 31 HB2 TYR 31 5.984 -5.094 -9.015 269 HB3 TYR 31 HB3 TYR 31 7.327 -5.475 -7.949 270 HD1 TYR 31 HD1 TYR 31 5.566 -2.909 -8.323 271 HD2 TYR 31 HD2 TYR 31 9.532 -3.982 -9.694 272 HE1 TYR 31 HE1 TYR 31 6.204 -0.526 -8.320 273 HE2 TYR 31 HE2 TYR 31 10.206 -1.594 -9.519 274 HH TYR 31 HH TYR 31 7.906 1.003 -8.658 275 H ARG 32 H ARG 32 8.466 -8.205 -9.016 276 HA ARG 32 HA ARG 32 6.002 -9.756 -9.761 277 HB2 ARG 32 HB2 ARG 32 7.429 -11.686 -10.355 278 HB3 ARG 32 HB3 ARG 32 7.479 -10.345 -11.472 279 HG2 ARG 32 HG2 ARG 32 9.658 -10.710 -9.386 280 HG3 ARG 32 HG3 ARG 32 9.650 -11.605 -10.911 281 HD2 ARG 32 HD2 ARG 32 9.486 -9.412 -12.151 282 HD3 ARG 32 HD3 ARG 32 9.744 -8.588 -10.605 283 HE ARG 32 HE ARG 32 11.790 -10.571 -11.160 284 HH11 ARG 32 HH11 ARG 32 13.882 -9.856 -11.408 285 HH12 ARG 32 HH12 ARG 32 14.191 -8.206 -11.843 286 HH21 ARG 32 HH21 ARG 32 10.885 -7.262 -11.949 287 HH22 ARG 32 HH22 ARG 32 12.558 -6.759 -12.033 288 H ALA 33 H ALA 33 6.718 -8.638 -7.244 289 HA ALA 33 HA ALA 33 6.963 -8.997 -5.043 290 HB1 ALA 33 HB1 ALA 33 5.568 -11.600 -5.734 291 HB2 ALA 33 HB2 ALA 33 5.603 -10.796 -4.142 292 HB3 ALA 33 HB3 ALA 33 4.807 -10.021 -5.535 293 H SER 34 H SER 34 7.960 -12.077 -6.599 294 HA SER 34 HA SER 34 9.640 -12.995 -4.532 295 HB2 SER 34 HB2 SER 34 9.764 -13.582 -7.508 296 HB3 SER 34 HB3 SER 34 10.531 -14.545 -6.228 297 HG SER 34 HG SER 34 8.485 -15.396 -6.853 298 H ASP 35 H ASP 35 10.288 -10.446 -6.723 299 HA ASP 35 HA ASP 35 13.220 -10.619 -6.537 300 HB2 ASP 35 HB2 ASP 35 11.917 -9.857 -8.568 301 HB3 ASP 35 HB3 ASP 35 11.475 -8.406 -7.669 302 H TRP 36 H TRP 36 10.774 -9.541 -4.423 303 HA TRP 36 HA TRP 36 12.366 -7.386 -3.187 304 HB2 TRP 36 HB2 TRP 36 9.652 -8.472 -2.400 305 HB3 TRP 36 HB3 TRP 36 10.386 -6.966 -1.900 306 HD1 TRP 36 HD1 TRP 36 11.005 -6.530 -5.338 307 HE1 TRP 36 HE1 TRP 36 9.061 -5.391 -6.596 308 HE3 TRP 36 HE3 TRP 36 7.228 -7.350 -1.973 309 HZ2 TRP 36 HZ2 TRP 36 6.353 -4.680 -6.083 310 HZ3 TRP 36 HZ3 TRP 36 4.973 -6.352 -2.357 311 HH2 TRP 36 HH2 TRP 36 4.541 -5.015 -4.397 312 H LYS 37 H LYS 37 12.428 -7.460 -0.791 313 HA LYS 37 HA LYS 37 13.617 -9.919 0.213 314 HB2 LYS 37 HB2 LYS 37 13.190 -7.138 1.382 315 HB3 LYS 37 HB3 LYS 37 13.925 -8.428 2.305 316 HG2 LYS 37 HG2 LYS 37 14.995 -7.226 -0.251 317 HG3 LYS 37 HG3 LYS 37 15.631 -7.074 1.399 318 HD2 LYS 37 HD2 LYS 37 15.760 -9.736 1.212 319 HD3 LYS 37 HD3 LYS 37 15.814 -9.402 -0.518 320 HE2 LYS 37 HE2 LYS 37 17.666 -8.238 1.609 321 HE3 LYS 37 HE3 LYS 37 18.044 -9.636 0.599 322 HZ1 LYS 37 HZ1 LYS 37 17.562 -6.886 -0.432 323 HZ2 LYS 37 HZ2 LYS 37 19.015 -7.618 -0.329 324 HZ3 LYS 37 HZ3 LYS 37 17.892 -8.191 -1.363 325 H LEU 38 H LEU 38 11.270 -10.787 -0.337 326 HA LEU 38 HA LEU 38 9.148 -10.632 1.495 327 HB2 LEU 38 HB2 LEU 38 10.121 -13.062 -0.056 328 HB3 LEU 38 HB3 LEU 38 8.512 -12.860 0.640 329 HG LEU 38 HG LEU 38 9.725 -11.314 -1.667 330 HD11 LEU 38 HD11 LEU 38 7.307 -13.173 -1.426 331 HD12 LEU 38 HD12 LEU 38 7.821 -12.352 -2.906 332 HD13 LEU 38 HD13 LEU 38 8.867 -13.580 -2.177 333 HD21 LEU 38 HD21 LEU 38 7.452 -10.223 -1.855 334 HD22 LEU 38 HD22 LEU 38 7.079 -10.865 -0.239 335 HD23 LEU 38 HD23 LEU 38 8.397 -9.696 -0.461 336 H ASP 39 H ASP 39 12.165 -12.381 1.913 337 HA ASP 39 HA ASP 39 11.065 -14.068 4.094 338 HB2 ASP 39 HB2 ASP 39 12.598 -14.948 2.318 339 HB3 ASP 39 HB3 ASP 39 13.876 -13.917 2.958 340 H GLN 40 H GLN 40 12.207 -10.949 3.892 341 HA GLN 40 HA GLN 40 13.072 -10.767 6.710 342 HB2 GLN 40 HB2 GLN 40 15.293 -9.855 6.116 343 HB3 GLN 40 HB3 GLN 40 15.069 -11.544 5.696 344 HG2 GLN 40 HG2 GLN 40 14.403 -10.383 3.303 345 HG3 GLN 40 HG3 GLN 40 15.548 -9.198 3.924 346 HE21 GLN 40 HE21 GLN 40 16.886 -12.691 2.394 347 HE22 GLN 40 HE22 GLN 40 15.201 -12.208 2.292 348 HA PRO 41 HA PRO 41 10.738 -7.061 5.030 349 HB2 PRO 41 HB2 PRO 41 8.985 -6.820 7.188 350 HB3 PRO 41 HB3 PRO 41 8.662 -7.767 5.714 351 HG2 PRO 41 HG2 PRO 41 9.775 -8.750 8.356 352 HG3 PRO 41 HG3 PRO 41 8.464 -9.471 7.369 353 HD2 PRO 41 HD2 PRO 41 10.975 -10.444 7.263 354 HD3 PRO 41 HD3 PRO 41 10.007 -10.300 5.766 355 H ASP 42 H ASP 42 10.997 -4.984 5.621 356 HA ASP 42 HA ASP 42 13.104 -4.292 7.541 357 HB2 ASP 42 HB2 ASP 42 12.811 -3.190 5.323 358 HB3 ASP 42 HB3 ASP 42 11.241 -2.581 5.840 359 H TRP 43 H TRP 43 9.606 -4.316 7.446 360 HA TRP 43 HA TRP 43 9.347 -3.922 10.326 361 HB2 TRP 43 HB2 TRP 43 9.409 -1.595 9.661 362 HB3 TRP 43 HB3 TRP 43 8.329 -1.889 8.310 363 HD1 TRP 43 HD1 TRP 43 8.301 -1.155 12.020 364 HE1 TRP 43 HE1 TRP 43 5.899 -0.623 12.760 365 HE3 TRP 43 HE3 TRP 43 5.822 -2.691 7.831 366 HZ2 TRP 43 HZ2 TRP 43 3.261 -0.612 11.555 367 HZ3 TRP 43 HZ3 TRP 43 3.364 -2.306 7.608 368 HH2 TRP 43 HH2 TRP 43 2.074 -1.310 9.477 369 H THR 44 H THR 44 7.257 -4.603 11.078 370 HA THR 44 HA THR 44 5.262 -5.436 9.066 371 HB THR 44 HB THR 44 4.714 -7.485 10.219 372 HG1 THR 44 HG1 THR 44 7.130 -7.137 11.659 373 HG21 THR 44 HG21 THR 44 6.460 -8.903 9.456 374 HG22 THR 44 HG22 THR 44 6.265 -7.559 8.325 375 HG23 THR 44 HG23 THR 44 7.640 -7.561 9.451 376 H GLY 45 H GLY 45 3.140 -5.424 9.750 377 HA2 GLY 45 HA2 GLY 45 2.215 -4.893 12.395 378 HA3 GLY 45 HA3 GLY 45 2.492 -3.350 11.591 379 H ARG 46 H ARG 46 0.504 -2.638 11.281 380 HA ARG 46 HA ARG 46 -1.614 -4.355 10.045 381 HB2 ARG 46 HB2 ARG 46 -1.899 -1.937 11.862 382 HB3 ARG 46 HB3 ARG 46 -3.207 -2.959 11.253 383 HG2 ARG 46 HG2 ARG 46 -2.255 -4.890 12.527 384 HG3 ARG 46 HG3 ARG 46 -1.015 -3.825 13.201 385 HD2 ARG 46 HD2 ARG 46 -4.020 -3.418 13.550 386 HD3 ARG 46 HD3 ARG 46 -2.971 -4.222 14.713 387 HE ARG 46 HE ARG 46 -1.842 -2.172 15.193 388 HH11 ARG 46 HH11 ARG 46 -1.683 -0.069 15.354 389 HH12 ARG 46 HH12 ARG 46 -2.836 0.988 14.506 390 HH21 ARG 46 HH21 ARG 46 -4.514 -1.459 12.955 391 HH22 ARG 46 HH22 ARG 46 -4.201 0.264 13.185 392 H LEU 47 H LEU 47 -3.000 -3.487 8.600 393 HA LEU 47 HA LEU 47 -2.156 -1.110 7.010 394 HB2 LEU 47 HB2 LEU 47 -2.555 -3.303 5.858 395 HB3 LEU 47 HB3 LEU 47 -4.168 -3.341 6.549 396 HG LEU 47 HG LEU 47 -4.544 -1.067 5.255 397 HD11 LEU 47 HD11 LEU 47 -2.169 -0.757 4.593 398 HD12 LEU 47 HD12 LEU 47 -2.244 -2.271 3.663 399 HD13 LEU 47 HD13 LEU 47 -3.250 -0.881 3.198 400 HD21 LEU 47 HD21 LEU 47 -4.369 -3.799 3.988 401 HD22 LEU 47 HD22 LEU 47 -5.769 -3.039 4.761 402 HD23 LEU 47 HD23 LEU 47 -5.171 -2.400 3.231 403 H ARG 48 H ARG 48 -3.346 0.729 7.043 404 HA ARG 48 HA ARG 48 -6.265 0.542 7.538 405 HB2 ARG 48 HB2 ARG 48 -5.240 1.465 9.640 406 HB3 ARG 48 HB3 ARG 48 -4.555 2.791 8.693 407 HG2 ARG 48 HG2 ARG 48 -6.952 3.334 7.936 408 HG3 ARG 48 HG3 ARG 48 -7.512 2.147 9.109 409 HD2 ARG 48 HD2 ARG 48 -5.972 4.712 9.652 410 HD3 ARG 48 HD3 ARG 48 -7.670 4.417 10.017 411 HE ARG 48 HE ARG 48 -5.330 3.636 11.571 412 HH11 ARG 48 HH11 ARG 48 -5.420 2.451 13.336 413 HH12 ARG 48 HH12 ARG 48 -6.958 1.871 13.965 414 HH21 ARG 48 HH21 ARG 48 -8.748 2.905 11.203 415 HH22 ARG 48 HH22 ARG 48 -8.801 2.065 12.728 416 H ILE 49 H ILE 49 -7.067 0.952 5.624 417 HA ILE 49 HA ILE 49 -5.913 3.129 3.936 418 HB ILE 49 HB ILE 49 -8.145 1.252 3.160 419 HG12 ILE 49 HG12 ILE 49 -5.147 1.110 2.552 420 HG13 ILE 49 HG13 ILE 49 -6.090 -0.048 3.494 421 HG21 ILE 49 HG21 ILE 49 -6.413 3.143 1.506 422 HG22 ILE 49 HG22 ILE 49 -7.738 2.121 0.900 423 HG23 ILE 49 HG23 ILE 49 -8.093 3.456 1.979 424 HD11 ILE 49 HD11 ILE 49 -7.509 -0.390 1.370 425 HD12 ILE 49 HD12 ILE 49 -6.158 0.394 0.512 426 HD13 ILE 49 HD13 ILE 49 -5.900 -1.089 1.448 427 H THR 50 H THR 50 -6.799 4.997 3.892 428 HA THR 50 HA THR 50 -9.470 5.593 5.037 429 HB THR 50 HB THR 50 -7.968 7.692 5.893 430 HG1 THR 50 HG1 THR 50 -6.121 7.122 6.696 431 HG21 THR 50 HG21 THR 50 -7.832 6.525 8.123 432 HG22 THR 50 HG22 THR 50 -9.438 6.490 7.378 433 HG23 THR 50 HG23 THR 50 -8.399 5.046 7.321 434 H SER 51 H SER 51 -10.108 7.987 4.497 435 HA SER 51 HA SER 51 -8.714 9.217 2.223 436 HB2 SER 51 HB2 SER 51 -10.133 7.468 1.157 437 HB3 SER 51 HB3 SER 51 -11.562 8.190 1.924 438 HG SER 51 HG SER 51 -11.175 8.886 -0.248 439 H LYS 52 H LYS 52 -9.194 11.290 1.887 440 HA LYS 52 HA LYS 52 -11.720 12.301 2.744 441 HB2 LYS 52 HB2 LYS 52 -10.218 12.628 4.775 442 HB3 LYS 52 HB3 LYS 52 -9.338 13.819 3.818 443 HG2 LYS 52 HG2 LYS 52 -11.002 14.857 5.283 444 HG3 LYS 52 HG3 LYS 52 -11.330 15.185 3.590 445 HD2 LYS 52 HD2 LYS 52 -13.379 14.757 4.887 446 HD3 LYS 52 HD3 LYS 52 -13.173 13.566 3.601 447 HE2 LYS 52 HE2 LYS 52 -12.344 11.910 5.197 448 HE3 LYS 52 HE3 LYS 52 -12.448 13.084 6.520 449 HZ1 LYS 52 HZ1 LYS 52 -14.795 12.256 4.895 450 HZ2 LYS 52 HZ2 LYS 52 -14.401 11.523 6.278 451 HZ3 LYS 52 HZ3 LYS 52 -14.829 13.112 6.290 452 H GLY 53 H GLY 53 -12.497 13.514 1.204 453 HA2 GLY 53 HA2 GLY 53 -12.751 15.252 -0.293 454 HA3 GLY 53 HA3 GLY 53 -11.207 15.878 0.283 455 H LYS 54 H LYS 54 -11.998 12.899 -1.503 456 HA LYS 54 HA LYS 54 -11.267 11.947 -3.416 457 HB2 LYS 54 HB2 LYS 54 -10.798 14.739 -4.494 458 HB3 LYS 54 HB3 LYS 54 -10.852 13.249 -5.431 459 HG2 LYS 54 HG2 LYS 54 -13.202 12.875 -4.776 460 HG3 LYS 54 HG3 LYS 54 -13.204 14.386 -3.858 461 HD2 LYS 54 HD2 LYS 54 -12.712 14.149 -6.857 462 HD3 LYS 54 HD3 LYS 54 -14.247 14.594 -6.096 463 HE2 LYS 54 HE2 LYS 54 -13.153 16.574 -5.050 464 HE3 LYS 54 HE3 LYS 54 -11.639 16.159 -5.863 465 HZ1 LYS 54 HZ1 LYS 54 -12.884 17.821 -7.115 466 HZ2 LYS 54 HZ2 LYS 54 -12.777 16.455 -7.999 467 HZ3 LYS 54 HZ3 LYS 54 -14.178 16.840 -7.249 468 H THR 55 H THR 55 -9.449 12.558 -1.203 469 HA THR 55 HA THR 55 -7.028 11.581 -2.625 470 HB THR 55 HB THR 55 -6.944 13.345 -0.159 471 HG1 THR 55 HG1 THR 55 -6.049 14.868 -1.539 472 HG21 THR 55 HG21 THR 55 -4.502 13.341 -0.609 473 HG22 THR 55 HG22 THR 55 -5.108 11.715 -0.271 474 HG23 THR 55 HG23 THR 55 -4.761 12.191 -1.949 475 H ALA 56 H ALA 56 -6.816 9.534 -2.100 476 HA ALA 56 HA ALA 56 -7.868 8.456 0.452 477 HB1 ALA 56 HB1 ALA 56 -6.684 7.073 -1.968 478 HB2 ALA 56 HB2 ALA 56 -7.330 6.272 -0.520 479 HB3 ALA 56 HB3 ALA 56 -8.413 7.218 -1.563 480 H TYR 57 H TYR 57 -6.476 7.141 1.754 481 HA TYR 57 HA TYR 57 -3.586 7.875 1.774 482 HB2 TYR 57 HB2 TYR 57 -5.527 7.965 4.119 483 HB3 TYR 57 HB3 TYR 57 -3.804 8.297 4.186 484 HD1 TYR 57 HD1 TYR 57 -7.038 9.819 3.989 485 HD2 TYR 57 HD2 TYR 57 -2.965 10.253 2.594 486 HE1 TYR 57 HE1 TYR 57 -7.457 12.203 3.500 487 HE2 TYR 57 HE2 TYR 57 -3.406 12.666 2.127 488 HH TYR 57 HH TYR 57 -6.612 14.158 2.658 489 H ILE 58 H ILE 58 -2.516 5.951 1.618 490 HA ILE 58 HA ILE 58 -3.574 3.545 3.081 491 HB ILE 58 HB ILE 58 -1.247 3.789 1.139 492 HG12 ILE 58 HG12 ILE 58 -2.620 2.035 -0.131 493 HG13 ILE 58 HG13 ILE 58 -3.997 2.502 0.859 494 HG21 ILE 58 HG21 ILE 58 -2.337 1.352 2.619 495 HG22 ILE 58 HG22 ILE 58 -1.048 1.341 1.391 496 HG23 ILE 58 HG23 ILE 58 -0.770 2.131 2.925 497 HD11 ILE 58 HD11 ILE 58 -2.401 4.415 -0.903 498 HD12 ILE 58 HD12 ILE 58 -3.841 3.537 -1.443 499 HD13 ILE 58 HD13 ILE 58 -3.988 4.730 -0.149 500 H LYS 59 H LYS 59 -3.311 4.038 5.193 501 HA LYS 59 HA LYS 59 -0.568 4.784 6.094 502 HB2 LYS 59 HB2 LYS 59 -3.161 4.790 7.671 503 HB3 LYS 59 HB3 LYS 59 -1.569 5.345 8.211 504 HG2 LYS 59 HG2 LYS 59 -1.669 6.865 6.044 505 HG3 LYS 59 HG3 LYS 59 -3.404 6.556 6.121 506 HD2 LYS 59 HD2 LYS 59 -3.468 7.520 8.410 507 HD3 LYS 59 HD3 LYS 59 -1.710 7.793 8.341 508 HE2 LYS 59 HE2 LYS 59 -2.023 9.207 6.307 509 HE3 LYS 59 HE3 LYS 59 -3.779 8.971 6.437 510 HZ1 LYS 59 HZ1 LYS 59 -2.148 10.231 8.569 511 HZ2 LYS 59 HZ2 LYS 59 -2.960 11.072 7.432 512 HZ3 LYS 59 HZ3 LYS 59 -3.802 10.141 8.480 513 H LEU 60 H LEU 60 0.665 3.629 7.302 514 HA LEU 60 HA LEU 60 -0.078 0.805 7.988 515 HB2 LEU 60 HB2 LEU 60 2.389 2.124 6.902 516 HB3 LEU 60 HB3 LEU 60 2.626 0.874 8.112 517 HG LEU 60 HG LEU 60 1.496 -0.784 6.822 518 HD11 LEU 60 HD11 LEU 60 0.979 1.390 4.740 519 HD12 LEU 60 HD12 LEU 60 0.784 -0.355 4.454 520 HD13 LEU 60 HD13 LEU 60 -0.244 0.456 5.634 521 HD21 LEU 60 HD21 LEU 60 3.397 0.791 5.029 522 HD22 LEU 60 HD22 LEU 60 3.897 -0.250 6.377 523 HD23 LEU 60 HD23 LEU 60 3.077 -0.959 4.984 524 H GLU 61 H GLU 61 0.015 0.151 10.058 525 HA GLU 61 HA GLU 61 0.990 2.078 12.145 526 HB2 GLU 61 HB2 GLU 61 -1.665 0.625 12.131 527 HB3 GLU 61 HB3 GLU 61 -0.998 1.631 13.438 528 HG2 GLU 61 HG2 GLU 61 -1.096 3.609 11.974 529 HG3 GLU 61 HG3 GLU 61 -1.847 2.624 10.705 530 H ASP 62 H ASP 62 1.564 1.229 14.167 531 HA ASP 62 HA ASP 62 2.692 -1.408 14.056 532 HB2 ASP 62 HB2 ASP 62 3.551 0.702 15.222 533 HB3 ASP 62 HB3 ASP 62 2.347 0.355 16.479 534 H LYS 63 H LYS 63 2.226 -3.210 15.162 535 HA LYS 63 HA LYS 63 -0.574 -3.696 15.889 536 HB2 LYS 63 HB2 LYS 63 0.250 -6.132 15.925 537 HB3 LYS 63 HB3 LYS 63 0.329 -5.301 14.375 538 HG2 LYS 63 HG2 LYS 63 2.700 -4.889 14.607 539 HG3 LYS 63 HG3 LYS 63 2.719 -5.544 16.252 540 HD2 LYS 63 HD2 LYS 63 2.350 -7.768 15.468 541 HD3 LYS 63 HD3 LYS 63 1.878 -7.199 13.844 542 HE2 LYS 63 HE2 LYS 63 4.158 -6.261 13.518 543 HE3 LYS 63 HE3 LYS 63 4.653 -6.891 15.090 544 HZ1 LYS 63 HZ1 LYS 63 4.402 -9.115 14.276 545 HZ2 LYS 63 HZ2 LYS 63 3.640 -8.634 12.908 546 HZ3 LYS 63 HZ3 LYS 63 5.219 -8.295 13.104 547 H VAL 64 H VAL 64 2.055 -2.790 17.684 548 HA VAL 64 HA VAL 64 0.801 -3.886 20.171 549 HB VAL 64 HB VAL 64 3.717 -3.312 19.534 550 HG11 VAL 64 HG11 VAL 64 2.468 -4.251 22.157 551 HG12 VAL 64 HG12 VAL 64 4.210 -4.233 21.804 552 HG13 VAL 64 HG13 VAL 64 3.322 -2.713 21.881 553 HG21 VAL 64 HG21 VAL 64 2.278 -5.923 20.182 554 HG22 VAL 64 HG22 VAL 64 2.969 -5.458 18.612 555 HG23 VAL 64 HG23 VAL 64 4.036 -5.738 19.985 556 H SER 65 H SER 65 2.566 -1.083 18.755 557 HA SER 65 HA SER 65 1.880 0.526 21.144 558 HB2 SER 65 HB2 SER 65 3.540 1.159 18.685 559 HB3 SER 65 HB3 SER 65 3.317 2.240 20.074 560 HG SER 65 HG SER 65 5.237 1.001 20.240 561 H GLY 66 H GLY 66 0.697 0.141 17.886 562 HA2 GLY 66 HA2 GLY 66 -1.234 1.011 16.925 563 HA3 GLY 66 HA3 GLY 66 -1.500 2.029 18.338 564 H GLU 67 H GLU 67 1.663 2.410 17.205 565 HA GLU 67 HA GLU 67 1.114 5.147 16.423 566 HB2 GLU 67 HB2 GLU 67 3.441 5.494 16.661 567 HB3 GLU 67 HB3 GLU 67 2.898 4.456 17.988 568 HG2 GLU 67 HG2 GLU 67 3.817 2.475 16.832 569 HG3 GLU 67 HG3 GLU 67 4.361 3.489 15.493 570 H LEU 68 H LEU 68 1.908 6.197 14.528 571 HA LEU 68 HA LEU 68 1.397 4.722 12.083 572 HB2 LEU 68 HB2 LEU 68 0.723 7.099 12.500 573 HB3 LEU 68 HB3 LEU 68 2.425 7.550 12.542 574 HG LEU 68 HG LEU 68 2.611 6.706 10.133 575 HD11 LEU 68 HD11 LEU 68 0.542 5.315 10.082 576 HD12 LEU 68 HD12 LEU 68 -0.437 6.772 10.319 577 HD13 LEU 68 HD13 LEU 68 0.527 6.563 8.837 578 HD21 LEU 68 HD21 LEU 68 2.440 9.095 10.678 579 HD22 LEU 68 HD22 LEU 68 1.552 8.727 9.192 580 HD23 LEU 68 HD23 LEU 68 0.666 8.980 10.711 581 H PHE 69 H PHE 69 2.811 3.640 10.862 582 HA PHE 69 HA PHE 69 5.748 3.934 11.201 583 HB2 PHE 69 HB2 PHE 69 4.972 1.686 11.068 584 HB3 PHE 69 HB3 PHE 69 3.982 2.019 9.657 585 HD1 PHE 69 HD1 PHE 69 4.837 1.637 7.470 586 HD2 PHE 69 HD2 PHE 69 7.567 1.979 10.791 587 HE1 PHE 69 HE1 PHE 69 6.727 1.080 5.974 588 HE2 PHE 69 HE2 PHE 69 9.452 1.356 9.298 589 HZ PHE 69 HZ PHE 69 9.033 0.903 6.886 590 H ALA 70 H ALA 70 3.359 4.105 8.511 591 HA ALA 70 HA ALA 70 4.696 6.421 7.326 592 HB1 ALA 70 HB1 ALA 70 5.211 5.317 5.213 593 HB2 ALA 70 HB2 ALA 70 6.075 4.494 6.514 594 HB3 ALA 70 HB3 ALA 70 4.607 3.760 5.827 595 H GLN 71 H GLN 71 3.543 7.205 5.390 596 HA GLN 71 HA GLN 71 0.781 6.212 4.996 597 HB2 GLN 71 HB2 GLN 71 -0.028 8.592 5.058 598 HB3 GLN 71 HB3 GLN 71 0.380 7.888 6.624 599 HG2 GLN 71 HG2 GLN 71 2.257 9.234 6.932 600 HG3 GLN 71 HG3 GLN 71 2.516 9.473 5.217 601 HE21 GLN 71 HE21 GLN 71 1.067 12.638 5.369 602 HE22 GLN 71 HE22 GLN 71 2.352 11.577 4.769 603 H ALA 72 H ALA 72 0.144 6.240 2.901 604 HA ALA 72 HA ALA 72 1.727 7.842 0.921 605 HB1 ALA 72 HB1 ALA 72 1.203 6.041 -0.682 606 HB2 ALA 72 HB2 ALA 72 2.209 5.513 0.677 607 HB3 ALA 72 HB3 ALA 72 0.485 5.100 0.641 608 HA PRO 73 HA PRO 73 -2.466 9.524 0.214 609 HB2 PRO 73 HB2 PRO 73 -1.761 11.920 -0.854 610 HB3 PRO 73 HB3 PRO 73 -1.687 11.585 0.903 611 HG2 PRO 73 HG2 PRO 73 0.580 11.475 -1.099 612 HG3 PRO 73 HG3 PRO 73 0.559 12.265 0.508 613 HD2 PRO 73 HD2 PRO 73 1.592 9.760 0.099 614 HD3 PRO 73 HD3 PRO 73 0.786 10.212 1.629 615 H VAL 74 H VAL 74 -3.674 9.233 -1.534 616 HA VAL 74 HA VAL 74 -2.490 8.910 -4.275 617 HB VAL 74 HB VAL 74 -4.619 7.234 -2.881 618 HG11 VAL 74 HG11 VAL 74 -4.639 5.866 -4.953 619 HG12 VAL 74 HG12 VAL 74 -5.249 7.491 -5.232 620 HG13 VAL 74 HG13 VAL 74 -3.597 7.064 -5.750 621 HG21 VAL 74 HG21 VAL 74 -3.126 5.348 -3.186 622 HG22 VAL 74 HG22 VAL 74 -1.920 6.367 -3.980 623 HG23 VAL 74 HG23 VAL 74 -2.294 6.598 -2.257 624 H GLU 75 H GLU 75 -3.335 10.434 -5.613 625 HA GLU 75 HA GLU 75 -5.743 11.930 -4.800 626 HB2 GLU 75 HB2 GLU 75 -3.801 12.282 -7.111 627 HB3 GLU 75 HB3 GLU 75 -5.141 13.373 -6.735 628 HG2 GLU 75 HG2 GLU 75 -4.170 13.788 -4.478 629 HG3 GLU 75 HG3 GLU 75 -2.790 12.769 -4.891 630 H GLN 76 H GLN 76 -5.138 9.326 -6.954 631 HA GLN 76 HA GLN 76 -7.927 9.017 -7.521 632 HB2 GLN 76 HB2 GLN 76 -7.995 9.143 -9.877 633 HB3 GLN 76 HB3 GLN 76 -7.348 10.673 -9.333 634 HG2 GLN 76 HG2 GLN 76 -5.757 8.385 -10.580 635 HG3 GLN 76 HG3 GLN 76 -6.260 9.862 -11.374 636 HE21 GLN 76 HE21 GLN 76 -2.935 9.923 -9.001 637 HE22 GLN 76 HE22 GLN 76 -4.038 8.530 -8.950 638 H TYR 77 H TYR 77 -8.388 6.863 -8.321 639 HA TYR 77 HA TYR 77 -6.046 5.041 -8.158 640 HB2 TYR 77 HB2 TYR 77 -7.656 4.970 -6.274 641 HB3 TYR 77 HB3 TYR 77 -8.876 4.336 -7.387 642 HD1 TYR 77 HD1 TYR 77 -8.742 1.967 -8.088 643 HD2 TYR 77 HD2 TYR 77 -5.578 3.810 -5.839 644 HE1 TYR 77 HE1 TYR 77 -7.652 -0.259 -7.799 645 HE2 TYR 77 HE2 TYR 77 -4.417 1.607 -5.635 646 HH TYR 77 HH TYR 77 -5.793 -1.380 -7.061 647 HA PRO 78 HA PRO 78 -5.012 3.331 -8.991 648 HB2 PRO 78 HB2 PRO 78 -4.125 2.992 -11.832 649 HB3 PRO 78 HB3 PRO 78 -3.851 1.927 -10.419 650 HG2 PRO 78 HG2 PRO 78 -5.689 1.255 -12.294 651 HG3 PRO 78 HG3 PRO 78 -6.079 1.057 -10.551 652 HD2 PRO 78 HD2 PRO 78 -6.815 3.377 -12.378 653 HD3 PRO 78 HD3 PRO 78 -7.876 2.428 -11.292 654 H GLY 79 H GLY 79 -3.051 4.492 -8.776 655 HA2 GLY 79 HA2 GLY 79 -2.594 6.932 -10.463 656 HA3 GLY 79 HA3 GLY 79 -2.547 6.988 -8.699 657 H ILE 80 H ILE 80 -0.360 7.881 -9.220 658 HA ILE 80 HA ILE 80 1.744 5.916 -9.838 659 HB ILE 80 HB ILE 80 2.055 8.207 -10.535 660 HG12 ILE 80 HG12 ILE 80 4.024 7.507 -8.310 661 HG13 ILE 80 HG13 ILE 80 3.991 6.736 -9.898 662 HG21 ILE 80 HG21 ILE 80 2.141 9.028 -7.591 663 HG22 ILE 80 HG22 ILE 80 2.352 10.076 -9.004 664 HG23 ILE 80 HG23 ILE 80 0.781 9.353 -8.688 665 HD11 ILE 80 HD11 ILE 80 4.489 8.933 -10.953 666 HD12 ILE 80 HD12 ILE 80 4.592 9.664 -9.330 667 HD13 ILE 80 HD13 ILE 80 5.738 8.402 -9.802 668 H ALA 81 H ALA 81 0.244 7.240 -6.914 669 HA ALA 81 HA ALA 81 2.380 6.307 -5.158 670 HB1 ALA 81 HB1 ALA 81 0.932 7.359 -3.417 671 HB2 ALA 81 HB2 ALA 81 1.316 8.448 -4.763 672 HB3 ALA 81 HB3 ALA 81 -0.283 7.696 -4.676 673 H VAL 82 H VAL 82 0.545 4.402 -6.739 674 HA VAL 82 HA VAL 82 0.460 2.327 -4.750 675 HB VAL 82 HB VAL 82 -1.687 3.468 -4.283 676 HG11 VAL 82 HG11 VAL 82 -2.668 2.685 -7.017 677 HG12 VAL 82 HG12 VAL 82 -3.435 3.681 -5.749 678 HG13 VAL 82 HG13 VAL 82 -2.060 4.312 -6.628 679 HG21 VAL 82 HG21 VAL 82 -1.274 0.967 -4.037 680 HG22 VAL 82 HG22 VAL 82 -2.942 1.519 -4.059 681 HG23 VAL 82 HG23 VAL 82 -2.231 0.767 -5.513 682 H GLU 83 H GLU 83 0.552 0.338 -5.659 683 HA GLU 83 HA GLU 83 0.035 -0.147 -8.517 684 HB2 GLU 83 HB2 GLU 83 2.663 0.743 -7.660 685 HB3 GLU 83 HB3 GLU 83 2.785 -0.956 -8.103 686 HG2 GLU 83 HG2 GLU 83 1.544 -0.395 -10.253 687 HG3 GLU 83 HG3 GLU 83 1.713 1.313 -9.825 688 H THR 84 H THR 84 0.484 -2.334 -9.222 689 HA THR 84 HA THR 84 0.394 -4.447 -7.091 690 HB THR 84 HB THR 84 -0.611 -5.817 -8.995 691 HG1 THR 84 HG1 THR 84 -1.588 -4.642 -10.640 692 HG21 THR 84 HG21 THR 84 -2.183 -3.437 -7.930 693 HG22 THR 84 HG22 THR 84 -2.889 -4.872 -8.714 694 HG23 THR 84 HG23 THR 84 -2.006 -5.049 -7.194 695 H VAL 85 H VAL 85 1.432 -6.445 -7.570 696 HA VAL 85 HA VAL 85 3.859 -6.336 -9.263 697 HB VAL 85 HB VAL 85 4.367 -8.507 -8.322 698 HG11 VAL 85 HG11 VAL 85 3.476 -6.585 -6.137 699 HG12 VAL 85 HG12 VAL 85 4.726 -7.824 -6.013 700 HG13 VAL 85 HG13 VAL 85 4.965 -6.443 -7.093 701 HG21 VAL 85 HG21 VAL 85 1.760 -8.301 -6.766 702 HG22 VAL 85 HG22 VAL 85 2.038 -9.396 -8.129 703 HG23 VAL 85 HG23 VAL 85 2.975 -9.587 -6.656 704 H THR 86 H THR 86 4.213 -8.471 -10.571 705 HA THR 86 HA THR 86 1.925 -8.923 -12.384 706 HB THR 86 HB THR 86 3.547 -10.048 -13.801 707 HG1 THR 86 HG1 THR 86 5.675 -10.237 -13.140 708 HG21 THR 86 HG21 THR 86 5.086 -8.213 -14.250 709 HG22 THR 86 HG22 THR 86 3.493 -7.541 -13.822 710 HG23 THR 86 HG23 THR 86 4.815 -7.534 -12.638 711 H ASP 87 H ASP 87 3.814 -10.768 -10.037 712 HA ASP 87 HA ASP 87 2.919 -13.301 -11.107 713 HB2 ASP 87 HB2 ASP 87 5.234 -12.807 -10.355 714 HB3 ASP 87 HB3 ASP 87 4.642 -12.710 -8.691 715 H SER 88 H SER 88 2.331 -11.596 -8.017 716 HA SER 88 HA SER 88 0.073 -13.512 -7.486 717 HB2 SER 88 HB2 SER 88 1.962 -14.452 -6.325 718 HB3 SER 88 HB3 SER 88 2.272 -12.914 -5.499 719 HG SER 88 HG SER 88 0.969 -14.574 -4.341 720 H SER 89 H SER 89 -1.740 -12.694 -6.727 721 HA SER 89 HA SER 89 -2.181 -9.931 -6.747 722 HB2 SER 89 HB2 SER 89 -4.012 -11.846 -5.296 723 HB3 SER 89 HB3 SER 89 -4.439 -10.415 -6.237 724 HG SER 89 HG SER 89 -3.810 -11.526 -8.118 725 H ARG 90 H ARG 90 -0.839 -11.627 -4.082 726 HA ARG 90 HA ARG 90 -2.097 -9.880 -2.092 727 HB2 ARG 90 HB2 ARG 90 -1.507 -11.333 -0.418 728 HB3 ARG 90 HB3 ARG 90 -1.984 -12.340 -1.767 729 HG2 ARG 90 HG2 ARG 90 0.391 -12.782 -2.303 730 HG3 ARG 90 HG3 ARG 90 0.891 -11.727 -0.965 731 HD2 ARG 90 HD2 ARG 90 -0.328 -13.227 0.627 732 HD3 ARG 90 HD3 ARG 90 -0.654 -14.333 -0.723 733 HE ARG 90 HE ARG 90 2.136 -13.776 -0.669 734 HH11 ARG 90 HH11 ARG 90 3.602 -15.198 -0.032 735 HH12 ARG 90 HH12 ARG 90 3.212 -16.449 1.124 736 HH21 ARG 90 HH21 ARG 90 -0.024 -15.406 1.609 737 HH22 ARG 90 HH22 ARG 90 1.191 -16.587 1.978 738 H TYR 91 H TYR 91 0.042 -8.857 -4.009 739 HA TYR 91 HA TYR 91 1.717 -7.543 -1.945 740 HB2 TYR 91 HB2 TYR 91 2.667 -8.758 -4.550 741 HB3 TYR 91 HB3 TYR 91 3.649 -7.824 -3.445 742 HD1 TYR 91 HD1 TYR 91 4.215 -8.727 -1.182 743 HD2 TYR 91 HD2 TYR 91 2.203 -11.102 -4.160 744 HE1 TYR 91 HE1 TYR 91 4.814 -10.798 0.067 745 HE2 TYR 91 HE2 TYR 91 2.906 -13.184 -2.974 746 HH TYR 91 HH TYR 91 4.775 -13.073 0.081 747 H PHE 92 H PHE 92 2.095 -5.435 -2.238 748 HA PHE 92 HA PHE 92 1.342 -4.089 -4.787 749 HB2 PHE 92 HB2 PHE 92 0.464 -3.158 -2.030 750 HB3 PHE 92 HB3 PHE 92 0.099 -2.380 -3.551 751 HD1 PHE 92 HD1 PHE 92 -0.947 -4.815 -1.148 752 HD2 PHE 92 HD2 PHE 92 -1.354 -3.660 -5.270 753 HE1 PHE 92 HE1 PHE 92 -3.043 -6.120 -1.292 754 HE2 PHE 92 HE2 PHE 92 -3.414 -5.054 -5.450 755 HZ PHE 92 HZ PHE 92 -4.265 -6.278 -3.470 756 H VAL 93 H VAL 93 2.142 -1.899 -4.932 757 HA VAL 93 HA VAL 93 4.368 -1.187 -3.058 758 HB VAL 93 HB VAL 93 4.202 -0.622 -6.037 759 HG11 VAL 93 HG11 VAL 93 6.358 0.548 -5.794 760 HG12 VAL 93 HG12 VAL 93 5.079 1.387 -4.925 761 HG13 VAL 93 HG13 VAL 93 6.256 0.400 -4.028 762 HG21 VAL 93 HG21 VAL 93 5.048 -2.831 -5.555 763 HG22 VAL 93 HG22 VAL 93 6.424 -1.819 -5.995 764 HG23 VAL 93 HG23 VAL 93 6.136 -2.209 -4.294 765 H ILE 94 H ILE 94 4.295 0.901 -2.205 766 HA ILE 94 HA ILE 94 2.358 2.770 -3.401 767 HB ILE 94 HB ILE 94 1.516 3.577 -1.330 768 HG12 ILE 94 HG12 ILE 94 3.303 2.716 0.229 769 HG13 ILE 94 HG13 ILE 94 1.649 2.595 0.790 770 HG21 ILE 94 HG21 ILE 94 -0.151 1.848 -0.843 771 HG22 ILE 94 HG22 ILE 94 0.093 2.157 -2.559 772 HG23 ILE 94 HG23 ILE 94 0.775 0.692 -1.824 773 HD11 ILE 94 HD11 ILE 94 3.322 0.268 -0.250 774 HD12 ILE 94 HD12 ILE 94 2.897 0.619 1.431 775 HD13 ILE 94 HD13 ILE 94 1.632 0.164 0.285 776 H ARG 95 H ARG 95 2.758 4.945 -3.052 777 HA ARG 95 HA ARG 95 5.627 5.543 -2.474 778 HB2 ARG 95 HB2 ARG 95 4.562 6.231 -4.665 779 HB3 ARG 95 HB3 ARG 95 3.636 7.433 -3.748 780 HG2 ARG 95 HG2 ARG 95 5.822 8.366 -2.891 781 HG3 ARG 95 HG3 ARG 95 6.669 7.181 -3.895 782 HD2 ARG 95 HD2 ARG 95 6.714 9.135 -5.175 783 HD3 ARG 95 HD3 ARG 95 5.414 8.177 -5.902 784 HE ARG 95 HE ARG 95 4.228 9.870 -3.955 785 HH11 ARG 95 HH11 ARG 95 3.496 11.972 -4.323 786 HH12 ARG 95 HH12 ARG 95 3.701 12.663 -5.906 787 HH21 ARG 95 HH21 ARG 95 5.774 10.207 -7.079 788 HH22 ARG 95 HH22 ARG 95 5.024 11.749 -7.387 789 H ILE 96 H ILE 96 5.708 5.548 -0.279 790 HA ILE 96 HA ILE 96 3.787 7.091 1.288 791 HB ILE 96 HB ILE 96 4.994 6.545 3.254 792 HG12 ILE 96 HG12 ILE 96 6.836 4.593 2.829 793 HG13 ILE 96 HG13 ILE 96 7.157 5.561 1.403 794 HG21 ILE 96 HG21 ILE 96 4.516 4.155 1.464 795 HG22 ILE 96 HG22 ILE 96 4.633 4.110 3.229 796 HG23 ILE 96 HG23 ILE 96 3.324 5.003 2.483 797 HD11 ILE 96 HD11 ILE 96 7.558 7.541 2.903 798 HD12 ILE 96 HD12 ILE 96 7.217 6.496 4.307 799 HD13 ILE 96 HD13 ILE 96 8.619 6.169 3.274 800 H GLN 97 H GLN 97 4.017 9.019 2.281 801 HA GLN 97 HA GLN 97 6.227 10.845 1.453 802 HB2 GLN 97 HB2 GLN 97 3.291 11.093 0.707 803 HB3 GLN 97 HB3 GLN 97 4.407 12.453 0.669 804 HG2 GLN 97 HG2 GLN 97 5.608 11.650 -1.149 805 HG3 GLN 97 HG3 GLN 97 5.109 9.979 -0.915 806 HE21 GLN 97 HE21 GLN 97 2.069 10.282 -2.706 807 HE22 GLN 97 HE22 GLN 97 3.073 9.266 -1.678 808 H ASP 98 H ASP 98 6.483 12.557 2.741 809 HA ASP 98 HA ASP 98 4.964 12.651 5.307 810 HB2 ASP 98 HB2 ASP 98 7.491 14.026 4.359 811 HB3 ASP 98 HB3 ASP 98 6.707 14.438 5.873 812 H GLY 99 H GLY 99 4.507 14.024 2.311 813 HA2 GLY 99 HA2 GLY 99 2.959 15.618 1.622 814 HA3 GLY 99 HA3 GLY 99 2.682 16.092 3.298 815 H THR 100 H THR 100 5.963 16.162 2.780 816 HA THR 100 HA THR 100 6.021 19.107 2.321 817 HB THR 100 HB THR 100 6.715 18.102 4.512 818 HG1 THR 100 HG1 THR 100 8.444 19.490 4.723 819 HG21 THR 100 HG21 THR 100 8.005 16.150 3.570 820 HG22 THR 100 HG22 THR 100 9.257 17.296 3.039 821 HG23 THR 100 HG23 THR 100 8.892 17.105 4.766 822 H GLY 101 H GLY 101 6.442 16.498 0.422 823 HA2 GLY 101 HA2 GLY 101 7.326 16.627 -1.804 824 HA3 GLY 101 HA3 GLY 101 8.587 17.731 -1.262 825 H ARG 102 H ARG 102 8.532 15.441 1.089 826 HA ARG 102 HA ARG 102 10.666 13.694 0.105 827 HB2 ARG 102 HB2 ARG 102 8.864 13.663 2.567 828 HB3 ARG 102 HB3 ARG 102 10.089 12.435 2.242 829 HG2 ARG 102 HG2 ARG 102 11.876 14.031 2.392 830 HG3 ARG 102 HG3 ARG 102 10.726 15.390 2.538 831 HD2 ARG 102 HD2 ARG 102 9.809 14.420 4.601 832 HD3 ARG 102 HD3 ARG 102 10.924 13.044 4.480 833 HE ARG 102 HE ARG 102 12.501 15.383 4.531 834 HH11 ARG 102 HH11 ARG 102 13.474 16.114 6.409 835 HH12 ARG 102 HH12 ARG 102 12.843 15.641 7.960 836 HH21 ARG 102 HH21 ARG 102 10.269 13.722 6.696 837 HH22 ARG 102 HH22 ARG 102 11.085 14.324 8.123 838 H SER 103 H SER 103 10.396 11.818 -0.799 839 HA SER 103 HA SER 103 7.965 10.264 -0.358 840 HB2 SER 103 HB2 SER 103 7.602 9.727 -2.741 841 HB3 SER 103 HB3 SER 103 7.409 11.460 -2.430 842 HG SER 103 HG SER 103 8.658 11.138 -4.292 843 H ALA 104 H ALA 104 8.129 8.035 -0.621 844 HA ALA 104 HA ALA 104 10.525 6.842 -1.855 845 HB1 ALA 104 HB1 ALA 104 9.663 6.206 1.003 846 HB2 ALA 104 HB2 ALA 104 10.913 5.346 0.078 847 HB3 ALA 104 HB3 ALA 104 11.159 7.043 0.532 848 H PHE 105 H PHE 105 10.098 4.891 -2.837 849 HA PHE 105 HA PHE 105 7.290 3.897 -2.799 850 HB2 PHE 105 HB2 PHE 105 9.640 3.303 -4.615 851 HB3 PHE 105 HB3 PHE 105 8.131 2.411 -4.640 852 HD1 PHE 105 HD1 PHE 105 9.743 5.610 -5.543 853 HD2 PHE 105 HD2 PHE 105 6.024 3.428 -5.419 854 HE1 PHE 105 HE1 PHE 105 8.749 7.203 -7.160 855 HE2 PHE 105 HE2 PHE 105 5.043 5.004 -7.050 856 HZ PHE 105 HZ PHE 105 6.408 6.890 -7.938 857 H ILE 106 H ILE 106 6.773 2.373 -1.408 858 HA ILE 106 HA ILE 106 8.826 0.356 -0.575 859 HB ILE 106 HB ILE 106 7.890 0.149 1.564 860 HG12 ILE 106 HG12 ILE 106 5.787 2.244 0.877 861 HG13 ILE 106 HG13 ILE 106 5.486 0.511 1.034 862 HG21 ILE 106 HG21 ILE 106 8.139 3.129 1.021 863 HG22 ILE 106 HG22 ILE 106 8.534 2.270 2.528 864 HG23 ILE 106 HG23 ILE 106 9.519 2.012 1.082 865 HD11 ILE 106 HD11 ILE 106 6.373 2.334 3.294 866 HD12 ILE 106 HD12 ILE 106 4.788 1.583 3.065 867 HD13 ILE 106 HD13 ILE 106 6.202 0.571 3.402 868 H GLY 107 H GLY 107 8.215 -1.803 -0.376 869 HA2 GLY 107 HA2 GLY 107 5.795 -2.592 -1.925 870 HA3 GLY 107 HA3 GLY 107 7.191 -3.609 -1.571 871 H ILE 108 H ILE 108 4.182 -3.739 -0.944 872 HA ILE 108 HA ILE 108 4.558 -4.666 1.836 873 HB ILE 108 HB ILE 108 2.236 -4.193 2.378 874 HG12 ILE 108 HG12 ILE 108 2.132 -2.405 -0.083 875 HG13 ILE 108 HG13 ILE 108 1.308 -3.958 0.076 876 HG21 ILE 108 HG21 ILE 108 2.620 -1.843 2.935 877 HG22 ILE 108 HG22 ILE 108 4.089 -2.802 3.121 878 HG23 ILE 108 HG23 ILE 108 3.901 -1.738 1.709 879 HD11 ILE 108 HD11 ILE 108 0.037 -3.072 2.049 880 HD12 ILE 108 HD12 ILE 108 0.748 -1.476 1.757 881 HD13 ILE 108 HD13 ILE 108 -0.290 -2.214 0.530 882 H GLY 109 H GLY 109 3.782 -6.590 2.373 883 HA2 GLY 109 HA2 GLY 109 2.278 -8.187 0.329 884 HA3 GLY 109 HA3 GLY 109 3.578 -8.867 1.293 885 H PHE 110 H PHE 110 0.651 -9.402 0.989 886 HA PHE 110 HA PHE 110 -0.404 -9.085 3.766 887 HB2 PHE 110 HB2 PHE 110 -1.613 -9.681 1.055 888 HB3 PHE 110 HB3 PHE 110 -2.512 -9.952 2.525 889 HD1 PHE 110 HD1 PHE 110 -0.467 -7.139 0.982 890 HD2 PHE 110 HD2 PHE 110 -4.027 -8.330 3.120 891 HE1 PHE 110 HE1 PHE 110 -1.245 -4.794 1.013 892 HE2 PHE 110 HE2 PHE 110 -4.844 -5.991 3.040 893 HZ PHE 110 HZ PHE 110 -3.441 -4.223 1.981 894 H THR 111 H THR 111 -1.773 -10.946 4.518 895 HA THR 111 HA THR 111 -0.210 -13.384 4.631 896 HB THR 111 HB THR 111 -1.486 -12.515 6.519 897 HG1 THR 111 HG1 THR 111 -2.261 -14.522 7.155 898 HG21 THR 111 HG21 THR 111 -4.010 -13.475 5.103 899 HG22 THR 111 HG22 THR 111 -3.880 -12.826 6.746 900 HG23 THR 111 HG23 THR 111 -3.577 -11.769 5.364 901 H ASP 112 H ASP 112 -3.144 -12.436 2.798 902 HA ASP 112 HA ASP 112 -2.764 -14.752 1.038 903 HB2 ASP 112 HB2 ASP 112 -4.194 -15.532 2.984 904 HB3 ASP 112 HB3 ASP 112 -5.401 -14.340 2.503 905 H ARG 113 H ARG 113 -3.966 -14.664 -0.914 906 HA ARG 113 HA ARG 113 -4.250 -12.105 -2.183 907 HB2 ARG 113 HB2 ARG 113 -5.427 -14.832 -2.932 908 HB3 ARG 113 HB3 ARG 113 -5.331 -13.425 -4.004 909 HG2 ARG 113 HG2 ARG 113 -2.878 -13.433 -3.815 910 HG3 ARG 113 HG3 ARG 113 -2.968 -14.799 -2.695 911 HD2 ARG 113 HD2 ARG 113 -2.338 -15.649 -4.863 912 HD3 ARG 113 HD3 ARG 113 -3.960 -16.217 -4.443 913 HE ARG 113 HE ARG 113 -3.908 -13.773 -6.096 914 HH11 ARG 113 HH11 ARG 113 -4.618 -13.783 -8.096 915 HH12 ARG 113 HH12 ARG 113 -4.975 -15.279 -8.939 916 HH21 ARG 113 HH21 ARG 113 -3.986 -17.277 -6.307 917 HH22 ARG 113 HH22 ARG 113 -4.607 -17.231 -7.935 918 H GLY 114 H GLY 114 -6.626 -14.236 -0.640 919 HA2 GLY 114 HA2 GLY 114 -8.929 -12.735 -1.462 920 HA3 GLY 114 HA3 GLY 114 -8.838 -13.968 -0.191 921 H ASP 115 H ASP 115 -6.547 -12.090 0.951 922 HA ASP 115 HA ASP 115 -8.348 -10.211 2.450 923 HB2 ASP 115 HB2 ASP 115 -5.619 -11.376 3.075 924 HB3 ASP 115 HB3 ASP 115 -6.264 -9.971 3.913 925 H ALA 116 H ALA 116 -5.385 -10.313 0.459 926 HA ALA 116 HA ALA 116 -4.932 -7.478 0.306 927 HB1 ALA 116 HB1 ALA 116 -3.687 -8.147 -1.748 928 HB2 ALA 116 HB2 ALA 116 -3.283 -9.142 -0.336 929 HB3 ALA 116 HB3 ALA 116 -4.359 -9.775 -1.608 930 H PHE 117 H PHE 117 -7.130 -9.608 -1.609 931 HA PHE 117 HA PHE 117 -7.798 -7.737 -3.574 932 HB2 PHE 117 HB2 PHE 117 -8.938 -10.203 -2.591 933 HB3 PHE 117 HB3 PHE 117 -10.230 -9.057 -2.872 934 HD1 PHE 117 HD1 PHE 117 -7.374 -10.832 -4.463 935 HD2 PHE 117 HD2 PHE 117 -10.786 -8.274 -5.110 936 HE1 PHE 117 HE1 PHE 117 -7.182 -11.195 -6.915 937 HE2 PHE 117 HE2 PHE 117 -10.589 -8.637 -7.562 938 HZ PHE 117 HZ PHE 117 -8.789 -10.097 -8.466 939 H ASP 118 H ASP 118 -8.793 -7.611 -0.198 940 HA ASP 118 HA ASP 118 -10.852 -5.622 -0.550 941 HB2 ASP 118 HB2 ASP 118 -10.486 -7.259 1.394 942 HB3 ASP 118 HB3 ASP 118 -9.214 -6.177 1.949 943 H PHE 119 H PHE 119 -7.331 -5.403 -0.350 944 HA PHE 119 HA PHE 119 -7.090 -2.592 0.292 945 HB2 PHE 119 HB2 PHE 119 -5.236 -4.106 0.562 946 HB3 PHE 119 HB3 PHE 119 -5.268 -4.552 -1.131 947 HD1 PHE 119 HD1 PHE 119 -4.541 -3.081 -2.924 948 HD2 PHE 119 HD2 PHE 119 -3.974 -2.138 1.227 949 HE1 PHE 119 HE1 PHE 119 -2.951 -1.283 -3.555 950 HE2 PHE 119 HE2 PHE 119 -2.399 -0.338 0.611 951 HZ PHE 119 HZ PHE 119 -1.873 0.102 -1.787 952 H ASN 120 H ASN 120 -7.059 -4.346 -2.847 953 HA ASN 120 HA ASN 120 -7.037 -1.808 -4.288 954 HB2 ASN 120 HB2 ASN 120 -6.952 -3.182 -6.315 955 HB3 ASN 120 HB3 ASN 120 -5.729 -3.638 -5.138 956 HD21 ASN 120 HD21 ASN 120 -8.624 -6.343 -6.152 957 HD22 ASN 120 HD22 ASN 120 -8.845 -4.662 -6.608 958 H VAL 121 H VAL 121 -9.639 -3.999 -3.347 959 HA VAL 121 HA VAL 121 -11.568 -2.720 -5.147 960 HB VAL 121 HB VAL 121 -11.886 -4.646 -2.832 961 HG11 VAL 121 HG11 VAL 121 -14.052 -3.503 -4.653 962 HG12 VAL 121 HG12 VAL 121 -14.253 -4.913 -3.588 963 HG13 VAL 121 HG13 VAL 121 -13.950 -3.325 -2.885 964 HG21 VAL 121 HG21 VAL 121 -12.534 -6.212 -4.625 965 HG22 VAL 121 HG22 VAL 121 -12.340 -4.933 -5.845 966 HG23 VAL 121 HG23 VAL 121 -10.932 -5.552 -4.963 967 H SER 122 H SER 122 -10.750 -2.334 -1.633 968 HA SER 122 HA SER 122 -12.856 -0.461 -1.151 969 HB2 SER 122 HB2 SER 122 -11.681 0.104 0.882 970 HB3 SER 122 HB3 SER 122 -11.664 -1.653 0.640 971 HG SER 122 HG SER 122 -9.595 -1.606 0.137 972 H LEU 123 H LEU 123 -9.562 0.064 -2.396 973 HA LEU 123 HA LEU 123 -9.705 2.948 -2.381 974 HB2 LEU 123 HB2 LEU 123 -8.029 0.918 -3.900 975 HB3 LEU 123 HB3 LEU 123 -7.852 2.653 -4.149 976 HG LEU 123 HG LEU 123 -7.530 1.345 -1.416 977 HD11 LEU 123 HD11 LEU 123 -5.135 1.482 -1.744 978 HD12 LEU 123 HD12 LEU 123 -5.828 0.514 -3.046 979 HD13 LEU 123 HD13 LEU 123 -5.348 2.199 -3.358 980 HD21 LEU 123 HD21 LEU 123 -6.746 4.088 -2.512 981 HD22 LEU 123 HD22 LEU 123 -7.999 3.758 -1.293 982 HD23 LEU 123 HD23 LEU 123 -6.304 3.461 -0.912 983 H GLN 124 H GLN 124 -10.236 0.596 -5.102 984 HA GLN 124 HA GLN 124 -10.994 2.671 -6.896 985 HB2 GLN 124 HB2 GLN 124 -11.403 1.022 -8.469 986 HB3 GLN 124 HB3 GLN 124 -10.192 0.296 -7.408 987 HG2 GLN 124 HG2 GLN 124 -12.043 -0.914 -6.236 988 HG3 GLN 124 HG3 GLN 124 -13.162 -0.324 -7.470 989 HE21 GLN 124 HE21 GLN 124 -10.324 -3.141 -8.514 990 HE22 GLN 124 HE22 GLN 124 -10.055 -2.114 -7.092 991 H ASP 125 H ASP 125 -12.974 0.869 -4.573 992 HA ASP 125 HA ASP 125 -15.478 1.873 -5.661 993 HB2 ASP 125 HB2 ASP 125 -15.229 -0.370 -4.604 994 HB3 ASP 125 HB3 ASP 125 -14.912 0.419 -3.054 995 H HIS 126 H HIS 126 -13.063 3.342 -3.784 996 HA HIS 126 HA HIS 126 -15.038 5.303 -2.757 997 HB2 HIS 126 HB2 HIS 126 -13.142 4.453 -1.268 998 HB3 HIS 126 HB3 HIS 126 -12.068 5.457 -2.250 999 HD2 HIS 126 HD2 HIS 126 -15.396 5.817 -0.224 1000 HE1 HIS 126 HE1 HIS 126 -13.406 9.576 0.015 1001 HE2 HIS 126 HE2 HIS 126 -15.444 8.254 0.771 1002 H PHE 127 H PHE 127 -12.927 4.820 -5.432 1003 HA PHE 127 HA PHE 127 -13.153 7.683 -6.240 1004 HB2 PHE 127 HB2 PHE 127 -11.297 5.427 -7.018 1005 HB3 PHE 127 HB3 PHE 127 -11.442 6.876 -7.993 1006 HD1 PHE 127 HD1 PHE 127 -9.672 5.466 -5.270 1007 HD2 PHE 127 HD2 PHE 127 -11.265 9.187 -6.736 1008 HE1 PHE 127 HE1 PHE 127 -7.991 6.701 -3.949 1009 HE2 PHE 127 HE2 PHE 127 -9.588 10.433 -5.400 1010 HZ PHE 127 HZ PHE 127 -7.944 9.198 -4.004 1011 H LYS 128 H LYS 128 -14.856 4.793 -7.020 1012 HA LYS 128 HA LYS 128 -15.116 5.016 -9.742 1013 HB2 LYS 128 HB2 LYS 128 -16.988 3.689 -9.744 1014 HB3 LYS 128 HB3 LYS 128 -16.032 3.169 -8.372 1015 HG2 LYS 128 HG2 LYS 128 -18.501 4.980 -8.190 1016 HG3 LYS 128 HG3 LYS 128 -18.510 3.223 -8.023 1017 HD2 LYS 128 HD2 LYS 128 -16.938 3.421 -6.099 1018 HD3 LYS 128 HD3 LYS 128 -17.040 5.180 -6.213 1019 HE2 LYS 128 HE2 LYS 128 -18.521 4.580 -4.505 1020 HE3 LYS 128 HE3 LYS 128 -19.526 4.997 -5.902 1021 HZ1 LYS 128 HZ1 LYS 128 -20.228 2.919 -4.755 1022 HZ2 LYS 128 HZ2 LYS 128 -19.823 2.613 -6.307 1023 HZ3 LYS 128 HZ3 LYS 128 -18.791 2.214 -5.101 1024 H TRP 129 H TRP 129 -16.685 7.207 -7.551 1025 HA TRP 129 HA TRP 129 -18.398 8.433 -9.583 1026 HB2 TRP 129 HB2 TRP 129 -18.978 9.996 -7.813 1027 HB3 TRP 129 HB3 TRP 129 -19.093 8.339 -7.245 1028 HD1 TRP 129 HD1 TRP 129 -17.040 7.485 -5.616 1029 HE1 TRP 129 HE1 TRP 129 -15.505 8.724 -4.017 1030 HE3 TRP 129 HE3 TRP 129 -17.961 12.302 -7.144 1031 HZ2 TRP 129 HZ2 TRP 129 -15.132 11.464 -3.131 1032 HZ3 TRP 129 HZ3 TRP 129 -17.074 14.208 -5.829 1033 HH2 TRP 129 HH2 TRP 129 -15.685 13.807 -3.810 1034 H VAL 130 H VAL 130 -15.129 8.899 -8.463 1035 HA VAL 130 HA VAL 130 -14.763 11.532 -9.744 1036 HB VAL 130 HB VAL 130 -12.664 9.668 -8.582 1037 HG11 VAL 130 HG11 VAL 130 -11.349 11.754 -8.318 1038 HG12 VAL 130 HG12 VAL 130 -11.716 11.431 -10.011 1039 HG13 VAL 130 HG13 VAL 130 -12.642 12.667 -9.130 1040 HG21 VAL 130 HG21 VAL 130 -14.217 10.170 -6.776 1041 HG22 VAL 130 HG22 VAL 130 -12.767 11.142 -6.553 1042 HG23 VAL 130 HG23 VAL 130 -14.236 11.892 -7.214 1043 H LYS 131 H LYS 131 -14.258 8.125 -10.403 1044 HA LYS 131 HA LYS 131 -12.743 8.550 -12.897 1045 HB2 LYS 131 HB2 LYS 131 -13.498 6.086 -11.275 1046 HB3 LYS 131 HB3 LYS 131 -12.608 5.997 -12.781 1047 HG2 LYS 131 HG2 LYS 131 -11.646 7.533 -10.326 1048 HG3 LYS 131 HG3 LYS 131 -11.191 5.877 -10.701 1049 HD2 LYS 131 HD2 LYS 131 -10.619 8.261 -12.518 1050 HD3 LYS 131 HD3 LYS 131 -9.479 7.592 -11.351 1051 HE2 LYS 131 HE2 LYS 131 -9.299 5.516 -12.498 1052 HE3 LYS 131 HE3 LYS 131 -10.722 5.838 -13.495 1053 HZ1 LYS 131 HZ1 LYS 131 -9.561 7.562 -14.644 1054 HZ2 LYS 131 HZ2 LYS 131 -8.219 7.410 -13.699 1055 HZ3 LYS 131 HZ3 LYS 131 -8.654 6.208 -14.722 1056 H GLN 132 H GLN 132 -15.422 9.501 -12.865 1057 HA GLN 132 HA GLN 132 -16.938 7.702 -14.616 1058 HB2 GLN 132 HB2 GLN 132 -17.463 10.528 -13.646 1059 HB3 GLN 132 HB3 GLN 132 -18.501 9.654 -14.780 1060 HG2 GLN 132 HG2 GLN 132 -17.835 8.686 -11.968 1061 HG3 GLN 132 HG3 GLN 132 -19.293 9.575 -12.392 1062 HE21 GLN 132 HE21 GLN 132 -19.275 5.591 -12.944 1063 HE22 GLN 132 HE22 GLN 132 -18.035 6.441 -12.017 1064 H GLU 133 H GLU 133 -15.683 7.404 -16.315 1065 HA GLU 133 HA GLU 133 -14.992 9.648 -18.180 1066 HB2 GLU 133 HB2 GLU 133 -13.189 7.351 -17.315 1067 HB3 GLU 133 HB3 GLU 133 -12.852 8.474 -18.635 1068 HG2 GLU 133 HG2 GLU 133 -12.908 10.376 -17.009 1069 HG3 GLU 133 HG3 GLU 133 -13.140 9.223 -15.692 Start of MODEL 16 1 H1 GLY -4 H1 GLY -4 0.500 31.198 18.635 2 H2 GLY -4 H2 GLY -4 1.109 30.108 19.694 3 H3 GLY -4 H3 GLY -4 -0.514 30.269 19.526 4 HA2 GLY -4 HA2 GLY -4 0.214 28.270 18.418 5 HA3 GLY -4 HA3 GLY -4 -0.428 29.454 17.265 6 H SER -3 H SER -3 0.845 28.183 15.704 7 HA SER -3 HA SER -3 3.498 29.376 15.272 8 HB2 SER -3 HB2 SER -3 4.691 27.319 15.048 9 HB3 SER -3 HB3 SER -3 3.875 27.247 16.603 10 HG SER -3 HG SER -3 2.315 25.896 15.690 11 HA PRO -2 HA PRO -2 2.077 29.229 11.080 12 HB2 PRO -2 HB2 PRO -2 4.344 29.063 9.549 13 HB3 PRO -2 HB3 PRO -2 3.922 30.498 10.530 14 HG2 PRO -2 HG2 PRO -2 5.760 28.203 11.296 15 HG3 PRO -2 HG3 PRO -2 6.102 29.965 11.373 16 HD2 PRO -2 HD2 PRO -2 5.276 28.614 13.551 17 HD3 PRO -2 HD3 PRO -2 4.655 30.256 13.226 18 H ASN -1 H ASN -1 3.351 26.385 12.423 19 HA ASN -1 HA ASN -1 3.588 24.645 10.191 20 HB2 ASN -1 HB2 ASN -1 2.797 24.073 13.084 21 HB3 ASN -1 HB3 ASN -1 3.241 22.847 11.901 22 HD21 ASN -1 HD21 ASN -1 6.176 24.809 13.832 23 HD22 ASN -1 HD22 ASN -1 4.473 25.064 14.223 24 H SER 0 H SER 0 0.663 25.930 11.642 25 HA SER 0 HA SER 0 -1.226 23.967 10.773 26 HB2 SER 0 HB2 SER 0 -2.861 25.805 11.007 27 HB3 SER 0 HB3 SER 0 -1.773 25.688 12.403 28 HG SER 0 HG SER 0 -2.016 27.858 11.682 29 H MET 1 H MET 1 0.593 26.299 8.919 30 HA MET 1 HA MET 1 -1.183 26.173 6.570 31 HB2 MET 1 HB2 MET 1 1.547 27.452 6.953 32 HB3 MET 1 HB3 MET 1 0.508 27.634 5.536 33 HG2 MET 1 HG2 MET 1 -1.265 28.618 6.961 34 HG3 MET 1 HG3 MET 1 -0.188 28.543 8.355 35 HE1 MET 1 HE1 MET 1 1.813 30.104 8.808 36 HE2 MET 1 HE2 MET 1 2.643 29.465 7.370 37 HE3 MET 1 HE3 MET 1 2.518 31.219 7.617 38 H ALA 2 H ALA 2 0.856 23.922 7.819 39 HA ALA 2 HA ALA 2 1.593 22.790 5.149 40 HB1 ALA 2 HB1 ALA 2 3.786 22.173 6.085 41 HB2 ALA 2 HB2 ALA 2 3.554 23.931 6.123 42 HB3 ALA 2 HB3 ALA 2 3.379 22.978 7.615 43 H THR 3 H THR 3 0.911 22.149 8.597 44 HA THR 3 HA THR 3 0.161 19.330 7.912 45 HB THR 3 HB THR 3 1.270 20.330 10.555 46 HG1 THR 3 HG1 THR 3 3.084 19.145 9.965 47 HG21 THR 3 HG21 THR 3 -0.241 18.383 10.805 48 HG22 THR 3 HG22 THR 3 0.625 17.526 9.512 49 HG23 THR 3 HG23 THR 3 1.437 17.892 11.052 50 H GLU 4 H GLU 4 -1.938 19.511 7.631 51 HA GLU 4 HA GLU 4 -3.666 20.419 9.877 52 HB2 GLU 4 HB2 GLU 4 -5.109 21.634 8.292 53 HB3 GLU 4 HB3 GLU 4 -3.492 22.319 8.414 54 HG2 GLU 4 HG2 GLU 4 -2.814 21.330 6.299 55 HG3 GLU 4 HG3 GLU 4 -4.345 20.457 6.159 56 H LEU 5 H LEU 5 -2.837 17.785 8.653 57 HA LEU 5 HA LEU 5 -5.222 16.665 7.440 58 HB2 LEU 5 HB2 LEU 5 -2.595 16.269 7.073 59 HB3 LEU 5 HB3 LEU 5 -2.856 14.980 8.237 60 HG LEU 5 HG LEU 5 -4.364 15.409 5.626 61 HD11 LEU 5 HD11 LEU 5 -2.171 13.411 6.336 62 HD12 LEU 5 HD12 LEU 5 -3.056 13.474 4.799 63 HD13 LEU 5 HD13 LEU 5 -2.002 14.818 5.262 64 HD21 LEU 5 HD21 LEU 5 -5.747 14.116 7.188 65 HD22 LEU 5 HD22 LEU 5 -5.154 13.068 5.898 66 HD23 LEU 5 HD23 LEU 5 -4.394 13.012 7.508 67 H GLU 6 H GLU 6 -6.127 17.538 9.706 68 HA GLU 6 HA GLU 6 -5.996 15.576 11.890 69 HB2 GLU 6 HB2 GLU 6 -5.933 18.133 12.092 70 HB3 GLU 6 HB3 GLU 6 -7.675 18.099 11.822 71 HG2 GLU 6 HG2 GLU 6 -7.897 16.601 13.845 72 HG3 GLU 6 HG3 GLU 6 -6.150 16.650 14.044 73 H TYR 7 H TYR 7 -7.047 14.338 9.664 74 HA TYR 7 HA TYR 7 -9.796 13.585 10.324 75 HB2 TYR 7 HB2 TYR 7 -10.598 14.220 8.081 76 HB3 TYR 7 HB3 TYR 7 -10.176 15.608 9.054 77 HD1 TYR 7 HD1 TYR 7 -8.747 13.374 6.381 78 HD2 TYR 7 HD2 TYR 7 -8.721 17.289 8.176 79 HE1 TYR 7 HE1 TYR 7 -7.561 14.232 4.421 80 HE2 TYR 7 HE2 TYR 7 -7.385 18.140 6.254 81 HH TYR 7 HH TYR 7 -6.493 16.043 3.480 82 H GLU 8 H GLU 8 -10.420 11.683 9.303 83 HA GLU 8 HA GLU 8 -9.192 10.541 7.088 84 HB2 GLU 8 HB2 GLU 8 -8.102 8.597 7.932 85 HB3 GLU 8 HB3 GLU 8 -7.332 10.000 8.622 86 HG2 GLU 8 HG2 GLU 8 -8.686 9.587 10.746 87 HG3 GLU 8 HG3 GLU 8 -9.216 8.065 9.999 88 H SER 9 H SER 9 -10.868 9.504 6.190 89 HA SER 9 HA SER 9 -12.904 8.190 7.949 90 HB2 SER 9 HB2 SER 9 -13.105 9.477 5.266 91 HB3 SER 9 HB3 SER 9 -14.110 8.046 5.569 92 HG SER 9 HG SER 9 -15.034 9.073 7.317 93 H VAL 10 H VAL 10 -12.246 6.240 8.351 94 HA VAL 10 HA VAL 10 -10.467 4.622 6.801 95 HB VAL 10 HB VAL 10 -12.421 3.738 8.968 96 HG11 VAL 10 HG11 VAL 10 -10.717 1.975 9.428 97 HG12 VAL 10 HG12 VAL 10 -11.465 1.784 7.851 98 HG13 VAL 10 HG13 VAL 10 -9.825 2.475 7.971 99 HG21 VAL 10 HG21 VAL 10 -10.563 4.039 10.547 100 HG22 VAL 10 HG22 VAL 10 -9.529 4.670 9.245 101 HG23 VAL 10 HG23 VAL 10 -10.955 5.576 9.792 102 H LEU 11 H LEU 11 -10.674 2.805 5.603 103 HA LEU 11 HA LEU 11 -13.325 2.271 4.305 104 HB2 LEU 11 HB2 LEU 11 -10.627 2.600 2.929 105 HB3 LEU 11 HB3 LEU 11 -12.158 2.186 2.159 106 HG LEU 11 HG LEU 11 -11.559 4.861 3.469 107 HD11 LEU 11 HD11 LEU 11 -10.229 4.611 1.483 108 HD12 LEU 11 HD12 LEU 11 -11.584 3.901 0.584 109 HD13 LEU 11 HD13 LEU 11 -11.628 5.607 1.049 110 HD21 LEU 11 HD21 LEU 11 -13.620 5.606 2.363 111 HD22 LEU 11 HD22 LEU 11 -13.913 3.960 1.747 112 HD23 LEU 11 HD23 LEU 11 -13.987 4.302 3.490 113 H CYS 12 H CYS 12 -9.999 1.066 4.912 114 HA CYS 12 HA CYS 12 -11.065 -1.654 5.312 115 HB2 CYS 12 HB2 CYS 12 -10.429 -1.508 2.879 116 HB3 CYS 12 HB3 CYS 12 -8.766 -1.134 3.391 117 HG CYS 12 HG CYS 12 -8.968 -3.638 2.579 118 H VAL 13 H VAL 13 -10.035 -2.689 6.875 119 HA VAL 13 HA VAL 13 -7.306 -1.857 7.716 120 HB VAL 13 HB VAL 13 -9.654 -2.364 9.569 121 HG11 VAL 13 HG11 VAL 13 -6.711 -1.964 10.279 122 HG12 VAL 13 HG12 VAL 13 -8.061 -1.970 11.431 123 HG13 VAL 13 HG13 VAL 13 -7.662 -3.443 10.548 124 HG21 VAL 13 HG21 VAL 13 -9.500 -0.052 8.661 125 HG22 VAL 13 HG22 VAL 13 -9.159 -0.100 10.394 126 HG23 VAL 13 HG23 VAL 13 -7.822 0.043 9.231 127 H LYS 14 H LYS 14 -5.956 -3.468 7.756 128 HA LYS 14 HA LYS 14 -6.899 -6.257 8.205 129 HB2 LYS 14 HB2 LYS 14 -4.759 -5.476 6.195 130 HB3 LYS 14 HB3 LYS 14 -5.184 -7.114 6.644 131 HG2 LYS 14 HG2 LYS 14 -7.101 -5.154 5.301 132 HG3 LYS 14 HG3 LYS 14 -6.130 -6.366 4.466 133 HD2 LYS 14 HD2 LYS 14 -7.271 -8.169 5.723 134 HD3 LYS 14 HD3 LYS 14 -8.296 -6.957 6.526 135 HE2 LYS 14 HE2 LYS 14 -9.176 -6.237 4.340 136 HE3 LYS 14 HE3 LYS 14 -8.128 -7.409 3.526 137 HZ1 LYS 14 HZ1 LYS 14 -9.295 -9.185 4.735 138 HZ2 LYS 14 HZ2 LYS 14 -10.313 -8.092 5.419 139 HZ3 LYS 14 HZ3 LYS 14 -10.330 -8.328 3.792 140 HA PRO 15 HA PRO 15 -4.026 -5.708 11.490 141 HB2 PRO 15 HB2 PRO 15 -4.019 -8.169 12.645 142 HB3 PRO 15 HB3 PRO 15 -5.456 -7.091 12.659 143 HG2 PRO 15 HG2 PRO 15 -4.843 -9.378 10.747 144 HG3 PRO 15 HG3 PRO 15 -6.367 -9.075 11.650 145 HD2 PRO 15 HD2 PRO 15 -6.058 -8.302 9.065 146 HD3 PRO 15 HD3 PRO 15 -6.955 -7.291 10.239 147 H ASP 16 H ASP 16 -3.136 -7.823 8.895 148 HA ASP 16 HA ASP 16 -0.340 -7.769 9.876 149 HB2 ASP 16 HB2 ASP 16 -1.409 -9.997 10.404 150 HB3 ASP 16 HB3 ASP 16 -1.553 -10.261 8.661 151 H VAL 17 H VAL 17 0.669 -6.588 8.591 152 HA VAL 17 HA VAL 17 0.856 -7.303 5.734 153 HB VAL 17 HB VAL 17 -0.836 -5.477 5.929 154 HG11 VAL 17 HG11 VAL 17 1.520 -3.682 6.655 155 HG12 VAL 17 HG12 VAL 17 -0.150 -3.182 6.335 156 HG13 VAL 17 HG13 VAL 17 0.221 -4.165 7.763 157 HG21 VAL 17 HG21 VAL 17 0.398 -5.860 3.840 158 HG22 VAL 17 HG22 VAL 17 0.023 -4.151 4.074 159 HG23 VAL 17 HG23 VAL 17 1.671 -4.736 4.380 160 H SER 18 H SER 18 2.839 -6.980 4.852 161 HA SER 18 HA SER 18 5.051 -6.275 6.757 162 HB2 SER 18 HB2 SER 18 4.919 -8.461 4.653 163 HB3 SER 18 HB3 SER 18 6.297 -8.111 5.717 164 HG SER 18 HG SER 18 4.920 -9.842 6.468 165 H VAL 19 H VAL 19 6.529 -4.852 6.098 166 HA VAL 19 HA VAL 19 6.451 -3.803 3.324 167 HB VAL 19 HB VAL 19 7.613 -2.687 5.873 168 HG11 VAL 19 HG11 VAL 19 7.847 -1.575 3.035 169 HG12 VAL 19 HG12 VAL 19 8.155 -0.640 4.519 170 HG13 VAL 19 HG13 VAL 19 9.182 -2.015 4.127 171 HG21 VAL 19 HG21 VAL 19 5.100 -2.492 5.363 172 HG22 VAL 19 HG22 VAL 19 5.968 -0.971 5.597 173 HG23 VAL 19 HG23 VAL 19 5.562 -1.508 3.959 174 H TYR 20 H TYR 20 7.904 -3.937 1.908 175 HA TYR 20 HA TYR 20 10.652 -4.791 2.647 176 HB2 TYR 20 HB2 TYR 20 9.628 -5.617 -0.020 177 HB3 TYR 20 HB3 TYR 20 10.836 -6.357 1.024 178 HD1 TYR 20 HD1 TYR 20 10.093 -7.852 2.913 179 HD2 TYR 20 HD2 TYR 20 7.332 -6.233 0.045 180 HE1 TYR 20 HE1 TYR 20 8.399 -9.536 3.613 181 HE2 TYR 20 HE2 TYR 20 5.654 -7.954 0.691 182 HH TYR 20 HH TYR 20 6.294 -10.394 3.235 183 H ARG 21 H ARG 21 12.067 -3.368 2.021 184 HA ARG 21 HA ARG 21 11.452 -1.127 0.215 185 HB2 ARG 21 HB2 ARG 21 14.199 -1.851 1.272 186 HB3 ARG 21 HB3 ARG 21 13.619 -0.280 0.724 187 HG2 ARG 21 HG2 ARG 21 12.800 -1.771 3.246 188 HG3 ARG 21 HG3 ARG 21 13.831 -0.362 3.175 189 HD2 ARG 21 HD2 ARG 21 10.967 -0.204 2.162 190 HD3 ARG 21 HD3 ARG 21 11.298 -0.154 3.876 191 HE ARG 21 HE ARG 21 11.979 1.913 1.891 192 HH11 ARG 21 HH11 ARG 21 12.572 3.913 2.643 193 HH12 ARG 21 HH12 ARG 21 12.986 4.130 4.316 194 HH21 ARG 21 HH21 ARG 21 12.503 0.853 5.238 195 HH22 ARG 21 HH22 ARG 21 12.933 2.467 5.731 196 H ILE 22 H ILE 22 11.375 -1.340 -1.879 197 HA ILE 22 HA ILE 22 12.101 -3.863 -3.036 198 HB ILE 22 HB ILE 22 10.882 -3.058 -5.037 199 HG12 ILE 22 HG12 ILE 22 10.542 -0.461 -3.472 200 HG13 ILE 22 HG13 ILE 22 11.419 -0.684 -4.991 201 HG21 ILE 22 HG21 ILE 22 9.352 -2.589 -2.461 202 HG22 ILE 22 HG22 ILE 22 8.717 -3.175 -4.014 203 HG23 ILE 22 HG23 ILE 22 9.807 -4.189 -3.071 204 HD11 ILE 22 HD11 ILE 22 8.434 -0.891 -4.528 205 HD12 ILE 22 HD12 ILE 22 9.306 0.253 -5.559 206 HD13 ILE 22 HD13 ILE 22 9.219 -1.467 -6.014 207 HA PRO 23 HA PRO 23 15.697 -2.811 -5.524 208 HB2 PRO 23 HB2 PRO 23 15.424 -4.545 -7.635 209 HB3 PRO 23 HB3 PRO 23 15.877 -5.077 -5.986 210 HG2 PRO 23 HG2 PRO 23 13.113 -5.066 -7.251 211 HG3 PRO 23 HG3 PRO 23 13.940 -6.420 -6.411 212 HD2 PRO 23 HD2 PRO 23 12.168 -4.837 -5.125 213 HD3 PRO 23 HD3 PRO 23 13.639 -5.415 -4.295 214 HA PRO 24 HA PRO 24 14.347 0.132 -8.567 215 HB2 PRO 24 HB2 PRO 24 16.267 0.062 -10.539 216 HB3 PRO 24 HB3 PRO 24 16.528 0.754 -8.909 217 HG2 PRO 24 HG2 PRO 24 17.230 -2.038 -9.876 218 HG3 PRO 24 HG3 PRO 24 18.278 -0.875 -9.000 219 HD2 PRO 24 HD2 PRO 24 16.991 -2.842 -7.680 220 HD3 PRO 24 HD3 PRO 24 17.097 -1.207 -6.966 221 H ARG 25 H ARG 25 13.299 0.421 -10.537 222 HA ARG 25 HA ARG 25 12.098 -2.069 -11.624 223 HB2 ARG 25 HB2 ARG 25 10.793 -0.170 -10.507 224 HB3 ARG 25 HB3 ARG 25 11.170 0.804 -11.909 225 HG2 ARG 25 HG2 ARG 25 9.982 -1.612 -12.927 226 HG3 ARG 25 HG3 ARG 25 9.066 -1.186 -11.499 227 HD2 ARG 25 HD2 ARG 25 8.819 1.158 -12.391 228 HD3 ARG 25 HD3 ARG 25 9.679 0.645 -13.850 229 HE ARG 25 HE ARG 25 7.720 -0.227 -14.657 230 HH11 ARG 25 HH11 ARG 25 5.552 -0.691 -14.707 231 HH12 ARG 25 HH12 ARG 25 4.656 -0.714 -13.176 232 HH21 ARG 25 HH21 ARG 25 7.196 0.017 -11.148 233 HH22 ARG 25 HH22 ARG 25 5.482 -0.349 -11.397 234 H ALA 26 H ALA 26 11.815 -2.487 -13.702 235 HA ALA 26 HA ALA 26 11.650 -0.269 -15.512 236 HB1 ALA 26 HB1 ALA 26 13.391 -2.627 -16.351 237 HB2 ALA 26 HB2 ALA 26 12.841 -1.298 -17.405 238 HB3 ALA 26 HB3 ALA 26 13.942 -0.961 -16.055 239 H SER 27 H SER 27 9.830 -0.576 -16.812 240 HA SER 27 HA SER 27 7.965 -2.530 -15.982 241 HB2 SER 27 HB2 SER 27 7.914 -0.650 -18.361 242 HB3 SER 27 HB3 SER 27 6.513 -1.555 -17.747 243 HG SER 27 HG SER 27 6.744 0.640 -16.922 244 H ASN 28 H ASN 28 10.254 -2.769 -18.614 245 HA ASN 28 HA ASN 28 8.924 -5.020 -19.920 246 HB2 ASN 28 HB2 ASN 28 11.019 -5.308 -21.117 247 HB3 ASN 28 HB3 ASN 28 10.515 -3.627 -21.146 248 HD21 ASN 28 HD21 ASN 28 13.501 -2.504 -19.623 249 HD22 ASN 28 HD22 ASN 28 11.980 -2.071 -20.386 250 H ARG 29 H ARG 29 10.447 -4.684 -16.927 251 HA ARG 29 HA ARG 29 10.879 -7.627 -16.564 252 HB2 ARG 29 HB2 ARG 29 11.818 -5.448 -14.695 253 HB3 ARG 29 HB3 ARG 29 12.265 -7.154 -14.746 254 HG2 ARG 29 HG2 ARG 29 13.378 -6.754 -16.966 255 HG3 ARG 29 HG3 ARG 29 12.962 -5.021 -16.820 256 HD2 ARG 29 HD2 ARG 29 14.123 -4.915 -14.666 257 HD3 ARG 29 HD3 ARG 29 14.586 -6.626 -14.840 258 HE ARG 29 HE ARG 29 15.458 -5.292 -17.178 259 HH11 ARG 29 HH11 ARG 29 17.550 -4.649 -17.536 260 HH12 ARG 29 HH12 ARG 29 18.621 -4.381 -16.193 261 HH21 ARG 29 HH21 ARG 29 16.318 -5.177 -13.781 262 HH22 ARG 29 HH22 ARG 29 17.951 -4.673 -14.121 263 H GLY 30 H GLY 30 9.726 -4.737 -14.736 264 HA2 GLY 30 HA2 GLY 30 7.929 -4.383 -13.445 265 HA3 GLY 30 HA3 GLY 30 7.241 -5.960 -13.877 266 H TYR 31 H TYR 31 7.228 -4.830 -11.290 267 HA TYR 31 HA TYR 31 9.085 -6.240 -9.578 268 HB2 TYR 31 HB2 TYR 31 6.297 -5.195 -8.995 269 HB3 TYR 31 HB3 TYR 31 7.541 -5.614 -7.822 270 HD1 TYR 31 HD1 TYR 31 9.879 -4.196 -9.524 271 HD2 TYR 31 HD2 TYR 31 5.935 -3.004 -8.213 272 HE1 TYR 31 HE1 TYR 31 10.688 -1.903 -9.195 273 HE2 TYR 31 HE2 TYR 31 6.708 -0.640 -8.085 274 HH TYR 31 HH TYR 31 10.111 0.295 -8.618 275 H ARG 32 H ARG 32 8.824 -8.308 -8.745 276 HA ARG 32 HA ARG 32 6.431 -9.912 -9.581 277 HB2 ARG 32 HB2 ARG 32 7.912 -11.805 -10.144 278 HB3 ARG 32 HB3 ARG 32 7.991 -10.449 -11.244 279 HG2 ARG 32 HG2 ARG 32 10.047 -10.709 -9.031 280 HG3 ARG 32 HG3 ARG 32 10.178 -11.679 -10.506 281 HD2 ARG 32 HD2 ARG 32 10.141 -9.649 -11.900 282 HD3 ARG 32 HD3 ARG 32 10.017 -8.646 -10.447 283 HE ARG 32 HE ARG 32 12.294 -10.325 -10.194 284 HH11 ARG 32 HH11 ARG 32 14.306 -9.388 -10.230 285 HH12 ARG 32 HH12 ARG 32 14.586 -7.944 -11.171 286 HH21 ARG 32 HH21 ARG 32 11.261 -7.452 -11.942 287 HH22 ARG 32 HH22 ARG 32 12.888 -6.819 -12.029 288 H ALA 33 H ALA 33 7.084 -8.794 -7.031 289 HA ALA 33 HA ALA 33 7.235 -9.188 -4.827 290 HB1 ALA 33 HB1 ALA 33 5.751 -10.945 -4.043 291 HB2 ALA 33 HB2 ALA 33 5.073 -10.100 -5.459 292 HB3 ALA 33 HB3 ALA 33 5.769 -11.710 -5.656 293 H SER 34 H SER 34 8.251 -12.262 -6.402 294 HA SER 34 HA SER 34 9.702 -13.307 -4.247 295 HB2 SER 34 HB2 SER 34 10.107 -13.754 -7.225 296 HB3 SER 34 HB3 SER 34 10.727 -14.798 -5.929 297 HG SER 34 HG SER 34 8.734 -15.565 -6.788 298 H ASP 35 H ASP 35 10.704 -10.744 -6.380 299 HA ASP 35 HA ASP 35 13.569 -11.027 -5.659 300 HB2 ASP 35 HB2 ASP 35 12.004 -9.127 -7.414 301 HB3 ASP 35 HB3 ASP 35 13.651 -8.765 -6.916 302 H TRP 36 H TRP 36 10.872 -9.849 -3.990 303 HA TRP 36 HA TRP 36 12.318 -7.712 -2.562 304 HB2 TRP 36 HB2 TRP 36 9.542 -8.810 -2.069 305 HB3 TRP 36 HB3 TRP 36 10.229 -7.321 -1.479 306 HD1 TRP 36 HD1 TRP 36 11.137 -6.957 -4.917 307 HE1 TRP 36 HE1 TRP 36 9.346 -5.696 -6.284 308 HE3 TRP 36 HE3 TRP 36 7.145 -7.534 -1.776 309 HZ2 TRP 36 HZ2 TRP 36 6.659 -4.784 -5.892 310 HZ3 TRP 36 HZ3 TRP 36 4.995 -6.362 -2.247 311 HH2 TRP 36 HH2 TRP 36 4.749 -4.998 -4.298 312 H LYS 37 H LYS 37 11.986 -7.844 -0.133 313 HA LYS 37 HA LYS 37 13.372 -10.225 0.836 314 HB2 LYS 37 HB2 LYS 37 12.550 -7.667 2.260 315 HB3 LYS 37 HB3 LYS 37 13.516 -8.966 2.955 316 HG2 LYS 37 HG2 LYS 37 15.137 -8.644 0.990 317 HG3 LYS 37 HG3 LYS 37 14.306 -7.097 0.722 318 HD2 LYS 37 HD2 LYS 37 15.834 -8.049 3.165 319 HD3 LYS 37 HD3 LYS 37 16.251 -6.704 2.092 320 HE2 LYS 37 HE2 LYS 37 14.260 -5.455 2.878 321 HE3 LYS 37 HE3 LYS 37 13.797 -6.827 3.902 322 HZ1 LYS 37 HZ1 LYS 37 15.832 -6.520 5.170 323 HZ2 LYS 37 HZ2 LYS 37 16.319 -5.280 4.219 324 HZ3 LYS 37 HZ3 LYS 37 15.002 -5.117 5.171 325 H LEU 38 H LEU 38 11.124 -11.315 0.145 326 HA LEU 38 HA LEU 38 8.899 -11.204 1.866 327 HB2 LEU 38 HB2 LEU 38 9.845 -13.598 0.253 328 HB3 LEU 38 HB3 LEU 38 8.213 -13.321 0.859 329 HG LEU 38 HG LEU 38 9.664 -11.716 -1.271 330 HD11 LEU 38 HD11 LEU 38 7.165 -13.486 -1.308 331 HD12 LEU 38 HD12 LEU 38 7.806 -12.601 -2.698 332 HD13 LEU 38 HD13 LEU 38 8.756 -13.912 -1.981 333 HD21 LEU 38 HD21 LEU 38 8.326 -10.109 -0.082 334 HD22 LEU 38 HD22 LEU 38 7.446 -10.530 -1.552 335 HD23 LEU 38 HD23 LEU 38 6.955 -11.235 0.008 336 H ASP 39 H ASP 39 11.888 -12.756 2.606 337 HA ASP 39 HA ASP 39 10.648 -14.303 4.855 338 HB2 ASP 39 HB2 ASP 39 13.292 -14.628 3.407 339 HB3 ASP 39 HB3 ASP 39 12.874 -15.482 4.891 340 H GLN 40 H GLN 40 12.083 -11.344 4.315 341 HA GLN 40 HA GLN 40 12.697 -10.968 7.151 342 HB2 GLN 40 HB2 GLN 40 14.956 -9.974 6.692 343 HB3 GLN 40 HB3 GLN 40 14.839 -11.714 6.724 344 HG2 GLN 40 HG2 GLN 40 14.903 -10.120 4.139 345 HG3 GLN 40 HG3 GLN 40 16.348 -10.658 4.963 346 HE21 GLN 40 HE21 GLN 40 15.097 -13.179 2.329 347 HE22 GLN 40 HE22 GLN 40 15.087 -11.424 2.250 348 HA PRO 41 HA PRO 41 10.654 -7.368 4.950 349 HB2 PRO 41 HB2 PRO 41 8.830 -6.859 7.019 350 HB3 PRO 41 HB3 PRO 41 8.527 -7.868 5.584 351 HG2 PRO 41 HG2 PRO 41 9.436 -8.755 8.334 352 HG3 PRO 41 HG3 PRO 41 8.150 -9.470 7.307 353 HD2 PRO 41 HD2 PRO 41 10.594 -10.577 7.420 354 HD3 PRO 41 HD3 PRO 41 9.753 -10.454 5.848 355 H ASP 42 H ASP 42 10.920 -5.236 5.360 356 HA ASP 42 HA ASP 42 13.049 -4.445 7.210 357 HB2 ASP 42 HB2 ASP 42 12.746 -3.557 4.887 358 HB3 ASP 42 HB3 ASP 42 11.233 -2.807 5.392 359 H TRP 43 H TRP 43 9.548 -4.328 7.103 360 HA TRP 43 HA TRP 43 9.378 -3.830 9.980 361 HB2 TRP 43 HB2 TRP 43 9.481 -1.527 9.266 362 HB3 TRP 43 HB3 TRP 43 8.356 -1.814 7.952 363 HD1 TRP 43 HD1 TRP 43 8.456 -0.992 11.636 364 HE1 TRP 43 HE1 TRP 43 6.088 -0.406 12.442 365 HE3 TRP 43 HE3 TRP 43 5.813 -2.607 7.580 366 HZ2 TRP 43 HZ2 TRP 43 3.407 -0.432 11.351 367 HZ3 TRP 43 HZ3 TRP 43 3.351 -2.204 7.437 368 HH2 TRP 43 HH2 TRP 43 2.141 -1.150 9.326 369 H THR 44 H THR 44 7.262 -4.387 10.835 370 HA THR 44 HA THR 44 5.211 -5.311 8.911 371 HB THR 44 HB THR 44 4.695 -7.293 10.233 372 HG1 THR 44 HG1 THR 44 6.239 -8.055 11.721 373 HG21 THR 44 HG21 THR 44 7.586 -7.394 9.337 374 HG22 THR 44 HG22 THR 44 6.420 -8.740 9.447 375 HG23 THR 44 HG23 THR 44 6.173 -7.456 8.260 376 H GLY 45 H GLY 45 3.097 -5.246 9.623 377 HA2 GLY 45 HA2 GLY 45 2.243 -4.504 12.273 378 HA3 GLY 45 HA3 GLY 45 2.466 -3.061 11.299 379 H ARG 46 H ARG 46 0.408 -2.433 11.108 380 HA ARG 46 HA ARG 46 -1.667 -4.226 9.903 381 HB2 ARG 46 HB2 ARG 46 -2.197 -1.649 11.412 382 HB3 ARG 46 HB3 ARG 46 -3.347 -2.900 10.950 383 HG2 ARG 46 HG2 ARG 46 -2.118 -4.460 12.557 384 HG3 ARG 46 HG3 ARG 46 -1.209 -3.040 13.102 385 HD2 ARG 46 HD2 ARG 46 -4.246 -3.274 13.175 386 HD3 ARG 46 HD3 ARG 46 -3.182 -3.646 14.527 387 HE ARG 46 HE ARG 46 -3.286 -0.915 13.258 388 HH11 ARG 46 HH11 ARG 46 -3.447 0.821 14.535 389 HH12 ARG 46 HH12 ARG 46 -3.545 0.636 16.274 390 HH21 ARG 46 HH21 ARG 46 -3.427 -2.790 16.238 391 HH22 ARG 46 HH22 ARG 46 -3.496 -1.351 17.209 392 H LEU 47 H LEU 47 -3.016 -3.430 8.381 393 HA LEU 47 HA LEU 47 -2.205 -1.095 6.718 394 HB2 LEU 47 HB2 LEU 47 -2.678 -3.273 5.604 395 HB3 LEU 47 HB3 LEU 47 -4.242 -3.331 6.411 396 HG LEU 47 HG LEU 47 -4.904 -1.221 5.141 397 HD11 LEU 47 HD11 LEU 47 -3.642 -0.746 3.077 398 HD12 LEU 47 HD12 LEU 47 -2.641 -0.440 4.503 399 HD13 LEU 47 HD13 LEU 47 -2.397 -1.920 3.548 400 HD21 LEU 47 HD21 LEU 47 -4.213 -3.724 3.595 401 HD22 LEU 47 HD22 LEU 47 -5.694 -3.431 4.529 402 HD23 LEU 47 HD23 LEU 47 -5.377 -2.478 3.084 403 H ARG 48 H ARG 48 -3.392 0.779 6.770 404 HA ARG 48 HA ARG 48 -6.281 0.640 7.429 405 HB2 ARG 48 HB2 ARG 48 -5.149 1.422 9.503 406 HB3 ARG 48 HB3 ARG 48 -4.405 2.746 8.603 407 HG2 ARG 48 HG2 ARG 48 -6.714 3.570 8.008 408 HG3 ARG 48 HG3 ARG 48 -7.405 2.301 9.011 409 HD2 ARG 48 HD2 ARG 48 -5.641 4.617 9.899 410 HD3 ARG 48 HD3 ARG 48 -7.369 4.459 10.192 411 HE ARG 48 HE ARG 48 -5.212 3.351 11.737 412 HH11 ARG 48 HH11 ARG 48 -5.413 1.870 13.246 413 HH12 ARG 48 HH12 ARG 48 -6.995 1.253 13.711 414 HH21 ARG 48 HH21 ARG 48 -8.607 2.801 11.081 415 HH22 ARG 48 HH22 ARG 48 -8.776 1.743 12.457 416 H ILE 49 H ILE 49 -6.952 0.877 5.410 417 HA ILE 49 HA ILE 49 -5.963 3.090 3.700 418 HB ILE 49 HB ILE 49 -8.317 1.264 3.132 419 HG12 ILE 49 HG12 ILE 49 -5.385 0.924 2.344 420 HG13 ILE 49 HG13 ILE 49 -6.331 -0.136 3.398 421 HG21 ILE 49 HG21 ILE 49 -7.969 2.053 0.811 422 HG22 ILE 49 HG22 ILE 49 -8.220 3.421 1.883 423 HG23 ILE 49 HG23 ILE 49 -6.573 3.023 1.335 424 HD11 ILE 49 HD11 ILE 49 -7.893 -0.530 1.417 425 HD12 ILE 49 HD12 ILE 49 -6.623 0.212 0.409 426 HD13 ILE 49 HD13 ILE 49 -6.283 -1.246 1.353 427 H THR 50 H THR 50 -6.860 5.009 3.635 428 HA THR 50 HA THR 50 -9.504 5.596 4.865 429 HB THR 50 HB THR 50 -8.282 7.705 5.809 430 HG1 THR 50 HG1 THR 50 -6.121 5.996 5.342 431 HG21 THR 50 HG21 THR 50 -8.104 4.944 6.989 432 HG22 THR 50 HG22 THR 50 -7.398 6.337 7.830 433 HG23 THR 50 HG23 THR 50 -9.124 6.321 7.457 434 H SER 51 H SER 51 -10.439 7.686 4.071 435 HA SER 51 HA SER 51 -8.948 9.172 2.015 436 HB2 SER 51 HB2 SER 51 -9.972 7.257 0.732 437 HB3 SER 51 HB3 SER 51 -11.568 7.852 1.240 438 HG SER 51 HG SER 51 -10.977 8.659 -0.798 439 H LYS 52 H LYS 52 -9.414 11.170 1.861 440 HA LYS 52 HA LYS 52 -11.998 12.303 2.700 441 HB2 LYS 52 HB2 LYS 52 -9.417 12.842 4.143 442 HB3 LYS 52 HB3 LYS 52 -10.688 14.063 4.081 443 HG2 LYS 52 HG2 LYS 52 -10.993 11.281 5.270 444 HG3 LYS 52 HG3 LYS 52 -10.709 12.759 6.159 445 HD2 LYS 52 HD2 LYS 52 -12.905 13.634 5.032 446 HD3 LYS 52 HD3 LYS 52 -13.227 11.900 4.776 447 HE2 LYS 52 HE2 LYS 52 -12.679 11.572 7.260 448 HE3 LYS 52 HE3 LYS 52 -12.617 13.332 7.413 449 HZ1 LYS 52 HZ1 LYS 52 -14.804 12.573 8.011 450 HZ2 LYS 52 HZ2 LYS 52 -14.986 13.303 6.556 451 HZ3 LYS 52 HZ3 LYS 52 -14.944 11.655 6.677 452 H GLY 53 H GLY 53 -12.558 13.743 1.335 453 HA2 GLY 53 HA2 GLY 53 -12.551 15.661 0.023 454 HA3 GLY 53 HA3 GLY 53 -10.890 15.955 0.538 455 H LYS 54 H LYS 54 -12.081 13.144 -1.262 456 HA LYS 54 HA LYS 54 -11.472 12.126 -3.173 457 HB2 LYS 54 HB2 LYS 54 -10.849 14.815 -4.426 458 HB3 LYS 54 HB3 LYS 54 -11.093 13.284 -5.226 459 HG2 LYS 54 HG2 LYS 54 -13.096 14.253 -5.628 460 HG3 LYS 54 HG3 LYS 54 -13.467 13.260 -4.231 461 HD2 LYS 54 HD2 LYS 54 -14.545 15.471 -4.161 462 HD3 LYS 54 HD3 LYS 54 -13.464 15.263 -2.785 463 HE2 LYS 54 HE2 LYS 54 -11.740 16.636 -3.907 464 HE3 LYS 54 HE3 LYS 54 -12.744 16.742 -5.360 465 HZ1 LYS 54 HZ1 LYS 54 -12.958 18.729 -3.985 466 HZ2 LYS 54 HZ2 LYS 54 -14.396 17.964 -4.049 467 HZ3 LYS 54 HZ3 LYS 54 -13.473 17.864 -2.702 468 H THR 55 H THR 55 -9.558 12.596 -1.062 469 HA THR 55 HA THR 55 -7.164 11.667 -2.572 470 HB THR 55 HB THR 55 -7.055 13.382 -0.067 471 HG1 THR 55 HG1 THR 55 -6.245 14.962 -1.430 472 HG21 THR 55 HG21 THR 55 -4.634 13.461 -0.571 473 HG22 THR 55 HG22 THR 55 -5.173 11.802 -0.286 474 HG23 THR 55 HG23 THR 55 -4.884 12.362 -1.950 475 H ALA 56 H ALA 56 -6.797 9.646 -2.065 476 HA ALA 56 HA ALA 56 -7.782 8.473 0.471 477 HB1 ALA 56 HB1 ALA 56 -7.223 6.325 -0.538 478 HB2 ALA 56 HB2 ALA 56 -8.311 7.262 -1.579 479 HB3 ALA 56 HB3 ALA 56 -6.576 7.151 -1.972 480 H TYR 57 H TYR 57 -6.348 7.238 1.787 481 HA TYR 57 HA TYR 57 -3.447 7.814 1.573 482 HB2 TYR 57 HB2 TYR 57 -4.978 8.094 4.162 483 HB3 TYR 57 HB3 TYR 57 -3.284 8.422 3.882 484 HD1 TYR 57 HD1 TYR 57 -2.611 10.472 2.627 485 HD2 TYR 57 HD2 TYR 57 -6.721 9.674 3.634 486 HE1 TYR 57 HE1 TYR 57 -3.180 12.855 2.174 487 HE2 TYR 57 HE2 TYR 57 -7.298 12.061 3.173 488 HH TYR 57 HH TYR 57 -4.824 14.449 2.157 489 H ILE 58 H ILE 58 -2.532 5.829 1.448 490 HA ILE 58 HA ILE 58 -3.644 3.535 3.019 491 HB ILE 58 HB ILE 58 -1.270 3.656 1.128 492 HG12 ILE 58 HG12 ILE 58 -2.670 1.982 -0.191 493 HG13 ILE 58 HG13 ILE 58 -4.062 2.498 0.757 494 HG21 ILE 58 HG21 ILE 58 -0.940 1.990 2.940 495 HG22 ILE 58 HG22 ILE 58 -2.524 1.282 2.560 496 HG23 ILE 58 HG23 ILE 58 -1.182 1.215 1.390 497 HD11 ILE 58 HD11 ILE 58 -3.779 3.534 -1.540 498 HD12 ILE 58 HD12 ILE 58 -3.940 4.723 -0.245 499 HD13 ILE 58 HD13 ILE 58 -2.333 4.363 -0.939 500 H LYS 59 H LYS 59 -3.438 4.256 5.110 501 HA LYS 59 HA LYS 59 -0.735 4.982 6.096 502 HB2 LYS 59 HB2 LYS 59 -3.319 4.703 7.662 503 HB3 LYS 59 HB3 LYS 59 -1.802 5.438 8.195 504 HG2 LYS 59 HG2 LYS 59 -2.080 7.110 6.259 505 HG3 LYS 59 HG3 LYS 59 -3.706 6.448 6.036 506 HD2 LYS 59 HD2 LYS 59 -4.203 7.026 8.444 507 HD3 LYS 59 HD3 LYS 59 -2.611 7.821 8.523 508 HE2 LYS 59 HE2 LYS 59 -3.314 9.277 6.582 509 HE3 LYS 59 HE3 LYS 59 -4.915 8.515 6.645 510 HZ1 LYS 59 HZ1 LYS 59 -3.666 10.138 8.798 511 HZ2 LYS 59 HZ2 LYS 59 -4.980 10.550 7.911 512 HZ3 LYS 59 HZ3 LYS 59 -5.063 9.312 8.989 513 H LEU 60 H LEU 60 0.569 3.763 7.263 514 HA LEU 60 HA LEU 60 -0.143 0.918 7.872 515 HB2 LEU 60 HB2 LEU 60 2.272 2.275 6.735 516 HB3 LEU 60 HB3 LEU 60 2.580 1.041 7.945 517 HG LEU 60 HG LEU 60 1.439 -0.650 6.702 518 HD11 LEU 60 HD11 LEU 60 -0.342 0.544 5.538 519 HD12 LEU 60 HD12 LEU 60 0.844 1.506 4.625 520 HD13 LEU 60 HD13 LEU 60 0.681 -0.242 4.338 521 HD21 LEU 60 HD21 LEU 60 3.822 -0.104 6.200 522 HD22 LEU 60 HD22 LEU 60 2.982 -0.809 4.819 523 HD23 LEU 60 HD23 LEU 60 3.289 0.941 4.868 524 H GLU 61 H GLU 61 -0.003 0.195 9.920 525 HA GLU 61 HA GLU 61 0.963 2.100 12.027 526 HB2 GLU 61 HB2 GLU 61 -1.593 0.471 11.993 527 HB3 GLU 61 HB3 GLU 61 -0.963 1.333 13.405 528 HG2 GLU 61 HG2 GLU 61 -1.092 3.471 12.122 529 HG3 GLU 61 HG3 GLU 61 -1.852 2.593 10.783 530 H ASP 62 H ASP 62 1.716 1.268 14.017 531 HA ASP 62 HA ASP 62 2.815 -1.461 13.919 532 HB2 ASP 62 HB2 ASP 62 3.999 0.466 14.993 533 HB3 ASP 62 HB3 ASP 62 2.669 0.563 16.171 534 H LYS 63 H LYS 63 1.785 -3.244 14.676 535 HA LYS 63 HA LYS 63 -0.962 -2.910 15.474 536 HB2 LYS 63 HB2 LYS 63 -1.190 -5.279 15.172 537 HB3 LYS 63 HB3 LYS 63 -0.056 -4.741 13.928 538 HG2 LYS 63 HG2 LYS 63 1.850 -5.479 15.352 539 HG3 LYS 63 HG3 LYS 63 0.686 -6.040 16.573 540 HD2 LYS 63 HD2 LYS 63 1.282 -7.971 15.393 541 HD3 LYS 63 HD3 LYS 63 -0.334 -7.530 14.820 542 HE2 LYS 63 HE2 LYS 63 1.044 -6.224 12.940 543 HE3 LYS 63 HE3 LYS 63 2.355 -7.296 13.441 544 HZ1 LYS 63 HZ1 LYS 63 1.159 -8.437 11.689 545 HZ2 LYS 63 HZ2 LYS 63 0.680 -9.164 13.058 546 HZ3 LYS 63 HZ3 LYS 63 -0.297 -8.051 12.338 547 H VAL 64 H VAL 64 1.667 -2.764 17.424 548 HA VAL 64 HA VAL 64 0.245 -4.034 19.714 549 HB VAL 64 HB VAL 64 3.215 -3.510 19.316 550 HG11 VAL 64 HG11 VAL 64 1.745 -5.090 21.474 551 HG12 VAL 64 HG12 VAL 64 3.510 -5.017 21.275 552 HG13 VAL 64 HG13 VAL 64 2.618 -3.557 21.704 553 HG21 VAL 64 HG21 VAL 64 2.573 -5.269 17.778 554 HG22 VAL 64 HG22 VAL 64 3.411 -6.006 19.137 555 HG23 VAL 64 HG23 VAL 64 1.638 -6.102 19.045 556 H SER 65 H SER 65 2.049 -1.162 18.638 557 HA SER 65 HA SER 65 1.277 0.243 21.163 558 HB2 SER 65 HB2 SER 65 3.471 0.765 19.144 559 HB3 SER 65 HB3 SER 65 3.088 1.837 20.508 560 HG SER 65 HG SER 65 4.761 0.334 21.015 561 H GLY 66 H GLY 66 0.477 0.201 17.768 562 HA2 GLY 66 HA2 GLY 66 -1.126 1.428 16.664 563 HA3 GLY 66 HA3 GLY 66 -1.459 2.348 18.138 564 H GLU 67 H GLU 67 1.822 2.208 16.997 565 HA GLU 67 HA GLU 67 2.106 5.036 16.533 566 HB2 GLU 67 HB2 GLU 67 3.851 2.748 15.544 567 HB3 GLU 67 HB3 GLU 67 4.323 4.437 15.655 568 HG2 GLU 67 HG2 GLU 67 3.696 2.547 17.938 569 HG3 GLU 67 HG3 GLU 67 5.287 3.115 17.450 570 H LEU 68 H LEU 68 2.721 6.007 14.506 571 HA LEU 68 HA LEU 68 1.495 4.793 12.057 572 HB2 LEU 68 HB2 LEU 68 0.750 7.093 12.632 573 HB3 LEU 68 HB3 LEU 68 2.425 7.638 12.585 574 HG LEU 68 HG LEU 68 2.505 6.940 10.134 575 HD11 LEU 68 HD11 LEU 68 0.561 5.393 10.101 576 HD12 LEU 68 HD12 LEU 68 -0.522 6.742 10.487 577 HD13 LEU 68 HD13 LEU 68 0.361 6.706 8.943 578 HD21 LEU 68 HD21 LEU 68 1.262 8.915 9.352 579 HD22 LEU 68 HD22 LEU 68 0.427 9.024 10.919 580 HD23 LEU 68 HD23 LEU 68 2.183 9.281 10.820 581 H PHE 69 H PHE 69 2.858 3.701 10.781 582 HA PHE 69 HA PHE 69 5.796 4.060 10.988 583 HB2 PHE 69 HB2 PHE 69 5.052 1.807 10.909 584 HB3 PHE 69 HB3 PHE 69 3.999 2.105 9.535 585 HD1 PHE 69 HD1 PHE 69 7.624 2.122 10.529 586 HD2 PHE 69 HD2 PHE 69 4.771 1.752 7.313 587 HE1 PHE 69 HE1 PHE 69 9.462 1.545 8.960 588 HE2 PHE 69 HE2 PHE 69 6.617 1.232 5.743 589 HZ PHE 69 HZ PHE 69 8.962 1.104 6.564 590 H ALA 70 H ALA 70 3.321 4.178 8.387 591 HA ALA 70 HA ALA 70 4.644 6.443 7.090 592 HB1 ALA 70 HB1 ALA 70 4.414 3.743 5.669 593 HB2 ALA 70 HB2 ALA 70 5.043 5.261 4.988 594 HB3 ALA 70 HB3 ALA 70 5.930 4.446 6.277 595 H GLN 71 H GLN 71 3.415 7.148 5.146 596 HA GLN 71 HA GLN 71 0.657 6.159 4.861 597 HB2 GLN 71 HB2 GLN 71 -0.207 8.527 4.911 598 HB3 GLN 71 HB3 GLN 71 0.205 7.827 6.476 599 HG2 GLN 71 HG2 GLN 71 1.998 9.240 6.834 600 HG3 GLN 71 HG3 GLN 71 2.368 9.412 5.130 601 HE21 GLN 71 HE21 GLN 71 0.938 12.598 5.114 602 HE22 GLN 71 HE22 GLN 71 2.285 11.540 4.664 603 H ALA 72 H ALA 72 0.036 6.135 2.757 604 HA ALA 72 HA ALA 72 1.579 7.786 0.776 605 HB1 ALA 72 HB1 ALA 72 2.002 5.439 0.490 606 HB2 ALA 72 HB2 ALA 72 0.265 5.081 0.452 607 HB3 ALA 72 HB3 ALA 72 1.006 6.031 -0.847 608 HA PRO 73 HA PRO 73 -2.475 9.857 0.242 609 HB2 PRO 73 HB2 PRO 73 -0.505 11.728 -1.047 610 HB3 PRO 73 HB3 PRO 73 -1.935 12.107 -0.044 611 HG2 PRO 73 HG2 PRO 73 0.597 12.234 0.953 612 HG3 PRO 73 HG3 PRO 73 -0.758 11.622 1.950 613 HD2 PRO 73 HD2 PRO 73 1.377 10.051 0.515 614 HD3 PRO 73 HD3 PRO 73 0.626 9.766 2.107 615 H VAL 74 H VAL 74 -3.677 9.610 -1.553 616 HA VAL 74 HA VAL 74 -2.456 9.267 -4.251 617 HB VAL 74 HB VAL 74 -4.826 7.597 -3.359 618 HG11 VAL 74 HG11 VAL 74 -2.720 7.153 -5.502 619 HG12 VAL 74 HG12 VAL 74 -4.137 6.130 -5.181 620 HG13 VAL 74 HG13 VAL 74 -4.361 7.786 -5.747 621 HG21 VAL 74 HG21 VAL 74 -3.174 6.905 -1.754 622 HG22 VAL 74 HG22 VAL 74 -3.385 5.657 -2.973 623 HG23 VAL 74 HG23 VAL 74 -1.946 6.704 -3.026 624 H GLU 75 H GLU 75 -3.512 10.556 -5.765 625 HA GLU 75 HA GLU 75 -5.988 11.963 -4.931 626 HB2 GLU 75 HB2 GLU 75 -4.192 12.276 -7.360 627 HB3 GLU 75 HB3 GLU 75 -5.612 13.270 -7.010 628 HG2 GLU 75 HG2 GLU 75 -4.584 13.968 -4.847 629 HG3 GLU 75 HG3 GLU 75 -3.132 13.050 -5.251 630 H GLN 76 H GLN 76 -5.187 9.300 -7.034 631 HA GLN 76 HA GLN 76 -7.940 8.617 -7.405 632 HB2 GLN 76 HB2 GLN 76 -7.611 8.496 -10.027 633 HB3 GLN 76 HB3 GLN 76 -8.279 9.903 -9.232 634 HG2 GLN 76 HG2 GLN 76 -6.739 10.527 -11.016 635 HG3 GLN 76 HG3 GLN 76 -6.225 11.151 -9.466 636 HE21 GLN 76 HE21 GLN 76 -3.029 9.672 -9.797 637 HE22 GLN 76 HE22 GLN 76 -4.037 10.857 -8.988 638 H TYR 77 H TYR 77 -8.224 6.491 -8.230 639 HA TYR 77 HA TYR 77 -5.755 4.856 -8.480 640 HB2 TYR 77 HB2 TYR 77 -6.676 4.703 -6.205 641 HB3 TYR 77 HB3 TYR 77 -8.220 4.172 -6.881 642 HD1 TYR 77 HD1 TYR 77 -4.592 3.290 -6.726 643 HD2 TYR 77 HD2 TYR 77 -8.620 1.884 -7.339 644 HE1 TYR 77 HE1 TYR 77 -3.757 0.954 -6.900 645 HE2 TYR 77 HE2 TYR 77 -7.787 -0.468 -7.418 646 HH TYR 77 HH TYR 77 -4.301 -1.251 -7.160 647 HA PRO 78 HA PRO 78 -5.022 2.869 -9.434 648 HB2 PRO 78 HB2 PRO 78 -4.902 2.588 -12.421 649 HB3 PRO 78 HB3 PRO 78 -4.249 1.508 -11.148 650 HG2 PRO 78 HG2 PRO 78 -6.531 0.840 -12.436 651 HG3 PRO 78 HG3 PRO 78 -6.438 0.656 -10.650 652 HD2 PRO 78 HD2 PRO 78 -7.634 2.961 -12.234 653 HD3 PRO 78 HD3 PRO 78 -8.356 2.036 -10.883 654 H GLY 79 H GLY 79 -3.090 4.007 -9.536 655 HA2 GLY 79 HA2 GLY 79 -2.731 6.384 -11.255 656 HA3 GLY 79 HA3 GLY 79 -3.030 6.695 -9.548 657 H ILE 80 H ILE 80 -0.954 7.703 -9.454 658 HA ILE 80 HA ILE 80 1.465 6.189 -10.082 659 HB ILE 80 HB ILE 80 1.422 8.421 -10.721 660 HG12 ILE 80 HG12 ILE 80 3.571 7.427 -9.606 661 HG13 ILE 80 HG13 ILE 80 3.495 9.093 -10.153 662 HG21 ILE 80 HG21 ILE 80 0.798 9.287 -7.871 663 HG22 ILE 80 HG22 ILE 80 1.257 10.372 -9.201 664 HG23 ILE 80 HG23 ILE 80 -0.235 9.454 -9.309 665 HD11 ILE 80 HD11 ILE 80 3.229 8.216 -7.250 666 HD12 ILE 80 HD12 ILE 80 4.660 8.909 -8.038 667 HD13 ILE 80 HD13 ILE 80 3.206 9.891 -7.849 668 H ALA 81 H ALA 81 -0.141 7.152 -7.057 669 HA ALA 81 HA ALA 81 2.170 6.313 -5.434 670 HB1 ALA 81 HB1 ALA 81 -0.535 7.463 -4.680 671 HB2 ALA 81 HB2 ALA 81 0.841 7.228 -3.583 672 HB3 ALA 81 HB3 ALA 81 0.966 8.379 -4.925 673 H VAL 82 H VAL 82 0.237 4.360 -6.968 674 HA VAL 82 HA VAL 82 0.434 2.245 -4.959 675 HB VAL 82 HB VAL 82 -2.231 2.740 -6.283 676 HG11 VAL 82 HG11 VAL 82 -1.344 0.848 -4.045 677 HG12 VAL 82 HG12 VAL 82 -3.015 1.028 -4.602 678 HG13 VAL 82 HG13 VAL 82 -1.788 0.370 -5.690 679 HG21 VAL 82 HG21 VAL 82 -2.045 4.518 -4.667 680 HG22 VAL 82 HG22 VAL 82 -3.197 3.315 -4.105 681 HG23 VAL 82 HG23 VAL 82 -1.572 3.368 -3.394 682 H GLU 83 H GLU 83 1.011 0.393 -5.938 683 HA GLU 83 HA GLU 83 0.508 -0.130 -8.821 684 HB2 GLU 83 HB2 GLU 83 3.020 0.828 -7.658 685 HB3 GLU 83 HB3 GLU 83 3.257 -0.783 -8.312 686 HG2 GLU 83 HG2 GLU 83 1.875 1.392 -9.915 687 HG3 GLU 83 HG3 GLU 83 3.633 1.246 -9.847 688 H THR 84 H THR 84 1.236 -2.304 -9.500 689 HA THR 84 HA THR 84 0.837 -4.393 -7.347 690 HB THR 84 HB THR 84 -0.243 -5.741 -9.040 691 HG1 THR 84 HG1 THR 84 -0.704 -4.890 -11.070 692 HG21 THR 84 HG21 THR 84 -1.672 -4.168 -7.772 693 HG22 THR 84 HG22 THR 84 -1.472 -2.945 -9.046 694 HG23 THR 84 HG23 THR 84 -2.309 -4.479 -9.386 695 H VAL 85 H VAL 85 1.790 -6.475 -7.757 696 HA VAL 85 HA VAL 85 4.323 -6.471 -9.298 697 HB VAL 85 HB VAL 85 4.762 -8.604 -8.267 698 HG11 VAL 85 HG11 VAL 85 5.303 -6.512 -7.040 699 HG12 VAL 85 HG12 VAL 85 3.770 -6.648 -6.157 700 HG13 VAL 85 HG13 VAL 85 5.016 -7.885 -5.962 701 HG21 VAL 85 HG21 VAL 85 3.279 -9.630 -6.648 702 HG22 VAL 85 HG22 VAL 85 2.074 -8.347 -6.870 703 HG23 VAL 85 HG23 VAL 85 2.431 -9.486 -8.177 704 H THR 86 H THR 86 4.671 -8.628 -10.541 705 HA THR 86 HA THR 86 2.428 -9.091 -12.410 706 HB THR 86 HB THR 86 4.111 -10.156 -13.807 707 HG1 THR 86 HG1 THR 86 6.238 -10.273 -13.092 708 HG21 THR 86 HG21 THR 86 3.977 -7.656 -13.798 709 HG22 THR 86 HG22 THR 86 5.259 -7.617 -12.574 710 HG23 THR 86 HG23 THR 86 5.608 -8.259 -14.188 711 H ASP 87 H ASP 87 4.246 -10.891 -9.983 712 HA ASP 87 HA ASP 87 3.417 -13.468 -11.027 713 HB2 ASP 87 HB2 ASP 87 5.677 -12.979 -10.124 714 HB3 ASP 87 HB3 ASP 87 4.964 -12.789 -8.516 715 H SER 88 H SER 88 2.692 -11.666 -8.016 716 HA SER 88 HA SER 88 0.296 -13.436 -7.615 717 HB2 SER 88 HB2 SER 88 2.071 -14.496 -6.362 718 HB3 SER 88 HB3 SER 88 2.407 -12.987 -5.494 719 HG SER 88 HG SER 88 0.950 -14.579 -4.443 720 H SER 89 H SER 89 -1.507 -12.394 -7.124 721 HA SER 89 HA SER 89 -1.563 -9.584 -6.938 722 HB2 SER 89 HB2 SER 89 -3.909 -11.225 -6.026 723 HB3 SER 89 HB3 SER 89 -3.885 -9.735 -6.966 724 HG SER 89 HG SER 89 -3.068 -10.935 -8.731 725 H ARG 90 H ARG 90 -0.686 -11.531 -4.357 726 HA ARG 90 HA ARG 90 -1.999 -9.908 -2.299 727 HB2 ARG 90 HB2 ARG 90 -1.475 -11.461 -0.719 728 HB3 ARG 90 HB3 ARG 90 -1.850 -12.402 -2.157 729 HG2 ARG 90 HG2 ARG 90 0.601 -12.619 -2.609 730 HG3 ARG 90 HG3 ARG 90 0.921 -11.769 -1.080 731 HD2 ARG 90 HD2 ARG 90 -0.326 -13.553 0.138 732 HD3 ARG 90 HD3 ARG 90 -0.508 -14.425 -1.402 733 HE ARG 90 HE ARG 90 2.247 -13.666 -0.650 734 HH11 ARG 90 HH11 ARG 90 3.754 -15.159 -0.427 735 HH12 ARG 90 HH12 ARG 90 3.343 -16.846 -0.217 736 HH21 ARG 90 HH21 ARG 90 -0.054 -16.311 -0.449 737 HH22 ARG 90 HH22 ARG 90 1.213 -17.487 -0.244 738 H TYR 91 H TYR 91 0.151 -8.783 -4.173 739 HA TYR 91 HA TYR 91 1.782 -7.512 -2.063 740 HB2 TYR 91 HB2 TYR 91 2.818 -8.773 -4.615 741 HB3 TYR 91 HB3 TYR 91 3.764 -7.797 -3.517 742 HD1 TYR 91 HD1 TYR 91 4.230 -8.617 -1.188 743 HD2 TYR 91 HD2 TYR 91 2.464 -11.127 -4.213 744 HE1 TYR 91 HE1 TYR 91 4.772 -10.634 0.171 745 HE2 TYR 91 HE2 TYR 91 3.126 -13.150 -2.919 746 HH TYR 91 HH TYR 91 4.723 -12.915 0.283 747 H PHE 92 H PHE 92 2.067 -5.390 -2.352 748 HA PHE 92 HA PHE 92 1.481 -4.100 -4.975 749 HB2 PHE 92 HB2 PHE 92 0.362 -3.224 -2.282 750 HB3 PHE 92 HB3 PHE 92 0.188 -2.350 -3.791 751 HD1 PHE 92 HD1 PHE 92 -1.142 -4.987 -1.710 752 HD2 PHE 92 HD2 PHE 92 -1.107 -3.409 -5.708 753 HE1 PHE 92 HE1 PHE 92 -3.197 -6.254 -2.223 754 HE2 PHE 92 HE2 PHE 92 -3.132 -4.765 -6.253 755 HZ PHE 92 HZ PHE 92 -4.167 -6.188 -4.531 756 H VAL 93 H VAL 93 2.289 -1.899 -5.097 757 HA VAL 93 HA VAL 93 4.407 -1.190 -3.106 758 HB VAL 93 HB VAL 93 4.427 -0.733 -6.107 759 HG11 VAL 93 HG11 VAL 93 6.378 0.357 -4.038 760 HG12 VAL 93 HG12 VAL 93 6.571 0.432 -5.802 761 HG13 VAL 93 HG13 VAL 93 5.251 1.307 -5.032 762 HG21 VAL 93 HG21 VAL 93 5.219 -2.928 -5.500 763 HG22 VAL 93 HG22 VAL 93 6.634 -1.944 -5.882 764 HG23 VAL 93 HG23 VAL 93 6.234 -2.270 -4.196 765 H ILE 94 H ILE 94 4.347 0.960 -2.328 766 HA ILE 94 HA ILE 94 2.365 2.747 -3.603 767 HB ILE 94 HB ILE 94 1.510 3.576 -1.540 768 HG12 ILE 94 HG12 ILE 94 3.365 2.761 -0.003 769 HG13 ILE 94 HG13 ILE 94 1.722 2.679 0.597 770 HG21 ILE 94 HG21 ILE 94 0.178 2.024 -2.769 771 HG22 ILE 94 HG22 ILE 94 0.894 0.635 -1.944 772 HG23 ILE 94 HG23 ILE 94 -0.102 1.800 -1.040 773 HD11 ILE 94 HD11 ILE 94 3.315 0.286 -0.423 774 HD12 ILE 94 HD12 ILE 94 3.013 0.719 1.267 775 HD13 ILE 94 HD13 ILE 94 1.665 0.245 0.230 776 H ARG 95 H ARG 95 2.683 4.927 -3.394 777 HA ARG 95 HA ARG 95 5.487 5.713 -2.730 778 HB2 ARG 95 HB2 ARG 95 4.499 6.468 -4.928 779 HB3 ARG 95 HB3 ARG 95 3.389 7.488 -4.012 780 HG2 ARG 95 HG2 ARG 95 5.339 8.631 -2.939 781 HG3 ARG 95 HG3 ARG 95 6.439 7.624 -3.900 782 HD2 ARG 95 HD2 ARG 95 5.538 8.574 -5.965 783 HD3 ARG 95 HD3 ARG 95 4.334 9.502 -5.043 784 HE ARG 95 HE ARG 95 7.060 10.091 -4.201 785 HH11 ARG 95 HH11 ARG 95 7.918 12.009 -4.545 786 HH12 ARG 95 HH12 ARG 95 7.315 13.081 -5.794 787 HH21 ARG 95 HH21 ARG 95 4.763 10.961 -6.714 788 HH22 ARG 95 HH22 ARG 95 5.542 12.494 -6.989 789 H ILE 96 H ILE 96 5.508 5.637 -0.527 790 HA ILE 96 HA ILE 96 3.538 7.104 1.064 791 HB ILE 96 HB ILE 96 4.774 6.617 3.016 792 HG12 ILE 96 HG12 ILE 96 6.762 4.796 2.538 793 HG13 ILE 96 HG13 ILE 96 7.014 5.864 1.171 794 HG21 ILE 96 HG21 ILE 96 4.482 4.201 1.230 795 HG22 ILE 96 HG22 ILE 96 4.588 4.168 2.994 796 HG23 ILE 96 HG23 ILE 96 3.221 4.965 2.237 797 HD11 ILE 96 HD11 ILE 96 8.399 6.513 3.082 798 HD12 ILE 96 HD12 ILE 96 7.211 7.793 2.773 799 HD13 ILE 96 HD13 ILE 96 6.967 6.647 4.117 800 H GLN 97 H GLN 97 3.762 9.061 2.108 801 HA GLN 97 HA GLN 97 5.985 10.850 1.237 802 HB2 GLN 97 HB2 GLN 97 3.019 11.410 0.943 803 HB3 GLN 97 HB3 GLN 97 4.261 12.643 0.823 804 HG2 GLN 97 HG2 GLN 97 4.906 12.056 -1.269 805 HG3 GLN 97 HG3 GLN 97 4.681 10.329 -1.009 806 HE21 GLN 97 HE21 GLN 97 1.395 10.231 -2.306 807 HE22 GLN 97 HE22 GLN 97 2.749 9.344 -1.612 808 H ASP 98 H ASP 98 6.527 12.414 2.596 809 HA ASP 98 HA ASP 98 5.521 12.183 5.375 810 HB2 ASP 98 HB2 ASP 98 7.940 11.888 4.711 811 HB3 ASP 98 HB3 ASP 98 7.979 13.612 4.350 812 H GLY 99 H GLY 99 4.284 13.880 3.085 813 HA2 GLY 99 HA2 GLY 99 2.805 15.654 3.112 814 HA3 GLY 99 HA3 GLY 99 3.214 15.947 4.802 815 H THR 100 H THR 100 6.019 16.004 2.965 816 HA THR 100 HA THR 100 5.995 18.984 2.644 817 HB THR 100 HB THR 100 6.990 18.151 4.762 818 HG1 THR 100 HG1 THR 100 8.773 19.469 4.639 819 HG21 THR 100 HG21 THR 100 9.200 17.130 4.776 820 HG22 THR 100 HG22 THR 100 8.060 16.078 3.933 821 HG23 THR 100 HG23 THR 100 9.225 17.054 3.002 822 H GLY 101 H GLY 101 6.143 16.334 0.797 823 HA2 GLY 101 HA2 GLY 101 6.676 16.295 -1.517 824 HA3 GLY 101 HA3 GLY 101 7.888 17.556 -1.287 825 H ARG 102 H ARG 102 8.435 15.537 1.198 826 HA ARG 102 HA ARG 102 10.559 13.881 0.043 827 HB2 ARG 102 HB2 ARG 102 10.970 14.939 2.163 828 HB3 ARG 102 HB3 ARG 102 9.401 14.431 2.796 829 HG2 ARG 102 HG2 ARG 102 10.139 12.072 2.760 830 HG3 ARG 102 HG3 ARG 102 11.748 12.608 2.201 831 HD2 ARG 102 HD2 ARG 102 11.906 14.035 4.271 832 HD3 ARG 102 HD3 ARG 102 10.329 13.416 4.772 833 HE ARG 102 HE ARG 102 12.534 11.479 4.268 834 HH11 ARG 102 HH11 ARG 102 13.235 10.187 5.906 835 HH12 ARG 102 HH12 ARG 102 12.606 10.390 7.514 836 HH21 ARG 102 HH21 ARG 102 10.450 12.949 6.743 837 HH22 ARG 102 HH22 ARG 102 11.132 11.925 7.976 838 H SER 103 H SER 103 10.261 11.891 -0.534 839 HA SER 103 HA SER 103 7.973 10.239 0.313 840 HB2 SER 103 HB2 SER 103 7.059 9.908 -1.895 841 HB3 SER 103 HB3 SER 103 7.075 11.635 -1.519 842 HG SER 103 HG SER 103 9.181 11.630 -2.688 843 H ALA 104 H ALA 104 7.982 8.048 -0.493 844 HA ALA 104 HA ALA 104 10.355 7.036 -1.908 845 HB1 ALA 104 HB1 ALA 104 11.063 6.971 0.470 846 HB2 ALA 104 HB2 ALA 104 9.602 6.043 0.880 847 HB3 ALA 104 HB3 ALA 104 10.839 5.335 -0.180 848 H PHE 105 H PHE 105 10.022 5.008 -2.880 849 HA PHE 105 HA PHE 105 7.217 3.988 -2.919 850 HB2 PHE 105 HB2 PHE 105 9.568 3.559 -4.769 851 HB3 PHE 105 HB3 PHE 105 8.151 2.525 -4.774 852 HD1 PHE 105 HD1 PHE 105 5.952 3.327 -5.503 853 HD2 PHE 105 HD2 PHE 105 9.410 5.892 -5.637 854 HE1 PHE 105 HE1 PHE 105 4.767 4.818 -7.088 855 HE2 PHE 105 HE2 PHE 105 8.216 7.405 -7.207 856 HZ PHE 105 HZ PHE 105 5.908 6.853 -7.958 857 H ILE 106 H ILE 106 6.742 2.449 -1.532 858 HA ILE 106 HA ILE 106 8.829 0.440 -0.754 859 HB ILE 106 HB ILE 106 7.951 0.233 1.419 860 HG12 ILE 106 HG12 ILE 106 5.849 2.342 0.772 861 HG13 ILE 106 HG13 ILE 106 5.542 0.617 0.976 862 HG21 ILE 106 HG21 ILE 106 8.657 2.337 2.364 863 HG22 ILE 106 HG22 ILE 106 9.589 2.071 0.884 864 HG23 ILE 106 HG23 ILE 106 8.222 3.210 0.875 865 HD11 ILE 106 HD11 ILE 106 4.912 1.715 3.006 866 HD12 ILE 106 HD12 ILE 106 6.351 0.732 3.320 867 HD13 ILE 106 HD13 ILE 106 6.494 2.496 3.161 868 H GLY 107 H GLY 107 8.210 -1.716 -0.503 869 HA2 GLY 107 HA2 GLY 107 5.768 -2.516 -2.005 870 HA3 GLY 107 HA3 GLY 107 7.143 -3.545 -1.610 871 H ILE 108 H ILE 108 4.179 -3.725 -1.045 872 HA ILE 108 HA ILE 108 4.481 -4.552 1.769 873 HB ILE 108 HB ILE 108 2.115 -4.105 2.208 874 HG12 ILE 108 HG12 ILE 108 2.128 -2.297 -0.243 875 HG13 ILE 108 HG13 ILE 108 1.329 -3.868 -0.166 876 HG21 ILE 108 HG21 ILE 108 3.905 -2.712 3.060 877 HG22 ILE 108 HG22 ILE 108 3.822 -1.661 1.629 878 HG23 ILE 108 HG23 ILE 108 2.461 -1.744 2.766 879 HD11 ILE 108 HD11 ILE 108 0.617 -1.439 1.529 880 HD12 ILE 108 HD12 ILE 108 -0.330 -2.174 0.228 881 HD13 ILE 108 HD13 ILE 108 -0.072 -3.058 1.744 882 H GLY 109 H GLY 109 3.738 -6.490 2.298 883 HA2 GLY 109 HA2 GLY 109 2.367 -8.177 0.233 884 HA3 GLY 109 HA3 GLY 109 3.639 -8.780 1.295 885 H PHE 110 H PHE 110 0.764 -9.484 0.841 886 HA PHE 110 HA PHE 110 -0.444 -9.024 3.523 887 HB2 PHE 110 HB2 PHE 110 -1.521 -9.759 0.798 888 HB3 PHE 110 HB3 PHE 110 -2.490 -9.936 2.243 889 HD1 PHE 110 HD1 PHE 110 -0.379 -7.284 0.533 890 HD2 PHE 110 HD2 PHE 110 -3.904 -8.206 2.852 891 HE1 PHE 110 HE1 PHE 110 -1.031 -4.901 0.501 892 HE2 PHE 110 HE2 PHE 110 -4.598 -5.835 2.719 893 HZ PHE 110 HZ PHE 110 -3.135 -4.171 1.573 894 H THR 111 H THR 111 -1.689 -10.719 4.501 895 HA THR 111 HA THR 111 -0.222 -13.184 4.806 896 HB THR 111 HB THR 111 -1.409 -12.012 6.617 897 HG1 THR 111 HG1 THR 111 -2.166 -13.881 7.571 898 HG21 THR 111 HG21 THR 111 -3.990 -13.107 5.422 899 HG22 THR 111 HG22 THR 111 -3.800 -12.253 6.965 900 HG23 THR 111 HG23 THR 111 -3.524 -11.391 5.447 901 H ASP 112 H ASP 112 -2.961 -12.267 2.791 902 HA ASP 112 HA ASP 112 -2.910 -14.840 1.457 903 HB2 ASP 112 HB2 ASP 112 -4.435 -15.212 3.461 904 HB3 ASP 112 HB3 ASP 112 -5.499 -13.968 2.810 905 H ARG 113 H ARG 113 -3.993 -14.827 -0.565 906 HA ARG 113 HA ARG 113 -4.058 -12.321 -1.960 907 HB2 ARG 113 HB2 ARG 113 -3.551 -14.642 -2.869 908 HB3 ARG 113 HB3 ARG 113 -5.288 -14.982 -2.801 909 HG2 ARG 113 HG2 ARG 113 -5.688 -13.060 -4.353 910 HG3 ARG 113 HG3 ARG 113 -3.938 -12.755 -4.386 911 HD2 ARG 113 HD2 ARG 113 -3.591 -15.070 -5.291 912 HD3 ARG 113 HD3 ARG 113 -5.349 -15.297 -5.299 913 HE ARG 113 HE ARG 113 -4.194 -13.016 -6.849 914 HH11 ARG 113 HH11 ARG 113 -4.554 -12.849 -8.921 915 HH12 ARG 113 HH12 ARG 113 -5.335 -14.130 -9.830 916 HH21 ARG 113 HH21 ARG 113 -5.646 -16.208 -7.093 917 HH22 ARG 113 HH22 ARG 113 -5.936 -16.010 -8.800 918 H GLY 114 H GLY 114 -6.676 -14.186 -0.429 919 HA2 GLY 114 HA2 GLY 114 -8.862 -12.646 -1.551 920 HA3 GLY 114 HA3 GLY 114 -8.903 -13.692 -0.125 921 H ASP 115 H ASP 115 -6.657 -12.098 1.143 922 HA ASP 115 HA ASP 115 -8.297 -9.904 2.288 923 HB2 ASP 115 HB2 ASP 115 -5.666 -11.197 3.079 924 HB3 ASP 115 HB3 ASP 115 -6.215 -9.678 3.779 925 H ALA 116 H ALA 116 -5.353 -10.336 0.292 926 HA ALA 116 HA ALA 116 -4.817 -7.528 -0.032 927 HB1 ALA 116 HB1 ALA 116 -3.565 -8.317 -1.992 928 HB2 ALA 116 HB2 ALA 116 -3.242 -9.317 -0.563 929 HB3 ALA 116 HB3 ALA 116 -4.315 -9.912 -1.852 930 H PHE 117 H PHE 117 -7.049 -9.751 -1.794 931 HA PHE 117 HA PHE 117 -7.815 -7.940 -3.812 932 HB2 PHE 117 HB2 PHE 117 -8.855 -10.422 -2.704 933 HB3 PHE 117 HB3 PHE 117 -10.173 -9.326 -3.058 934 HD1 PHE 117 HD1 PHE 117 -7.358 -11.233 -4.523 935 HD2 PHE 117 HD2 PHE 117 -10.654 -8.578 -5.346 936 HE1 PHE 117 HE1 PHE 117 -7.164 -11.747 -6.946 937 HE2 PHE 117 HE2 PHE 117 -10.459 -9.094 -7.771 938 HZ PHE 117 HZ PHE 117 -8.715 -10.677 -8.573 939 H ASP 118 H ASP 118 -8.792 -7.881 -0.396 940 HA ASP 118 HA ASP 118 -10.839 -5.855 -0.750 941 HB2 ASP 118 HB2 ASP 118 -9.255 -6.805 1.667 942 HB3 ASP 118 HB3 ASP 118 -10.426 -5.501 1.754 943 H PHE 119 H PHE 119 -7.306 -5.631 -0.570 944 HA PHE 119 HA PHE 119 -7.160 -2.835 0.139 945 HB2 PHE 119 HB2 PHE 119 -5.259 -4.260 0.429 946 HB3 PHE 119 HB3 PHE 119 -5.239 -4.711 -1.262 947 HD1 PHE 119 HD1 PHE 119 -4.404 -3.273 -3.021 948 HD2 PHE 119 HD2 PHE 119 -4.252 -2.126 1.122 949 HE1 PHE 119 HE1 PHE 119 -2.819 -1.452 -3.584 950 HE2 PHE 119 HE2 PHE 119 -2.679 -0.315 0.570 951 HZ PHE 119 HZ PHE 119 -1.949 0.043 -1.789 952 H ASN 120 H ASN 120 -6.919 -4.442 -3.088 953 HA ASN 120 HA ASN 120 -6.996 -1.868 -4.418 954 HB2 ASN 120 HB2 ASN 120 -6.961 -3.172 -6.492 955 HB3 ASN 120 HB3 ASN 120 -5.737 -3.728 -5.358 956 HD21 ASN 120 HD21 ASN 120 -8.739 -6.266 -6.472 957 HD22 ASN 120 HD22 ASN 120 -8.862 -4.565 -6.890 958 H VAL 121 H VAL 121 -9.569 -4.113 -3.507 959 HA VAL 121 HA VAL 121 -11.559 -2.773 -5.178 960 HB VAL 121 HB VAL 121 -11.794 -4.732 -2.880 961 HG11 VAL 121 HG11 VAL 121 -14.034 -3.527 -4.570 962 HG12 VAL 121 HG12 VAL 121 -14.200 -4.953 -3.520 963 HG13 VAL 121 HG13 VAL 121 -13.838 -3.381 -2.807 964 HG21 VAL 121 HG21 VAL 121 -12.544 -6.260 -4.666 965 HG22 VAL 121 HG22 VAL 121 -12.410 -4.959 -5.871 966 HG23 VAL 121 HG23 VAL 121 -10.959 -5.602 -5.082 967 H SER 122 H SER 122 -10.533 -2.463 -1.733 968 HA SER 122 HA SER 122 -12.480 -0.586 -0.925 969 HB2 SER 122 HB2 SER 122 -10.963 -1.739 0.606 970 HB3 SER 122 HB3 SER 122 -9.573 -0.873 -0.083 971 HG SER 122 HG SER 122 -11.790 0.217 1.332 972 H LEU 123 H LEU 123 -9.339 0.011 -2.550 973 HA LEU 123 HA LEU 123 -9.584 2.885 -2.574 974 HB2 LEU 123 HB2 LEU 123 -7.977 0.940 -4.275 975 HB3 LEU 123 HB3 LEU 123 -7.825 2.692 -4.392 976 HG LEU 123 HG LEU 123 -7.312 1.154 -1.808 977 HD11 LEU 123 HD11 LEU 123 -5.339 2.158 -3.896 978 HD12 LEU 123 HD12 LEU 123 -4.926 1.439 -2.320 979 HD13 LEU 123 HD13 LEU 123 -5.724 0.459 -3.555 980 HD21 LEU 123 HD21 LEU 123 -7.822 3.556 -1.473 981 HD22 LEU 123 HD22 LEU 123 -6.128 3.207 -1.142 982 HD23 LEU 123 HD23 LEU 123 -6.581 3.989 -2.671 983 H GLN 124 H GLN 124 -10.245 0.489 -5.225 984 HA GLN 124 HA GLN 124 -11.112 2.551 -6.998 985 HB2 GLN 124 HB2 GLN 124 -11.551 0.886 -8.552 986 HB3 GLN 124 HB3 GLN 124 -10.260 0.213 -7.554 987 HG2 GLN 124 HG2 GLN 124 -12.039 -1.036 -6.269 988 HG3 GLN 124 HG3 GLN 124 -13.210 -0.520 -7.485 989 HE21 GLN 124 HE21 GLN 124 -10.293 -3.234 -8.570 990 HE22 GLN 124 HE22 GLN 124 -10.028 -2.182 -7.162 991 H ASP 125 H ASP 125 -12.968 0.669 -4.625 992 HA ASP 125 HA ASP 125 -15.517 1.684 -5.632 993 HB2 ASP 125 HB2 ASP 125 -15.219 -0.643 -4.760 994 HB3 ASP 125 HB3 ASP 125 -14.931 0.034 -3.151 995 H HIS 126 H HIS 126 -13.098 3.088 -3.789 996 HA HIS 126 HA HIS 126 -15.073 4.956 -2.579 997 HB2 HIS 126 HB2 HIS 126 -13.102 4.304 -1.199 998 HB3 HIS 126 HB3 HIS 126 -12.057 5.125 -2.369 999 HD2 HIS 126 HD2 HIS 126 -14.918 5.824 0.155 1000 HE1 HIS 126 HE1 HIS 126 -13.280 9.627 -0.848 1001 HE2 HIS 126 HE2 HIS 126 -14.947 8.412 0.644 1002 H PHE 127 H PHE 127 -12.575 4.790 -5.142 1003 HA PHE 127 HA PHE 127 -13.055 7.569 -5.894 1004 HB2 PHE 127 HB2 PHE 127 -11.269 5.363 -6.944 1005 HB3 PHE 127 HB3 PHE 127 -11.411 6.905 -7.764 1006 HD1 PHE 127 HD1 PHE 127 -9.457 5.200 -5.429 1007 HD2 PHE 127 HD2 PHE 127 -11.246 9.056 -6.109 1008 HE1 PHE 127 HE1 PHE 127 -7.626 6.265 -4.144 1009 HE2 PHE 127 HE2 PHE 127 -9.417 10.128 -4.812 1010 HZ PHE 127 HZ PHE 127 -7.598 8.738 -3.849 1011 H LYS 128 H LYS 128 -14.788 4.763 -6.818 1012 HA LYS 128 HA LYS 128 -15.083 5.087 -9.500 1013 HB2 LYS 128 HB2 LYS 128 -16.979 3.778 -9.537 1014 HB3 LYS 128 HB3 LYS 128 -16.001 3.198 -8.207 1015 HG2 LYS 128 HG2 LYS 128 -18.468 4.993 -7.917 1016 HG3 LYS 128 HG3 LYS 128 -18.454 3.234 -7.790 1017 HD2 LYS 128 HD2 LYS 128 -16.829 3.415 -5.898 1018 HD3 LYS 128 HD3 LYS 128 -16.978 5.173 -5.963 1019 HE2 LYS 128 HE2 LYS 128 -18.391 4.455 -4.228 1020 HE3 LYS 128 HE3 LYS 128 -19.431 4.951 -5.576 1021 HZ1 LYS 128 HZ1 LYS 128 -20.103 2.810 -4.523 1022 HZ2 LYS 128 HZ2 LYS 128 -19.756 2.601 -6.104 1023 HZ3 LYS 128 HZ3 LYS 128 -18.687 2.119 -4.965 1024 H TRP 129 H TRP 129 -16.703 7.184 -7.225 1025 HA TRP 129 HA TRP 129 -18.390 8.464 -9.257 1026 HB2 TRP 129 HB2 TRP 129 -19.132 9.885 -7.461 1027 HB3 TRP 129 HB3 TRP 129 -19.155 8.210 -6.934 1028 HD1 TRP 129 HD1 TRP 129 -17.093 7.457 -5.270 1029 HE1 TRP 129 HE1 TRP 129 -15.635 8.742 -3.653 1030 HE3 TRP 129 HE3 TRP 129 -18.306 12.230 -6.710 1031 HZ2 TRP 129 HZ2 TRP 129 -15.373 11.498 -2.745 1032 HZ3 TRP 129 HZ3 TRP 129 -17.486 14.169 -5.391 1033 HH2 TRP 129 HH2 TRP 129 -16.050 13.814 -3.394 1034 H VAL 130 H VAL 130 -15.217 9.017 -7.856 1035 HA VAL 130 HA VAL 130 -14.858 11.734 -8.874 1036 HB VAL 130 HB VAL 130 -12.731 9.746 -7.981 1037 HG11 VAL 130 HG11 VAL 130 -12.724 12.792 -8.118 1038 HG12 VAL 130 HG12 VAL 130 -11.422 11.779 -7.456 1039 HG13 VAL 130 HG13 VAL 130 -11.805 11.694 -9.173 1040 HG21 VAL 130 HG21 VAL 130 -14.275 10.000 -6.120 1041 HG22 VAL 130 HG22 VAL 130 -12.833 10.949 -5.777 1042 HG23 VAL 130 HG23 VAL 130 -14.312 11.764 -6.331 1043 H LYS 131 H LYS 131 -14.284 8.450 -9.997 1044 HA LYS 131 HA LYS 131 -13.002 9.374 -12.517 1045 HB2 LYS 131 HB2 LYS 131 -12.973 6.710 -11.048 1046 HB3 LYS 131 HB3 LYS 131 -12.333 6.908 -12.669 1047 HG2 LYS 131 HG2 LYS 131 -11.343 8.340 -10.168 1048 HG3 LYS 131 HG3 LYS 131 -10.542 7.015 -11.005 1049 HD2 LYS 131 HD2 LYS 131 -10.988 9.826 -12.111 1050 HD3 LYS 131 HD3 LYS 131 -9.476 9.176 -11.514 1051 HE2 LYS 131 HE2 LYS 131 -9.195 7.695 -13.324 1052 HE3 LYS 131 HE3 LYS 131 -10.899 7.764 -13.784 1053 HZ1 LYS 131 HZ1 LYS 131 -9.444 9.073 -15.262 1054 HZ2 LYS 131 HZ2 LYS 131 -10.651 9.946 -14.611 1055 HZ3 LYS 131 HZ3 LYS 131 -9.108 10.107 -14.039 1056 H GLN 132 H GLN 132 -15.648 9.912 -12.289 1057 HA GLN 132 HA GLN 132 -16.891 8.136 -14.267 1058 HB2 GLN 132 HB2 GLN 132 -17.831 10.736 -12.987 1059 HB3 GLN 132 HB3 GLN 132 -18.753 9.897 -14.232 1060 HG2 GLN 132 HG2 GLN 132 -18.013 8.707 -11.535 1061 HG3 GLN 132 HG3 GLN 132 -19.573 9.407 -11.945 1062 HE21 GLN 132 HE21 GLN 132 -18.924 5.549 -12.876 1063 HE22 GLN 132 HE22 GLN 132 -17.872 6.477 -11.802 1064 H GLU 133 H GLU 133 -14.486 10.075 -14.476 1065 HA GLU 133 HA GLU 133 -14.629 10.536 -17.341 1066 HB2 GLU 133 HB2 GLU 133 -14.082 12.905 -17.287 1067 HB3 GLU 133 HB3 GLU 133 -15.657 12.611 -16.564 1068 HG2 GLU 133 HG2 GLU 133 -14.641 12.817 -14.285 1069 HG3 GLU 133 HG3 GLU 133 -13.072 13.139 -15.028 Start of MODEL 17 1 H1 GLY -4 H1 GLY -4 0.633 32.168 8.927 2 H2 GLY -4 H2 GLY -4 -0.030 33.308 7.958 3 H3 GLY -4 H3 GLY -4 0.093 31.760 7.434 4 HA2 GLY -4 HA2 GLY -4 -2.182 32.229 8.047 5 HA3 GLY -4 HA3 GLY -4 -1.463 30.998 9.100 6 H SER -3 H SER -3 -3.449 31.891 10.334 7 HA SER -3 HA SER -3 -3.101 34.414 11.756 8 HB2 SER -3 HB2 SER -3 -5.205 34.030 12.662 9 HB3 SER -3 HB3 SER -3 -5.314 33.264 11.088 10 HG SER -3 HG SER -3 -5.088 31.257 12.064 11 HA PRO -2 HA PRO -2 -0.885 32.868 15.295 12 HB2 PRO -2 HB2 PRO -2 -1.684 34.430 17.374 13 HB3 PRO -2 HB3 PRO -2 -0.817 35.088 15.956 14 HG2 PRO -2 HG2 PRO -2 -3.818 35.039 16.435 15 HG3 PRO -2 HG3 PRO -2 -2.795 36.447 15.991 16 HD2 PRO -2 HD2 PRO -2 -4.162 35.021 14.134 17 HD3 PRO -2 HD3 PRO -2 -2.539 35.680 13.775 18 H ASN -1 H ASN -1 -4.066 31.981 14.931 19 HA ASN -1 HA ASN -1 -4.681 30.927 17.570 20 HB2 ASN -1 HB2 ASN -1 -5.909 30.374 14.835 21 HB3 ASN -1 HB3 ASN -1 -6.584 29.852 16.372 22 HD21 ASN -1 HD21 ASN -1 -7.284 33.621 15.112 23 HD22 ASN -1 HD22 ASN -1 -6.355 32.474 14.140 24 H SER 0 H SER 0 -5.129 28.618 17.979 25 HA SER 0 HA SER 0 -2.850 26.929 17.428 26 HB2 SER 0 HB2 SER 0 -4.118 25.279 18.792 27 HB3 SER 0 HB3 SER 0 -3.944 26.860 19.572 28 HG SER 0 HG SER 0 -6.095 26.044 19.722 29 H MET 1 H MET 1 -5.747 27.431 15.685 30 HA MET 1 HA MET 1 -5.189 25.107 13.910 31 HB2 MET 1 HB2 MET 1 -7.845 25.962 15.103 32 HB3 MET 1 HB3 MET 1 -7.784 25.158 13.537 33 HG2 MET 1 HG2 MET 1 -6.560 23.989 16.055 34 HG3 MET 1 HG3 MET 1 -8.185 23.629 15.468 35 HE1 MET 1 HE1 MET 1 -6.034 21.391 16.117 36 HE2 MET 1 HE2 MET 1 -7.680 21.051 15.530 37 HE3 MET 1 HE3 MET 1 -6.280 20.293 14.740 38 H ALA 2 H ALA 2 -5.703 25.404 11.746 39 HA ALA 2 HA ALA 2 -6.490 28.073 10.750 40 HB1 ALA 2 HB1 ALA 2 -3.753 26.861 10.142 41 HB2 ALA 2 HB2 ALA 2 -4.441 28.313 9.384 42 HB3 ALA 2 HB3 ALA 2 -4.068 28.313 11.117 43 H THR 3 H THR 3 -5.208 24.855 9.712 44 HA THR 3 HA THR 3 -6.885 24.858 7.280 45 HB THR 3 HB THR 3 -5.164 22.666 8.493 46 HG1 THR 3 HG1 THR 3 -4.017 24.493 7.742 47 HG21 THR 3 HG21 THR 3 -5.243 21.676 6.203 48 HG22 THR 3 HG22 THR 3 -6.818 21.648 7.002 49 HG23 THR 3 HG23 THR 3 -6.483 22.867 5.749 50 H GLU 4 H GLU 4 -6.878 23.406 10.442 51 HA GLU 4 HA GLU 4 -8.385 22.304 11.708 52 HB2 GLU 4 HB2 GLU 4 -9.016 24.768 11.579 53 HB3 GLU 4 HB3 GLU 4 -10.377 24.278 10.569 54 HG2 GLU 4 HG2 GLU 4 -11.013 22.625 12.428 55 HG3 GLU 4 HG3 GLU 4 -9.707 23.323 13.387 56 H LEU 5 H LEU 5 -8.214 20.306 10.539 57 HA LEU 5 HA LEU 5 -10.974 19.399 10.046 58 HB2 LEU 5 HB2 LEU 5 -10.435 17.843 8.378 59 HB3 LEU 5 HB3 LEU 5 -10.068 19.481 7.862 60 HG LEU 5 HG LEU 5 -7.607 18.790 8.615 61 HD11 LEU 5 HD11 LEU 5 -8.221 16.547 9.473 62 HD12 LEU 5 HD12 LEU 5 -8.859 16.119 7.879 63 HD13 LEU 5 HD13 LEU 5 -7.116 16.448 8.101 64 HD21 LEU 5 HD21 LEU 5 -8.880 17.815 6.042 65 HD22 LEU 5 HD22 LEU 5 -8.276 19.455 6.352 66 HD23 LEU 5 HD23 LEU 5 -7.143 18.094 6.313 67 H GLU 6 H GLU 6 -11.578 17.588 10.937 68 HA GLU 6 HA GLU 6 -9.640 15.959 12.513 69 HB2 GLU 6 HB2 GLU 6 -10.977 17.667 13.873 70 HB3 GLU 6 HB3 GLU 6 -12.411 16.706 13.514 71 HG2 GLU 6 HG2 GLU 6 -11.287 14.728 14.609 72 HG3 GLU 6 HG3 GLU 6 -9.875 15.732 14.921 73 H TYR 7 H TYR 7 -10.107 15.174 10.033 74 HA TYR 7 HA TYR 7 -11.729 12.757 10.325 75 HB2 TYR 7 HB2 TYR 7 -12.791 13.122 8.095 76 HB3 TYR 7 HB3 TYR 7 -13.362 14.137 9.409 77 HD1 TYR 7 HD1 TYR 7 -10.955 14.207 6.488 78 HD2 TYR 7 HD2 TYR 7 -13.616 16.421 9.078 79 HE1 TYR 7 HE1 TYR 7 -10.589 16.266 5.147 80 HE2 TYR 7 HE2 TYR 7 -13.358 18.426 7.626 81 HH TYR 7 HH TYR 7 -11.241 18.429 4.735 82 H GLU 8 H GLU 8 -11.391 11.245 8.819 83 HA GLU 8 HA GLU 8 -9.315 10.898 6.919 84 HB2 GLU 8 HB2 GLU 8 -8.094 11.216 9.287 85 HB3 GLU 8 HB3 GLU 8 -8.542 9.515 9.494 86 HG2 GLU 8 HG2 GLU 8 -7.141 8.789 7.833 87 HG3 GLU 8 HG3 GLU 8 -7.196 10.285 6.926 88 H SER 9 H SER 9 -11.304 10.052 6.063 89 HA SER 9 HA SER 9 -13.010 8.396 7.649 90 HB2 SER 9 HB2 SER 9 -13.416 10.088 5.614 91 HB3 SER 9 HB3 SER 9 -13.274 8.601 4.663 92 HG SER 9 HG SER 9 -15.454 9.016 5.354 93 H VAL 10 H VAL 10 -12.751 6.288 8.037 94 HA VAL 10 HA VAL 10 -10.654 4.793 6.723 95 HB VAL 10 HB VAL 10 -12.663 3.845 8.809 96 HG11 VAL 10 HG11 VAL 10 -9.949 2.712 7.975 97 HG12 VAL 10 HG12 VAL 10 -10.881 2.200 9.401 98 HG13 VAL 10 HG13 VAL 10 -11.537 1.921 7.796 99 HG21 VAL 10 HG21 VAL 10 -10.869 4.300 10.452 100 HG22 VAL 10 HG22 VAL 10 -9.855 4.990 9.164 101 HG23 VAL 10 HG23 VAL 10 -11.366 5.783 9.647 102 H LEU 11 H LEU 11 -10.733 2.887 5.587 103 HA LEU 11 HA LEU 11 -13.271 2.262 4.104 104 HB2 LEU 11 HB2 LEU 11 -10.489 2.777 2.966 105 HB3 LEU 11 HB3 LEU 11 -11.852 2.164 2.039 106 HG LEU 11 HG LEU 11 -11.777 4.897 3.389 107 HD11 LEU 11 HD11 LEU 11 -11.565 5.748 1.069 108 HD12 LEU 11 HD12 LEU 11 -10.158 4.812 1.583 109 HD13 LEU 11 HD13 LEU 11 -11.360 4.086 0.489 110 HD21 LEU 11 HD21 LEU 11 -14.088 4.059 3.090 111 HD22 LEU 11 HD22 LEU 11 -13.742 5.379 1.976 112 HD23 LEU 11 HD23 LEU 11 -13.740 3.707 1.379 113 H CYS 12 H CYS 12 -10.002 1.182 5.033 114 HA CYS 12 HA CYS 12 -10.966 -1.592 5.295 115 HB2 CYS 12 HB2 CYS 12 -10.090 -1.311 2.930 116 HB3 CYS 12 HB3 CYS 12 -8.506 -0.930 3.639 117 HG CYS 12 HG CYS 12 -8.609 -3.411 2.688 118 H VAL 13 H VAL 13 -9.979 -2.633 6.898 119 HA VAL 13 HA VAL 13 -7.351 -1.724 7.932 120 HB VAL 13 HB VAL 13 -9.722 -2.325 9.744 121 HG11 VAL 13 HG11 VAL 13 -6.849 -1.544 10.423 122 HG12 VAL 13 HG12 VAL 13 -8.184 -1.703 11.582 123 HG13 VAL 13 HG13 VAL 13 -7.597 -3.130 10.728 124 HG21 VAL 13 HG21 VAL 13 -9.884 -0.045 8.801 125 HG22 VAL 13 HG22 VAL 13 -9.441 0.023 10.509 126 HG23 VAL 13 HG23 VAL 13 -8.201 0.272 9.260 127 H LYS 14 H LYS 14 -5.992 -3.385 8.076 128 HA LYS 14 HA LYS 14 -7.012 -6.148 8.437 129 HB2 LYS 14 HB2 LYS 14 -4.886 -5.448 6.383 130 HB3 LYS 14 HB3 LYS 14 -5.432 -7.061 6.788 131 HG2 LYS 14 HG2 LYS 14 -7.246 -4.918 5.607 132 HG3 LYS 14 HG3 LYS 14 -6.359 -6.100 4.652 133 HD2 LYS 14 HD2 LYS 14 -7.592 -7.939 5.587 134 HD3 LYS 14 HD3 LYS 14 -8.375 -6.895 6.795 135 HE2 LYS 14 HE2 LYS 14 -9.463 -5.613 4.999 136 HE3 LYS 14 HE3 LYS 14 -8.668 -6.620 3.780 137 HZ1 LYS 14 HZ1 LYS 14 -10.607 -7.604 5.802 138 HZ2 LYS 14 HZ2 LYS 14 -10.921 -7.338 4.213 139 HZ3 LYS 14 HZ3 LYS 14 -9.862 -8.535 4.667 140 HA PRO 15 HA PRO 15 -4.033 -5.968 11.604 141 HB2 PRO 15 HB2 PRO 15 -3.996 -8.528 12.521 142 HB3 PRO 15 HB3 PRO 15 -5.443 -7.472 12.641 143 HG2 PRO 15 HG2 PRO 15 -4.819 -9.549 10.507 144 HG3 PRO 15 HG3 PRO 15 -6.336 -9.361 11.454 145 HD2 PRO 15 HD2 PRO 15 -6.069 -8.331 8.960 146 HD3 PRO 15 HD3 PRO 15 -6.962 -7.456 10.243 147 H ASP 16 H ASP 16 -3.201 -7.990 8.872 148 HA ASP 16 HA ASP 16 -0.364 -8.188 9.816 149 HB2 ASP 16 HB2 ASP 16 -2.129 -10.357 8.644 150 HB3 ASP 16 HB3 ASP 16 -0.370 -10.437 8.630 151 H VAL 17 H VAL 17 0.670 -6.825 8.604 152 HA VAL 17 HA VAL 17 0.869 -7.398 5.724 153 HB VAL 17 HB VAL 17 -0.775 -5.555 5.881 154 HG11 VAL 17 HG11 VAL 17 1.511 -3.858 6.966 155 HG12 VAL 17 HG12 VAL 17 -0.096 -3.290 6.475 156 HG13 VAL 17 HG13 VAL 17 0.069 -4.370 7.866 157 HG21 VAL 17 HG21 VAL 17 1.842 -4.690 4.604 158 HG22 VAL 17 HG22 VAL 17 0.650 -5.807 3.887 159 HG23 VAL 17 HG23 VAL 17 0.211 -4.124 4.199 160 H SER 18 H SER 18 2.878 -7.112 4.896 161 HA SER 18 HA SER 18 5.077 -6.477 6.843 162 HB2 SER 18 HB2 SER 18 4.945 -8.630 4.700 163 HB3 SER 18 HB3 SER 18 6.313 -8.318 5.789 164 HG SER 18 HG SER 18 4.908 -10.039 6.498 165 H VAL 19 H VAL 19 6.594 -5.056 6.209 166 HA VAL 19 HA VAL 19 6.515 -3.977 3.444 167 HB VAL 19 HB VAL 19 7.705 -2.873 5.989 168 HG11 VAL 19 HG11 VAL 19 7.876 -1.749 3.152 169 HG12 VAL 19 HG12 VAL 19 8.194 -0.812 4.633 170 HG13 VAL 19 HG13 VAL 19 9.233 -2.174 4.223 171 HG21 VAL 19 HG21 VAL 19 5.176 -2.695 5.520 172 HG22 VAL 19 HG22 VAL 19 6.046 -1.179 5.776 173 HG23 VAL 19 HG23 VAL 19 5.615 -1.678 4.133 174 H TYR 20 H TYR 20 8.005 -4.092 2.034 175 HA TYR 20 HA TYR 20 10.762 -4.871 2.818 176 HB2 TYR 20 HB2 TYR 20 9.847 -5.711 0.115 177 HB3 TYR 20 HB3 TYR 20 11.014 -6.440 1.208 178 HD1 TYR 20 HD1 TYR 20 10.245 -8.004 2.988 179 HD2 TYR 20 HD2 TYR 20 7.522 -6.322 0.119 180 HE1 TYR 20 HE1 TYR 20 8.533 -9.689 3.645 181 HE2 TYR 20 HE2 TYR 20 5.808 -8.023 0.752 182 HH TYR 20 HH TYR 20 6.417 -10.502 3.264 183 H ARG 21 H ARG 21 12.100 -3.288 2.308 184 HA ARG 21 HA ARG 21 11.447 -1.123 0.429 185 HB2 ARG 21 HB2 ARG 21 14.096 -1.881 1.731 186 HB3 ARG 21 HB3 ARG 21 13.799 -0.418 0.795 187 HG2 ARG 21 HG2 ARG 21 12.511 -1.154 3.460 188 HG3 ARG 21 HG3 ARG 21 13.732 0.083 3.167 189 HD2 ARG 21 HD2 ARG 21 12.046 1.254 1.650 190 HD3 ARG 21 HD3 ARG 21 10.849 0.075 2.191 191 HE ARG 21 HE ARG 21 10.790 1.026 4.327 192 HH11 ARG 21 HH11 ARG 21 10.910 2.773 5.700 193 HH12 ARG 21 HH12 ARG 21 12.004 4.075 5.349 194 HH21 ARG 21 HH21 ARG 21 13.219 2.725 2.450 195 HH22 ARG 21 HH22 ARG 21 13.269 4.061 3.564 196 H ILE 22 H ILE 22 11.242 -1.465 -1.615 197 HA ILE 22 HA ILE 22 12.312 -3.779 -2.938 198 HB ILE 22 HB ILE 22 11.091 -2.940 -4.917 199 HG12 ILE 22 HG12 ILE 22 10.369 -0.537 -3.180 200 HG13 ILE 22 HG13 ILE 22 11.409 -0.512 -4.607 201 HG21 ILE 22 HG21 ILE 22 9.383 -2.812 -2.414 202 HG22 ILE 22 HG22 ILE 22 8.895 -3.321 -4.047 203 HG23 ILE 22 HG23 ILE 22 10.020 -4.308 -3.113 204 HD11 ILE 22 HD11 ILE 22 8.442 -1.055 -4.500 205 HD12 ILE 22 HD12 ILE 22 9.293 0.264 -5.321 206 HD13 ILE 22 HD13 ILE 22 9.433 -1.396 -5.941 207 HA PRO 23 HA PRO 23 15.622 -1.790 -5.413 208 HB2 PRO 23 HB2 PRO 23 15.600 -3.378 -7.630 209 HB3 PRO 23 HB3 PRO 23 16.282 -3.930 -6.069 210 HG2 PRO 23 HG2 PRO 23 13.505 -4.465 -7.184 211 HG3 PRO 23 HG3 PRO 23 14.671 -5.649 -6.508 212 HD2 PRO 23 HD2 PRO 23 12.657 -4.589 -5.017 213 HD3 PRO 23 HD3 PRO 23 14.253 -4.946 -4.301 214 HA PRO 24 HA PRO 24 13.107 0.824 -8.073 215 HB2 PRO 24 HB2 PRO 24 14.799 1.508 -10.128 216 HB3 PRO 24 HB3 PRO 24 14.949 2.152 -8.464 217 HG2 PRO 24 HG2 PRO 24 16.441 -0.191 -9.695 218 HG3 PRO 24 HG3 PRO 24 17.120 1.194 -8.780 219 HD2 PRO 24 HD2 PRO 24 16.631 -1.181 -7.576 220 HD3 PRO 24 HD3 PRO 24 16.296 0.354 -6.721 221 H ARG 25 H ARG 25 11.817 0.744 -9.944 222 HA ARG 25 HA ARG 25 11.240 -1.883 -10.910 223 HB2 ARG 25 HB2 ARG 25 9.701 0.228 -10.662 224 HB3 ARG 25 HB3 ARG 25 10.292 0.638 -12.274 225 HG2 ARG 25 HG2 ARG 25 9.442 -1.771 -12.919 226 HG3 ARG 25 HG3 ARG 25 8.568 -1.706 -11.399 227 HD2 ARG 25 HD2 ARG 25 8.298 0.154 -13.785 228 HD3 ARG 25 HD3 ARG 25 7.144 -1.047 -13.240 229 HE ARG 25 HE ARG 25 6.412 0.355 -11.479 230 HH11 ARG 25 HH11 ARG 25 6.180 2.250 -10.421 231 HH12 ARG 25 HH12 ARG 25 7.054 3.669 -10.956 232 HH21 ARG 25 HH21 ARG 25 8.837 2.035 -13.388 233 HH22 ARG 25 HH22 ARG 25 8.527 3.548 -12.582 234 H ALA 26 H ALA 26 11.441 -2.849 -12.823 235 HA ALA 26 HA ALA 26 13.373 -2.121 -14.861 236 HB1 ALA 26 HB1 ALA 26 12.651 -4.441 -14.319 237 HB2 ALA 26 HB2 ALA 26 10.997 -4.014 -14.826 238 HB3 ALA 26 HB3 ALA 26 12.322 -4.053 -16.017 239 H SER 27 H SER 27 12.420 -2.177 -17.192 240 HA SER 27 HA SER 27 10.607 0.163 -17.531 241 HB2 SER 27 HB2 SER 27 11.521 0.235 -19.810 242 HB3 SER 27 HB3 SER 27 12.798 0.283 -18.582 243 HG SER 27 HG SER 27 13.441 -1.205 -20.088 244 H ASN 28 H ASN 28 11.000 -3.183 -18.606 245 HA ASN 28 HA ASN 28 8.175 -3.264 -19.606 246 HB2 ASN 28 HB2 ASN 28 10.746 -4.501 -20.688 247 HB3 ASN 28 HB3 ASN 28 9.141 -4.969 -21.236 248 HD21 ASN 28 HD21 ASN 28 10.643 -1.380 -22.481 249 HD22 ASN 28 HD22 ASN 28 11.401 -2.179 -21.108 250 H ARG 29 H ARG 29 10.015 -4.464 -17.089 251 HA ARG 29 HA ARG 29 8.701 -7.157 -17.108 252 HB2 ARG 29 HB2 ARG 29 11.024 -6.274 -15.353 253 HB3 ARG 29 HB3 ARG 29 10.323 -7.874 -15.472 254 HG2 ARG 29 HG2 ARG 29 11.902 -6.417 -17.629 255 HG3 ARG 29 HG3 ARG 29 12.372 -7.861 -16.717 256 HD2 ARG 29 HD2 ARG 29 10.360 -9.034 -17.693 257 HD3 ARG 29 HD3 ARG 29 10.090 -7.607 -18.707 258 HE ARG 29 HE ARG 29 12.794 -8.532 -19.029 259 HH11 ARG 29 HH11 ARG 29 13.449 -9.584 -20.874 260 HH12 ARG 29 HH12 ARG 29 12.273 -10.322 -21.921 261 HH21 ARG 29 HH21 ARG 29 9.556 -9.426 -20.027 262 HH22 ARG 29 HH22 ARG 29 10.124 -10.237 -21.461 263 H GLY 30 H GLY 30 9.313 -4.535 -14.640 264 HA2 GLY 30 HA2 GLY 30 7.667 -3.740 -13.205 265 HA3 GLY 30 HA3 GLY 30 6.611 -5.089 -13.646 266 H TYR 31 H TYR 31 6.806 -4.558 -11.108 267 HA TYR 31 HA TYR 31 8.773 -6.066 -9.640 268 HB2 TYR 31 HB2 TYR 31 6.004 -5.204 -8.770 269 HB3 TYR 31 HB3 TYR 31 7.381 -5.585 -7.746 270 HD1 TYR 31 HD1 TYR 31 5.487 -3.048 -8.077 271 HD2 TYR 31 HD2 TYR 31 9.517 -3.941 -9.361 272 HE1 TYR 31 HE1 TYR 31 6.070 -0.648 -7.914 273 HE2 TYR 31 HE2 TYR 31 10.154 -1.575 -8.911 274 HH TYR 31 HH TYR 31 7.731 0.922 -8.052 275 H ARG 32 H ARG 32 8.579 -8.144 -8.823 276 HA ARG 32 HA ARG 32 6.244 -9.828 -9.679 277 HB2 ARG 32 HB2 ARG 32 7.856 -11.636 -10.279 278 HB3 ARG 32 HB3 ARG 32 7.802 -10.269 -11.365 279 HG2 ARG 32 HG2 ARG 32 9.938 -10.413 -9.212 280 HG3 ARG 32 HG3 ARG 32 10.095 -11.329 -10.717 281 HD2 ARG 32 HD2 ARG 32 9.831 -9.277 -12.049 282 HD3 ARG 32 HD3 ARG 32 9.713 -8.316 -10.573 283 HE ARG 32 HE ARG 32 12.144 -9.707 -10.367 284 HH11 ARG 32 HH11 ARG 32 14.005 -8.818 -10.741 285 HH12 ARG 32 HH12 ARG 32 14.212 -7.480 -11.867 286 HH21 ARG 32 HH21 ARG 32 10.794 -7.140 -12.366 287 HH22 ARG 32 HH22 ARG 32 12.390 -6.543 -12.768 288 H ALA 33 H ALA 33 6.945 -8.737 -7.083 289 HA ALA 33 HA ALA 33 7.064 -9.211 -4.895 290 HB1 ALA 33 HB1 ALA 33 4.952 -10.250 -5.587 291 HB2 ALA 33 HB2 ALA 33 5.761 -11.806 -5.770 292 HB3 ALA 33 HB3 ALA 33 5.666 -11.045 -4.159 293 H SER 34 H SER 34 8.180 -12.197 -6.552 294 HA SER 34 HA SER 34 9.785 -13.182 -4.445 295 HB2 SER 34 HB2 SER 34 10.012 -13.668 -7.435 296 HB3 SER 34 HB3 SER 34 10.749 -14.664 -6.163 297 HG SER 34 HG SER 34 8.737 -15.518 -6.881 298 H ASP 35 H ASP 35 10.494 -10.556 -6.555 299 HA ASP 35 HA ASP 35 13.409 -10.713 -6.276 300 HB2 ASP 35 HB2 ASP 35 11.641 -9.376 -7.995 301 HB3 ASP 35 HB3 ASP 35 12.262 -8.086 -6.987 302 H TRP 36 H TRP 36 10.836 -9.700 -4.197 303 HA TRP 36 HA TRP 36 12.393 -7.680 -2.746 304 HB2 TRP 36 HB2 TRP 36 9.649 -8.782 -2.127 305 HB3 TRP 36 HB3 TRP 36 10.358 -7.287 -1.570 306 HD1 TRP 36 HD1 TRP 36 11.091 -6.794 -5.000 307 HE1 TRP 36 HE1 TRP 36 9.178 -5.621 -6.290 308 HE3 TRP 36 HE3 TRP 36 7.241 -7.639 -1.737 309 HZ2 TRP 36 HZ2 TRP 36 6.465 -4.885 -5.810 310 HZ3 TRP 36 HZ3 TRP 36 5.010 -6.597 -2.137 311 HH2 TRP 36 HH2 TRP 36 4.619 -5.247 -4.174 312 H LYS 37 H LYS 37 12.154 -7.871 -0.311 313 HA LYS 37 HA LYS 37 13.564 -10.288 0.549 314 HB2 LYS 37 HB2 LYS 37 12.887 -7.693 1.979 315 HB3 LYS 37 HB3 LYS 37 13.793 -9.019 2.700 316 HG2 LYS 37 HG2 LYS 37 15.423 -8.877 0.762 317 HG3 LYS 37 HG3 LYS 37 14.637 -7.344 0.327 318 HD2 LYS 37 HD2 LYS 37 16.176 -8.066 2.839 319 HD3 LYS 37 HD3 LYS 37 16.566 -6.828 1.631 320 HE2 LYS 37 HE2 LYS 37 14.462 -5.601 2.327 321 HE3 LYS 37 HE3 LYS 37 14.230 -6.810 3.597 322 HZ1 LYS 37 HZ1 LYS 37 15.370 -4.789 4.384 323 HZ2 LYS 37 HZ2 LYS 37 16.324 -6.108 4.584 324 HZ3 LYS 37 HZ3 LYS 37 16.618 -5.050 3.366 325 H LEU 38 H LEU 38 11.326 -11.346 -0.040 326 HA LEU 38 HA LEU 38 9.147 -11.235 1.739 327 HB2 LEU 38 HB2 LEU 38 10.049 -13.613 0.076 328 HB3 LEU 38 HB3 LEU 38 8.435 -13.355 0.736 329 HG LEU 38 HG LEU 38 9.806 -11.693 -1.406 330 HD11 LEU 38 HD11 LEU 38 7.350 -13.517 -1.424 331 HD12 LEU 38 HD12 LEU 38 7.942 -12.591 -2.809 332 HD13 LEU 38 HD13 LEU 38 8.934 -13.896 -2.138 333 HD21 LEU 38 HD21 LEU 38 8.455 -10.146 -0.144 334 HD22 LEU 38 HD22 LEU 38 7.558 -10.552 -1.609 335 HD23 LEU 38 HD23 LEU 38 7.116 -11.310 -0.061 336 H ASP 39 H ASP 39 12.155 -12.766 2.424 337 HA ASP 39 HA ASP 39 10.941 -14.327 4.670 338 HB2 ASP 39 HB2 ASP 39 12.249 -15.559 2.919 339 HB3 ASP 39 HB3 ASP 39 13.681 -14.670 3.425 340 H GLN 40 H GLN 40 12.323 -11.370 4.138 341 HA GLN 40 HA GLN 40 12.908 -10.999 6.974 342 HB2 GLN 40 HB2 GLN 40 15.101 -9.879 6.564 343 HB3 GLN 40 HB3 GLN 40 15.082 -11.626 6.558 344 HG2 GLN 40 HG2 GLN 40 15.164 -9.935 4.039 345 HG3 GLN 40 HG3 GLN 40 16.583 -10.508 4.876 346 HE21 GLN 40 HE21 GLN 40 15.306 -12.923 2.112 347 HE22 GLN 40 HE22 GLN 40 15.187 -11.170 2.116 348 HA PRO 41 HA PRO 41 10.707 -7.400 4.986 349 HB2 PRO 41 HB2 PRO 41 8.911 -7.053 7.093 350 HB3 PRO 41 HB3 PRO 41 8.610 -8.046 5.646 351 HG2 PRO 41 HG2 PRO 41 9.639 -8.954 8.346 352 HG3 PRO 41 HG3 PRO 41 8.348 -9.694 7.346 353 HD2 PRO 41 HD2 PRO 41 10.844 -10.700 7.354 354 HD3 PRO 41 HD3 PRO 41 9.931 -10.598 5.821 355 H ASP 42 H ASP 42 11.030 -5.313 5.478 356 HA ASP 42 HA ASP 42 13.109 -4.590 7.407 357 HB2 ASP 42 HB2 ASP 42 11.322 -2.973 5.535 358 HB3 ASP 42 HB3 ASP 42 12.614 -2.282 6.524 359 H TRP 43 H TRP 43 9.613 -4.517 7.278 360 HA TRP 43 HA TRP 43 9.401 -4.078 10.166 361 HB2 TRP 43 HB2 TRP 43 9.492 -1.763 9.485 362 HB3 TRP 43 HB3 TRP 43 8.388 -2.042 8.153 363 HD1 TRP 43 HD1 TRP 43 8.428 -1.252 11.845 364 HE1 TRP 43 HE1 TRP 43 6.049 -0.659 12.612 365 HE3 TRP 43 HE3 TRP 43 5.854 -2.835 7.734 366 HZ2 TRP 43 HZ2 TRP 43 3.390 -0.619 11.447 367 HZ3 TRP 43 HZ3 TRP 43 3.405 -2.387 7.531 368 HH2 TRP 43 HH2 TRP 43 2.164 -1.325 9.396 369 H THR 44 H THR 44 7.288 -4.683 10.974 370 HA THR 44 HA THR 44 5.262 -5.522 8.997 371 HB THR 44 HB THR 44 4.684 -7.537 10.193 372 HG1 THR 44 HG1 THR 44 7.120 -7.209 11.603 373 HG21 THR 44 HG21 THR 44 6.203 -7.690 8.284 374 HG22 THR 44 HG22 THR 44 7.597 -7.677 9.387 375 HG23 THR 44 HG23 THR 44 6.404 -9.005 9.447 376 H GLY 45 H GLY 45 3.149 -5.442 9.683 377 HA2 GLY 45 HA2 GLY 45 2.248 -4.850 12.329 378 HA3 GLY 45 HA3 GLY 45 2.540 -3.332 11.488 379 H ARG 46 H ARG 46 0.533 -2.618 11.230 380 HA ARG 46 HA ARG 46 -1.609 -4.335 10.036 381 HB2 ARG 46 HB2 ARG 46 -1.845 -1.863 11.787 382 HB3 ARG 46 HB3 ARG 46 -3.175 -2.872 11.205 383 HG2 ARG 46 HG2 ARG 46 -2.251 -4.793 12.520 384 HG3 ARG 46 HG3 ARG 46 -0.999 -3.730 13.172 385 HD2 ARG 46 HD2 ARG 46 -4.002 -3.273 13.500 386 HD3 ARG 46 HD3 ARG 46 -2.971 -4.071 14.683 387 HE ARG 46 HE ARG 46 -1.814 -2.033 15.133 388 HH11 ARG 46 HH11 ARG 46 -1.630 0.071 15.267 389 HH12 ARG 46 HH12 ARG 46 -2.756 1.130 14.390 390 HH21 ARG 46 HH21 ARG 46 -4.449 -1.314 12.853 391 HH22 ARG 46 HH22 ARG 46 -4.115 0.407 13.060 392 H LEU 47 H LEU 47 -2.996 -3.500 8.575 393 HA LEU 47 HA LEU 47 -2.144 -1.188 6.901 394 HB2 LEU 47 HB2 LEU 47 -2.688 -3.307 5.744 395 HB3 LEU 47 HB3 LEU 47 -4.226 -3.378 6.602 396 HG LEU 47 HG LEU 47 -4.944 -1.256 5.407 397 HD11 LEU 47 HD11 LEU 47 -2.481 -1.842 3.708 398 HD12 LEU 47 HD12 LEU 47 -3.754 -0.656 3.345 399 HD13 LEU 47 HD13 LEU 47 -2.703 -0.414 4.743 400 HD21 LEU 47 HD21 LEU 47 -5.530 -2.398 3.375 401 HD22 LEU 47 HD22 LEU 47 -4.279 -3.635 3.684 402 HD23 LEU 47 HD23 LEU 47 -5.687 -3.475 4.752 403 H ARG 48 H ARG 48 -3.262 0.688 6.886 404 HA ARG 48 HA ARG 48 -6.172 0.590 7.449 405 HB2 ARG 48 HB2 ARG 48 -5.030 1.702 9.383 406 HB3 ARG 48 HB3 ARG 48 -4.367 2.905 8.273 407 HG2 ARG 48 HG2 ARG 48 -6.707 3.526 7.602 408 HG3 ARG 48 HG3 ARG 48 -7.334 2.377 8.783 409 HD2 ARG 48 HD2 ARG 48 -5.682 4.874 9.329 410 HD3 ARG 48 HD3 ARG 48 -7.396 4.669 9.672 411 HE ARG 48 HE ARG 48 -5.140 3.810 11.283 412 HH11 ARG 48 HH11 ARG 48 -5.308 2.637 13.053 413 HH12 ARG 48 HH12 ARG 48 -6.876 2.089 13.630 414 HH21 ARG 48 HH21 ARG 48 -8.555 3.138 10.805 415 HH22 ARG 48 HH22 ARG 48 -8.673 2.315 12.336 416 H ILE 49 H ILE 49 -7.294 1.276 5.749 417 HA ILE 49 HA ILE 49 -6.040 3.174 3.804 418 HB ILE 49 HB ILE 49 -8.405 1.393 3.184 419 HG12 ILE 49 HG12 ILE 49 -5.474 1.024 2.396 420 HG13 ILE 49 HG13 ILE 49 -6.412 -0.025 3.461 421 HG21 ILE 49 HG21 ILE 49 -6.617 3.119 1.402 422 HG22 ILE 49 HG22 ILE 49 -8.017 2.170 0.864 423 HG23 ILE 49 HG23 ILE 49 -8.259 3.550 1.927 424 HD11 ILE 49 HD11 ILE 49 -8.029 -0.316 1.435 425 HD12 ILE 49 HD12 ILE 49 -6.661 0.291 0.471 426 HD13 ILE 49 HD13 ILE 49 -6.492 -1.172 1.457 427 H THR 50 H THR 50 -6.910 5.049 3.634 428 HA THR 50 HA THR 50 -9.307 5.930 5.189 429 HB THR 50 HB THR 50 -7.499 7.806 5.836 430 HG1 THR 50 HG1 THR 50 -5.804 6.214 5.003 431 HG21 THR 50 HG21 THR 50 -8.170 5.200 7.253 432 HG22 THR 50 HG22 THR 50 -7.393 6.583 8.050 433 HG23 THR 50 HG23 THR 50 -9.029 6.738 7.380 434 H SER 51 H SER 51 -10.096 8.072 4.452 435 HA SER 51 HA SER 51 -8.740 9.456 2.267 436 HB2 SER 51 HB2 SER 51 -9.838 7.606 1.015 437 HB3 SER 51 HB3 SER 51 -11.388 8.026 1.763 438 HG SER 51 HG SER 51 -9.829 9.848 0.207 439 H LYS 52 H LYS 52 -9.638 11.548 1.916 440 HA LYS 52 HA LYS 52 -11.800 12.309 3.831 441 HB2 LYS 52 HB2 LYS 52 -9.336 13.846 3.036 442 HB3 LYS 52 HB3 LYS 52 -10.591 14.284 4.246 443 HG2 LYS 52 HG2 LYS 52 -9.884 12.491 5.680 444 HG3 LYS 52 HG3 LYS 52 -8.719 11.910 4.494 445 HD2 LYS 52 HD2 LYS 52 -7.587 14.230 4.632 446 HD3 LYS 52 HD3 LYS 52 -8.619 14.527 6.045 447 HE2 LYS 52 HE2 LYS 52 -7.771 12.295 6.951 448 HE3 LYS 52 HE3 LYS 52 -6.581 12.286 5.644 449 HZ1 LYS 52 HZ1 LYS 52 -5.691 13.124 7.683 450 HZ2 LYS 52 HZ2 LYS 52 -5.702 14.373 6.601 451 HZ3 LYS 52 HZ3 LYS 52 -6.831 14.291 7.811 452 H GLY 53 H GLY 53 -10.396 13.414 0.748 453 HA2 GLY 53 HA2 GLY 53 -13.030 14.304 -0.227 454 HA3 GLY 53 HA3 GLY 53 -11.947 15.621 0.233 455 H LYS 54 H LYS 54 -12.406 12.880 -1.873 456 HA LYS 54 HA LYS 54 -11.527 12.131 -3.819 457 HB2 LYS 54 HB2 LYS 54 -10.872 15.037 -4.419 458 HB3 LYS 54 HB3 LYS 54 -10.939 13.709 -5.583 459 HG2 LYS 54 HG2 LYS 54 -13.345 13.376 -5.088 460 HG3 LYS 54 HG3 LYS 54 -13.297 14.738 -3.949 461 HD2 LYS 54 HD2 LYS 54 -12.583 16.245 -5.803 462 HD3 LYS 54 HD3 LYS 54 -12.729 14.883 -6.942 463 HE2 LYS 54 HE2 LYS 54 -15.117 14.632 -6.337 464 HE3 LYS 54 HE3 LYS 54 -14.972 15.954 -5.170 465 HZ1 LYS 54 HZ1 LYS 54 -15.898 16.735 -7.282 466 HZ2 LYS 54 HZ2 LYS 54 -14.454 17.449 -7.029 467 HZ3 LYS 54 HZ3 LYS 54 -14.587 16.229 -8.109 468 H THR 55 H THR 55 -9.852 12.334 -1.405 469 HA THR 55 HA THR 55 -7.253 11.712 -2.691 470 HB THR 55 HB THR 55 -7.418 13.429 -0.183 471 HG1 THR 55 HG1 THR 55 -8.084 14.701 -1.896 472 HG21 THR 55 HG21 THR 55 -5.024 13.791 -0.681 473 HG22 THR 55 HG22 THR 55 -5.383 12.075 -0.423 474 HG23 THR 55 HG23 THR 55 -5.153 12.693 -2.077 475 H ALA 56 H ALA 56 -6.673 9.771 -2.014 476 HA ALA 56 HA ALA 56 -7.748 8.679 0.541 477 HB1 ALA 56 HB1 ALA 56 -6.700 7.184 -1.879 478 HB2 ALA 56 HB2 ALA 56 -7.334 6.466 -0.386 479 HB3 ALA 56 HB3 ALA 56 -8.411 7.399 -1.439 480 H TYR 57 H TYR 57 -6.362 7.402 1.776 481 HA TYR 57 HA TYR 57 -3.440 7.978 1.689 482 HB2 TYR 57 HB2 TYR 57 -5.283 8.248 4.104 483 HB3 TYR 57 HB3 TYR 57 -3.548 8.511 4.081 484 HD1 TYR 57 HD1 TYR 57 -6.839 10.027 3.547 485 HD2 TYR 57 HD2 TYR 57 -2.616 10.456 2.724 486 HE1 TYR 57 HE1 TYR 57 -7.190 12.397 2.992 487 HE2 TYR 57 HE2 TYR 57 -2.983 12.881 2.225 488 HH TYR 57 HH TYR 57 -6.220 14.393 2.365 489 H ILE 58 H ILE 58 -2.530 5.969 1.528 490 HA ILE 58 HA ILE 58 -3.641 3.686 3.128 491 HB ILE 58 HB ILE 58 -1.340 3.738 1.138 492 HG12 ILE 58 HG12 ILE 58 -2.861 1.966 0.003 493 HG13 ILE 58 HG13 ILE 58 -4.177 2.647 0.955 494 HG21 ILE 58 HG21 ILE 58 -2.517 1.441 2.764 495 HG22 ILE 58 HG22 ILE 58 -1.285 1.281 1.490 496 HG23 ILE 58 HG23 ILE 58 -0.896 2.141 2.967 497 HD11 ILE 58 HD11 ILE 58 -3.890 4.804 -0.214 498 HD12 ILE 58 HD12 ILE 58 -2.405 4.193 -0.997 499 HD13 ILE 58 HD13 ILE 58 -3.986 3.496 -1.398 500 H LYS 59 H LYS 59 -3.191 3.840 5.182 501 HA LYS 59 HA LYS 59 -0.488 4.799 6.046 502 HB2 LYS 59 HB2 LYS 59 -3.134 4.837 7.546 503 HB3 LYS 59 HB3 LYS 59 -1.555 5.287 8.210 504 HG2 LYS 59 HG2 LYS 59 -1.383 6.941 6.221 505 HG3 LYS 59 HG3 LYS 59 -3.110 6.662 5.975 506 HD2 LYS 59 HD2 LYS 59 -3.604 7.490 8.227 507 HD3 LYS 59 HD3 LYS 59 -1.869 7.617 8.591 508 HE2 LYS 59 HE2 LYS 59 -1.655 9.245 6.662 509 HE3 LYS 59 HE3 LYS 59 -3.422 9.214 6.519 510 HZ1 LYS 59 HZ1 LYS 59 -3.551 10.007 8.815 511 HZ2 LYS 59 HZ2 LYS 59 -1.905 10.083 8.927 512 HZ3 LYS 59 HZ3 LYS 59 -2.719 11.063 7.897 513 H LEU 60 H LEU 60 0.805 3.596 7.129 514 HA LEU 60 HA LEU 60 0.019 0.806 7.896 515 HB2 LEU 60 HB2 LEU 60 2.484 2.055 6.744 516 HB3 LEU 60 HB3 LEU 60 2.726 0.830 7.982 517 HG LEU 60 HG LEU 60 1.524 -0.837 6.761 518 HD11 LEU 60 HD11 LEU 60 1.011 1.292 4.631 519 HD12 LEU 60 HD12 LEU 60 0.759 -0.454 4.406 520 HD13 LEU 60 HD13 LEU 60 -0.217 0.425 5.582 521 HD21 LEU 60 HD21 LEU 60 3.408 0.635 4.870 522 HD22 LEU 60 HD22 LEU 60 3.928 -0.341 6.256 523 HD23 LEU 60 HD23 LEU 60 3.066 -1.111 4.922 524 H GLU 61 H GLU 61 0.110 0.164 9.955 525 HA GLU 61 HA GLU 61 1.103 2.095 12.030 526 HB2 GLU 61 HB2 GLU 61 -1.587 0.701 11.965 527 HB3 GLU 61 HB3 GLU 61 -0.915 1.671 13.301 528 HG2 GLU 61 HG2 GLU 61 -0.926 3.668 11.869 529 HG3 GLU 61 HG3 GLU 61 -1.669 2.726 10.564 530 H ASP 62 H ASP 62 1.630 1.258 14.075 531 HA ASP 62 HA ASP 62 2.739 -1.389 13.986 532 HB2 ASP 62 HB2 ASP 62 3.615 0.721 15.136 533 HB3 ASP 62 HB3 ASP 62 2.405 0.393 16.394 534 H LYS 63 H LYS 63 2.245 -3.176 15.097 535 HA LYS 63 HA LYS 63 -0.562 -3.625 15.817 536 HB2 LYS 63 HB2 LYS 63 0.228 -6.072 15.857 537 HB3 LYS 63 HB3 LYS 63 0.327 -5.243 14.307 538 HG2 LYS 63 HG2 LYS 63 2.705 -4.864 14.555 539 HG3 LYS 63 HG3 LYS 63 2.701 -5.525 16.198 540 HD2 LYS 63 HD2 LYS 63 2.304 -7.739 15.407 541 HD3 LYS 63 HD3 LYS 63 1.849 -7.160 13.782 542 HE2 LYS 63 HE2 LYS 63 4.145 -6.261 13.466 543 HE3 LYS 63 HE3 LYS 63 4.623 -6.896 15.041 544 HZ1 LYS 63 HZ1 LYS 63 5.176 -8.313 13.061 545 HZ2 LYS 63 HZ2 LYS 63 4.341 -9.117 14.231 546 HZ3 LYS 63 HZ3 LYS 63 3.592 -8.628 12.858 547 H VAL 64 H VAL 64 2.076 -2.750 17.612 548 HA VAL 64 HA VAL 64 0.808 -3.819 20.103 549 HB VAL 64 HB VAL 64 3.730 -3.288 19.460 550 HG11 VAL 64 HG11 VAL 64 4.215 -4.202 21.735 551 HG12 VAL 64 HG12 VAL 64 3.350 -2.669 21.803 552 HG13 VAL 64 HG13 VAL 64 2.472 -4.191 22.092 553 HG21 VAL 64 HG21 VAL 64 2.257 -5.874 20.130 554 HG22 VAL 64 HG22 VAL 64 2.949 -5.431 18.555 555 HG23 VAL 64 HG23 VAL 64 4.017 -5.716 19.927 556 H SER 65 H SER 65 2.608 -1.047 18.673 557 HA SER 65 HA SER 65 1.954 0.578 21.061 558 HB2 SER 65 HB2 SER 65 3.615 1.180 18.595 559 HB3 SER 65 HB3 SER 65 3.411 2.270 19.980 560 HG SER 65 HG SER 65 5.313 1.004 20.145 561 H GLY 66 H GLY 66 0.768 0.212 17.796 562 HA2 GLY 66 HA2 GLY 66 -1.157 1.108 16.841 563 HA3 GLY 66 HA3 GLY 66 -1.407 2.128 18.256 564 H GLU 67 H GLU 67 1.760 2.460 17.118 565 HA GLU 67 HA GLU 67 1.255 5.204 16.321 566 HB2 GLU 67 HB2 GLU 67 3.590 5.512 16.547 567 HB3 GLU 67 HB3 GLU 67 3.033 4.494 17.886 568 HG2 GLU 67 HG2 GLU 67 3.911 2.488 16.742 569 HG3 GLU 67 HG3 GLU 67 4.470 3.481 15.394 570 H LEU 68 H LEU 68 2.087 6.220 14.412 571 HA LEU 68 HA LEU 68 1.534 4.716 11.989 572 HB2 LEU 68 HB2 LEU 68 0.882 7.111 12.391 573 HB3 LEU 68 HB3 LEU 68 2.589 7.543 12.380 574 HG LEU 68 HG LEU 68 2.703 6.638 9.985 575 HD11 LEU 68 HD11 LEU 68 0.624 5.272 10.011 576 HD12 LEU 68 HD12 LEU 68 -0.336 6.735 10.273 577 HD13 LEU 68 HD13 LEU 68 0.568 6.506 8.754 578 HD21 LEU 68 HD21 LEU 68 2.577 9.042 10.474 579 HD22 LEU 68 HD22 LEU 68 1.641 8.650 9.024 580 HD23 LEU 68 HD23 LEU 68 0.805 8.951 10.564 581 H PHE 69 H PHE 69 2.937 3.599 10.787 582 HA PHE 69 HA PHE 69 5.875 3.879 11.105 583 HB2 PHE 69 HB2 PHE 69 5.082 1.635 10.989 584 HB3 PHE 69 HB3 PHE 69 4.090 1.967 9.577 585 HD1 PHE 69 HD1 PHE 69 4.935 1.533 7.397 586 HD2 PHE 69 HD2 PHE 69 7.681 1.949 10.698 587 HE1 PHE 69 HE1 PHE 69 6.823 0.987 5.897 588 HE2 PHE 69 HE2 PHE 69 9.564 1.331 9.201 589 HZ PHE 69 HZ PHE 69 9.136 0.855 6.793 590 H ALA 70 H ALA 70 3.445 4.101 8.457 591 HA ALA 70 HA ALA 70 4.849 6.342 7.214 592 HB1 ALA 70 HB1 ALA 70 4.657 3.664 5.752 593 HB2 ALA 70 HB2 ALA 70 5.307 5.191 5.111 594 HB3 ALA 70 HB3 ALA 70 6.155 4.359 6.417 595 H GLN 71 H GLN 71 3.707 7.157 5.295 596 HA GLN 71 HA GLN 71 0.889 6.293 4.959 597 HB2 GLN 71 HB2 GLN 71 0.213 8.716 5.040 598 HB3 GLN 71 HB3 GLN 71 0.625 7.988 6.596 599 HG2 GLN 71 HG2 GLN 71 2.599 9.211 6.840 600 HG3 GLN 71 HG3 GLN 71 2.791 9.471 5.120 601 HE21 GLN 71 HE21 GLN 71 1.567 12.718 5.448 602 HE22 GLN 71 HE22 GLN 71 2.788 11.609 4.801 603 H ALA 72 H ALA 72 0.237 6.293 2.885 604 HA ALA 72 HA ALA 72 1.826 7.781 0.828 605 HB1 ALA 72 HB1 ALA 72 0.475 5.077 0.679 606 HB2 ALA 72 HB2 ALA 72 1.178 5.947 -0.702 607 HB3 ALA 72 HB3 ALA 72 2.214 5.431 0.637 608 HA PRO 73 HA PRO 73 -2.331 9.624 0.262 609 HB2 PRO 73 HB2 PRO 73 -1.561 12.000 -0.815 610 HB3 PRO 73 HB3 PRO 73 -1.457 11.657 0.938 611 HG2 PRO 73 HG2 PRO 73 0.749 11.453 -1.118 612 HG3 PRO 73 HG3 PRO 73 0.800 12.258 0.482 613 HD2 PRO 73 HD2 PRO 73 1.734 9.720 0.091 614 HD3 PRO 73 HD3 PRO 73 0.948 10.202 1.622 615 H VAL 74 H VAL 74 -3.604 9.667 -1.526 616 HA VAL 74 HA VAL 74 -2.472 9.127 -4.246 617 HB VAL 74 HB VAL 74 -4.805 7.593 -3.038 618 HG11 VAL 74 HG11 VAL 74 -4.365 6.022 -4.897 619 HG12 VAL 74 HG12 VAL 74 -4.729 7.642 -5.484 620 HG13 VAL 74 HG13 VAL 74 -3.046 7.062 -5.470 621 HG21 VAL 74 HG21 VAL 74 -1.920 6.656 -3.126 622 HG22 VAL 74 HG22 VAL 74 -2.927 6.905 -1.685 623 HG23 VAL 74 HG23 VAL 74 -3.338 5.631 -2.828 624 H GLU 75 H GLU 75 -3.441 10.458 -5.752 625 HA GLU 75 HA GLU 75 -5.868 11.983 -4.947 626 HB2 GLU 75 HB2 GLU 75 -4.015 12.211 -7.348 627 HB3 GLU 75 HB3 GLU 75 -5.401 13.262 -7.030 628 HG2 GLU 75 HG2 GLU 75 -4.387 13.938 -4.856 629 HG3 GLU 75 HG3 GLU 75 -2.967 12.957 -5.221 630 H GLN 76 H GLN 76 -5.100 9.322 -7.036 631 HA GLN 76 HA GLN 76 -7.865 8.682 -7.402 632 HB2 GLN 76 HB2 GLN 76 -8.082 8.727 -9.753 633 HB3 GLN 76 HB3 GLN 76 -7.592 10.337 -9.276 634 HG2 GLN 76 HG2 GLN 76 -5.831 8.221 -10.588 635 HG3 GLN 76 HG3 GLN 76 -6.535 9.623 -11.363 636 HE21 GLN 76 HE21 GLN 76 -3.083 10.058 -9.222 637 HE22 GLN 76 HE22 GLN 76 -4.030 8.562 -9.090 638 H TYR 77 H TYR 77 -8.144 6.495 -8.022 639 HA TYR 77 HA TYR 77 -5.662 4.875 -8.270 640 HB2 TYR 77 HB2 TYR 77 -6.800 4.600 -6.117 641 HB3 TYR 77 HB3 TYR 77 -8.268 4.107 -6.967 642 HD1 TYR 77 HD1 TYR 77 -8.623 1.837 -7.465 643 HD2 TYR 77 HD2 TYR 77 -4.635 3.228 -6.610 644 HE1 TYR 77 HE1 TYR 77 -7.799 -0.514 -7.488 645 HE2 TYR 77 HE2 TYR 77 -3.804 0.880 -6.733 646 HH TYR 77 HH TYR 77 -6.020 -1.887 -7.268 647 HA PRO 78 HA PRO 78 -4.758 3.166 -9.363 648 HB2 PRO 78 HB2 PRO 78 -3.666 2.747 -11.820 649 HB3 PRO 78 HB3 PRO 78 -4.709 1.548 -10.995 650 HG2 PRO 78 HG2 PRO 78 -5.527 3.588 -13.094 651 HG3 PRO 78 HG3 PRO 78 -5.875 1.828 -13.070 652 HD2 PRO 78 HD2 PRO 78 -7.685 3.649 -12.170 653 HD3 PRO 78 HD3 PRO 78 -7.478 2.076 -11.347 654 H GLY 79 H GLY 79 -2.854 4.333 -9.325 655 HA2 GLY 79 HA2 GLY 79 -2.430 6.768 -10.942 656 HA3 GLY 79 HA3 GLY 79 -2.645 6.988 -9.200 657 H ILE 80 H ILE 80 -0.406 7.889 -9.358 658 HA ILE 80 HA ILE 80 1.782 6.032 -9.917 659 HB ILE 80 HB ILE 80 2.050 8.362 -10.445 660 HG12 ILE 80 HG12 ILE 80 3.942 7.614 -8.173 661 HG13 ILE 80 HG13 ILE 80 3.996 6.889 -9.781 662 HG21 ILE 80 HG21 ILE 80 1.968 8.988 -7.452 663 HG22 ILE 80 HG22 ILE 80 2.234 10.135 -8.778 664 HG23 ILE 80 HG23 ILE 80 0.666 9.363 -8.602 665 HD11 ILE 80 HD11 ILE 80 5.693 8.600 -9.551 666 HD12 ILE 80 HD12 ILE 80 4.495 9.101 -10.767 667 HD13 ILE 80 HD13 ILE 80 4.481 9.823 -9.139 668 H ALA 81 H ALA 81 0.120 7.062 -6.970 669 HA ALA 81 HA ALA 81 2.295 6.170 -5.230 670 HB1 ALA 81 HB1 ALA 81 1.094 8.243 -4.788 671 HB2 ALA 81 HB2 ALA 81 -0.439 7.359 -4.666 672 HB3 ALA 81 HB3 ALA 81 0.841 7.099 -3.459 673 H VAL 82 H VAL 82 0.401 4.234 -6.835 674 HA VAL 82 HA VAL 82 0.488 2.115 -4.836 675 HB VAL 82 HB VAL 82 -2.154 2.717 -6.160 676 HG11 VAL 82 HG11 VAL 82 -1.337 0.743 -3.960 677 HG12 VAL 82 HG12 VAL 82 -2.997 0.986 -4.520 678 HG13 VAL 82 HG13 VAL 82 -1.787 0.315 -5.617 679 HG21 VAL 82 HG21 VAL 82 -1.931 4.442 -4.502 680 HG22 VAL 82 HG22 VAL 82 -3.111 3.256 -3.964 681 HG23 VAL 82 HG23 VAL 82 -1.483 3.252 -3.257 682 H GLU 83 H GLU 83 1.099 0.301 -5.839 683 HA GLU 83 HA GLU 83 0.495 -0.243 -8.712 684 HB2 GLU 83 HB2 GLU 83 3.205 0.145 -7.436 685 HB3 GLU 83 HB3 GLU 83 3.032 -1.127 -8.643 686 HG2 GLU 83 HG2 GLU 83 2.116 0.509 -10.255 687 HG3 GLU 83 HG3 GLU 83 2.387 1.805 -9.080 688 H THR 84 H THR 84 0.841 -2.434 -9.358 689 HA THR 84 HA THR 84 0.560 -4.518 -7.210 690 HB THR 84 HB THR 84 -0.445 -5.863 -9.033 691 HG1 THR 84 HG1 THR 84 -1.001 -4.827 -10.956 692 HG21 THR 84 HG21 THR 84 -1.808 -3.151 -8.696 693 HG22 THR 84 HG22 THR 84 -2.583 -4.672 -9.200 694 HG23 THR 84 HG23 THR 84 -1.912 -4.523 -7.572 695 H VAL 85 H VAL 85 1.579 -6.563 -7.598 696 HA VAL 85 HA VAL 85 4.075 -6.538 -9.191 697 HB VAL 85 HB VAL 85 4.518 -8.694 -8.220 698 HG11 VAL 85 HG11 VAL 85 3.591 -6.750 -6.065 699 HG12 VAL 85 HG12 VAL 85 4.815 -8.012 -5.897 700 HG13 VAL 85 HG13 VAL 85 5.115 -6.636 -6.967 701 HG21 VAL 85 HG21 VAL 85 2.181 -9.560 -8.083 702 HG22 VAL 85 HG22 VAL 85 3.072 -9.730 -6.579 703 HG23 VAL 85 HG23 VAL 85 1.865 -8.444 -6.744 704 H THR 86 H THR 86 4.416 -8.585 -10.559 705 HA THR 86 HA THR 86 2.114 -9.047 -12.350 706 HB THR 86 HB THR 86 3.772 -10.027 -13.841 707 HG1 THR 86 HG1 THR 86 5.935 -10.083 -13.201 708 HG21 THR 86 HG21 THR 86 3.548 -7.524 -13.707 709 HG22 THR 86 HG22 THR 86 4.913 -7.504 -12.577 710 HG23 THR 86 HG23 THR 86 5.158 -8.072 -14.237 711 H ASP 87 H ASP 87 4.043 -10.865 -10.053 712 HA ASP 87 HA ASP 87 3.270 -13.451 -11.129 713 HB2 ASP 87 HB2 ASP 87 5.532 -12.995 -10.323 714 HB3 ASP 87 HB3 ASP 87 4.904 -12.647 -8.708 715 H SER 88 H SER 88 2.717 -11.802 -8.012 716 HA SER 88 HA SER 88 0.518 -13.775 -7.357 717 HB2 SER 88 HB2 SER 88 2.920 -13.007 -5.672 718 HB3 SER 88 HB3 SER 88 1.439 -13.694 -4.984 719 HG SER 88 HG SER 88 3.189 -14.902 -6.887 720 H SER 89 H SER 89 -1.356 -12.722 -7.035 721 HA SER 89 HA SER 89 -1.499 -9.951 -6.913 722 HB2 SER 89 HB2 SER 89 -3.798 -11.580 -5.885 723 HB3 SER 89 HB3 SER 89 -3.810 -10.163 -6.934 724 HG SER 89 HG SER 89 -2.954 -11.487 -8.603 725 H ARG 90 H ARG 90 -0.731 -11.803 -4.178 726 HA ARG 90 HA ARG 90 -2.021 -10.003 -2.263 727 HB2 ARG 90 HB2 ARG 90 -1.610 -11.462 -0.560 728 HB3 ARG 90 HB3 ARG 90 -2.089 -12.432 -1.942 729 HG2 ARG 90 HG2 ARG 90 0.287 -13.026 -2.337 730 HG3 ARG 90 HG3 ARG 90 0.738 -12.090 -0.889 731 HD2 ARG 90 HD2 ARG 90 -0.665 -13.528 0.526 732 HD3 ARG 90 HD3 ARG 90 -1.236 -14.406 -0.891 733 HE ARG 90 HE ARG 90 0.782 -15.552 -1.073 734 HH11 ARG 90 HH11 ARG 90 2.623 -16.454 -0.269 735 HH12 ARG 90 HH12 ARG 90 3.396 -15.765 1.128 736 HH21 ARG 90 HH21 ARG 90 1.113 -13.251 1.595 737 HH22 ARG 90 HH22 ARG 90 2.608 -13.984 2.102 738 H TYR 91 H TYR 91 0.100 -8.924 -4.045 739 HA TYR 91 HA TYR 91 1.739 -7.666 -1.933 740 HB2 TYR 91 HB2 TYR 91 2.757 -8.955 -4.480 741 HB3 TYR 91 HB3 TYR 91 3.710 -7.922 -3.443 742 HD1 TYR 91 HD1 TYR 91 2.325 -11.283 -3.901 743 HD2 TYR 91 HD2 TYR 91 4.353 -8.659 -1.153 744 HE1 TYR 91 HE1 TYR 91 3.035 -13.249 -2.562 745 HE2 TYR 91 HE2 TYR 91 5.007 -10.627 0.230 746 HH TYR 91 HH TYR 91 4.238 -13.981 -0.745 747 H PHE 92 H PHE 92 2.131 -5.532 -2.248 748 HA PHE 92 HA PHE 92 1.496 -4.238 -4.852 749 HB2 PHE 92 HB2 PHE 92 0.430 -3.309 -2.155 750 HB3 PHE 92 HB3 PHE 92 0.227 -2.474 -3.680 751 HD1 PHE 92 HD1 PHE 92 -1.239 -3.452 -5.484 752 HD2 PHE 92 HD2 PHE 92 -0.972 -5.145 -1.539 753 HE1 PHE 92 HE1 PHE 92 -3.324 -4.758 -5.893 754 HE2 PHE 92 HE2 PHE 92 -3.080 -6.367 -1.911 755 HZ PHE 92 HZ PHE 92 -4.240 -6.224 -4.125 756 H VAL 93 H VAL 93 2.285 -2.016 -4.928 757 HA VAL 93 HA VAL 93 4.408 -1.334 -2.936 758 HB VAL 93 HB VAL 93 4.482 -0.935 -5.936 759 HG11 VAL 93 HG11 VAL 93 5.218 1.182 -4.942 760 HG12 VAL 93 HG12 VAL 93 6.355 0.313 -3.883 761 HG13 VAL 93 HG13 VAL 93 6.580 0.313 -5.642 762 HG21 VAL 93 HG21 VAL 93 6.679 -2.095 -5.671 763 HG22 VAL 93 HG22 VAL 93 6.351 -2.289 -3.953 764 HG23 VAL 93 HG23 VAL 93 5.302 -3.072 -5.156 765 H ILE 94 H ILE 94 4.342 0.773 -2.138 766 HA ILE 94 HA ILE 94 2.403 2.610 -3.405 767 HB ILE 94 HB ILE 94 1.504 3.414 -1.375 768 HG12 ILE 94 HG12 ILE 94 3.299 2.668 0.229 769 HG13 ILE 94 HG13 ILE 94 1.644 2.475 0.769 770 HG21 ILE 94 HG21 ILE 94 0.218 1.841 -2.634 771 HG22 ILE 94 HG22 ILE 94 0.918 0.465 -1.776 772 HG23 ILE 94 HG23 ILE 94 -0.110 1.629 -0.911 773 HD11 ILE 94 HD11 ILE 94 3.435 0.208 -0.212 774 HD12 ILE 94 HD12 ILE 94 2.994 0.578 1.462 775 HD13 ILE 94 HD13 ILE 94 1.755 0.041 0.323 776 H ARG 95 H ARG 95 2.757 4.782 -3.154 777 HA ARG 95 HA ARG 95 5.610 5.456 -2.583 778 HB2 ARG 95 HB2 ARG 95 4.521 6.120 -4.759 779 HB3 ARG 95 HB3 ARG 95 3.551 7.284 -3.839 780 HG2 ARG 95 HG2 ARG 95 5.696 8.295 -2.980 781 HG3 ARG 95 HG3 ARG 95 6.594 7.181 -4.031 782 HD2 ARG 95 HD2 ARG 95 5.392 8.154 -6.004 783 HD3 ARG 95 HD3 ARG 95 4.578 9.292 -4.911 784 HE ARG 95 HE ARG 95 7.440 9.448 -4.570 785 HH11 ARG 95 HH11 ARG 95 8.549 11.152 -5.205 786 HH12 ARG 95 HH12 ARG 95 7.985 12.182 -6.506 787 HH21 ARG 95 HH21 ARG 95 5.003 10.490 -6.868 788 HH22 ARG 95 HH22 ARG 95 5.986 11.822 -7.413 789 H ILE 96 H ILE 96 5.690 5.434 -0.382 790 HA ILE 96 HA ILE 96 3.849 7.050 1.202 791 HB ILE 96 HB ILE 96 5.048 6.485 3.154 792 HG12 ILE 96 HG12 ILE 96 6.897 4.534 2.732 793 HG13 ILE 96 HG13 ILE 96 7.219 5.512 1.312 794 HG21 ILE 96 HG21 ILE 96 4.578 4.085 1.379 795 HG22 ILE 96 HG22 ILE 96 4.697 4.049 3.143 796 HG23 ILE 96 HG23 ILE 96 3.385 4.939 2.397 797 HD11 ILE 96 HD11 ILE 96 7.597 7.486 2.827 798 HD12 ILE 96 HD12 ILE 96 7.259 6.428 4.222 799 HD13 ILE 96 HD13 ILE 96 8.668 6.120 3.195 800 H GLN 97 H GLN 97 4.178 8.981 2.199 801 HA GLN 97 HA GLN 97 6.419 10.737 1.274 802 HB2 GLN 97 HB2 GLN 97 3.459 11.062 0.700 803 HB3 GLN 97 HB3 GLN 97 4.582 12.417 0.658 804 HG2 GLN 97 HG2 GLN 97 5.705 11.666 -1.223 805 HG3 GLN 97 HG3 GLN 97 5.221 9.985 -1.015 806 HE21 GLN 97 HE21 GLN 97 2.187 10.305 -2.786 807 HE22 GLN 97 HE22 GLN 97 3.201 9.272 -1.778 808 H ASP 98 H ASP 98 6.830 12.436 2.554 809 HA ASP 98 HA ASP 98 5.521 12.486 5.229 810 HB2 ASP 98 HB2 ASP 98 8.088 13.758 4.295 811 HB3 ASP 98 HB3 ASP 98 7.421 13.920 5.910 812 H GLY 99 H GLY 99 4.739 13.903 2.444 813 HA2 GLY 99 HA2 GLY 99 3.092 15.493 2.063 814 HA3 GLY 99 HA3 GLY 99 3.140 15.960 3.764 815 H THR 100 H THR 100 6.194 16.018 2.271 816 HA THR 100 HA THR 100 6.113 18.963 1.755 817 HB THR 100 HB THR 100 6.837 18.418 4.052 818 HG1 THR 100 HG1 THR 100 8.782 19.539 2.340 819 HG21 THR 100 HG21 THR 100 8.009 16.278 3.661 820 HG22 THR 100 HG22 THR 100 9.282 17.139 2.764 821 HG23 THR 100 HG23 THR 100 9.031 17.460 4.491 822 H GLY 101 H GLY 101 6.394 16.376 0.008 823 HA2 GLY 101 HA2 GLY 101 7.279 16.242 -2.172 824 HA3 GLY 101 HA3 GLY 101 8.500 17.454 -1.787 825 H ARG 102 H ARG 102 8.655 15.391 0.756 826 HA ARG 102 HA ARG 102 10.819 13.638 -0.148 827 HB2 ARG 102 HB2 ARG 102 9.101 13.809 2.363 828 HB3 ARG 102 HB3 ARG 102 10.331 12.563 2.114 829 HG2 ARG 102 HG2 ARG 102 12.097 14.200 2.039 830 HG3 ARG 102 HG3 ARG 102 10.928 15.539 2.068 831 HD2 ARG 102 HD2 ARG 102 11.890 15.222 4.309 832 HD3 ARG 102 HD3 ARG 102 10.156 14.880 4.289 833 HE ARG 102 HE ARG 102 10.516 12.598 4.613 834 HH11 ARG 102 HH11 ARG 102 11.518 10.931 5.416 835 HH12 ARG 102 HH12 ARG 102 13.253 10.915 5.651 836 HH21 ARG 102 HH21 ARG 102 13.681 14.123 4.442 837 HH22 ARG 102 HH22 ARG 102 14.464 12.712 5.102 838 H SER 103 H SER 103 10.605 11.618 -0.696 839 HA SER 103 HA SER 103 8.221 10.093 -0.144 840 HB2 SER 103 HB2 SER 103 7.493 9.533 -2.350 841 HB3 SER 103 HB3 SER 103 7.576 11.295 -2.257 842 HG SER 103 HG SER 103 9.776 11.000 -3.197 843 H ALA 104 H ALA 104 8.283 7.858 -0.556 844 HA ALA 104 HA ALA 104 10.627 6.664 -1.867 845 HB1 ALA 104 HB1 ALA 104 11.290 6.696 0.521 846 HB2 ALA 104 HB2 ALA 104 9.772 5.878 0.957 847 HB3 ALA 104 HB3 ALA 104 10.983 5.039 -0.035 848 H PHE 105 H PHE 105 10.144 4.718 -2.871 849 HA PHE 105 HA PHE 105 7.302 3.797 -2.823 850 HB2 PHE 105 HB2 PHE 105 9.608 3.228 -4.703 851 HB3 PHE 105 HB3 PHE 105 8.123 2.296 -4.684 852 HD1 PHE 105 HD1 PHE 105 6.011 3.182 -5.502 853 HD2 PHE 105 HD2 PHE 105 9.572 5.614 -5.532 854 HE1 PHE 105 HE1 PHE 105 4.940 4.716 -7.108 855 HE2 PHE 105 HE2 PHE 105 8.487 7.169 -7.127 856 HZ PHE 105 HZ PHE 105 6.185 6.712 -7.943 857 H ILE 106 H ILE 106 6.804 2.262 -1.419 858 HA ILE 106 HA ILE 106 8.884 0.259 -0.609 859 HB ILE 106 HB ILE 106 7.993 0.075 1.550 860 HG12 ILE 106 HG12 ILE 106 5.858 2.142 0.874 861 HG13 ILE 106 HG13 ILE 106 5.580 0.411 1.078 862 HG21 ILE 106 HG21 ILE 106 8.199 3.058 1.001 863 HG22 ILE 106 HG22 ILE 106 8.659 2.190 2.485 864 HG23 ILE 106 HG23 ILE 106 9.593 1.960 1.000 865 HD11 ILE 106 HD11 ILE 106 4.916 1.524 3.094 866 HD12 ILE 106 HD12 ILE 106 6.345 0.528 3.423 867 HD13 ILE 106 HD13 ILE 106 6.501 2.291 3.275 868 H GLY 107 H GLY 107 8.284 -1.900 -0.383 869 HA2 GLY 107 HA2 GLY 107 5.847 -2.708 -1.895 870 HA3 GLY 107 HA3 GLY 107 7.234 -3.730 -1.519 871 H ILE 108 H ILE 108 4.262 -3.905 -0.955 872 HA ILE 108 HA ILE 108 4.553 -4.745 1.853 873 HB ILE 108 HB ILE 108 2.210 -4.251 2.311 874 HG12 ILE 108 HG12 ILE 108 2.214 -2.461 -0.153 875 HG13 ILE 108 HG13 ILE 108 1.389 -4.019 -0.050 876 HG21 ILE 108 HG21 ILE 108 2.604 -1.894 2.845 877 HG22 ILE 108 HG22 ILE 108 4.043 -2.877 3.116 878 HG23 ILE 108 HG23 ILE 108 3.940 -1.833 1.680 879 HD11 ILE 108 HD11 ILE 108 -0.237 -2.294 0.369 880 HD12 ILE 108 HD12 ILE 108 0.046 -3.172 1.887 881 HD13 ILE 108 HD13 ILE 108 0.751 -1.567 1.644 882 H GLY 109 H GLY 109 3.813 -6.669 2.382 883 HA2 GLY 109 HA2 GLY 109 2.437 -8.363 0.323 884 HA3 GLY 109 HA3 GLY 109 3.644 -8.967 1.460 885 H PHE 110 H PHE 110 0.704 -9.509 0.886 886 HA PHE 110 HA PHE 110 -0.547 -8.991 3.535 887 HB2 PHE 110 HB2 PHE 110 -1.592 -9.671 0.781 888 HB3 PHE 110 HB3 PHE 110 -2.589 -9.889 2.202 889 HD1 PHE 110 HD1 PHE 110 -3.977 -8.162 2.876 890 HD2 PHE 110 HD2 PHE 110 -0.431 -7.227 0.596 891 HE1 PHE 110 HE1 PHE 110 -4.617 -5.773 2.852 892 HE2 PHE 110 HE2 PHE 110 -1.041 -4.828 0.650 893 HZ PHE 110 HZ PHE 110 -3.116 -4.095 1.768 894 H THR 111 H THR 111 -1.718 -10.595 4.613 895 HA THR 111 HA THR 111 -0.390 -13.154 4.811 896 HB THR 111 HB THR 111 -1.344 -11.842 6.694 897 HG1 THR 111 HG1 THR 111 -0.908 -13.991 7.027 898 HG21 THR 111 HG21 THR 111 -3.524 -11.165 5.726 899 HG22 THR 111 HG22 THR 111 -4.062 -12.860 5.775 900 HG23 THR 111 HG23 THR 111 -3.695 -11.995 7.277 901 H ASP 112 H ASP 112 -3.126 -12.047 2.945 902 HA ASP 112 HA ASP 112 -3.488 -14.705 1.815 903 HB2 ASP 112 HB2 ASP 112 -4.962 -14.652 3.889 904 HB3 ASP 112 HB3 ASP 112 -5.869 -13.341 3.135 905 H ARG 113 H ARG 113 -4.510 -14.711 -0.192 906 HA ARG 113 HA ARG 113 -4.293 -12.320 -1.769 907 HB2 ARG 113 HB2 ARG 113 -3.945 -14.713 -2.510 908 HB3 ARG 113 HB3 ARG 113 -5.702 -14.939 -2.455 909 HG2 ARG 113 HG2 ARG 113 -5.974 -13.145 -4.156 910 HG3 ARG 113 HG3 ARG 113 -4.217 -12.885 -4.146 911 HD2 ARG 113 HD2 ARG 113 -3.903 -15.264 -4.886 912 HD3 ARG 113 HD3 ARG 113 -5.660 -15.446 -4.952 913 HE ARG 113 HE ARG 113 -4.183 -13.419 -6.626 914 HH11 ARG 113 HH11 ARG 113 -4.644 -13.222 -8.672 915 HH12 ARG 113 HH12 ARG 113 -5.758 -14.314 -9.476 916 HH21 ARG 113 HH21 ARG 113 -6.416 -16.135 -6.624 917 HH22 ARG 113 HH22 ARG 113 -6.747 -15.936 -8.322 918 H GLY 114 H GLY 114 -7.117 -13.815 -0.196 919 HA2 GLY 114 HA2 GLY 114 -9.125 -12.234 -1.560 920 HA3 GLY 114 HA3 GLY 114 -9.295 -13.080 -0.015 921 H ASP 115 H ASP 115 -7.012 -11.620 1.217 922 HA ASP 115 HA ASP 115 -8.479 -9.177 2.019 923 HB2 ASP 115 HB2 ASP 115 -5.970 -10.534 3.060 924 HB3 ASP 115 HB3 ASP 115 -6.541 -8.972 3.644 925 H ALA 116 H ALA 116 -5.485 -9.986 0.216 926 HA ALA 116 HA ALA 116 -4.729 -7.281 -0.356 927 HB1 ALA 116 HB1 ALA 116 -3.606 -8.422 -2.291 928 HB2 ALA 116 HB2 ALA 116 -3.290 -9.178 -0.711 929 HB3 ALA 116 HB3 ALA 116 -4.433 -9.915 -1.856 930 H PHE 117 H PHE 117 -7.038 -9.510 -2.038 931 HA PHE 117 HA PHE 117 -7.836 -7.607 -4.041 932 HB2 PHE 117 HB2 PHE 117 -8.926 -10.152 -2.934 933 HB3 PHE 117 HB3 PHE 117 -10.104 -9.055 -3.620 934 HD1 PHE 117 HD1 PHE 117 -10.502 -9.013 -5.929 935 HD2 PHE 117 HD2 PHE 117 -6.786 -10.644 -4.470 936 HE1 PHE 117 HE1 PHE 117 -9.923 -9.759 -8.224 937 HE2 PHE 117 HE2 PHE 117 -6.224 -11.409 -6.763 938 HZ PHE 117 HZ PHE 117 -7.786 -10.964 -8.644 939 H ASP 118 H ASP 118 -8.990 -8.073 -0.661 940 HA ASP 118 HA ASP 118 -11.022 -6.095 -0.840 941 HB2 ASP 118 HB2 ASP 118 -10.579 -7.963 0.934 942 HB3 ASP 118 HB3 ASP 118 -9.570 -6.771 1.741 943 H PHE 119 H PHE 119 -7.570 -5.745 0.053 944 HA PHE 119 HA PHE 119 -7.473 -2.943 0.613 945 HB2 PHE 119 HB2 PHE 119 -5.561 -4.230 1.027 946 HB3 PHE 119 HB3 PHE 119 -5.525 -4.921 -0.574 947 HD1 PHE 119 HD1 PHE 119 -4.475 -2.094 1.473 948 HD2 PHE 119 HD2 PHE 119 -4.720 -3.600 -2.550 949 HE1 PHE 119 HE1 PHE 119 -2.962 -0.318 0.728 950 HE2 PHE 119 HE2 PHE 119 -3.180 -1.820 -3.306 951 HZ PHE 119 HZ PHE 119 -2.288 -0.159 -1.676 952 H ASN 120 H ASN 120 -7.172 -4.597 -2.558 953 HA ASN 120 HA ASN 120 -7.000 -2.154 -4.057 954 HB2 ASN 120 HB2 ASN 120 -6.061 -4.020 -5.123 955 HB3 ASN 120 HB3 ASN 120 -7.343 -5.106 -4.600 956 HD21 ASN 120 HD21 ASN 120 -9.158 -4.856 -7.558 957 HD22 ASN 120 HD22 ASN 120 -8.910 -5.663 -6.021 958 H VAL 121 H VAL 121 -9.816 -4.287 -3.383 959 HA VAL 121 HA VAL 121 -11.625 -2.785 -5.012 960 HB VAL 121 HB VAL 121 -12.087 -4.713 -2.716 961 HG11 VAL 121 HG11 VAL 121 -14.183 -3.409 -4.512 962 HG12 VAL 121 HG12 VAL 121 -14.465 -4.820 -3.469 963 HG13 VAL 121 HG13 VAL 121 -14.064 -3.264 -2.743 964 HG21 VAL 121 HG21 VAL 121 -12.812 -6.214 -4.524 965 HG22 VAL 121 HG22 VAL 121 -12.591 -4.926 -5.728 966 HG23 VAL 121 HG23 VAL 121 -11.192 -5.618 -4.894 967 H SER 122 H SER 122 -10.718 -2.449 -1.572 968 HA SER 122 HA SER 122 -12.588 -0.378 -0.944 969 HB2 SER 122 HB2 SER 122 -9.861 -0.963 0.262 970 HB3 SER 122 HB3 SER 122 -11.102 0.092 0.967 971 HG SER 122 HG SER 122 -11.147 -2.704 0.559 972 H LEU 123 H LEU 123 -9.772 -0.184 -2.945 973 HA LEU 123 HA LEU 123 -9.749 2.795 -2.801 974 HB2 LEU 123 HB2 LEU 123 -8.006 0.815 -4.307 975 HB3 LEU 123 HB3 LEU 123 -7.892 2.564 -4.469 976 HG LEU 123 HG LEU 123 -7.454 1.098 -1.830 977 HD11 LEU 123 HD11 LEU 123 -5.068 1.457 -2.227 978 HD12 LEU 123 HD12 LEU 123 -5.763 0.462 -3.513 979 HD13 LEU 123 HD13 LEU 123 -5.420 2.179 -3.818 980 HD21 LEU 123 HD21 LEU 123 -6.380 3.213 -1.149 981 HD22 LEU 123 HD22 LEU 123 -6.826 3.953 -2.701 982 HD23 LEU 123 HD23 LEU 123 -8.081 3.468 -1.535 983 H GLN 124 H GLN 124 -10.233 0.210 -5.319 984 HA GLN 124 HA GLN 124 -11.018 2.186 -7.228 985 HB2 GLN 124 HB2 GLN 124 -11.293 0.491 -8.768 986 HB3 GLN 124 HB3 GLN 124 -10.045 -0.109 -7.668 987 HG2 GLN 124 HG2 GLN 124 -11.636 -1.553 -6.575 988 HG3 GLN 124 HG3 GLN 124 -12.951 -0.975 -7.606 989 HE21 GLN 124 HE21 GLN 124 -10.090 -3.375 -9.367 990 HE22 GLN 124 HE22 GLN 124 -9.623 -2.483 -7.925 991 H ASP 125 H ASP 125 -13.027 0.323 -4.973 992 HA ASP 125 HA ASP 125 -15.492 1.425 -6.150 993 HB2 ASP 125 HB2 ASP 125 -15.338 -0.951 -5.360 994 HB3 ASP 125 HB3 ASP 125 -15.152 -0.347 -3.709 995 H HIS 126 H HIS 126 -13.166 2.796 -4.365 996 HA HIS 126 HA HIS 126 -15.093 4.594 -2.955 997 HB2 HIS 126 HB2 HIS 126 -13.312 3.731 -1.528 998 HB3 HIS 126 HB3 HIS 126 -12.088 4.368 -2.634 999 HD2 HIS 126 HD2 HIS 126 -11.275 6.776 -2.152 1000 HE1 HIS 126 HE1 HIS 126 -14.465 8.149 0.324 1001 HE2 HIS 126 HE2 HIS 126 -12.159 8.707 -0.608 1002 H PHE 127 H PHE 127 -12.542 4.528 -5.463 1003 HA PHE 127 HA PHE 127 -12.975 7.375 -6.088 1004 HB2 PHE 127 HB2 PHE 127 -11.108 5.223 -7.108 1005 HB3 PHE 127 HB3 PHE 127 -11.246 6.775 -7.906 1006 HD1 PHE 127 HD1 PHE 127 -9.479 5.047 -5.364 1007 HD2 PHE 127 HD2 PHE 127 -11.055 8.924 -6.378 1008 HE1 PHE 127 HE1 PHE 127 -7.710 6.115 -3.999 1009 HE2 PHE 127 HE2 PHE 127 -9.301 9.999 -4.982 1010 HZ PHE 127 HZ PHE 127 -7.613 8.599 -3.814 1011 H LYS 128 H LYS 128 -14.712 4.632 -7.112 1012 HA LYS 128 HA LYS 128 -14.960 5.020 -9.822 1013 HB2 LYS 128 HB2 LYS 128 -16.874 3.745 -9.890 1014 HB3 LYS 128 HB3 LYS 128 -15.916 3.111 -8.570 1015 HG2 LYS 128 HG2 LYS 128 -18.334 4.965 -8.230 1016 HG3 LYS 128 HG3 LYS 128 -18.383 3.204 -8.183 1017 HD2 LYS 128 HD2 LYS 128 -16.783 3.235 -6.273 1018 HD3 LYS 128 HD3 LYS 128 -16.845 4.999 -6.262 1019 HE2 LYS 128 HE2 LYS 128 -18.309 4.262 -4.572 1020 HE3 LYS 128 HE3 LYS 128 -19.303 4.890 -5.898 1021 HZ1 LYS 128 HZ1 LYS 128 -18.722 1.990 -5.473 1022 HZ2 LYS 128 HZ2 LYS 128 -20.092 2.726 -4.956 1023 HZ3 LYS 128 HZ3 LYS 128 -19.778 2.611 -6.552 1024 H TRP 129 H TRP 129 -16.555 7.055 -7.472 1025 HA TRP 129 HA TRP 129 -18.226 8.425 -9.450 1026 HB2 TRP 129 HB2 TRP 129 -18.954 9.780 -7.605 1027 HB3 TRP 129 HB3 TRP 129 -18.967 8.090 -7.120 1028 HD1 TRP 129 HD1 TRP 129 -16.891 7.303 -5.491 1029 HE1 TRP 129 HE1 TRP 129 -15.413 8.547 -3.869 1030 HE3 TRP 129 HE3 TRP 129 -18.134 12.098 -6.816 1031 HZ2 TRP 129 HZ2 TRP 129 -15.039 11.304 -2.988 1032 HZ3 TRP 129 HZ3 TRP 129 -17.260 14.016 -5.501 1033 HH2 TRP 129 HH2 TRP 129 -15.712 13.635 -3.591 1034 H VAL 130 H VAL 130 -14.982 8.786 -8.261 1035 HA VAL 130 HA VAL 130 -14.646 11.571 -9.153 1036 HB VAL 130 HB VAL 130 -12.511 9.584 -8.299 1037 HG11 VAL 130 HG11 VAL 130 -11.208 11.626 -7.784 1038 HG12 VAL 130 HG12 VAL 130 -11.607 11.537 -9.499 1039 HG13 VAL 130 HG13 VAL 130 -12.522 12.631 -8.435 1040 HG21 VAL 130 HG21 VAL 130 -14.041 9.830 -6.422 1041 HG22 VAL 130 HG22 VAL 130 -12.607 10.799 -6.090 1042 HG23 VAL 130 HG23 VAL 130 -14.098 11.591 -6.641 1043 H LYS 131 H LYS 131 -14.114 8.297 -10.341 1044 HA LYS 131 HA LYS 131 -12.812 9.232 -12.827 1045 HB2 LYS 131 HB2 LYS 131 -11.765 7.454 -11.484 1046 HB3 LYS 131 HB3 LYS 131 -13.182 6.435 -11.681 1047 HG2 LYS 131 HG2 LYS 131 -11.192 5.873 -13.114 1048 HG3 LYS 131 HG3 LYS 131 -12.701 6.050 -13.994 1049 HD2 LYS 131 HD2 LYS 131 -12.046 8.283 -14.774 1050 HD3 LYS 131 HD3 LYS 131 -10.554 8.212 -13.804 1051 HE2 LYS 131 HE2 LYS 131 -9.741 6.324 -15.127 1052 HE3 LYS 131 HE3 LYS 131 -11.285 6.210 -15.986 1053 HZ1 LYS 131 HZ1 LYS 131 -9.620 7.403 -17.299 1054 HZ2 LYS 131 HZ2 LYS 131 -10.886 8.379 -16.951 1055 HZ3 LYS 131 HZ3 LYS 131 -9.465 8.551 -16.144 1056 H GLN 132 H GLN 132 -15.198 10.221 -12.820 1057 HA GLN 132 HA GLN 132 -16.977 8.495 -14.445 1058 HB2 GLN 132 HB2 GLN 132 -17.487 11.067 -12.919 1059 HB3 GLN 132 HB3 GLN 132 -18.622 10.412 -14.104 1060 HG2 GLN 132 HG2 GLN 132 -17.639 8.912 -11.648 1061 HG3 GLN 132 HG3 GLN 132 -19.167 9.783 -11.743 1062 HE21 GLN 132 HE21 GLN 132 -19.099 5.990 -13.013 1063 HE22 GLN 132 HE22 GLN 132 -17.851 6.710 -11.991 1064 H GLU 133 H GLU 133 -16.272 8.539 -16.418 1065 HA GLU 133 HA GLU 133 -15.060 10.694 -17.882 1066 HB2 GLU 133 HB2 GLU 133 -16.512 8.202 -18.851 1067 HB3 GLU 133 HB3 GLU 133 -15.588 9.282 -19.887 1068 HG2 GLU 133 HG2 GLU 133 -14.455 7.668 -17.557 1069 HG3 GLU 133 HG3 GLU 133 -14.346 7.236 -19.254 Start of MODEL 18 1 H1 GLY -4 H1 GLY -4 -12.102 32.149 16.976 2 H2 GLY -4 H2 GLY -4 -10.573 32.733 17.067 3 H3 GLY -4 H3 GLY -4 -11.313 32.165 18.412 4 HA2 GLY -4 HA2 GLY -4 -11.356 29.929 17.531 5 HA3 GLY -4 HA3 GLY -4 -10.578 30.539 16.060 6 H SER -3 H SER -3 -9.582 28.468 17.831 7 HA SER -3 HA SER -3 -7.497 29.478 19.540 8 HB2 SER -3 HB2 SER -3 -8.514 27.285 19.854 9 HB3 SER -3 HB3 SER -3 -7.888 26.738 18.288 10 HG SER -3 HG SER -3 -6.670 26.158 20.227 11 HA PRO -2 HA PRO -2 -4.380 30.234 16.341 12 HB2 PRO -2 HB2 PRO -2 -2.098 30.274 17.854 13 HB3 PRO -2 HB3 PRO -2 -3.304 31.596 17.861 14 HG2 PRO -2 HG2 PRO -2 -3.063 29.294 19.827 15 HG3 PRO -2 HG3 PRO -2 -3.213 31.045 20.189 16 HD2 PRO -2 HD2 PRO -2 -5.369 29.407 20.224 17 HD3 PRO -2 HD3 PRO -2 -5.500 31.069 19.575 18 H ASN -1 H ASN -1 -4.461 27.438 18.439 19 HA ASN -1 HA ASN -1 -2.368 25.885 17.192 20 HB2 ASN -1 HB2 ASN -1 -4.810 25.015 18.807 21 HB3 ASN -1 HB3 ASN -1 -3.421 24.010 18.420 22 HD21 ASN -1 HD21 ASN -1 -3.144 26.647 21.505 23 HD22 ASN -1 HD22 ASN -1 -4.588 26.611 20.501 24 H SER 0 H SER 0 -5.707 26.539 16.291 25 HA SER 0 HA SER 0 -6.006 24.314 14.445 26 HB2 SER 0 HB2 SER 0 -7.547 26.928 14.685 27 HB3 SER 0 HB3 SER 0 -8.045 25.506 13.756 28 HG SER 0 HG SER 0 -9.037 25.513 15.802 29 H MET 1 H MET 1 -4.310 27.295 14.201 30 HA MET 1 HA MET 1 -4.924 27.891 11.440 31 HB2 MET 1 HB2 MET 1 -2.828 29.127 13.257 32 HB3 MET 1 HB3 MET 1 -3.445 29.804 11.747 33 HG2 MET 1 HG2 MET 1 -5.060 29.352 14.282 34 HG3 MET 1 HG3 MET 1 -4.439 30.889 13.698 35 HE1 MET 1 HE1 MET 1 -8.334 31.225 13.354 36 HE2 MET 1 HE2 MET 1 -7.465 30.286 14.590 37 HE3 MET 1 HE3 MET 1 -6.856 31.882 14.093 38 H ALA 2 H ALA 2 -3.865 25.321 11.555 39 HA ALA 2 HA ALA 2 -1.701 25.486 9.597 40 HB1 ALA 2 HB1 ALA 2 -0.151 24.001 10.849 41 HB2 ALA 2 HB2 ALA 2 -0.380 25.549 11.682 42 HB3 ALA 2 HB3 ALA 2 -1.206 24.092 12.277 43 H THR 3 H THR 3 -3.489 23.261 11.775 44 HA THR 3 HA THR 3 -4.771 21.915 9.527 45 HB THR 3 HB THR 3 -2.968 20.367 11.443 46 HG1 THR 3 HG1 THR 3 -2.320 21.352 9.266 47 HG21 THR 3 HG21 THR 3 -5.007 19.313 9.425 48 HG22 THR 3 HG22 THR 3 -3.757 18.332 10.221 49 HG23 THR 3 HG23 THR 3 -5.032 19.067 11.190 50 H GLU 4 H GLU 4 -6.821 21.675 10.111 51 HA GLU 4 HA GLU 4 -7.558 21.116 12.943 52 HB2 GLU 4 HB2 GLU 4 -9.351 22.771 12.859 53 HB3 GLU 4 HB3 GLU 4 -7.781 23.523 12.616 54 HG2 GLU 4 HG2 GLU 4 -8.144 23.736 10.230 55 HG3 GLU 4 HG3 GLU 4 -9.622 22.766 10.309 56 H LEU 5 H LEU 5 -7.498 19.564 10.307 57 HA LEU 5 HA LEU 5 -10.307 18.937 9.764 58 HB2 LEU 5 HB2 LEU 5 -7.645 18.086 8.636 59 HB3 LEU 5 HB3 LEU 5 -8.993 16.983 8.483 60 HG LEU 5 HG LEU 5 -10.369 18.851 7.466 61 HD11 LEU 5 HD11 LEU 5 -9.030 20.795 8.168 62 HD12 LEU 5 HD12 LEU 5 -7.632 20.183 7.251 63 HD13 LEU 5 HD13 LEU 5 -9.107 20.701 6.405 64 HD21 LEU 5 HD21 LEU 5 -9.403 17.051 6.134 65 HD22 LEU 5 HD22 LEU 5 -9.321 18.580 5.250 66 HD23 LEU 5 HD23 LEU 5 -7.854 17.928 6.020 67 H GLU 6 H GLU 6 -11.400 17.984 11.317 68 HA GLU 6 HA GLU 6 -10.370 15.697 12.841 69 HB2 GLU 6 HB2 GLU 6 -11.914 17.467 13.771 70 HB3 GLU 6 HB3 GLU 6 -13.192 16.828 12.747 71 HG2 GLU 6 HG2 GLU 6 -13.460 15.960 14.975 72 HG3 GLU 6 HG3 GLU 6 -12.992 14.621 13.942 73 H TYR 7 H TYR 7 -9.838 14.862 10.534 74 HA TYR 7 HA TYR 7 -12.013 13.295 9.297 75 HB2 TYR 7 HB2 TYR 7 -10.887 15.750 8.559 76 HB3 TYR 7 HB3 TYR 7 -9.941 14.624 7.632 77 HD1 TYR 7 HD1 TYR 7 -11.531 12.662 6.500 78 HD2 TYR 7 HD2 TYR 7 -12.654 16.636 7.632 79 HE1 TYR 7 HE1 TYR 7 -13.186 12.683 4.639 80 HE2 TYR 7 HE2 TYR 7 -14.369 16.690 5.759 81 HH TYR 7 HH TYR 7 -14.829 13.887 3.560 82 H GLU 8 H GLU 8 -11.444 11.302 8.842 83 HA GLU 8 HA GLU 8 -9.205 10.559 7.329 84 HB2 GLU 8 HB2 GLU 8 -8.586 10.529 10.151 85 HB3 GLU 8 HB3 GLU 8 -8.731 8.839 9.624 86 HG2 GLU 8 HG2 GLU 8 -7.159 9.248 7.774 87 HG3 GLU 8 HG3 GLU 8 -7.013 10.937 8.252 88 H SER 9 H SER 9 -11.023 9.940 6.213 89 HA SER 9 HA SER 9 -13.108 8.233 7.243 90 HB2 SER 9 HB2 SER 9 -12.341 9.549 4.620 91 HB3 SER 9 HB3 SER 9 -13.639 8.322 4.642 92 HG SER 9 HG SER 9 -14.759 9.599 6.124 93 H VAL 10 H VAL 10 -12.515 6.200 7.828 94 HA VAL 10 HA VAL 10 -10.435 4.662 6.627 95 HB VAL 10 HB VAL 10 -12.702 3.751 8.432 96 HG11 VAL 10 HG11 VAL 10 -10.040 2.410 7.765 97 HG12 VAL 10 HG12 VAL 10 -11.134 1.917 9.076 98 HG13 VAL 10 HG13 VAL 10 -11.670 1.777 7.408 99 HG21 VAL 10 HG21 VAL 10 -11.291 5.521 9.464 100 HG22 VAL 10 HG22 VAL 10 -11.029 3.958 10.237 101 HG23 VAL 10 HG23 VAL 10 -9.834 4.579 9.076 102 H LEU 11 H LEU 11 -10.390 2.874 5.327 103 HA LEU 11 HA LEU 11 -12.786 2.332 3.605 104 HB2 LEU 11 HB2 LEU 11 -9.886 2.726 2.761 105 HB3 LEU 11 HB3 LEU 11 -11.160 2.131 1.712 106 HG LEU 11 HG LEU 11 -11.028 4.915 2.935 107 HD11 LEU 11 HD11 LEU 11 -9.405 4.600 1.149 108 HD12 LEU 11 HD12 LEU 11 -10.632 3.851 0.104 109 HD13 LEU 11 HD13 LEU 11 -10.746 5.566 0.532 110 HD21 LEU 11 HD21 LEU 11 -12.934 5.427 1.436 111 HD22 LEU 11 HD22 LEU 11 -13.055 3.705 0.997 112 HD23 LEU 11 HD23 LEU 11 -13.385 4.247 2.660 113 H CYS 12 H CYS 12 -9.623 1.069 4.748 114 HA CYS 12 HA CYS 12 -10.800 -1.597 5.081 115 HB2 CYS 12 HB2 CYS 12 -10.016 -1.568 2.698 116 HB3 CYS 12 HB3 CYS 12 -8.375 -1.211 3.284 117 HG CYS 12 HG CYS 12 -8.564 -3.726 2.561 118 H VAL 13 H VAL 13 -9.941 -2.590 6.781 119 HA VAL 13 HA VAL 13 -7.230 -1.830 7.753 120 HB VAL 13 HB VAL 13 -9.682 -2.277 9.480 121 HG11 VAL 13 HG11 VAL 13 -6.787 -1.780 10.316 122 HG12 VAL 13 HG12 VAL 13 -8.191 -1.796 11.400 123 HG13 VAL 13 HG13 VAL 13 -7.707 -3.280 10.579 124 HG21 VAL 13 HG21 VAL 13 -7.890 0.161 9.120 125 HG22 VAL 13 HG22 VAL 13 -9.547 0.004 8.508 126 HG23 VAL 13 HG23 VAL 13 -9.254 0.033 10.250 127 H LYS 14 H LYS 14 -5.910 -3.485 7.878 128 HA LYS 14 HA LYS 14 -6.950 -6.246 8.288 129 HB2 LYS 14 HB2 LYS 14 -4.773 -5.536 6.287 130 HB3 LYS 14 HB3 LYS 14 -5.258 -7.157 6.731 131 HG2 LYS 14 HG2 LYS 14 -7.099 -5.134 5.384 132 HG3 LYS 14 HG3 LYS 14 -6.157 -6.366 4.547 133 HD2 LYS 14 HD2 LYS 14 -7.351 -8.148 5.786 134 HD3 LYS 14 HD3 LYS 14 -8.347 -6.916 6.594 135 HE2 LYS 14 HE2 LYS 14 -9.209 -6.160 4.418 136 HE3 LYS 14 HE3 LYS 14 -8.179 -7.338 3.588 137 HZ1 LYS 14 HZ1 LYS 14 -10.373 -8.018 5.473 138 HZ2 LYS 14 HZ2 LYS 14 -10.409 -8.210 3.841 139 HZ3 LYS 14 HZ3 LYS 14 -9.381 -9.112 4.751 140 HA PRO 15 HA PRO 15 -4.022 -5.874 11.546 141 HB2 PRO 15 HB2 PRO 15 -4.101 -8.354 12.663 142 HB3 PRO 15 HB3 PRO 15 -5.491 -7.223 12.701 143 HG2 PRO 15 HG2 PRO 15 -4.985 -9.490 10.739 144 HG3 PRO 15 HG3 PRO 15 -6.484 -9.152 11.669 145 HD2 PRO 15 HD2 PRO 15 -6.178 -8.336 9.098 146 HD3 PRO 15 HD3 PRO 15 -7.025 -7.318 10.304 147 H ASP 16 H ASP 16 -3.262 -7.969 8.899 148 HA ASP 16 HA ASP 16 -0.431 -8.237 9.848 149 HB2 ASP 16 HB2 ASP 16 -2.194 -10.327 8.520 150 HB3 ASP 16 HB3 ASP 16 -0.436 -10.424 8.576 151 H VAL 17 H VAL 17 0.578 -6.759 8.695 152 HA VAL 17 HA VAL 17 0.825 -7.316 5.814 153 HB VAL 17 HB VAL 17 -0.797 -5.436 5.983 154 HG11 VAL 17 HG11 VAL 17 1.558 -3.786 6.985 155 HG12 VAL 17 HG12 VAL 17 -0.046 -3.184 6.529 156 HG13 VAL 17 HG13 VAL 17 0.133 -4.243 7.937 157 HG21 VAL 17 HG21 VAL 17 0.588 -5.771 3.973 158 HG22 VAL 17 HG22 VAL 17 0.212 -4.067 4.260 159 HG23 VAL 17 HG23 VAL 17 1.829 -4.684 4.652 160 H SER 18 H SER 18 2.839 -7.078 5.019 161 HA SER 18 HA SER 18 5.028 -6.382 6.962 162 HB2 SER 18 HB2 SER 18 4.994 -8.561 4.849 163 HB3 SER 18 HB3 SER 18 6.327 -8.180 5.960 164 HG SER 18 HG SER 18 4.983 -9.957 6.658 165 H VAL 19 H VAL 19 6.530 -4.967 6.283 166 HA VAL 19 HA VAL 19 6.396 -3.924 3.498 167 HB VAL 19 HB VAL 19 7.653 -2.794 6.003 168 HG11 VAL 19 HG11 VAL 19 7.725 -1.702 3.145 169 HG12 VAL 19 HG12 VAL 19 8.109 -0.753 4.601 170 HG13 VAL 19 HG13 VAL 19 9.119 -2.125 4.161 171 HG21 VAL 19 HG21 VAL 19 5.106 -2.620 5.597 172 HG22 VAL 19 HG22 VAL 19 5.990 -1.113 5.851 173 HG23 VAL 19 HG23 VAL 19 5.516 -1.590 4.213 174 H TYR 20 H TYR 20 7.879 -4.101 2.071 175 HA TYR 20 HA TYR 20 10.629 -4.866 2.872 176 HB2 TYR 20 HB2 TYR 20 9.783 -5.852 0.221 177 HB3 TYR 20 HB3 TYR 20 10.865 -6.550 1.410 178 HD1 TYR 20 HD1 TYR 20 9.938 -7.993 3.246 179 HD2 TYR 20 HD2 TYR 20 7.460 -6.398 0.113 180 HE1 TYR 20 HE1 TYR 20 8.167 -9.652 3.810 181 HE2 TYR 20 HE2 TYR 20 5.682 -8.053 0.680 182 HH TYR 20 HH TYR 20 6.085 -10.460 3.306 183 H ARG 21 H ARG 21 11.963 -3.349 2.275 184 HA ARG 21 HA ARG 21 11.489 -1.314 0.234 185 HB2 ARG 21 HB2 ARG 21 14.042 -2.354 1.538 186 HB3 ARG 21 HB3 ARG 21 13.997 -1.023 0.370 187 HG2 ARG 21 HG2 ARG 21 12.492 0.268 1.851 188 HG3 ARG 21 HG3 ARG 21 12.519 -1.041 3.048 189 HD2 ARG 21 HD2 ARG 21 14.979 -0.797 3.262 190 HD3 ARG 21 HD3 ARG 21 14.954 0.469 2.034 191 HE ARG 21 HE ARG 21 13.871 1.965 3.523 192 HH11 ARG 21 HH11 ARG 21 13.881 2.897 5.514 193 HH12 ARG 21 HH12 ARG 21 14.205 1.941 6.928 194 HH21 ARG 21 HH21 ARG 21 14.582 -1.039 5.269 195 HH22 ARG 21 HH22 ARG 21 14.659 -0.184 6.785 196 H ILE 22 H ILE 22 11.791 -1.374 -1.884 197 HA ILE 22 HA ILE 22 12.183 -4.046 -3.078 198 HB ILE 22 HB ILE 22 11.064 -3.160 -5.059 199 HG12 ILE 22 HG12 ILE 22 10.733 -0.564 -3.490 200 HG13 ILE 22 HG13 ILE 22 11.714 -0.793 -4.942 201 HG21 ILE 22 HG21 ILE 22 9.426 -2.593 -2.566 202 HG22 ILE 22 HG22 ILE 22 8.860 -3.190 -4.146 203 HG23 ILE 22 HG23 ILE 22 9.854 -4.223 -3.117 204 HD11 ILE 22 HD11 ILE 22 9.671 0.229 -5.635 205 HD12 ILE 22 HD12 ILE 22 9.606 -1.467 -6.169 206 HD13 ILE 22 HD13 ILE 22 8.691 -0.941 -4.738 207 HA PRO 23 HA PRO 23 15.912 -2.833 -5.339 208 HB2 PRO 23 HB2 PRO 23 15.807 -4.538 -7.474 209 HB3 PRO 23 HB3 PRO 23 16.209 -5.089 -5.818 210 HG2 PRO 23 HG2 PRO 23 13.514 -5.187 -7.213 211 HG3 PRO 23 HG3 PRO 23 14.358 -6.506 -6.336 212 HD2 PRO 23 HD2 PRO 23 12.436 -4.971 -5.163 213 HD3 PRO 23 HD3 PRO 23 13.845 -5.566 -4.238 214 HA PRO 24 HA PRO 24 14.381 0.112 -8.292 215 HB2 PRO 24 HB2 PRO 24 16.329 0.250 -10.240 216 HB3 PRO 24 HB3 PRO 24 16.501 0.931 -8.593 217 HG2 PRO 24 HG2 PRO 24 17.478 -1.759 -9.605 218 HG3 PRO 24 HG3 PRO 24 18.389 -0.532 -8.668 219 HD2 PRO 24 HD2 PRO 24 17.250 -2.657 -7.448 220 HD3 PRO 24 HD3 PRO 24 17.206 -1.046 -6.676 221 H ARG 25 H ARG 25 13.045 0.197 -10.026 222 HA ARG 25 HA ARG 25 12.126 -2.277 -11.193 223 HB2 ARG 25 HB2 ARG 25 10.814 -0.068 -10.603 224 HB3 ARG 25 HB3 ARG 25 11.402 0.498 -12.159 225 HG2 ARG 25 HG2 ARG 25 10.243 -2.050 -12.703 226 HG3 ARG 25 HG3 ARG 25 9.188 -1.340 -11.516 227 HD2 ARG 25 HD2 ARG 25 10.067 0.061 -14.072 228 HD3 ARG 25 HD3 ARG 25 8.563 -0.836 -13.901 229 HE ARG 25 HE ARG 25 9.170 1.823 -12.812 230 HH11 ARG 25 HH11 ARG 25 7.638 2.919 -11.573 231 HH12 ARG 25 HH12 ARG 25 6.221 2.051 -11.011 232 HH21 ARG 25 HH21 ARG 25 6.949 -0.887 -12.523 233 HH22 ARG 25 HH22 ARG 25 5.768 0.089 -11.668 234 H ALA 26 H ALA 26 11.894 -2.777 -13.373 235 HA ALA 26 HA ALA 26 12.835 -0.855 -15.344 236 HB1 ALA 26 HB1 ALA 26 14.698 -2.383 -15.343 237 HB2 ALA 26 HB2 ALA 26 13.622 -3.781 -15.516 238 HB3 ALA 26 HB3 ALA 26 13.768 -2.598 -16.843 239 H SER 27 H SER 27 11.717 -1.105 -17.360 240 HA SER 27 HA SER 27 8.885 -1.278 -16.816 241 HB2 SER 27 HB2 SER 27 8.717 -0.246 -19.064 242 HB3 SER 27 HB3 SER 27 9.876 0.592 -18.007 243 HG SER 27 HG SER 27 10.795 0.305 -20.047 244 H ASN 28 H ASN 28 11.120 -3.014 -18.898 245 HA ASN 28 HA ASN 28 9.032 -4.864 -19.913 246 HB2 ASN 28 HB2 ASN 28 11.956 -4.374 -20.613 247 HB3 ASN 28 HB3 ASN 28 11.041 -5.740 -21.241 248 HD21 ASN 28 HD21 ASN 28 10.021 -2.014 -22.635 249 HD22 ASN 28 HD22 ASN 28 10.750 -2.107 -21.042 250 H ARG 29 H ARG 29 9.931 -4.696 -17.057 251 HA ARG 29 HA ARG 29 10.487 -7.586 -16.570 252 HB2 ARG 29 HB2 ARG 29 11.893 -5.238 -15.200 253 HB3 ARG 29 HB3 ARG 29 12.014 -6.920 -14.697 254 HG2 ARG 29 HG2 ARG 29 12.944 -5.834 -17.395 255 HG3 ARG 29 HG3 ARG 29 13.978 -6.187 -16.004 256 HD2 ARG 29 HD2 ARG 29 13.220 -8.542 -16.009 257 HD3 ARG 29 HD3 ARG 29 12.223 -8.244 -17.418 258 HE ARG 29 HE ARG 29 15.178 -8.431 -17.324 259 HH11 ARG 29 HH11 ARG 29 16.288 -8.696 -19.217 260 HH12 ARG 29 HH12 ARG 29 15.481 -8.483 -20.742 261 HH21 ARG 29 HH21 ARG 29 12.413 -7.721 -19.399 262 HH22 ARG 29 HH22 ARG 29 13.356 -7.970 -20.847 263 H GLY 30 H GLY 30 9.765 -4.543 -14.697 264 HA2 GLY 30 HA2 GLY 30 7.933 -4.146 -13.409 265 HA3 GLY 30 HA3 GLY 30 7.263 -5.730 -13.844 266 H TYR 31 H TYR 31 7.094 -4.724 -11.319 267 HA TYR 31 HA TYR 31 8.945 -6.056 -9.508 268 HB2 TYR 31 HB2 TYR 31 6.112 -5.046 -9.054 269 HB3 TYR 31 HB3 TYR 31 7.317 -5.433 -7.831 270 HD1 TYR 31 HD1 TYR 31 5.671 -2.812 -8.309 271 HD2 TYR 31 HD2 TYR 31 9.686 -3.991 -9.452 272 HE1 TYR 31 HE1 TYR 31 6.420 -0.476 -8.120 273 HE2 TYR 31 HE2 TYR 31 10.450 -1.677 -9.096 274 HH TYR 31 HH TYR 31 8.186 0.998 -8.300 275 H ARG 32 H ARG 32 8.795 -8.155 -8.808 276 HA ARG 32 HA ARG 32 6.421 -9.793 -9.634 277 HB2 ARG 32 HB2 ARG 32 7.972 -11.650 -10.169 278 HB3 ARG 32 HB3 ARG 32 8.021 -10.295 -11.270 279 HG2 ARG 32 HG2 ARG 32 10.073 -10.545 -9.042 280 HG3 ARG 32 HG3 ARG 32 10.231 -11.447 -10.555 281 HD2 ARG 32 HD2 ARG 32 10.093 -9.333 -11.852 282 HD3 ARG 32 HD3 ARG 32 10.054 -8.420 -10.337 283 HE ARG 32 HE ARG 32 12.349 -10.069 -10.236 284 HH11 ARG 32 HH11 ARG 32 14.280 -9.356 -10.531 285 HH12 ARG 32 HH12 ARG 32 14.634 -7.902 -11.461 286 HH21 ARG 32 HH21 ARG 32 11.270 -7.194 -11.960 287 HH22 ARG 32 HH22 ARG 32 12.920 -6.668 -12.216 288 H ALA 33 H ALA 33 7.068 -8.671 -7.048 289 HA ALA 33 HA ALA 33 7.173 -9.096 -4.848 290 HB1 ALA 33 HB1 ALA 33 5.767 -11.647 -5.695 291 HB2 ALA 33 HB2 ALA 33 5.724 -10.886 -4.083 292 HB3 ALA 33 HB3 ALA 33 5.028 -10.057 -5.498 293 H SER 34 H SER 34 8.209 -12.156 -6.429 294 HA SER 34 HA SER 34 9.706 -13.149 -4.255 295 HB2 SER 34 HB2 SER 34 10.008 -13.729 -7.220 296 HB3 SER 34 HB3 SER 34 10.653 -14.724 -5.899 297 HG SER 34 HG SER 34 8.624 -15.497 -6.667 298 H ASP 35 H ASP 35 10.633 -10.630 -6.431 299 HA ASP 35 HA ASP 35 13.517 -10.928 -5.849 300 HB2 ASP 35 HB2 ASP 35 11.933 -9.540 -7.844 301 HB3 ASP 35 HB3 ASP 35 12.963 -8.387 -7.030 302 H TRP 36 H TRP 36 10.887 -9.720 -4.080 303 HA TRP 36 HA TRP 36 12.389 -7.587 -2.716 304 HB2 TRP 36 HB2 TRP 36 9.641 -8.695 -2.112 305 HB3 TRP 36 HB3 TRP 36 10.334 -7.188 -1.569 306 HD1 TRP 36 HD1 TRP 36 11.143 -6.835 -5.015 307 HE1 TRP 36 HE1 TRP 36 9.302 -5.593 -6.339 308 HE3 TRP 36 HE3 TRP 36 7.220 -7.506 -1.804 309 HZ2 TRP 36 HZ2 TRP 36 6.616 -4.729 -5.892 310 HZ3 TRP 36 HZ3 TRP 36 5.026 -6.404 -2.254 311 HH2 TRP 36 HH2 TRP 36 4.725 -5.035 -4.295 312 H LYS 37 H LYS 37 12.169 -7.690 -0.278 313 HA LYS 37 HA LYS 37 13.576 -10.070 0.673 314 HB2 LYS 37 HB2 LYS 37 12.836 -7.467 2.044 315 HB3 LYS 37 HB3 LYS 37 13.767 -8.762 2.789 316 HG2 LYS 37 HG2 LYS 37 15.435 -8.613 0.925 317 HG3 LYS 37 HG3 LYS 37 14.600 -7.143 0.371 318 HD2 LYS 37 HD2 LYS 37 16.033 -7.643 2.998 319 HD3 LYS 37 HD3 LYS 37 16.470 -6.491 1.720 320 HE2 LYS 37 HE2 LYS 37 14.262 -5.305 2.182 321 HE3 LYS 37 HE3 LYS 37 14.036 -6.390 3.559 322 HZ1 LYS 37 HZ1 LYS 37 15.034 -4.229 4.170 323 HZ2 LYS 37 HZ2 LYS 37 16.037 -5.469 4.558 324 HZ3 LYS 37 HZ3 LYS 37 16.345 -4.536 3.246 325 H LEU 38 H LEU 38 11.338 -11.160 0.073 326 HA LEU 38 HA LEU 38 9.166 -11.064 1.882 327 HB2 LEU 38 HB2 LEU 38 10.062 -13.459 0.240 328 HB3 LEU 38 HB3 LEU 38 8.453 -13.179 0.902 329 HG LEU 38 HG LEU 38 9.827 -11.600 -1.292 330 HD11 LEU 38 HD11 LEU 38 7.324 -13.360 -1.232 331 HD12 LEU 38 HD12 LEU 38 7.925 -12.488 -2.650 332 HD13 LEU 38 HD13 LEU 38 8.892 -13.797 -1.950 333 HD21 LEU 38 HD21 LEU 38 7.614 -10.400 -1.510 334 HD22 LEU 38 HD22 LEU 38 7.150 -11.104 0.056 335 HD23 LEU 38 HD23 LEU 38 8.523 -9.983 -0.056 336 H ASP 39 H ASP 39 12.217 -12.493 2.526 337 HA ASP 39 HA ASP 39 11.095 -14.139 4.758 338 HB2 ASP 39 HB2 ASP 39 12.454 -15.274 2.976 339 HB3 ASP 39 HB3 ASP 39 13.843 -14.329 3.497 340 H GLN 40 H GLN 40 12.361 -11.110 4.251 341 HA GLN 40 HA GLN 40 12.892 -10.761 7.102 342 HB2 GLN 40 HB2 GLN 40 15.050 -9.541 6.730 343 HB3 GLN 40 HB3 GLN 40 15.102 -11.288 6.719 344 HG2 GLN 40 HG2 GLN 40 15.148 -9.589 4.202 345 HG3 GLN 40 HG3 GLN 40 16.579 -10.101 5.062 346 HE21 GLN 40 HE21 GLN 40 15.448 -12.563 2.276 347 HE22 GLN 40 HE22 GLN 40 15.251 -10.818 2.281 348 HA PRO 41 HA PRO 41 10.501 -7.263 5.272 349 HB2 PRO 41 HB2 PRO 41 9.465 -7.364 8.103 350 HB3 PRO 41 HB3 PRO 41 8.561 -7.042 6.602 351 HG2 PRO 41 HG2 PRO 41 8.434 -9.484 7.791 352 HG3 PRO 41 HG3 PRO 41 8.580 -9.364 6.011 353 HD2 PRO 41 HD2 PRO 41 10.753 -9.934 8.037 354 HD3 PRO 41 HD3 PRO 41 10.432 -10.730 6.467 355 H ASP 42 H ASP 42 10.870 -5.108 5.552 356 HA ASP 42 HA ASP 42 13.005 -4.145 7.332 357 HB2 ASP 42 HB2 ASP 42 11.040 -2.758 5.461 358 HB3 ASP 42 HB3 ASP 42 12.295 -1.922 6.380 359 H TRP 43 H TRP 43 9.500 -4.327 7.332 360 HA TRP 43 HA TRP 43 9.329 -3.803 10.197 361 HB2 TRP 43 HB2 TRP 43 9.330 -1.504 9.458 362 HB3 TRP 43 HB3 TRP 43 8.203 -1.853 8.163 363 HD1 TRP 43 HD1 TRP 43 8.311 -0.968 11.834 364 HE1 TRP 43 HE1 TRP 43 5.939 -0.365 12.617 365 HE3 TRP 43 HE3 TRP 43 5.692 -2.707 7.821 366 HZ2 TRP 43 HZ2 TRP 43 3.258 -0.374 11.487 367 HZ3 TRP 43 HZ3 TRP 43 3.240 -2.264 7.631 368 HH2 TRP 43 HH2 TRP 43 2.017 -1.145 9.471 369 H THR 44 H THR 44 7.253 -4.412 11.065 370 HA THR 44 HA THR 44 5.223 -5.492 9.193 371 HB THR 44 HB THR 44 4.756 -7.376 10.753 372 HG1 THR 44 HG1 THR 44 6.465 -8.021 12.116 373 HG21 THR 44 HG21 THR 44 6.002 -7.689 8.647 374 HG22 THR 44 HG22 THR 44 7.533 -7.494 9.532 375 HG23 THR 44 HG23 THR 44 6.447 -8.860 9.893 376 H GLY 45 H GLY 45 3.145 -5.227 9.770 377 HA2 GLY 45 HA2 GLY 45 2.222 -4.489 12.395 378 HA3 GLY 45 HA3 GLY 45 2.457 -3.058 11.419 379 H ARG 46 H ARG 46 0.351 -2.505 11.343 380 HA ARG 46 HA ARG 46 -1.619 -4.357 10.057 381 HB2 ARG 46 HB2 ARG 46 -2.245 -1.970 11.827 382 HB3 ARG 46 HB3 ARG 46 -3.364 -3.177 11.191 383 HG2 ARG 46 HG2 ARG 46 -2.075 -4.918 12.615 384 HG3 ARG 46 HG3 ARG 46 -1.242 -3.549 13.339 385 HD2 ARG 46 HD2 ARG 46 -3.458 -2.561 13.968 386 HD3 ARG 46 HD3 ARG 46 -4.262 -3.992 13.296 387 HE ARG 46 HE ARG 46 -2.383 -4.909 15.205 388 HH11 ARG 46 HH11 ARG 46 -2.726 -5.097 17.407 389 HH12 ARG 46 HH12 ARG 46 -4.306 -4.733 18.044 390 HH21 ARG 46 HH21 ARG 46 -5.462 -3.247 15.178 391 HH22 ARG 46 HH22 ARG 46 -5.779 -3.622 16.850 392 H LEU 47 H LEU 47 -2.879 -3.634 8.469 393 HA LEU 47 HA LEU 47 -2.091 -1.244 6.897 394 HB2 LEU 47 HB2 LEU 47 -2.545 -3.439 5.776 395 HB3 LEU 47 HB3 LEU 47 -4.143 -3.454 6.517 396 HG LEU 47 HG LEU 47 -4.668 -1.306 5.220 397 HD11 LEU 47 HD11 LEU 47 -2.149 -2.144 3.712 398 HD12 LEU 47 HD12 LEU 47 -3.317 -0.913 3.191 399 HD13 LEU 47 HD13 LEU 47 -2.351 -0.644 4.645 400 HD21 LEU 47 HD21 LEU 47 -5.101 -2.587 3.140 401 HD22 LEU 47 HD22 LEU 47 -4.065 -3.890 3.770 402 HD23 LEU 47 HD23 LEU 47 -5.572 -3.455 4.599 403 H ARG 48 H ARG 48 -3.251 0.629 6.985 404 HA ARG 48 HA ARG 48 -6.143 0.526 7.591 405 HB2 ARG 48 HB2 ARG 48 -5.184 1.036 9.754 406 HB3 ARG 48 HB3 ARG 48 -4.193 2.335 9.084 407 HG2 ARG 48 HG2 ARG 48 -6.049 3.749 8.736 408 HG3 ARG 48 HG3 ARG 48 -7.224 2.429 8.840 409 HD2 ARG 48 HD2 ARG 48 -6.909 2.195 11.206 410 HD3 ARG 48 HD3 ARG 48 -5.497 3.241 11.206 411 HE ARG 48 HE ARG 48 -8.311 4.065 11.163 412 HH11 ARG 48 HH11 ARG 48 -8.819 6.288 11.176 413 HH12 ARG 48 HH12 ARG 48 -7.483 7.422 10.952 414 HH21 ARG 48 HH21 ARG 48 -4.960 5.258 10.830 415 HH22 ARG 48 HH22 ARG 48 -5.584 6.916 10.716 416 H ILE 49 H ILE 49 -6.504 0.743 5.489 417 HA ILE 49 HA ILE 49 -5.545 3.061 3.958 418 HB ILE 49 HB ILE 49 -7.908 1.304 3.250 419 HG12 ILE 49 HG12 ILE 49 -4.961 0.870 2.591 420 HG13 ILE 49 HG13 ILE 49 -6.019 -0.187 3.542 421 HG21 ILE 49 HG21 ILE 49 -7.622 3.527 2.076 422 HG22 ILE 49 HG22 ILE 49 -6.034 2.983 1.513 423 HG23 ILE 49 HG23 ILE 49 -7.510 2.147 0.986 424 HD11 ILE 49 HD11 ILE 49 -5.980 -1.236 1.496 425 HD12 ILE 49 HD12 ILE 49 -7.491 -0.339 1.426 426 HD13 ILE 49 HD13 ILE 49 -6.057 0.274 0.563 427 H THR 50 H THR 50 -6.295 4.960 4.195 428 HA THR 50 HA THR 50 -8.998 5.578 5.293 429 HB THR 50 HB THR 50 -7.663 7.745 6.059 430 HG1 THR 50 HG1 THR 50 -5.722 5.716 6.277 431 HG21 THR 50 HG21 THR 50 -7.727 5.108 7.558 432 HG22 THR 50 HG22 THR 50 -7.378 6.698 8.283 433 HG23 THR 50 HG23 THR 50 -8.964 6.389 7.559 434 H SER 51 H SER 51 -9.378 8.049 4.770 435 HA SER 51 HA SER 51 -8.369 9.082 2.273 436 HB2 SER 51 HB2 SER 51 -10.551 9.095 1.181 437 HB3 SER 51 HB3 SER 51 -9.997 7.434 1.410 438 HG SER 51 HG SER 51 -11.361 7.429 3.342 439 H LYS 52 H LYS 52 -9.609 11.131 1.807 440 HA LYS 52 HA LYS 52 -11.241 12.101 4.037 441 HB2 LYS 52 HB2 LYS 52 -8.841 13.672 3.166 442 HB3 LYS 52 HB3 LYS 52 -10.164 14.256 4.219 443 HG2 LYS 52 HG2 LYS 52 -9.472 12.816 6.016 444 HG3 LYS 52 HG3 LYS 52 -8.300 11.997 5.014 445 HD2 LYS 52 HD2 LYS 52 -7.143 14.242 4.668 446 HD3 LYS 52 HD3 LYS 52 -8.213 14.875 5.939 447 HE2 LYS 52 HE2 LYS 52 -7.386 13.001 7.425 448 HE3 LYS 52 HE3 LYS 52 -6.257 12.541 6.151 449 HZ1 LYS 52 HZ1 LYS 52 -5.201 13.989 7.802 450 HZ2 LYS 52 HZ2 LYS 52 -5.235 14.758 6.359 451 HZ3 LYS 52 HZ3 LYS 52 -6.287 15.172 7.543 452 H GLY 53 H GLY 53 -10.158 14.535 1.859 453 HA2 GLY 53 HA2 GLY 53 -12.772 14.496 0.400 454 HA3 GLY 53 HA3 GLY 53 -11.682 15.863 0.557 455 H LYS 54 H LYS 54 -12.579 13.193 -1.352 456 HA LYS 54 HA LYS 54 -11.943 12.292 -3.348 457 HB2 LYS 54 HB2 LYS 54 -11.055 15.142 -3.910 458 HB3 LYS 54 HB3 LYS 54 -11.301 13.882 -5.127 459 HG2 LYS 54 HG2 LYS 54 -13.674 13.687 -4.509 460 HG3 LYS 54 HG3 LYS 54 -13.472 14.958 -3.284 461 HD2 LYS 54 HD2 LYS 54 -12.777 16.549 -5.075 462 HD3 LYS 54 HD3 LYS 54 -13.059 15.279 -6.290 463 HE2 LYS 54 HE2 LYS 54 -15.429 15.120 -5.570 464 HE3 LYS 54 HE3 LYS 54 -15.146 16.364 -4.343 465 HZ1 LYS 54 HZ1 LYS 54 -16.125 17.314 -6.356 466 HZ2 LYS 54 HZ2 LYS 54 -14.630 17.929 -6.144 467 HZ3 LYS 54 HZ3 LYS 54 -14.890 16.781 -7.279 468 H THR 55 H THR 55 -10.052 12.033 -1.255 469 HA THR 55 HA THR 55 -7.576 11.348 -2.736 470 HB THR 55 HB THR 55 -7.596 12.963 -0.144 471 HG1 THR 55 HG1 THR 55 -8.194 14.360 -1.721 472 HG21 THR 55 HG21 THR 55 -5.363 12.235 -2.077 473 HG22 THR 55 HG22 THR 55 -5.205 13.276 -0.643 474 HG23 THR 55 HG23 THR 55 -5.599 11.563 -0.443 475 H ALA 56 H ALA 56 -6.807 9.427 -2.035 476 HA ALA 56 HA ALA 56 -7.866 8.206 0.473 477 HB1 ALA 56 HB1 ALA 56 -8.382 6.920 -1.539 478 HB2 ALA 56 HB2 ALA 56 -6.653 6.845 -1.945 479 HB3 ALA 56 HB3 ALA 56 -7.258 6.056 -0.477 480 H TYR 57 H TYR 57 -6.335 7.026 1.778 481 HA TYR 57 HA TYR 57 -3.459 7.765 1.519 482 HB2 TYR 57 HB2 TYR 57 -5.064 7.973 4.092 483 HB3 TYR 57 HB3 TYR 57 -3.359 8.336 3.877 484 HD1 TYR 57 HD1 TYR 57 -6.745 9.632 3.758 485 HD2 TYR 57 HD2 TYR 57 -2.701 10.353 2.453 486 HE1 TYR 57 HE1 TYR 57 -7.369 11.932 3.168 487 HE2 TYR 57 HE2 TYR 57 -3.311 12.722 1.935 488 HH TYR 57 HH TYR 57 -6.631 13.980 2.342 489 H ILE 58 H ILE 58 -2.471 5.769 1.301 490 HA ILE 58 HA ILE 58 -3.459 3.440 2.898 491 HB ILE 58 HB ILE 58 -1.096 3.655 1.000 492 HG12 ILE 58 HG12 ILE 58 -2.405 1.926 -0.305 493 HG13 ILE 58 HG13 ILE 58 -3.807 2.284 0.697 494 HG21 ILE 58 HG21 ILE 58 -0.909 1.207 1.290 495 HG22 ILE 58 HG22 ILE 58 -0.638 2.029 2.810 496 HG23 ILE 58 HG23 ILE 58 -2.204 1.245 2.509 497 HD11 ILE 58 HD11 ILE 58 -3.708 3.388 -1.582 498 HD12 ILE 58 HD12 ILE 58 -3.944 4.525 -0.256 499 HD13 ILE 58 HD13 ILE 58 -2.332 4.343 -1.005 500 H LYS 59 H LYS 59 -3.234 4.003 5.022 501 HA LYS 59 HA LYS 59 -0.500 4.745 5.939 502 HB2 LYS 59 HB2 LYS 59 -3.086 4.816 7.526 503 HB3 LYS 59 HB3 LYS 59 -1.489 5.378 8.027 504 HG2 LYS 59 HG2 LYS 59 -1.570 6.879 5.892 505 HG3 LYS 59 HG3 LYS 59 -3.296 6.531 5.869 506 HD2 LYS 59 HD2 LYS 59 -3.536 7.505 8.137 507 HD3 LYS 59 HD3 LYS 59 -1.777 7.775 8.205 508 HE2 LYS 59 HE2 LYS 59 -2.019 9.162 6.072 509 HE3 LYS 59 HE3 LYS 59 -3.774 9.052 6.289 510 HZ1 LYS 59 HZ1 LYS 59 -2.859 11.083 7.267 511 HZ2 LYS 59 HZ2 LYS 59 -3.500 10.147 8.453 512 HZ3 LYS 59 HZ3 LYS 59 -1.867 10.237 8.239 513 H LEU 60 H LEU 60 0.704 3.616 7.193 514 HA LEU 60 HA LEU 60 -0.060 0.813 7.943 515 HB2 LEU 60 HB2 LEU 60 2.391 2.090 6.766 516 HB3 LEU 60 HB3 LEU 60 2.650 0.872 8.001 517 HG LEU 60 HG LEU 60 1.473 -0.812 6.779 518 HD11 LEU 60 HD11 LEU 60 -0.277 0.399 5.587 519 HD12 LEU 60 HD12 LEU 60 0.931 1.316 4.658 520 HD13 LEU 60 HD13 LEU 60 0.732 -0.433 4.407 521 HD21 LEU 60 HD21 LEU 60 3.343 0.693 4.895 522 HD22 LEU 60 HD22 LEU 60 3.871 -0.279 6.283 523 HD23 LEU 60 HD23 LEU 60 3.028 -1.058 4.941 524 H GLU 61 H GLU 61 -0.067 0.293 10.041 525 HA GLU 61 HA GLU 61 1.073 2.223 12.017 526 HB2 GLU 61 HB2 GLU 61 -1.764 1.169 11.879 527 HB3 GLU 61 HB3 GLU 61 -1.060 1.915 13.323 528 HG2 GLU 61 HG2 GLU 61 -0.661 4.009 12.129 529 HG3 GLU 61 HG3 GLU 61 -1.207 3.298 10.610 530 H ASP 62 H ASP 62 1.728 1.371 14.058 531 HA ASP 62 HA ASP 62 2.638 -1.309 13.944 532 HB2 ASP 62 HB2 ASP 62 3.791 0.396 15.234 533 HB3 ASP 62 HB3 ASP 62 2.405 0.461 16.359 534 H LYS 63 H LYS 63 2.091 -3.150 14.985 535 HA LYS 63 HA LYS 63 -0.748 -3.431 15.432 536 HB2 LYS 63 HB2 LYS 63 -0.425 -5.825 15.173 537 HB3 LYS 63 HB3 LYS 63 0.444 -5.002 13.894 538 HG2 LYS 63 HG2 LYS 63 1.805 -5.920 16.443 539 HG3 LYS 63 HG3 LYS 63 1.530 -6.990 15.068 540 HD2 LYS 63 HD2 LYS 63 3.131 -6.032 13.751 541 HD3 LYS 63 HD3 LYS 63 2.910 -4.427 14.419 542 HE2 LYS 63 HE2 LYS 63 4.013 -5.426 16.580 543 HE3 LYS 63 HE3 LYS 63 4.609 -6.664 15.459 544 HZ1 LYS 63 HZ1 LYS 63 6.197 -4.874 15.514 545 HZ2 LYS 63 HZ2 LYS 63 5.420 -4.710 14.069 546 HZ3 LYS 63 HZ3 LYS 63 5.045 -3.722 15.326 547 H VAL 64 H VAL 64 1.565 -2.742 17.614 548 HA VAL 64 HA VAL 64 -0.109 -3.888 19.815 549 HB VAL 64 HB VAL 64 2.798 -3.003 19.951 550 HG11 VAL 64 HG11 VAL 64 1.042 -4.475 21.969 551 HG12 VAL 64 HG12 VAL 64 2.784 -4.169 22.148 552 HG13 VAL 64 HG13 VAL 64 1.659 -2.813 22.125 553 HG21 VAL 64 HG21 VAL 64 3.322 -5.435 20.229 554 HG22 VAL 64 HG22 VAL 64 1.631 -5.822 19.836 555 HG23 VAL 64 HG23 VAL 64 2.692 -5.062 18.627 556 H SER 65 H SER 65 1.680 -0.991 18.704 557 HA SER 65 HA SER 65 0.268 0.608 20.807 558 HB2 SER 65 HB2 SER 65 2.968 0.919 19.481 559 HB3 SER 65 HB3 SER 65 2.245 2.144 20.544 560 HG SER 65 HG SER 65 3.626 0.687 21.681 561 H GLY 66 H GLY 66 0.147 0.206 17.446 562 HA2 GLY 66 HA2 GLY 66 -1.174 1.324 15.908 563 HA3 GLY 66 HA3 GLY 66 -1.697 2.429 17.182 564 H GLU 67 H GLU 67 1.703 2.173 16.704 565 HA GLU 67 HA GLU 67 2.069 4.947 16.231 566 HB2 GLU 67 HB2 GLU 67 4.014 2.648 15.804 567 HB3 GLU 67 HB3 GLU 67 4.435 4.364 15.996 568 HG2 GLU 67 HG2 GLU 67 3.284 4.205 18.291 569 HG3 GLU 67 HG3 GLU 67 3.243 2.452 18.013 570 H LEU 68 H LEU 68 2.060 6.111 14.331 571 HA LEU 68 HA LEU 68 1.566 4.835 11.797 572 HB2 LEU 68 HB2 LEU 68 0.711 7.069 12.377 573 HB3 LEU 68 HB3 LEU 68 2.359 7.692 12.473 574 HG LEU 68 HG LEU 68 2.663 7.217 10.028 575 HD11 LEU 68 HD11 LEU 68 0.644 6.799 8.644 576 HD12 LEU 68 HD12 LEU 68 1.012 5.430 9.684 577 HD13 LEU 68 HD13 LEU 68 -0.309 6.531 10.123 578 HD21 LEU 68 HD21 LEU 68 0.242 8.938 10.708 579 HD22 LEU 68 HD22 LEU 68 1.944 9.442 10.812 580 HD23 LEU 68 HD23 LEU 68 1.235 9.054 9.236 581 H PHE 69 H PHE 69 3.018 3.637 10.785 582 HA PHE 69 HA PHE 69 5.917 4.090 10.945 583 HB2 PHE 69 HB2 PHE 69 5.177 1.829 10.934 584 HB3 PHE 69 HB3 PHE 69 4.129 2.080 9.548 585 HD1 PHE 69 HD1 PHE 69 7.755 2.141 10.537 586 HD2 PHE 69 HD2 PHE 69 4.890 1.605 7.354 587 HE1 PHE 69 HE1 PHE 69 9.591 1.513 8.986 588 HE2 PHE 69 HE2 PHE 69 6.736 1.053 5.795 589 HZ PHE 69 HZ PHE 69 9.085 0.979 6.608 590 H ALA 70 H ALA 70 3.425 4.193 8.362 591 HA ALA 70 HA ALA 70 4.778 6.385 6.996 592 HB1 ALA 70 HB1 ALA 70 4.566 3.665 5.618 593 HB2 ALA 70 HB2 ALA 70 5.202 5.177 4.928 594 HB3 ALA 70 HB3 ALA 70 6.077 4.376 6.233 595 H GLN 71 H GLN 71 3.581 7.141 5.111 596 HA GLN 71 HA GLN 71 0.790 6.204 4.793 597 HB2 GLN 71 HB2 GLN 71 0.048 8.621 4.870 598 HB3 GLN 71 HB3 GLN 71 0.435 7.876 6.422 599 HG2 GLN 71 HG2 GLN 71 2.355 9.144 6.755 600 HG3 GLN 71 HG3 GLN 71 2.617 9.420 5.044 601 HE21 GLN 71 HE21 GLN 71 1.300 12.636 5.324 602 HE22 GLN 71 HE22 GLN 71 2.564 11.558 4.712 603 H ALA 72 H ALA 72 0.177 6.176 2.686 604 HA ALA 72 HA ALA 72 1.706 7.824 0.689 605 HB1 ALA 72 HB1 ALA 72 2.187 5.477 0.443 606 HB2 ALA 72 HB2 ALA 72 0.461 5.081 0.391 607 HB3 ALA 72 HB3 ALA 72 1.194 6.031 -0.913 608 HA PRO 73 HA PRO 73 -2.471 9.640 0.191 609 HB2 PRO 73 HB2 PRO 73 -0.801 11.716 -1.189 610 HB3 PRO 73 HB3 PRO 73 -2.124 11.934 -0.009 611 HG2 PRO 73 HG2 PRO 73 0.480 12.263 0.710 612 HG3 PRO 73 HG3 PRO 73 -0.668 11.436 1.816 613 HD2 PRO 73 HD2 PRO 73 1.315 10.187 -0.108 614 HD3 PRO 73 HD3 PRO 73 1.014 9.798 1.613 615 H VAL 74 H VAL 74 -3.779 9.473 -1.571 616 HA VAL 74 HA VAL 74 -2.636 9.098 -4.303 617 HB VAL 74 HB VAL 74 -4.982 7.456 -3.311 618 HG11 VAL 74 HG11 VAL 74 -4.326 5.960 -5.131 619 HG12 VAL 74 HG12 VAL 74 -4.564 7.605 -5.722 620 HG13 VAL 74 HG13 VAL 74 -2.916 6.980 -5.493 621 HG21 VAL 74 HG21 VAL 74 -3.522 5.524 -2.941 622 HG22 VAL 74 HG22 VAL 74 -2.094 6.576 -3.033 623 HG23 VAL 74 HG23 VAL 74 -3.287 6.787 -1.737 624 H GLU 75 H GLU 75 -3.626 10.499 -5.733 625 HA GLU 75 HA GLU 75 -6.118 11.879 -4.888 626 HB2 GLU 75 HB2 GLU 75 -4.275 12.271 -7.278 627 HB3 GLU 75 HB3 GLU 75 -5.699 13.256 -6.919 628 HG2 GLU 75 HG2 GLU 75 -4.707 13.882 -4.718 629 HG3 GLU 75 HG3 GLU 75 -3.252 12.969 -5.123 630 H GLN 76 H GLN 76 -5.265 9.309 -7.048 631 HA GLN 76 HA GLN 76 -8.013 8.579 -7.360 632 HB2 GLN 76 HB2 GLN 76 -8.275 8.589 -9.705 633 HB3 GLN 76 HB3 GLN 76 -7.835 10.220 -9.251 634 HG2 GLN 76 HG2 GLN 76 -6.021 8.159 -10.583 635 HG3 GLN 76 HG3 GLN 76 -6.796 9.525 -11.355 636 HE21 GLN 76 HE21 GLN 76 -3.323 10.119 -9.285 637 HE22 GLN 76 HE22 GLN 76 -4.206 8.587 -9.126 638 H TYR 77 H TYR 77 -8.216 6.366 -7.833 639 HA TYR 77 HA TYR 77 -5.688 4.829 -8.153 640 HB2 TYR 77 HB2 TYR 77 -6.623 4.561 -5.933 641 HB3 TYR 77 HB3 TYR 77 -8.173 4.073 -6.619 642 HD1 TYR 77 HD1 TYR 77 -8.607 1.805 -7.109 643 HD2 TYR 77 HD2 TYR 77 -4.542 3.136 -6.567 644 HE1 TYR 77 HE1 TYR 77 -7.816 -0.552 -7.262 645 HE2 TYR 77 HE2 TYR 77 -3.749 0.791 -6.828 646 HH TYR 77 HH TYR 77 -4.331 -1.391 -7.139 647 HA PRO 78 HA PRO 78 -4.801 3.044 -9.201 648 HB2 PRO 78 HB2 PRO 78 -3.810 2.560 -11.689 649 HB3 PRO 78 HB3 PRO 78 -4.792 1.375 -10.773 650 HG2 PRO 78 HG2 PRO 78 -5.743 3.323 -12.904 651 HG3 PRO 78 HG3 PRO 78 -6.057 1.560 -12.800 652 HD2 PRO 78 HD2 PRO 78 -7.859 3.377 -11.884 653 HD3 PRO 78 HD3 PRO 78 -7.578 1.844 -11.008 654 H GLY 79 H GLY 79 -2.924 4.237 -9.248 655 HA2 GLY 79 HA2 GLY 79 -2.483 6.549 -10.986 656 HA3 GLY 79 HA3 GLY 79 -2.926 6.965 -9.331 657 H ILE 80 H ILE 80 -0.758 8.023 -9.511 658 HA ILE 80 HA ILE 80 1.645 6.574 -9.889 659 HB ILE 80 HB ILE 80 1.464 8.962 -10.222 660 HG12 ILE 80 HG12 ILE 80 3.452 9.841 -9.093 661 HG13 ILE 80 HG13 ILE 80 3.447 8.498 -7.952 662 HG21 ILE 80 HG21 ILE 80 -0.117 9.573 -8.397 663 HG22 ILE 80 HG22 ILE 80 1.177 9.323 -7.202 664 HG23 ILE 80 HG23 ILE 80 1.307 10.605 -8.414 665 HD11 ILE 80 HD11 ILE 80 5.124 8.230 -9.743 666 HD12 ILE 80 HD12 ILE 80 3.936 6.920 -9.788 667 HD13 ILE 80 HD13 ILE 80 3.835 8.252 -10.968 668 H ALA 81 H ALA 81 -0.151 7.079 -6.905 669 HA ALA 81 HA ALA 81 2.146 6.303 -5.242 670 HB1 ALA 81 HB1 ALA 81 0.670 7.033 -3.402 671 HB2 ALA 81 HB2 ALA 81 0.839 8.263 -4.666 672 HB3 ALA 81 HB3 ALA 81 -0.640 7.290 -4.580 673 H VAL 82 H VAL 82 0.260 4.319 -6.911 674 HA VAL 82 HA VAL 82 0.536 2.155 -4.941 675 HB VAL 82 HB VAL 82 -2.162 2.643 -6.204 676 HG11 VAL 82 HG11 VAL 82 -1.191 0.675 -4.077 677 HG12 VAL 82 HG12 VAL 82 -2.887 0.874 -4.551 678 HG13 VAL 82 HG13 VAL 82 -1.707 0.266 -5.718 679 HG21 VAL 82 HG21 VAL 82 -1.959 4.368 -4.525 680 HG22 VAL 82 HG22 VAL 82 -3.083 3.128 -3.984 681 HG23 VAL 82 HG23 VAL 82 -1.444 3.178 -3.309 682 H GLU 83 H GLU 83 1.168 0.336 -5.931 683 HA GLU 83 HA GLU 83 0.456 -0.233 -8.766 684 HB2 GLU 83 HB2 GLU 83 3.279 0.014 -7.657 685 HB3 GLU 83 HB3 GLU 83 2.904 -1.008 -9.045 686 HG2 GLU 83 HG2 GLU 83 1.819 0.996 -10.127 687 HG3 GLU 83 HG3 GLU 83 2.530 1.994 -8.840 688 H THR 84 H THR 84 0.833 -2.387 -9.440 689 HA THR 84 HA THR 84 0.624 -4.480 -7.298 690 HB THR 84 HB THR 84 -0.434 -5.833 -9.059 691 HG1 THR 84 HG1 THR 84 0.359 -5.036 -10.945 692 HG21 THR 84 HG21 THR 84 -1.862 -4.384 -7.650 693 HG22 THR 84 HG22 THR 84 -1.741 -3.081 -8.854 694 HG23 THR 84 HG23 THR 84 -2.542 -4.616 -9.266 695 H VAL 85 H VAL 85 1.713 -6.497 -7.664 696 HA VAL 85 HA VAL 85 4.207 -6.387 -9.242 697 HB VAL 85 HB VAL 85 4.675 -8.559 -8.279 698 HG11 VAL 85 HG11 VAL 85 3.678 -6.642 -6.132 699 HG12 VAL 85 HG12 VAL 85 4.938 -7.867 -5.962 700 HG13 VAL 85 HG13 VAL 85 5.203 -6.477 -7.022 701 HG21 VAL 85 HG21 VAL 85 3.216 -9.633 -6.682 702 HG22 VAL 85 HG22 VAL 85 2.003 -8.350 -6.837 703 HG23 VAL 85 HG23 VAL 85 2.334 -9.441 -8.191 704 H THR 86 H THR 86 4.610 -8.506 -10.544 705 HA THR 86 HA THR 86 2.421 -8.934 -12.479 706 HB THR 86 HB THR 86 4.157 -9.967 -13.847 707 HG1 THR 86 HG1 THR 86 6.264 -10.069 -13.071 708 HG21 THR 86 HG21 THR 86 5.229 -7.428 -12.545 709 HG22 THR 86 HG22 THR 86 5.658 -8.051 -14.146 710 HG23 THR 86 HG23 THR 86 4.002 -7.473 -13.823 711 H ASP 87 H ASP 87 4.230 -10.782 -10.082 712 HA ASP 87 HA ASP 87 3.366 -13.335 -11.168 713 HB2 ASP 87 HB2 ASP 87 5.660 -12.860 -10.336 714 HB3 ASP 87 HB3 ASP 87 5.006 -12.722 -8.698 715 H SER 88 H SER 88 2.742 -11.604 -8.086 716 HA SER 88 HA SER 88 0.428 -13.465 -7.585 717 HB2 SER 88 HB2 SER 88 2.377 -14.416 -6.478 718 HB3 SER 88 HB3 SER 88 2.628 -12.909 -5.579 719 HG SER 88 HG SER 88 1.368 -14.658 -4.520 720 H SER 89 H SER 89 -1.385 -12.386 -7.195 721 HA SER 89 HA SER 89 -1.410 -9.593 -6.935 722 HB2 SER 89 HB2 SER 89 -3.836 -11.178 -6.184 723 HB3 SER 89 HB3 SER 89 -3.713 -9.701 -7.136 724 HG SER 89 HG SER 89 -2.782 -10.973 -8.827 725 H ARG 90 H ARG 90 -0.707 -11.568 -4.360 726 HA ARG 90 HA ARG 90 -1.967 -9.855 -2.308 727 HB2 ARG 90 HB2 ARG 90 -1.055 -11.500 -0.663 728 HB3 ARG 90 HB3 ARG 90 -2.323 -12.045 -1.734 729 HG2 ARG 90 HG2 ARG 90 -0.788 -13.286 -3.103 730 HG3 ARG 90 HG3 ARG 90 0.618 -12.621 -2.254 731 HD2 ARG 90 HD2 ARG 90 -1.536 -14.273 -0.871 732 HD3 ARG 90 HD3 ARG 90 -0.144 -15.002 -1.662 733 HE ARG 90 HE ARG 90 0.031 -13.081 0.655 734 HH11 ARG 90 HH11 ARG 90 1.560 -13.345 2.082 735 HH12 ARG 90 HH12 ARG 90 2.765 -14.615 1.930 736 HH21 ARG 90 HH21 ARG 90 1.449 -15.846 -1.001 737 HH22 ARG 90 HH22 ARG 90 2.702 -15.991 0.199 738 H TYR 91 H TYR 91 0.158 -8.850 -4.120 739 HA TYR 91 HA TYR 91 1.799 -7.631 -1.997 740 HB2 TYR 91 HB2 TYR 91 2.873 -8.867 -4.549 741 HB3 TYR 91 HB3 TYR 91 3.797 -7.869 -3.447 742 HD1 TYR 91 HD1 TYR 91 4.354 -8.667 -1.164 743 HD2 TYR 91 HD2 TYR 91 2.439 -11.215 -4.062 744 HE1 TYR 91 HE1 TYR 91 4.928 -10.665 0.211 745 HE2 TYR 91 HE2 TYR 91 3.065 -13.216 -2.718 746 HH TYR 91 HH TYR 91 4.857 -12.943 0.377 747 H PHE 92 H PHE 92 2.097 -5.497 -2.261 748 HA PHE 92 HA PHE 92 1.540 -4.186 -4.884 749 HB2 PHE 92 HB2 PHE 92 0.460 -3.254 -2.196 750 HB3 PHE 92 HB3 PHE 92 0.269 -2.424 -3.727 751 HD1 PHE 92 HD1 PHE 92 -1.006 -5.021 -1.559 752 HD2 PHE 92 HD2 PHE 92 -1.127 -3.465 -5.565 753 HE1 PHE 92 HE1 PHE 92 -3.111 -6.252 -1.958 754 HE2 PHE 92 HE2 PHE 92 -3.209 -4.786 -5.998 755 HZ PHE 92 HZ PHE 92 -4.193 -6.172 -4.212 756 H VAL 93 H VAL 93 2.377 -1.994 -4.994 757 HA VAL 93 HA VAL 93 4.486 -1.311 -2.989 758 HB VAL 93 HB VAL 93 4.550 -0.732 -5.969 759 HG11 VAL 93 HG11 VAL 93 5.458 1.186 -4.681 760 HG12 VAL 93 HG12 VAL 93 6.583 0.085 -3.855 761 HG13 VAL 93 HG13 VAL 93 6.700 0.346 -5.606 762 HG21 VAL 93 HG21 VAL 93 5.252 -2.974 -5.532 763 HG22 VAL 93 HG22 VAL 93 6.717 -2.025 -5.814 764 HG23 VAL 93 HG23 VAL 93 6.272 -2.469 -4.162 765 H ILE 94 H ILE 94 4.382 0.805 -2.168 766 HA ILE 94 HA ILE 94 2.446 2.614 -3.480 767 HB ILE 94 HB ILE 94 1.522 3.429 -1.454 768 HG12 ILE 94 HG12 ILE 94 3.348 2.656 0.140 769 HG13 ILE 94 HG13 ILE 94 1.689 2.550 0.694 770 HG21 ILE 94 HG21 ILE 94 0.283 1.824 -2.734 771 HG22 ILE 94 HG22 ILE 94 0.976 0.468 -1.840 772 HG23 ILE 94 HG23 ILE 94 -0.080 1.639 -1.015 773 HD11 ILE 94 HD11 ILE 94 3.346 0.176 -0.266 774 HD12 ILE 94 HD12 ILE 94 2.998 0.618 1.413 775 HD13 ILE 94 HD13 ILE 94 1.682 0.117 0.347 776 H ARG 95 H ARG 95 2.760 4.779 -3.281 777 HA ARG 95 HA ARG 95 5.593 5.512 -2.716 778 HB2 ARG 95 HB2 ARG 95 4.454 6.124 -4.906 779 HB3 ARG 95 HB3 ARG 95 3.540 7.334 -3.990 780 HG2 ARG 95 HG2 ARG 95 5.692 8.321 -3.195 781 HG3 ARG 95 HG3 ARG 95 6.579 7.132 -4.169 782 HD2 ARG 95 HD2 ARG 95 5.460 8.031 -6.211 783 HD3 ARG 95 HD3 ARG 95 4.660 9.260 -5.212 784 HE ARG 95 HE ARG 95 7.345 9.580 -4.601 785 HH11 ARG 95 HH11 ARG 95 8.729 10.914 -5.481 786 HH12 ARG 95 HH12 ARG 95 8.562 11.464 -7.136 787 HH21 ARG 95 HH21 ARG 95 5.628 9.725 -7.658 788 HH22 ARG 95 HH22 ARG 95 6.818 10.796 -8.350 789 H ILE 96 H ILE 96 5.619 5.483 -0.494 790 HA ILE 96 HA ILE 96 3.739 7.072 1.053 791 HB ILE 96 HB ILE 96 4.955 6.535 3.015 792 HG12 ILE 96 HG12 ILE 96 6.855 4.624 2.536 793 HG13 ILE 96 HG13 ILE 96 7.153 5.668 1.160 794 HG21 ILE 96 HG21 ILE 96 4.551 4.140 1.217 795 HG22 ILE 96 HG22 ILE 96 4.662 4.087 2.978 796 HG23 ILE 96 HG23 ILE 96 3.328 4.948 2.233 797 HD11 ILE 96 HD11 ILE 96 7.454 7.595 2.750 798 HD12 ILE 96 HD12 ILE 96 7.164 6.468 4.103 799 HD13 ILE 96 HD13 ILE 96 8.580 6.258 3.058 800 H GLN 97 H GLN 97 3.985 9.006 2.048 801 HA GLN 97 HA GLN 97 6.194 10.803 1.153 802 HB2 GLN 97 HB2 GLN 97 3.225 11.110 0.628 803 HB3 GLN 97 HB3 GLN 97 4.332 12.485 0.613 804 HG2 GLN 97 HG2 GLN 97 5.436 11.815 -1.294 805 HG3 GLN 97 HG3 GLN 97 5.020 10.111 -1.115 806 HE21 GLN 97 HE21 GLN 97 2.054 10.328 -2.996 807 HE22 GLN 97 HE22 GLN 97 3.109 9.313 -2.014 808 H ASP 98 H ASP 98 6.606 12.484 2.403 809 HA ASP 98 HA ASP 98 5.518 12.430 5.160 810 HB2 ASP 98 HB2 ASP 98 7.990 12.391 4.568 811 HB3 ASP 98 HB3 ASP 98 7.798 14.069 4.056 812 H GLY 99 H GLY 99 4.519 13.955 2.458 813 HA2 GLY 99 HA2 GLY 99 2.844 15.550 2.206 814 HA3 GLY 99 HA3 GLY 99 2.991 15.989 3.908 815 H THR 100 H THR 100 5.956 16.038 2.216 816 HA THR 100 HA THR 100 5.883 18.981 1.722 817 HB THR 100 HB THR 100 6.551 18.493 4.047 818 HG1 THR 100 HG1 THR 100 8.545 19.574 2.370 819 HG21 THR 100 HG21 THR 100 9.036 17.197 2.861 820 HG22 THR 100 HG22 THR 100 8.709 17.523 4.575 821 HG23 THR 100 HG23 THR 100 7.724 16.341 3.702 822 H GLY 101 H GLY 101 6.177 16.435 -0.020 823 HA2 GLY 101 HA2 GLY 101 7.116 16.256 -2.155 824 HA3 GLY 101 HA3 GLY 101 8.307 17.494 -1.769 825 H ARG 102 H ARG 102 8.476 15.387 0.763 826 HA ARG 102 HA ARG 102 10.708 13.723 -0.194 827 HB2 ARG 102 HB2 ARG 102 9.093 13.738 2.389 828 HB3 ARG 102 HB3 ARG 102 10.482 12.694 2.089 829 HG2 ARG 102 HG2 ARG 102 11.972 14.561 1.973 830 HG3 ARG 102 HG3 ARG 102 10.624 15.721 2.026 831 HD2 ARG 102 HD2 ARG 102 10.002 14.918 4.273 832 HD3 ARG 102 HD3 ARG 102 11.374 13.796 4.269 833 HE ARG 102 HE ARG 102 12.693 16.073 3.860 834 HH11 ARG 102 HH11 ARG 102 13.426 17.592 5.275 835 HH12 ARG 102 HH12 ARG 102 12.565 17.902 6.754 836 HH21 ARG 102 HH21 ARG 102 10.060 15.612 6.213 837 HH22 ARG 102 HH22 ARG 102 10.749 16.816 7.265 838 H SER 103 H SER 103 10.455 11.753 -0.952 839 HA SER 103 HA SER 103 8.171 10.165 -0.151 840 HB2 SER 103 HB2 SER 103 7.308 9.608 -2.339 841 HB3 SER 103 HB3 SER 103 7.334 11.369 -2.182 842 HG SER 103 HG SER 103 9.395 11.295 -3.301 843 H ALA 104 H ALA 104 8.196 7.923 -0.677 844 HA ALA 104 HA ALA 104 10.542 6.768 -2.029 845 HB1 ALA 104 HB1 ALA 104 9.752 5.988 0.815 846 HB2 ALA 104 HB2 ALA 104 10.969 5.171 -0.189 847 HB3 ALA 104 HB3 ALA 104 11.241 6.840 0.349 848 H PHE 105 H PHE 105 10.130 4.733 -2.923 849 HA PHE 105 HA PHE 105 7.297 3.782 -2.891 850 HB2 PHE 105 HB2 PHE 105 9.624 3.235 -4.749 851 HB3 PHE 105 HB3 PHE 105 8.179 2.246 -4.716 852 HD1 PHE 105 HD1 PHE 105 9.579 5.445 -5.833 853 HD2 PHE 105 HD2 PHE 105 5.950 3.176 -5.342 854 HE1 PHE 105 HE1 PHE 105 8.429 6.907 -7.482 855 HE2 PHE 105 HE2 PHE 105 4.812 4.602 -7.011 856 HZ PHE 105 HZ PHE 105 6.057 6.469 -8.098 857 H ILE 106 H ILE 106 6.816 2.297 -1.438 858 HA ILE 106 HA ILE 106 8.882 0.276 -0.634 859 HB ILE 106 HB ILE 106 7.967 0.102 1.534 860 HG12 ILE 106 HG12 ILE 106 5.945 2.282 0.861 861 HG13 ILE 106 HG13 ILE 106 5.568 0.566 1.031 862 HG21 ILE 106 HG21 ILE 106 8.343 3.059 0.930 863 HG22 ILE 106 HG22 ILE 106 8.709 2.217 2.453 864 HG23 ILE 106 HG23 ILE 106 9.669 1.875 1.009 865 HD11 ILE 106 HD11 ILE 106 6.336 0.600 3.381 866 HD12 ILE 106 HD12 ILE 106 6.563 2.359 3.265 867 HD13 ILE 106 HD13 ILE 106 4.951 1.656 3.064 868 H GLY 107 H GLY 107 8.269 -1.875 -0.387 869 HA2 GLY 107 HA2 GLY 107 5.842 -2.683 -1.901 870 HA3 GLY 107 HA3 GLY 107 7.214 -3.705 -1.485 871 H ILE 108 H ILE 108 4.240 -3.896 -0.947 872 HA ILE 108 HA ILE 108 4.532 -4.734 1.864 873 HB ILE 108 HB ILE 108 2.184 -4.239 2.330 874 HG12 ILE 108 HG12 ILE 108 2.188 -2.437 -0.126 875 HG13 ILE 108 HG13 ILE 108 1.365 -3.995 -0.033 876 HG21 ILE 108 HG21 ILE 108 4.021 -2.861 3.135 877 HG22 ILE 108 HG22 ILE 108 3.899 -1.808 1.708 878 HG23 ILE 108 HG23 ILE 108 2.571 -1.890 2.882 879 HD11 ILE 108 HD11 ILE 108 0.720 -1.552 1.673 880 HD12 ILE 108 HD12 ILE 108 -0.257 -2.267 0.383 881 HD13 ILE 108 HD13 ILE 108 0.004 -3.157 1.896 882 H GLY 109 H GLY 109 3.753 -6.655 2.396 883 HA2 GLY 109 HA2 GLY 109 2.401 -8.326 0.303 884 HA3 GLY 109 HA3 GLY 109 3.600 -8.943 1.434 885 H PHE 110 H PHE 110 0.736 -9.577 0.838 886 HA PHE 110 HA PHE 110 -0.578 -9.167 3.489 887 HB2 PHE 110 HB2 PHE 110 -1.580 -9.760 0.692 888 HB3 PHE 110 HB3 PHE 110 -2.595 -9.989 2.098 889 HD1 PHE 110 HD1 PHE 110 -4.010 -8.270 2.727 890 HD2 PHE 110 HD2 PHE 110 -0.385 -7.303 0.587 891 HE1 PHE 110 HE1 PHE 110 -4.676 -5.888 2.656 892 HE2 PHE 110 HE2 PHE 110 -1.001 -4.911 0.642 893 HZ PHE 110 HZ PHE 110 -3.153 -4.202 1.631 894 H THR 111 H THR 111 -1.862 -10.928 4.356 895 HA THR 111 HA THR 111 -0.374 -13.414 4.466 896 HB THR 111 HB THR 111 -1.490 -12.343 6.393 897 HG1 THR 111 HG1 THR 111 -2.186 -14.283 7.265 898 HG21 THR 111 HG21 THR 111 -3.667 -11.707 5.346 899 HG22 THR 111 HG22 THR 111 -4.101 -13.428 5.255 900 HG23 THR 111 HG23 THR 111 -3.857 -12.648 6.829 901 H ASP 112 H ASP 112 -3.183 -12.362 2.626 902 HA ASP 112 HA ASP 112 -3.225 -14.878 1.158 903 HB2 ASP 112 HB2 ASP 112 -4.678 -15.294 3.193 904 HB3 ASP 112 HB3 ASP 112 -5.722 -13.979 2.656 905 H ARG 113 H ARG 113 -4.403 -14.771 -0.811 906 HA ARG 113 HA ARG 113 -4.416 -12.221 -2.132 907 HB2 ARG 113 HB2 ARG 113 -3.997 -14.480 -3.151 908 HB3 ARG 113 HB3 ARG 113 -5.728 -14.833 -3.005 909 HG2 ARG 113 HG2 ARG 113 -6.261 -12.954 -4.500 910 HG3 ARG 113 HG3 ARG 113 -4.557 -12.459 -4.512 911 HD2 ARG 113 HD2 ARG 113 -3.966 -14.679 -5.533 912 HD3 ARG 113 HD3 ARG 113 -5.682 -15.073 -5.625 913 HE ARG 113 HE ARG 113 -4.194 -13.013 -7.204 914 HH11 ARG 113 HH11 ARG 113 -5.006 -12.203 -8.965 915 HH12 ARG 113 HH12 ARG 113 -6.605 -12.640 -9.534 916 HH21 ARG 113 HH21 ARG 113 -7.289 -14.627 -6.792 917 HH22 ARG 113 HH22 ARG 113 -7.895 -13.972 -8.289 918 H GLY 114 H GLY 114 -7.046 -13.997 -0.532 919 HA2 GLY 114 HA2 GLY 114 -9.209 -12.360 -1.550 920 HA3 GLY 114 HA3 GLY 114 -9.228 -13.391 -0.113 921 H ASP 115 H ASP 115 -6.891 -11.945 1.092 922 HA ASP 115 HA ASP 115 -8.367 -9.665 2.279 923 HB2 ASP 115 HB2 ASP 115 -5.750 -11.047 2.967 924 HB3 ASP 115 HB3 ASP 115 -6.276 -9.551 3.733 925 H ALA 116 H ALA 116 -5.499 -10.233 0.218 926 HA ALA 116 HA ALA 116 -4.807 -7.462 -0.129 927 HB1 ALA 116 HB1 ALA 116 -4.486 -9.875 -1.957 928 HB2 ALA 116 HB2 ALA 116 -3.663 -8.321 -2.139 929 HB3 ALA 116 HB3 ALA 116 -3.344 -9.321 -0.707 930 H PHE 117 H PHE 117 -7.236 -9.546 -1.779 931 HA PHE 117 HA PHE 117 -7.986 -7.683 -3.757 932 HB2 PHE 117 HB2 PHE 117 -9.046 -10.152 -2.713 933 HB3 PHE 117 HB3 PHE 117 -10.361 -9.006 -2.861 934 HD1 PHE 117 HD1 PHE 117 -11.185 -8.311 -5.025 935 HD2 PHE 117 HD2 PHE 117 -7.574 -10.649 -4.720 936 HE1 PHE 117 HE1 PHE 117 -11.189 -8.638 -7.489 937 HE2 PHE 117 HE2 PHE 117 -7.576 -10.967 -7.186 938 HZ PHE 117 HZ PHE 117 -9.384 -9.966 -8.572 939 H ASP 118 H ASP 118 -8.942 -7.683 -0.314 940 HA ASP 118 HA ASP 118 -10.890 -5.563 -0.604 941 HB2 ASP 118 HB2 ASP 118 -9.326 -6.607 1.786 942 HB3 ASP 118 HB3 ASP 118 -10.486 -5.290 1.898 943 H PHE 119 H PHE 119 -7.351 -5.477 -0.308 944 HA PHE 119 HA PHE 119 -7.089 -2.664 0.271 945 HB2 PHE 119 HB2 PHE 119 -5.249 -4.122 0.601 946 HB3 PHE 119 HB3 PHE 119 -5.266 -4.679 -1.054 947 HD1 PHE 119 HD1 PHE 119 -4.536 -3.252 -2.943 948 HD2 PHE 119 HD2 PHE 119 -4.000 -2.118 1.175 949 HE1 PHE 119 HE1 PHE 119 -2.907 -1.521 -3.628 950 HE2 PHE 119 HE2 PHE 119 -2.387 -0.396 0.499 951 HZ PHE 119 HZ PHE 119 -1.822 -0.074 -1.910 952 H ASN 120 H ASN 120 -7.151 -4.412 -2.883 953 HA ASN 120 HA ASN 120 -7.123 -1.832 -4.271 954 HB2 ASN 120 HB2 ASN 120 -7.072 -3.126 -6.332 955 HB3 ASN 120 HB3 ASN 120 -5.843 -3.662 -5.194 956 HD21 ASN 120 HD21 ASN 120 -8.843 -6.245 -6.259 957 HD22 ASN 120 HD22 ASN 120 -9.086 -4.530 -6.537 958 H VAL 121 H VAL 121 -9.715 -4.051 -3.350 959 HA VAL 121 HA VAL 121 -11.669 -2.751 -5.095 960 HB VAL 121 HB VAL 121 -11.945 -4.678 -2.775 961 HG11 VAL 121 HG11 VAL 121 -14.157 -3.516 -4.529 962 HG12 VAL 121 HG12 VAL 121 -14.333 -4.929 -3.464 963 HG13 VAL 121 HG13 VAL 121 -14.003 -3.347 -2.764 964 HG21 VAL 121 HG21 VAL 121 -11.060 -5.585 -4.934 965 HG22 VAL 121 HG22 VAL 121 -12.659 -6.230 -4.558 966 HG23 VAL 121 HG23 VAL 121 -12.482 -4.947 -5.777 967 H SER 122 H SER 122 -10.784 -2.361 -1.600 968 HA SER 122 HA SER 122 -12.848 -0.436 -1.094 969 HB2 SER 122 HB2 SER 122 -11.624 0.119 0.909 970 HB3 SER 122 HB3 SER 122 -11.653 -1.641 0.685 971 HG SER 122 HG SER 122 -9.586 -1.646 0.121 972 H LEU 123 H LEU 123 -9.560 -0.027 -2.383 973 HA LEU 123 HA LEU 123 -9.615 2.853 -2.460 974 HB2 LEU 123 HB2 LEU 123 -8.044 0.733 -3.960 975 HB3 LEU 123 HB3 LEU 123 -7.830 2.454 -4.274 976 HG LEU 123 HG LEU 123 -7.424 1.213 -1.524 977 HD11 LEU 123 HD11 LEU 123 -5.369 1.985 -3.643 978 HD12 LEU 123 HD12 LEU 123 -5.022 1.386 -2.002 979 HD13 LEU 123 HD13 LEU 123 -5.801 0.326 -3.179 980 HD21 LEU 123 HD21 LEU 123 -7.885 3.630 -1.429 981 HD22 LEU 123 HD22 LEU 123 -6.182 3.328 -1.099 982 HD23 LEU 123 HD23 LEU 123 -6.676 3.933 -2.695 983 H GLN 124 H GLN 124 -10.358 0.456 -5.106 984 HA GLN 124 HA GLN 124 -11.074 2.571 -6.903 985 HB2 GLN 124 HB2 GLN 124 -11.632 0.932 -8.457 986 HB3 GLN 124 HB3 GLN 124 -10.347 0.219 -7.480 987 HG2 GLN 124 HG2 GLN 124 -12.156 -0.961 -6.159 988 HG3 GLN 124 HG3 GLN 124 -13.317 -0.421 -7.373 989 HE21 GLN 124 HE21 GLN 124 -10.469 -3.232 -8.418 990 HE22 GLN 124 HE22 GLN 124 -10.175 -2.155 -7.036 991 H ASP 125 H ASP 125 -12.999 0.873 -4.488 992 HA ASP 125 HA ASP 125 -15.529 2.015 -5.393 993 HB2 ASP 125 HB2 ASP 125 -15.348 -0.244 -4.365 994 HB3 ASP 125 HB3 ASP 125 -14.770 0.490 -2.866 995 H HIS 126 H HIS 126 -12.885 3.394 -3.804 996 HA HIS 126 HA HIS 126 -14.626 5.373 -2.439 997 HB2 HIS 126 HB2 HIS 126 -12.584 4.652 -1.266 998 HB3 HIS 126 HB3 HIS 126 -11.593 5.207 -2.618 999 HD2 HIS 126 HD2 HIS 126 -14.331 6.844 -0.329 1000 HE1 HIS 126 HE1 HIS 126 -11.181 9.666 -0.822 1001 HE2 HIS 126 HE2 HIS 126 -13.430 9.240 0.283 1002 H PHE 127 H PHE 127 -12.912 4.944 -5.453 1003 HA PHE 127 HA PHE 127 -13.265 7.820 -6.109 1004 HB2 PHE 127 HB2 PHE 127 -11.546 5.650 -7.332 1005 HB3 PHE 127 HB3 PHE 127 -11.712 7.263 -8.008 1006 HD1 PHE 127 HD1 PHE 127 -9.797 5.298 -5.750 1007 HD2 PHE 127 HD2 PHE 127 -11.300 9.290 -6.354 1008 HE1 PHE 127 HE1 PHE 127 -7.986 6.192 -4.309 1009 HE2 PHE 127 HE2 PHE 127 -9.492 10.183 -4.911 1010 HZ PHE 127 HZ PHE 127 -7.835 8.644 -3.891 1011 H LYS 128 H LYS 128 -15.083 5.014 -6.746 1012 HA LYS 128 HA LYS 128 -15.707 5.292 -9.422 1013 HB2 LYS 128 HB2 LYS 128 -17.614 4.031 -9.168 1014 HB3 LYS 128 HB3 LYS 128 -16.492 3.431 -7.968 1015 HG2 LYS 128 HG2 LYS 128 -18.749 5.392 -7.277 1016 HG3 LYS 128 HG3 LYS 128 -18.987 3.658 -7.370 1017 HD2 LYS 128 HD2 LYS 128 -17.373 3.229 -5.659 1018 HD3 LYS 128 HD3 LYS 128 -16.941 4.944 -5.519 1019 HE2 LYS 128 HE2 LYS 128 -18.891 5.520 -4.448 1020 HE3 LYS 128 HE3 LYS 128 -19.837 4.224 -5.218 1021 HZ1 LYS 128 HZ1 LYS 128 -18.658 2.627 -3.793 1022 HZ2 LYS 128 HZ2 LYS 128 -17.820 3.812 -3.090 1023 HZ3 LYS 128 HZ3 LYS 128 -19.456 3.738 -2.863 1024 H TRP 129 H TRP 129 -16.955 7.368 -6.902 1025 HA TRP 129 HA TRP 129 -18.904 8.701 -8.618 1026 HB2 TRP 129 HB2 TRP 129 -19.368 10.063 -6.698 1027 HB3 TRP 129 HB3 TRP 129 -19.271 8.382 -6.203 1028 HD1 TRP 129 HD1 TRP 129 -16.922 7.665 -4.905 1029 HE1 TRP 129 HE1 TRP 129 -15.347 8.986 -3.421 1030 HE3 TRP 129 HE3 TRP 129 -18.539 12.406 -6.027 1031 HZ2 TRP 129 HZ2 TRP 129 -15.043 11.732 -2.541 1032 HZ3 TRP 129 HZ3 TRP 129 -17.647 14.351 -4.769 1033 HH2 TRP 129 HH2 TRP 129 -15.913 14.029 -3.016 1034 H VAL 130 H VAL 130 -15.533 9.170 -7.871 1035 HA VAL 130 HA VAL 130 -15.385 11.925 -8.913 1036 HB VAL 130 HB VAL 130 -13.126 9.999 -8.232 1037 HG11 VAL 130 HG11 VAL 130 -12.383 11.901 -9.610 1038 HG12 VAL 130 HG12 VAL 130 -13.188 13.037 -8.503 1039 HG13 VAL 130 HG13 VAL 130 -11.797 12.074 -7.956 1040 HG21 VAL 130 HG21 VAL 130 -14.441 10.328 -6.202 1041 HG22 VAL 130 HG22 VAL 130 -12.965 11.279 -6.083 1042 HG23 VAL 130 HG23 VAL 130 -14.500 12.082 -6.478 1043 H LYS 131 H LYS 131 -14.963 8.626 -10.043 1044 HA LYS 131 HA LYS 131 -13.937 9.462 -12.686 1045 HB2 LYS 131 HB2 LYS 131 -12.768 7.741 -11.329 1046 HB3 LYS 131 HB3 LYS 131 -14.189 6.718 -11.387 1047 HG2 LYS 131 HG2 LYS 131 -12.310 6.072 -12.909 1048 HG3 LYS 131 HG3 LYS 131 -13.864 6.215 -13.692 1049 HD2 LYS 131 HD2 LYS 131 -12.084 7.097 -15.094 1050 HD3 LYS 131 HD3 LYS 131 -13.226 8.375 -14.680 1051 HE2 LYS 131 HE2 LYS 131 -11.689 9.258 -12.980 1052 HE3 LYS 131 HE3 LYS 131 -10.578 7.905 -13.234 1053 HZ1 LYS 131 HZ1 LYS 131 -11.296 9.861 -15.366 1054 HZ2 LYS 131 HZ2 LYS 131 -9.934 9.963 -14.454 1055 HZ3 LYS 131 HZ3 LYS 131 -10.160 8.698 -15.463 1056 H GLN 132 H GLN 132 -16.551 10.230 -12.104 1057 HA GLN 132 HA GLN 132 -18.280 8.538 -13.787 1058 HB2 GLN 132 HB2 GLN 132 -18.790 11.158 -12.324 1059 HB3 GLN 132 HB3 GLN 132 -19.961 10.383 -13.395 1060 HG2 GLN 132 HG2 GLN 132 -18.782 9.099 -10.901 1061 HG3 GLN 132 HG3 GLN 132 -20.350 9.897 -10.969 1062 HE21 GLN 132 HE21 GLN 132 -20.138 6.035 -12.063 1063 HE22 GLN 132 HE22 GLN 132 -18.838 6.874 -11.210 1064 H GLU 133 H GLU 133 -17.501 8.509 -15.677 1065 HA GLU 133 HA GLU 133 -16.870 10.987 -17.222 1066 HB2 GLU 133 HB2 GLU 133 -14.948 9.929 -15.894 1067 HB3 GLU 133 HB3 GLU 133 -15.055 8.553 -16.998 1068 HG2 GLU 133 HG2 GLU 133 -14.692 10.118 -18.907 1069 HG3 GLU 133 HG3 GLU 133 -14.590 11.461 -17.756 Start of MODEL 19 1 H1 GLY -4 H1 GLY -4 -12.226 28.343 22.291 2 H2 GLY -4 H2 GLY -4 -12.840 27.136 23.211 3 H3 GLY -4 H3 GLY -4 -13.710 27.732 21.957 4 HA2 GLY -4 HA2 GLY -4 -12.770 25.596 21.366 5 HA3 GLY -4 HA3 GLY -4 -12.125 26.904 20.357 6 H SER -3 H SER -3 -10.822 24.405 20.762 7 HA SER -3 HA SER -3 -8.684 24.675 22.705 8 HB2 SER -3 HB2 SER -3 -7.815 22.620 21.586 9 HB3 SER -3 HB3 SER -3 -9.470 22.504 22.196 10 HG SER -3 HG SER -3 -9.689 21.720 20.220 11 HA PRO -2 HA PRO -2 -5.912 27.198 20.474 12 HB2 PRO -2 HB2 PRO -2 -3.413 26.301 21.207 13 HB3 PRO -2 HB3 PRO -2 -4.526 27.168 22.308 14 HG2 PRO -2 HG2 PRO -2 -4.143 24.164 22.040 15 HG3 PRO -2 HG3 PRO -2 -4.136 25.151 23.539 16 HD2 PRO -2 HD2 PRO -2 -6.358 23.841 22.762 17 HD3 PRO -2 HD3 PRO -2 -6.484 25.499 23.421 18 H ASN -1 H ASN -1 -5.320 23.712 20.044 19 HA ASN -1 HA ASN -1 -3.834 23.874 17.594 20 HB2 ASN -1 HB2 ASN -1 -4.576 21.472 17.355 21 HB3 ASN -1 HB3 ASN -1 -3.783 21.857 18.879 22 HD21 ASN -1 HD21 ASN -1 -7.781 20.957 18.957 23 HD22 ASN -1 HD22 ASN -1 -7.012 21.253 17.406 24 H SER 0 H SER 0 -7.342 24.098 18.208 25 HA SER 0 HA SER 0 -8.124 23.575 15.497 26 HB2 SER 0 HB2 SER 0 -9.641 24.955 17.740 27 HB3 SER 0 HB3 SER 0 -10.327 24.480 16.179 28 HG SER 0 HG SER 0 -9.561 22.898 18.339 29 H MET 1 H MET 1 -6.492 26.266 16.658 30 HA MET 1 HA MET 1 -7.573 28.255 14.804 31 HB2 MET 1 HB2 MET 1 -4.949 28.155 16.346 32 HB3 MET 1 HB3 MET 1 -5.578 29.548 15.461 33 HG2 MET 1 HG2 MET 1 -7.555 29.626 16.943 34 HG3 MET 1 HG3 MET 1 -6.960 28.221 17.825 35 HE1 MET 1 HE1 MET 1 -4.993 31.513 16.551 36 HE2 MET 1 HE2 MET 1 -6.592 32.037 17.131 37 HE3 MET 1 HE3 MET 1 -5.127 32.476 18.035 38 H ALA 2 H ALA 2 -5.810 25.438 14.252 39 HA ALA 2 HA ALA 2 -4.901 26.343 11.586 40 HB1 ALA 2 HB1 ALA 2 -2.610 25.487 11.976 41 HB2 ALA 2 HB2 ALA 2 -2.986 26.829 13.073 42 HB3 ALA 2 HB3 ALA 2 -3.012 25.155 13.675 43 H THR 3 H THR 3 -5.262 23.636 13.898 44 HA THR 3 HA THR 3 -5.802 21.748 11.639 45 HB THR 3 HB THR 3 -4.367 21.081 14.227 46 HG1 THR 3 HG1 THR 3 -2.558 20.883 12.916 47 HG21 THR 3 HG21 THR 3 -5.605 19.163 13.262 48 HG22 THR 3 HG22 THR 3 -4.867 19.470 11.674 49 HG23 THR 3 HG23 THR 3 -3.866 18.943 13.047 50 H GLU 4 H GLU 4 -7.945 21.880 11.741 51 HA GLU 4 HA GLU 4 -9.352 20.976 14.216 52 HB2 GLU 4 HB2 GLU 4 -11.174 22.515 13.655 53 HB3 GLU 4 HB3 GLU 4 -9.661 23.377 13.903 54 HG2 GLU 4 HG2 GLU 4 -9.301 23.645 11.530 55 HG3 GLU 4 HG3 GLU 4 -10.699 22.626 11.143 56 H LEU 5 H LEU 5 -8.462 19.633 11.588 57 HA LEU 5 HA LEU 5 -10.982 18.800 10.348 58 HB2 LEU 5 HB2 LEU 5 -8.059 18.350 9.798 59 HB3 LEU 5 HB3 LEU 5 -9.178 17.105 9.287 60 HG LEU 5 HG LEU 5 -10.560 18.896 8.128 61 HD11 LEU 5 HD11 LEU 5 -9.617 20.902 9.198 62 HD12 LEU 5 HD12 LEU 5 -8.010 20.518 8.534 63 HD13 LEU 5 HD13 LEU 5 -9.353 20.945 7.450 64 HD21 LEU 5 HD21 LEU 5 -9.144 17.308 6.925 65 HD22 LEU 5 HD22 LEU 5 -9.099 18.897 6.152 66 HD23 LEU 5 HD23 LEU 5 -7.728 18.365 7.155 67 H GLU 6 H GLU 6 -12.264 17.681 11.623 68 HA GLU 6 HA GLU 6 -11.370 15.225 12.985 69 HB2 GLU 6 HB2 GLU 6 -13.138 16.777 13.903 70 HB3 GLU 6 HB3 GLU 6 -14.190 16.290 12.581 71 HG2 GLU 6 HG2 GLU 6 -14.789 15.055 14.558 72 HG3 GLU 6 HG3 GLU 6 -14.083 13.917 13.423 73 H TYR 7 H TYR 7 -10.398 14.737 10.704 74 HA TYR 7 HA TYR 7 -12.306 13.364 8.921 75 HB2 TYR 7 HB2 TYR 7 -10.926 15.816 8.618 76 HB3 TYR 7 HB3 TYR 7 -9.980 14.678 7.696 77 HD1 TYR 7 HD1 TYR 7 -12.559 16.887 7.594 78 HD2 TYR 7 HD2 TYR 7 -11.558 12.939 6.260 79 HE1 TYR 7 HE1 TYR 7 -14.063 17.200 5.579 80 HE2 TYR 7 HE2 TYR 7 -13.025 13.218 4.254 81 HH TYR 7 HH TYR 7 -14.874 16.240 3.656 82 H GLU 8 H GLU 8 -11.783 11.402 8.606 83 HA GLU 8 HA GLU 8 -9.501 10.637 7.231 84 HB2 GLU 8 HB2 GLU 8 -9.044 10.447 10.075 85 HB3 GLU 8 HB3 GLU 8 -9.184 8.787 9.434 86 HG2 GLU 8 HG2 GLU 8 -7.521 9.302 7.686 87 HG3 GLU 8 HG3 GLU 8 -7.354 10.940 8.309 88 H SER 9 H SER 9 -11.033 9.895 5.902 89 HA SER 9 HA SER 9 -13.293 8.238 6.670 90 HB2 SER 9 HB2 SER 9 -12.171 9.444 4.118 91 HB3 SER 9 HB3 SER 9 -13.489 8.232 4.071 92 HG SER 9 HG SER 9 -14.311 10.360 4.192 93 H VAL 10 H VAL 10 -12.427 6.380 7.575 94 HA VAL 10 HA VAL 10 -10.383 4.721 6.442 95 HB VAL 10 HB VAL 10 -12.575 3.944 8.404 96 HG11 VAL 10 HG11 VAL 10 -9.891 2.629 7.763 97 HG12 VAL 10 HG12 VAL 10 -10.923 2.214 9.148 98 HG13 VAL 10 HG13 VAL 10 -11.509 1.924 7.517 99 HG21 VAL 10 HG21 VAL 10 -9.727 4.913 8.896 100 HG22 VAL 10 HG22 VAL 10 -11.207 5.825 9.263 101 HG23 VAL 10 HG23 VAL 10 -10.858 4.338 10.140 102 H LEU 11 H LEU 11 -10.420 2.830 5.267 103 HA LEU 11 HA LEU 11 -12.917 2.246 3.712 104 HB2 LEU 11 HB2 LEU 11 -10.079 2.500 2.634 105 HB3 LEU 11 HB3 LEU 11 -11.500 2.029 1.712 106 HG LEU 11 HG LEU 11 -11.013 4.764 2.950 107 HD11 LEU 11 HD11 LEU 11 -10.904 5.467 0.551 108 HD12 LEU 11 HD12 LEU 11 -9.587 4.393 1.030 109 HD13 LEU 11 HD13 LEU 11 -10.948 3.763 0.080 110 HD21 LEU 11 HD21 LEU 11 -13.446 4.253 2.862 111 HD22 LEU 11 HD22 LEU 11 -12.994 5.487 1.695 112 HD23 LEU 11 HD23 LEU 11 -13.286 3.816 1.148 113 H CYS 12 H CYS 12 -9.697 1.029 4.719 114 HA CYS 12 HA CYS 12 -10.819 -1.665 5.124 115 HB2 CYS 12 HB2 CYS 12 -10.076 -1.540 2.704 116 HB3 CYS 12 HB3 CYS 12 -8.428 -1.237 3.296 117 HG CYS 12 HG CYS 12 -8.714 -3.732 2.483 118 H VAL 13 H VAL 13 -9.881 -2.645 6.790 119 HA VAL 13 HA VAL 13 -7.174 -1.801 7.733 120 HB VAL 13 HB VAL 13 -9.606 -2.269 9.495 121 HG11 VAL 13 HG11 VAL 13 -7.595 -3.189 10.601 122 HG12 VAL 13 HG12 VAL 13 -6.714 -1.677 10.279 123 HG13 VAL 13 HG13 VAL 13 -8.103 -1.693 11.385 124 HG21 VAL 13 HG21 VAL 13 -9.544 -0.001 8.475 125 HG22 VAL 13 HG22 VAL 13 -9.229 0.066 10.213 126 HG23 VAL 13 HG23 VAL 13 -7.881 0.197 9.064 127 H LYS 14 H LYS 14 -5.818 -3.453 7.797 128 HA LYS 14 HA LYS 14 -6.824 -6.203 8.339 129 HB2 LYS 14 HB2 LYS 14 -4.955 -5.360 6.162 130 HB3 LYS 14 HB3 LYS 14 -4.497 -6.784 7.066 131 HG2 LYS 14 HG2 LYS 14 -5.711 -7.346 5.034 132 HG3 LYS 14 HG3 LYS 14 -6.547 -7.938 6.478 133 HD2 LYS 14 HD2 LYS 14 -8.216 -6.249 6.335 134 HD3 LYS 14 HD3 LYS 14 -7.252 -5.287 5.205 135 HE2 LYS 14 HE2 LYS 14 -8.932 -6.188 3.875 136 HE3 LYS 14 HE3 LYS 14 -7.524 -7.184 3.515 137 HZ1 LYS 14 HZ1 LYS 14 -9.645 -8.402 3.870 138 HZ2 LYS 14 HZ2 LYS 14 -8.461 -8.940 4.876 139 HZ3 LYS 14 HZ3 LYS 14 -9.656 -7.958 5.442 140 HA PRO 15 HA PRO 15 -4.095 -5.818 11.822 141 HB2 PRO 15 HB2 PRO 15 -3.924 -8.437 12.607 142 HB3 PRO 15 HB3 PRO 15 -5.402 -7.441 12.827 143 HG2 PRO 15 HG2 PRO 15 -4.776 -9.392 10.575 144 HG3 PRO 15 HG3 PRO 15 -6.279 -9.285 11.555 145 HD2 PRO 15 HD2 PRO 15 -6.090 -8.162 9.118 146 HD3 PRO 15 HD3 PRO 15 -6.961 -7.330 10.444 147 H ASP 16 H ASP 16 -3.243 -7.802 9.056 148 HA ASP 16 HA ASP 16 -0.393 -7.946 9.948 149 HB2 ASP 16 HB2 ASP 16 -1.574 -10.053 10.458 150 HB3 ASP 16 HB3 ASP 16 -2.058 -10.193 8.766 151 H VAL 17 H VAL 17 0.711 -6.806 8.615 152 HA VAL 17 HA VAL 17 0.779 -7.495 5.756 153 HB VAL 17 HB VAL 17 -0.848 -5.628 5.905 154 HG11 VAL 17 HG11 VAL 17 1.504 -3.928 6.827 155 HG12 VAL 17 HG12 VAL 17 -0.107 -3.347 6.376 156 HG13 VAL 17 HG13 VAL 17 0.090 -4.375 7.801 157 HG21 VAL 17 HG21 VAL 17 0.474 -5.964 3.852 158 HG22 VAL 17 HG22 VAL 17 0.062 -4.268 4.122 159 HG23 VAL 17 HG23 VAL 17 1.708 -4.831 4.464 160 H SER 18 H SER 18 2.764 -7.145 4.799 161 HA SER 18 HA SER 18 5.023 -6.500 6.679 162 HB2 SER 18 HB2 SER 18 4.875 -8.632 4.523 163 HB3 SER 18 HB3 SER 18 6.262 -8.295 5.580 164 HG SER 18 HG SER 18 4.921 -10.060 6.303 165 H VAL 19 H VAL 19 6.489 -5.056 6.015 166 HA VAL 19 HA VAL 19 6.343 -3.967 3.256 167 HB VAL 19 HB VAL 19 7.471 -2.836 5.809 168 HG11 VAL 19 HG11 VAL 19 7.738 -1.712 2.982 169 HG12 VAL 19 HG12 VAL 19 8.009 -0.777 4.473 170 HG13 VAL 19 HG13 VAL 19 9.057 -2.137 4.101 171 HG21 VAL 19 HG21 VAL 19 4.958 -2.667 5.265 172 HG22 VAL 19 HG22 VAL 19 5.799 -1.140 5.545 173 HG23 VAL 19 HG23 VAL 19 5.433 -1.648 3.890 174 H TYR 20 H TYR 20 7.853 -3.971 1.853 175 HA TYR 20 HA TYR 20 10.583 -4.920 2.583 176 HB2 TYR 20 HB2 TYR 20 9.405 -5.496 -0.123 177 HB3 TYR 20 HB3 TYR 20 10.774 -6.242 0.700 178 HD1 TYR 20 HD1 TYR 20 7.198 -6.349 0.079 179 HD2 TYR 20 HD2 TYR 20 10.337 -7.843 2.615 180 HE1 TYR 20 HE1 TYR 20 5.697 -8.165 0.851 181 HE2 TYR 20 HE2 TYR 20 8.819 -9.645 3.433 182 HH TYR 20 HH TYR 20 5.457 -9.989 2.273 183 H ARG 21 H ARG 21 11.979 -3.355 2.248 184 HA ARG 21 HA ARG 21 11.603 -1.087 0.413 185 HB2 ARG 21 HB2 ARG 21 14.108 -2.144 1.794 186 HB3 ARG 21 HB3 ARG 21 14.014 -0.643 0.885 187 HG2 ARG 21 HG2 ARG 21 12.483 -1.300 3.439 188 HG3 ARG 21 HG3 ARG 21 13.900 -0.269 3.320 189 HD2 ARG 21 HD2 ARG 21 11.175 0.311 2.080 190 HD3 ARG 21 HD3 ARG 21 11.821 0.998 3.570 191 HE ARG 21 HE ARG 21 13.447 1.396 1.128 192 HH11 ARG 21 HH11 ARG 21 13.977 3.461 0.550 193 HH12 ARG 21 HH12 ARG 21 13.183 4.808 1.305 194 HH21 ARG 21 HH21 ARG 21 11.165 2.905 3.318 195 HH22 ARG 21 HH22 ARG 21 11.624 4.510 2.825 196 H ILE 22 H ILE 22 11.275 -1.613 -1.644 197 HA ILE 22 HA ILE 22 12.372 -3.945 -2.871 198 HB ILE 22 HB ILE 22 11.262 -3.180 -4.924 199 HG12 ILE 22 HG12 ILE 22 10.350 -0.698 -3.418 200 HG13 ILE 22 HG13 ILE 22 11.647 -0.702 -4.618 201 HG21 ILE 22 HG21 ILE 22 9.440 -2.837 -2.520 202 HG22 ILE 22 HG22 ILE 22 9.022 -3.456 -4.131 203 HG23 ILE 22 HG23 ILE 22 10.073 -4.396 -3.069 204 HD11 ILE 22 HD11 ILE 22 9.623 -0.015 -5.725 205 HD12 ILE 22 HD12 ILE 22 10.052 -1.638 -6.308 206 HD13 ILE 22 HD13 ILE 22 8.741 -1.430 -5.130 207 HA PRO 23 HA PRO 23 16.060 -2.429 -5.022 208 HB2 PRO 23 HB2 PRO 23 15.851 -3.742 -7.447 209 HB3 PRO 23 HB3 PRO 23 16.379 -4.530 -5.929 210 HG2 PRO 23 HG2 PRO 23 13.575 -4.473 -7.112 211 HG3 PRO 23 HG3 PRO 23 14.513 -5.904 -6.563 212 HD2 PRO 23 HD2 PRO 23 12.712 -4.775 -4.944 213 HD3 PRO 23 HD3 PRO 23 14.290 -5.267 -4.278 214 HA PRO 24 HA PRO 24 14.545 0.940 -7.558 215 HB2 PRO 24 HB2 PRO 24 16.632 1.501 -9.241 216 HB3 PRO 24 HB3 PRO 24 16.665 1.825 -7.482 217 HG2 PRO 24 HG2 PRO 24 17.812 -0.574 -8.946 218 HG3 PRO 24 HG3 PRO 24 18.602 0.453 -7.709 219 HD2 PRO 24 HD2 PRO 24 17.430 -1.915 -7.069 220 HD3 PRO 24 HD3 PRO 24 17.343 -0.512 -5.963 221 H ARG 25 H ARG 25 12.835 0.159 -8.628 222 HA ARG 25 HA ARG 25 13.060 -1.134 -11.308 223 HB2 ARG 25 HB2 ARG 25 12.035 -2.274 -8.687 224 HB3 ARG 25 HB3 ARG 25 11.182 -2.733 -10.141 225 HG2 ARG 25 HG2 ARG 25 14.179 -3.096 -9.894 226 HG3 ARG 25 HG3 ARG 25 12.988 -4.291 -9.371 227 HD2 ARG 25 HD2 ARG 25 12.021 -4.404 -11.625 228 HD3 ARG 25 HD3 ARG 25 13.081 -3.135 -12.192 229 HE ARG 25 HE ARG 25 14.759 -4.664 -12.508 230 HH11 ARG 25 HH11 ARG 25 16.060 -6.441 -12.177 231 HH12 ARG 25 HH12 ARG 25 15.533 -7.691 -11.080 232 HH21 ARG 25 HH21 ARG 25 12.555 -6.302 -10.257 233 HH22 ARG 25 HH22 ARG 25 13.736 -7.572 -9.992 234 H ALA 26 H ALA 26 10.832 -1.681 -12.111 235 HA ALA 26 HA ALA 26 8.655 0.101 -11.236 236 HB1 ALA 26 HB1 ALA 26 8.062 0.593 -13.597 237 HB2 ALA 26 HB2 ALA 26 9.659 1.244 -13.174 238 HB3 ALA 26 HB3 ALA 26 9.537 -0.243 -14.134 239 H SER 27 H SER 27 6.589 -0.733 -11.910 240 HA SER 27 HA SER 27 6.156 -3.439 -11.280 241 HB2 SER 27 HB2 SER 27 3.806 -2.997 -11.949 242 HB3 SER 27 HB3 SER 27 4.477 -1.763 -10.866 243 HG SER 27 HG SER 27 4.243 -0.317 -12.337 244 H ASN 28 H ASN 28 5.810 -1.864 -14.416 245 HA ASN 28 HA ASN 28 5.409 -4.394 -15.847 246 HB2 ASN 28 HB2 ASN 28 5.428 -1.452 -16.638 247 HB3 ASN 28 HB3 ASN 28 5.308 -2.747 -17.825 248 HD21 ASN 28 HD21 ASN 28 2.064 -2.178 -15.374 249 HD22 ASN 28 HD22 ASN 28 3.622 -1.676 -14.750 250 H ARG 29 H ARG 29 8.018 -3.637 -14.459 251 HA ARG 29 HA ARG 29 9.879 -4.502 -16.636 252 HB2 ARG 29 HB2 ARG 29 10.458 -2.417 -14.480 253 HB3 ARG 29 HB3 ARG 29 11.627 -3.041 -15.635 254 HG2 ARG 29 HG2 ARG 29 9.122 -1.452 -16.372 255 HG3 ARG 29 HG3 ARG 29 10.759 -0.803 -16.256 256 HD2 ARG 29 HD2 ARG 29 11.542 -2.328 -18.015 257 HD3 ARG 29 HD3 ARG 29 9.945 -3.039 -18.164 258 HE ARG 29 HE ARG 29 10.801 -0.339 -19.054 259 HH11 ARG 29 HH11 ARG 29 9.576 0.705 -20.564 260 HH12 ARG 29 HH12 ARG 29 8.002 0.099 -20.987 261 HH21 ARG 29 HH21 ARG 29 8.082 -2.582 -18.843 262 HH22 ARG 29 HH22 ARG 29 7.195 -1.714 -20.069 263 H GLY 30 H GLY 30 9.221 -4.440 -13.104 264 HA2 GLY 30 HA2 GLY 30 9.799 -7.186 -12.849 265 HA3 GLY 30 HA3 GLY 30 11.315 -6.322 -12.517 266 H TYR 31 H TYR 31 7.975 -5.429 -11.468 267 HA TYR 31 HA TYR 31 8.693 -6.155 -8.662 268 HB2 TYR 31 HB2 TYR 31 6.094 -5.185 -9.902 269 HB3 TYR 31 HB3 TYR 31 6.366 -5.504 -8.204 270 HD1 TYR 31 HD1 TYR 31 5.128 -3.162 -8.687 271 HD2 TYR 31 HD2 TYR 31 9.372 -3.926 -9.045 272 HE1 TYR 31 HE1 TYR 31 5.581 -0.748 -8.396 273 HE2 TYR 31 HE2 TYR 31 9.798 -1.501 -8.640 274 HH TYR 31 HH TYR 31 7.153 0.897 -8.417 275 H ARG 32 H ARG 32 9.004 -8.463 -8.809 276 HA ARG 32 HA ARG 32 6.543 -9.986 -9.637 277 HB2 ARG 32 HB2 ARG 32 7.920 -11.913 -10.210 278 HB3 ARG 32 HB3 ARG 32 8.187 -10.538 -11.254 279 HG2 ARG 32 HG2 ARG 32 10.081 -11.023 -8.936 280 HG3 ARG 32 HG3 ARG 32 10.174 -12.021 -10.394 281 HD2 ARG 32 HD2 ARG 32 10.301 -9.913 -11.781 282 HD3 ARG 32 HD3 ARG 32 10.398 -8.998 -10.279 283 HE ARG 32 HE ARG 32 12.609 -9.653 -9.985 284 HH11 ARG 32 HH11 ARG 32 14.471 -10.390 -10.456 285 HH12 ARG 32 HH12 ARG 32 14.734 -11.559 -11.750 286 HH21 ARG 32 HH21 ARG 32 11.376 -11.676 -12.588 287 HH22 ARG 32 HH22 ARG 32 12.975 -12.266 -12.949 288 H ALA 33 H ALA 33 7.102 -8.880 -7.077 289 HA ALA 33 HA ALA 33 7.240 -9.259 -4.871 290 HB1 ALA 33 HB1 ALA 33 5.969 -11.920 -5.573 291 HB2 ALA 33 HB2 ALA 33 5.848 -11.026 -4.035 292 HB3 ALA 33 HB3 ALA 33 5.127 -10.368 -5.530 293 H SER 34 H SER 34 8.403 -12.284 -6.442 294 HA SER 34 HA SER 34 9.998 -13.222 -4.346 295 HB2 SER 34 HB2 SER 34 10.318 -13.665 -7.331 296 HB3 SER 34 HB3 SER 34 11.024 -14.671 -6.049 297 HG SER 34 HG SER 34 9.042 -15.533 -6.839 298 H ASP 35 H ASP 35 10.762 -10.570 -6.430 299 HA ASP 35 HA ASP 35 13.670 -10.752 -6.013 300 HB2 ASP 35 HB2 ASP 35 12.084 -9.555 -7.930 301 HB3 ASP 35 HB3 ASP 35 12.497 -8.176 -6.934 302 H TRP 36 H TRP 36 11.055 -9.776 -4.054 303 HA TRP 36 HA TRP 36 12.504 -7.657 -2.611 304 HB2 TRP 36 HB2 TRP 36 9.751 -8.777 -2.074 305 HB3 TRP 36 HB3 TRP 36 10.423 -7.256 -1.539 306 HD1 TRP 36 HD1 TRP 36 11.299 -6.851 -4.938 307 HE1 TRP 36 HE1 TRP 36 9.442 -5.728 -6.342 308 HE3 TRP 36 HE3 TRP 36 7.307 -7.658 -1.838 309 HZ2 TRP 36 HZ2 TRP 36 6.714 -4.997 -6.010 310 HZ3 TRP 36 HZ3 TRP 36 5.083 -6.648 -2.375 311 HH2 TRP 36 HH2 TRP 36 4.791 -5.327 -4.435 312 H LYS 37 H LYS 37 12.157 -7.818 -0.169 313 HA LYS 37 HA LYS 37 13.614 -10.169 0.765 314 HB2 LYS 37 HB2 LYS 37 12.740 -7.633 2.199 315 HB3 LYS 37 HB3 LYS 37 13.705 -8.924 2.913 316 HG2 LYS 37 HG2 LYS 37 15.358 -8.612 0.991 317 HG3 LYS 37 HG3 LYS 37 14.512 -7.085 0.659 318 HD2 LYS 37 HD2 LYS 37 16.025 -7.933 3.154 319 HD3 LYS 37 HD3 LYS 37 16.424 -6.622 2.034 320 HE2 LYS 37 HE2 LYS 37 14.318 -5.445 2.748 321 HE3 LYS 37 HE3 LYS 37 14.029 -6.744 3.923 322 HZ1 LYS 37 HZ1 LYS 37 16.052 -6.125 5.065 323 HZ2 LYS 37 HZ2 LYS 37 16.478 -5.047 3.912 324 HZ3 LYS 37 HZ3 LYS 37 15.206 -4.734 4.871 325 H LEU 38 H LEU 38 11.428 -11.323 0.059 326 HA LEU 38 HA LEU 38 9.190 -11.332 1.779 327 HB2 LEU 38 HB2 LEU 38 10.227 -13.620 0.071 328 HB3 LEU 38 HB3 LEU 38 8.593 -13.452 0.706 329 HG LEU 38 HG LEU 38 9.926 -11.686 -1.373 330 HD11 LEU 38 HD11 LEU 38 7.529 -13.592 -1.441 331 HD12 LEU 38 HD12 LEU 38 8.091 -12.622 -2.805 332 HD13 LEU 38 HD13 LEU 38 9.127 -13.903 -2.154 333 HD21 LEU 38 HD21 LEU 38 8.522 -10.203 -0.108 334 HD22 LEU 38 HD22 LEU 38 7.642 -10.618 -1.579 335 HD23 LEU 38 HD23 LEU 38 7.218 -11.407 -0.040 336 H ASP 39 H ASP 39 12.235 -12.742 2.526 337 HA ASP 39 HA ASP 39 11.006 -14.404 4.695 338 HB2 ASP 39 HB2 ASP 39 12.363 -15.586 2.945 339 HB3 ASP 39 HB3 ASP 39 13.772 -14.686 3.492 340 H GLN 40 H GLN 40 12.325 -11.427 4.229 341 HA GLN 40 HA GLN 40 12.853 -11.051 7.068 342 HB2 GLN 40 HB2 GLN 40 15.052 -9.913 6.705 343 HB3 GLN 40 HB3 GLN 40 15.056 -11.659 6.686 344 HG2 GLN 40 HG2 GLN 40 15.113 -9.973 4.159 345 HG3 GLN 40 HG3 GLN 40 16.553 -10.474 5.015 346 HE21 GLN 40 HE21 GLN 40 15.430 -12.960 2.258 347 HE22 GLN 40 HE22 GLN 40 15.267 -11.212 2.243 348 HA PRO 41 HA PRO 41 10.630 -7.590 4.797 349 HB2 PRO 41 HB2 PRO 41 8.760 -7.182 6.837 350 HB3 PRO 41 HB3 PRO 41 8.523 -8.212 5.404 351 HG2 PRO 41 HG2 PRO 41 9.449 -9.050 8.164 352 HG3 PRO 41 HG3 PRO 41 8.217 -9.833 7.122 353 HD2 PRO 41 HD2 PRO 41 10.718 -10.805 7.261 354 HD3 PRO 41 HD3 PRO 41 9.893 -10.720 5.676 355 H ASP 42 H ASP 42 10.903 -5.454 5.191 356 HA ASP 42 HA ASP 42 13.042 -4.783 7.062 357 HB2 ASP 42 HB2 ASP 42 12.504 -3.910 4.607 358 HB3 ASP 42 HB3 ASP 42 11.506 -2.732 5.459 359 H TRP 43 H TRP 43 9.587 -4.456 6.936 360 HA TRP 43 HA TRP 43 9.453 -3.901 9.810 361 HB2 TRP 43 HB2 TRP 43 9.497 -1.626 9.028 362 HB3 TRP 43 HB3 TRP 43 8.368 -1.970 7.736 363 HD1 TRP 43 HD1 TRP 43 8.493 -0.908 11.327 364 HE1 TRP 43 HE1 TRP 43 6.129 -0.329 12.140 365 HE3 TRP 43 HE3 TRP 43 5.807 -2.919 7.473 366 HZ2 TRP 43 HZ2 TRP 43 3.418 -0.477 11.087 367 HZ3 TRP 43 HZ3 TRP 43 3.342 -2.570 7.351 368 HH2 TRP 43 HH2 TRP 43 2.138 -1.433 9.189 369 H THR 44 H THR 44 7.381 -4.525 10.699 370 HA THR 44 HA THR 44 5.319 -5.507 8.823 371 HB THR 44 HB THR 44 4.826 -7.471 10.207 372 HG1 THR 44 HG1 THR 44 7.397 -7.068 11.319 373 HG21 THR 44 HG21 THR 44 7.652 -7.577 9.107 374 HG22 THR 44 HG22 THR 44 6.544 -8.947 9.389 375 HG23 THR 44 HG23 THR 44 6.154 -7.733 8.163 376 H GLY 45 H GLY 45 3.225 -5.388 9.562 377 HA2 GLY 45 HA2 GLY 45 2.426 -4.813 12.227 378 HA3 GLY 45 HA3 GLY 45 2.687 -3.277 11.408 379 H ARG 46 H ARG 46 0.693 -2.544 11.242 380 HA ARG 46 HA ARG 46 -1.560 -4.214 10.201 381 HB2 ARG 46 HB2 ARG 46 -1.608 -1.615 11.786 382 HB3 ARG 46 HB3 ARG 46 -2.991 -2.609 11.337 383 HG2 ARG 46 HG2 ARG 46 -2.196 -4.429 12.797 384 HG3 ARG 46 HG3 ARG 46 -0.753 -3.491 13.243 385 HD2 ARG 46 HD2 ARG 46 -2.081 -1.783 14.302 386 HD3 ARG 46 HD3 ARG 46 -3.575 -2.405 13.611 387 HE ARG 46 HE ARG 46 -3.307 -4.439 15.023 388 HH11 ARG 46 HH11 ARG 46 -3.758 -4.827 17.146 389 HH12 ARG 46 HH12 ARG 46 -3.182 -3.739 18.371 390 HH21 ARG 46 HH21 ARG 46 -1.604 -1.603 16.214 391 HH22 ARG 46 HH22 ARG 46 -2.138 -1.890 17.853 392 H LEU 47 H LEU 47 -2.863 -3.476 8.639 393 HA LEU 47 HA LEU 47 -1.964 -1.213 6.907 394 HB2 LEU 47 HB2 LEU 47 -2.390 -3.410 5.809 395 HB3 LEU 47 HB3 LEU 47 -3.985 -3.452 6.548 396 HG LEU 47 HG LEU 47 -4.606 -1.380 5.217 397 HD11 LEU 47 HD11 LEU 47 -3.231 -0.870 3.226 398 HD12 LEU 47 HD12 LEU 47 -2.338 -0.526 4.713 399 HD13 LEU 47 HD13 LEU 47 -1.984 -2.002 3.787 400 HD21 LEU 47 HD21 LEU 47 -4.887 -2.637 3.111 401 HD22 LEU 47 HD22 LEU 47 -3.756 -3.871 3.727 402 HD23 LEU 47 HD23 LEU 47 -5.315 -3.592 4.531 403 H ARG 48 H ARG 48 -3.117 0.664 6.915 404 HA ARG 48 HA ARG 48 -6.033 0.471 7.347 405 HB2 ARG 48 HB2 ARG 48 -5.211 1.249 9.503 406 HB3 ARG 48 HB3 ARG 48 -4.362 2.602 8.742 407 HG2 ARG 48 HG2 ARG 48 -6.383 3.694 8.149 408 HG3 ARG 48 HG3 ARG 48 -7.342 2.224 8.292 409 HD2 ARG 48 HD2 ARG 48 -7.937 3.519 10.173 410 HD3 ARG 48 HD3 ARG 48 -6.891 2.248 10.790 411 HE ARG 48 HE ARG 48 -5.095 3.814 11.076 412 HH11 ARG 48 HH11 ARG 48 -4.320 5.875 11.398 413 HH12 ARG 48 HH12 ARG 48 -5.428 7.255 11.160 414 HH21 ARG 48 HH21 ARG 48 -8.153 5.471 10.392 415 HH22 ARG 48 HH22 ARG 48 -7.375 7.039 10.641 416 H ILE 49 H ILE 49 -6.636 0.742 5.365 417 HA ILE 49 HA ILE 49 -5.588 2.926 3.666 418 HB ILE 49 HB ILE 49 -8.017 1.212 3.096 419 HG12 ILE 49 HG12 ILE 49 -5.115 0.667 2.327 420 HG13 ILE 49 HG13 ILE 49 -6.147 -0.323 3.368 421 HG21 ILE 49 HG21 ILE 49 -6.154 2.799 1.266 422 HG22 ILE 49 HG22 ILE 49 -7.661 1.987 0.793 423 HG23 ILE 49 HG23 ILE 49 -7.714 3.391 1.857 424 HD11 ILE 49 HD11 ILE 49 -6.293 0.008 0.378 425 HD12 ILE 49 HD12 ILE 49 -6.260 -1.461 1.378 426 HD13 ILE 49 HD13 ILE 49 -7.733 -0.492 1.295 427 H THR 50 H THR 50 -6.205 4.857 4.056 428 HA THR 50 HA THR 50 -8.909 5.564 5.091 429 HB THR 50 HB THR 50 -7.380 7.736 5.708 430 HG1 THR 50 HG1 THR 50 -5.545 6.917 6.772 431 HG21 THR 50 HG21 THR 50 -7.837 5.232 7.354 432 HG22 THR 50 HG22 THR 50 -7.338 6.809 8.015 433 HG23 THR 50 HG23 THR 50 -8.916 6.641 7.226 434 H SER 51 H SER 51 -9.268 7.981 4.577 435 HA SER 51 HA SER 51 -8.301 9.036 2.077 436 HB2 SER 51 HB2 SER 51 -9.988 7.317 1.328 437 HB3 SER 51 HB3 SER 51 -11.222 8.152 2.288 438 HG SER 51 HG SER 51 -11.143 8.731 0.037 439 H LYS 52 H LYS 52 -9.597 11.086 1.675 440 HA LYS 52 HA LYS 52 -11.164 12.097 3.931 441 HB2 LYS 52 HB2 LYS 52 -8.645 13.507 3.085 442 HB3 LYS 52 HB3 LYS 52 -9.962 14.256 4.030 443 HG2 LYS 52 HG2 LYS 52 -9.486 12.827 5.933 444 HG3 LYS 52 HG3 LYS 52 -8.261 11.952 5.038 445 HD2 LYS 52 HD2 LYS 52 -6.998 14.085 4.708 446 HD3 LYS 52 HD3 LYS 52 -8.190 14.904 5.745 447 HE2 LYS 52 HE2 LYS 52 -7.648 13.302 7.572 448 HE3 LYS 52 HE3 LYS 52 -6.461 12.515 6.528 449 HZ1 LYS 52 HZ1 LYS 52 -5.411 14.134 8.016 450 HZ2 LYS 52 HZ2 LYS 52 -5.221 14.619 6.468 451 HZ3 LYS 52 HZ3 LYS 52 -6.325 15.349 7.428 452 H GLY 53 H GLY 53 -9.950 14.515 1.797 453 HA2 GLY 53 HA2 GLY 53 -12.540 14.625 0.318 454 HA3 GLY 53 HA3 GLY 53 -11.366 15.920 0.486 455 H LYS 54 H LYS 54 -12.263 13.090 -1.301 456 HA LYS 54 HA LYS 54 -11.665 12.162 -3.293 457 HB2 LYS 54 HB2 LYS 54 -10.937 15.023 -4.015 458 HB3 LYS 54 HB3 LYS 54 -11.190 13.698 -5.159 459 HG2 LYS 54 HG2 LYS 54 -13.527 13.452 -4.411 460 HG3 LYS 54 HG3 LYS 54 -13.314 14.797 -3.270 461 HD2 LYS 54 HD2 LYS 54 -12.780 16.317 -5.154 462 HD3 LYS 54 HD3 LYS 54 -13.010 14.978 -6.301 463 HE2 LYS 54 HE2 LYS 54 -15.353 14.724 -5.548 464 HE3 LYS 54 HE3 LYS 54 -15.129 16.025 -4.371 465 HZ1 LYS 54 HZ1 LYS 54 -14.722 17.550 -6.232 466 HZ2 LYS 54 HZ2 LYS 54 -14.927 16.350 -7.323 467 HZ3 LYS 54 HZ3 LYS 54 -16.182 16.845 -6.404 468 H THR 55 H THR 55 -9.696 12.079 -1.266 469 HA THR 55 HA THR 55 -7.249 11.464 -2.813 470 HB THR 55 HB THR 55 -7.218 13.172 -0.285 471 HG1 THR 55 HG1 THR 55 -7.912 14.477 -1.914 472 HG21 THR 55 HG21 THR 55 -5.047 12.392 -2.268 473 HG22 THR 55 HG22 THR 55 -4.847 13.494 -0.881 474 HG23 THR 55 HG23 THR 55 -5.215 11.784 -0.602 475 H ALA 56 H ALA 56 -6.732 9.443 -2.241 476 HA ALA 56 HA ALA 56 -7.714 8.269 0.301 477 HB1 ALA 56 HB1 ALA 56 -8.222 7.028 -1.731 478 HB2 ALA 56 HB2 ALA 56 -6.488 6.935 -2.123 479 HB3 ALA 56 HB3 ALA 56 -7.118 6.123 -0.678 480 H TYR 57 H TYR 57 -6.234 7.042 1.612 481 HA TYR 57 HA TYR 57 -3.335 7.699 1.368 482 HB2 TYR 57 HB2 TYR 57 -4.886 7.817 3.973 483 HB3 TYR 57 HB3 TYR 57 -3.194 8.211 3.720 484 HD1 TYR 57 HD1 TYR 57 -2.606 10.298 2.368 485 HD2 TYR 57 HD2 TYR 57 -6.619 9.447 3.698 486 HE1 TYR 57 HE1 TYR 57 -3.272 12.664 1.921 487 HE2 TYR 57 HE2 TYR 57 -7.287 11.761 3.205 488 HH TYR 57 HH TYR 57 -4.976 14.201 1.944 489 H ILE 58 H ILE 58 -2.300 5.740 1.185 490 HA ILE 58 HA ILE 58 -3.348 3.377 2.712 491 HB ILE 58 HB ILE 58 -1.005 3.570 0.789 492 HG12 ILE 58 HG12 ILE 58 -2.364 1.874 -0.511 493 HG13 ILE 58 HG13 ILE 58 -3.752 2.275 0.498 494 HG21 ILE 58 HG21 ILE 58 -2.139 1.182 2.311 495 HG22 ILE 58 HG22 ILE 58 -0.880 1.105 1.059 496 HG23 ILE 58 HG23 ILE 58 -0.546 1.924 2.570 497 HD11 ILE 58 HD11 ILE 58 -3.824 4.517 -0.454 498 HD12 ILE 58 HD12 ILE 58 -2.216 4.296 -1.199 499 HD13 ILE 58 HD13 ILE 58 -3.614 3.378 -1.783 500 H LYS 59 H LYS 59 -3.064 3.844 4.847 501 HA LYS 59 HA LYS 59 -0.335 4.650 5.718 502 HB2 LYS 59 HB2 LYS 59 -2.916 4.576 7.317 503 HB3 LYS 59 HB3 LYS 59 -1.328 5.119 7.876 504 HG2 LYS 59 HG2 LYS 59 -1.357 6.773 5.901 505 HG3 LYS 59 HG3 LYS 59 -3.066 6.380 5.711 506 HD2 LYS 59 HD2 LYS 59 -3.531 7.188 7.996 507 HD3 LYS 59 HD3 LYS 59 -1.800 7.477 8.259 508 HE2 LYS 59 HE2 LYS 59 -1.805 9.061 6.304 509 HE3 LYS 59 HE3 LYS 59 -3.561 8.862 6.190 510 HZ1 LYS 59 HZ1 LYS 59 -3.754 9.774 8.438 511 HZ2 LYS 59 HZ2 LYS 59 -2.125 9.915 8.572 512 HZ3 LYS 59 HZ3 LYS 59 -2.935 10.827 7.490 513 H LEU 60 H LEU 60 0.978 3.490 6.811 514 HA LEU 60 HA LEU 60 0.271 0.707 7.666 515 HB2 LEU 60 HB2 LEU 60 2.907 2.078 6.989 516 HB3 LEU 60 HB3 LEU 60 2.829 0.628 7.945 517 HG LEU 60 HG LEU 60 3.357 -0.214 5.953 518 HD11 LEU 60 HD11 LEU 60 0.333 -0.357 5.655 519 HD12 LEU 60 HD12 LEU 60 1.544 -1.504 5.050 520 HD13 LEU 60 HD13 LEU 60 1.282 -1.337 6.795 521 HD21 LEU 60 HD21 LEU 60 3.105 1.855 4.610 522 HD22 LEU 60 HD22 LEU 60 2.460 0.445 3.755 523 HD23 LEU 60 HD23 LEU 60 1.350 1.595 4.530 524 H GLU 61 H GLU 61 0.234 0.233 9.778 525 HA GLU 61 HA GLU 61 1.184 2.271 11.740 526 HB2 GLU 61 HB2 GLU 61 -1.616 1.096 11.649 527 HB3 GLU 61 HB3 GLU 61 -0.952 2.077 12.967 528 HG2 GLU 61 HG2 GLU 61 -0.552 3.944 11.347 529 HG3 GLU 61 HG3 GLU 61 -1.352 3.003 10.084 530 H ASP 62 H ASP 62 1.556 1.520 13.882 531 HA ASP 62 HA ASP 62 2.859 -1.009 13.808 532 HB2 ASP 62 HB2 ASP 62 3.526 1.099 15.043 533 HB3 ASP 62 HB3 ASP 62 2.254 0.696 16.221 534 H LYS 63 H LYS 63 2.518 -2.882 14.780 535 HA LYS 63 HA LYS 63 -0.202 -3.671 15.382 536 HB2 LYS 63 HB2 LYS 63 0.941 -6.006 15.551 537 HB3 LYS 63 HB3 LYS 63 0.976 -5.197 13.984 538 HG2 LYS 63 HG2 LYS 63 3.219 -4.438 14.297 539 HG3 LYS 63 HG3 LYS 63 3.231 -4.918 16.004 540 HD2 LYS 63 HD2 LYS 63 3.173 -7.291 15.329 541 HD3 LYS 63 HD3 LYS 63 3.156 -6.800 13.609 542 HE2 LYS 63 HE2 LYS 63 5.283 -5.496 14.040 543 HE3 LYS 63 HE3 LYS 63 5.302 -6.144 15.683 544 HZ1 LYS 63 HZ1 LYS 63 5.367 -8.416 14.596 545 HZ2 LYS 63 HZ2 LYS 63 5.651 -7.657 13.157 546 HZ3 LYS 63 HZ3 LYS 63 6.709 -7.511 14.372 547 H VAL 64 H VAL 64 2.113 -2.473 17.412 548 HA VAL 64 HA VAL 64 0.743 -3.707 19.771 549 HB VAL 64 HB VAL 64 3.609 -2.738 19.484 550 HG11 VAL 64 HG11 VAL 64 2.183 -3.937 21.904 551 HG12 VAL 64 HG12 VAL 64 3.934 -3.646 21.785 552 HG13 VAL 64 HG13 VAL 64 2.820 -2.280 21.769 553 HG21 VAL 64 HG21 VAL 64 3.309 -4.929 18.437 554 HG22 VAL 64 HG22 VAL 64 4.203 -5.112 19.945 555 HG23 VAL 64 HG23 VAL 64 2.478 -5.540 19.886 556 H SER 65 H SER 65 2.290 -0.709 18.522 557 HA SER 65 HA SER 65 1.062 0.816 20.751 558 HB2 SER 65 HB2 SER 65 3.067 1.615 18.618 559 HB3 SER 65 HB3 SER 65 2.513 2.652 19.948 560 HG SER 65 HG SER 65 4.483 1.571 20.431 561 H GLY 66 H GLY 66 0.456 0.303 17.372 562 HA2 GLY 66 HA2 GLY 66 -1.284 1.052 16.023 563 HA3 GLY 66 HA3 GLY 66 -1.912 2.011 17.366 564 H GLU 67 H GLU 67 1.395 2.629 16.737 565 HA GLU 67 HA GLU 67 0.783 5.342 15.883 566 HB2 GLU 67 HB2 GLU 67 3.003 5.854 16.479 567 HB3 GLU 67 HB3 GLU 67 2.357 4.749 17.706 568 HG2 GLU 67 HG2 GLU 67 3.595 2.873 16.691 569 HG3 GLU 67 HG3 GLU 67 4.241 3.948 15.447 570 H LEU 68 H LEU 68 1.828 6.435 14.106 571 HA LEU 68 HA LEU 68 1.489 4.941 11.669 572 HB2 LEU 68 HB2 LEU 68 0.818 7.322 12.035 573 HB3 LEU 68 HB3 LEU 68 2.520 7.766 12.135 574 HG LEU 68 HG LEU 68 2.817 6.960 9.752 575 HD11 LEU 68 HD11 LEU 68 0.747 6.728 8.379 576 HD12 LEU 68 HD12 LEU 68 0.899 5.432 9.559 577 HD13 LEU 68 HD13 LEU 68 -0.227 6.761 9.872 578 HD21 LEU 68 HD21 LEU 68 2.460 9.339 10.276 579 HD22 LEU 68 HD22 LEU 68 1.678 8.907 8.748 580 HD23 LEU 68 HD23 LEU 68 0.700 9.104 10.219 581 H PHE 69 H PHE 69 2.922 3.804 10.536 582 HA PHE 69 HA PHE 69 5.849 4.153 10.915 583 HB2 PHE 69 HB2 PHE 69 5.142 1.872 10.853 584 HB3 PHE 69 HB3 PHE 69 4.159 2.129 9.420 585 HD1 PHE 69 HD1 PHE 69 5.035 1.279 7.392 586 HD2 PHE 69 HD2 PHE 69 7.760 2.648 10.451 587 HE1 PHE 69 HE1 PHE 69 6.953 0.786 5.917 588 HE2 PHE 69 HE2 PHE 69 9.679 2.077 8.987 589 HZ PHE 69 HZ PHE 69 9.277 1.158 6.708 590 H ALA 70 H ALA 70 3.466 4.192 8.218 591 HA ALA 70 HA ALA 70 4.850 6.405 6.892 592 HB1 ALA 70 HB1 ALA 70 4.716 3.641 5.593 593 HB2 ALA 70 HB2 ALA 70 5.328 5.136 4.851 594 HB3 ALA 70 HB3 ALA 70 6.193 4.415 6.211 595 H GLN 71 H GLN 71 3.701 7.155 4.965 596 HA GLN 71 HA GLN 71 0.894 6.233 4.632 597 HB2 GLN 71 HB2 GLN 71 0.198 8.662 4.670 598 HB3 GLN 71 HB3 GLN 71 0.592 7.951 6.236 599 HG2 GLN 71 HG2 GLN 71 2.547 9.190 6.506 600 HG3 GLN 71 HG3 GLN 71 2.784 9.423 4.789 601 HE21 GLN 71 HE21 GLN 71 1.563 12.678 5.045 602 HE22 GLN 71 HE22 GLN 71 2.805 11.561 4.456 603 H ALA 72 H ALA 72 0.326 6.103 2.525 604 HA ALA 72 HA ALA 72 1.854 7.701 0.500 605 HB1 ALA 72 HB1 ALA 72 0.553 4.989 0.261 606 HB2 ALA 72 HB2 ALA 72 1.293 5.898 -1.069 607 HB3 ALA 72 HB3 ALA 72 2.287 5.356 0.295 608 HA PRO 73 HA PRO 73 -2.331 9.506 -0.002 609 HB2 PRO 73 HB2 PRO 73 -1.590 11.920 -1.014 610 HB3 PRO 73 HB3 PRO 73 -1.464 11.533 0.728 611 HG2 PRO 73 HG2 PRO 73 0.725 11.410 -1.358 612 HG3 PRO 73 HG3 PRO 73 0.783 12.160 0.268 613 HD2 PRO 73 HD2 PRO 73 1.731 9.645 -0.235 614 HD3 PRO 73 HD3 PRO 73 0.979 10.070 1.331 615 H VAL 74 H VAL 74 -3.615 9.412 -1.741 616 HA VAL 74 HA VAL 74 -2.481 9.094 -4.495 617 HB VAL 74 HB VAL 74 -4.852 7.482 -3.532 618 HG11 VAL 74 HG11 VAL 74 -4.364 7.634 -5.932 619 HG12 VAL 74 HG12 VAL 74 -2.742 6.963 -5.659 620 HG13 VAL 74 HG13 VAL 74 -4.187 5.982 -5.335 621 HG21 VAL 74 HG21 VAL 74 -1.984 6.564 -3.178 622 HG22 VAL 74 HG22 VAL 74 -3.207 6.793 -1.912 623 HG23 VAL 74 HG23 VAL 74 -3.428 5.531 -3.123 624 H GLU 75 H GLU 75 -3.445 10.533 -5.901 625 HA GLU 75 HA GLU 75 -5.915 11.941 -5.052 626 HB2 GLU 75 HB2 GLU 75 -4.093 12.286 -7.467 627 HB3 GLU 75 HB3 GLU 75 -5.498 13.295 -7.101 628 HG2 GLU 75 HG2 GLU 75 -4.473 13.925 -4.917 629 HG3 GLU 75 HG3 GLU 75 -3.035 12.988 -5.329 630 H GLN 76 H GLN 76 -5.097 9.366 -7.232 631 HA GLN 76 HA GLN 76 -7.856 8.641 -7.492 632 HB2 GLN 76 HB2 GLN 76 -8.150 8.638 -9.833 633 HB3 GLN 76 HB3 GLN 76 -7.701 10.272 -9.393 634 HG2 GLN 76 HG2 GLN 76 -5.909 8.202 -10.741 635 HG3 GLN 76 HG3 GLN 76 -6.693 9.563 -11.511 636 HE21 GLN 76 HE21 GLN 76 -3.191 10.169 -9.500 637 HE22 GLN 76 HE22 GLN 76 -4.070 8.635 -9.324 638 H TYR 77 H TYR 77 -8.068 6.427 -7.919 639 HA TYR 77 HA TYR 77 -5.547 4.884 -8.273 640 HB2 TYR 77 HB2 TYR 77 -6.470 4.609 -6.054 641 HB3 TYR 77 HB3 TYR 77 -8.032 4.151 -6.733 642 HD1 TYR 77 HD1 TYR 77 -4.415 3.152 -6.733 643 HD2 TYR 77 HD2 TYR 77 -8.510 1.897 -7.212 644 HE1 TYR 77 HE1 TYR 77 -3.668 0.796 -7.022 645 HE2 TYR 77 HE2 TYR 77 -7.764 -0.474 -7.389 646 HH TYR 77 HH TYR 77 -4.292 -1.374 -7.330 647 HA PRO 78 HA PRO 78 -4.665 3.101 -9.330 648 HB2 PRO 78 HB2 PRO 78 -3.680 2.612 -11.819 649 HB3 PRO 78 HB3 PRO 78 -4.668 1.433 -10.902 650 HG2 PRO 78 HG2 PRO 78 -5.610 3.386 -13.031 651 HG3 PRO 78 HG3 PRO 78 -5.934 1.625 -12.927 652 HD2 PRO 78 HD2 PRO 78 -7.725 3.452 -12.010 653 HD3 PRO 78 HD3 PRO 78 -7.453 1.916 -11.136 654 H GLY 79 H GLY 79 -2.790 4.291 -9.366 655 HA2 GLY 79 HA2 GLY 79 -2.309 6.576 -11.117 656 HA3 GLY 79 HA3 GLY 79 -2.797 7.029 -9.485 657 H ILE 80 H ILE 80 -0.596 8.069 -9.698 658 HA ILE 80 HA ILE 80 1.789 6.628 -10.020 659 HB ILE 80 HB ILE 80 1.578 9.026 -10.317 660 HG12 ILE 80 HG12 ILE 80 3.602 9.882 -9.259 661 HG13 ILE 80 HG13 ILE 80 3.632 8.541 -8.119 662 HG21 ILE 80 HG21 ILE 80 1.471 10.635 -8.479 663 HG22 ILE 80 HG22 ILE 80 0.055 9.590 -8.423 664 HG23 ILE 80 HG23 ILE 80 1.396 9.332 -7.284 665 HD11 ILE 80 HD11 ILE 80 4.065 6.960 -9.968 666 HD12 ILE 80 HD12 ILE 80 3.926 8.292 -11.144 667 HD13 ILE 80 HD13 ILE 80 5.252 8.272 -9.961 668 H ALA 81 H ALA 81 -0.028 7.057 -7.049 669 HA ALA 81 HA ALA 81 2.257 6.264 -5.373 670 HB1 ALA 81 HB1 ALA 81 0.759 6.958 -3.534 671 HB2 ALA 81 HB2 ALA 81 0.957 8.213 -4.769 672 HB3 ALA 81 HB3 ALA 81 -0.530 7.253 -4.727 673 H VAL 82 H VAL 82 0.316 4.319 -7.100 674 HA VAL 82 HA VAL 82 0.613 2.119 -5.160 675 HB VAL 82 HB VAL 82 -2.092 2.634 -6.388 676 HG11 VAL 82 HG11 VAL 82 -1.133 0.659 -4.258 677 HG12 VAL 82 HG12 VAL 82 -2.822 0.866 -4.748 678 HG13 VAL 82 HG13 VAL 82 -1.637 0.249 -5.904 679 HG21 VAL 82 HG21 VAL 82 -1.861 4.352 -4.705 680 HG22 VAL 82 HG22 VAL 82 -2.991 3.119 -4.161 681 HG23 VAL 82 HG23 VAL 82 -1.345 3.154 -3.498 682 H GLU 83 H GLU 83 1.241 0.323 -6.156 683 HA GLU 83 HA GLU 83 0.564 -0.278 -8.995 684 HB2 GLU 83 HB2 GLU 83 3.356 -0.015 -7.812 685 HB3 GLU 83 HB3 GLU 83 3.018 -0.932 -9.281 686 HG2 GLU 83 HG2 GLU 83 2.023 1.103 -10.306 687 HG3 GLU 83 HG3 GLU 83 2.539 2.045 -8.898 688 H THR 84 H THR 84 1.255 -2.489 -9.618 689 HA THR 84 HA THR 84 0.833 -4.519 -7.435 690 HB THR 84 HB THR 84 -0.238 -5.847 -9.227 691 HG1 THR 84 HG1 THR 84 -0.737 -4.832 -11.176 692 HG21 THR 84 HG21 THR 84 -2.314 -4.543 -9.446 693 HG22 THR 84 HG22 THR 84 -1.656 -4.415 -7.812 694 HG23 THR 84 HG23 THR 84 -1.463 -3.060 -8.950 695 H VAL 85 H VAL 85 1.787 -6.629 -7.785 696 HA VAL 85 HA VAL 85 4.343 -6.642 -9.226 697 HB VAL 85 HB VAL 85 4.680 -8.823 -8.251 698 HG11 VAL 85 HG11 VAL 85 3.597 -6.909 -6.146 699 HG12 VAL 85 HG12 VAL 85 4.801 -8.185 -5.913 700 HG13 VAL 85 HG13 VAL 85 5.186 -6.793 -6.917 701 HG21 VAL 85 HG21 VAL 85 2.329 -9.662 -8.314 702 HG22 VAL 85 HG22 VAL 85 3.117 -9.870 -6.751 703 HG23 VAL 85 HG23 VAL 85 1.929 -8.567 -6.979 704 H THR 86 H THR 86 4.782 -8.703 -10.528 705 HA THR 86 HA THR 86 2.707 -9.103 -12.589 706 HB THR 86 HB THR 86 4.473 -10.182 -13.852 707 HG1 THR 86 HG1 THR 86 6.499 -10.457 -12.971 708 HG21 THR 86 HG21 THR 86 6.112 -8.375 -14.047 709 HG22 THR 86 HG22 THR 86 4.489 -7.677 -13.809 710 HG23 THR 86 HG23 THR 86 5.650 -7.735 -12.468 711 H ASP 87 H ASP 87 4.347 -10.976 -10.092 712 HA ASP 87 HA ASP 87 3.480 -13.500 -11.253 713 HB2 ASP 87 HB2 ASP 87 5.783 -13.034 -10.457 714 HB3 ASP 87 HB3 ASP 87 5.166 -12.958 -8.802 715 H SER 88 H SER 88 2.796 -11.826 -8.146 716 HA SER 88 HA SER 88 0.602 -13.821 -7.680 717 HB2 SER 88 HB2 SER 88 2.650 -14.552 -6.482 718 HB3 SER 88 HB3 SER 88 2.564 -13.070 -5.515 719 HG SER 88 HG SER 88 1.480 -14.806 -4.492 720 H SER 89 H SER 89 -1.284 -12.965 -7.262 721 HA SER 89 HA SER 89 -1.588 -10.138 -6.979 722 HB2 SER 89 HB2 SER 89 -4.040 -10.731 -7.057 723 HB3 SER 89 HB3 SER 89 -3.037 -11.273 -8.411 724 HG SER 89 HG SER 89 -4.397 -12.945 -7.716 725 H ARG 90 H ARG 90 -0.320 -11.267 -4.657 726 HA ARG 90 HA ARG 90 -2.040 -9.985 -2.627 727 HB2 ARG 90 HB2 ARG 90 -1.427 -11.497 -0.874 728 HB3 ARG 90 HB3 ARG 90 -2.255 -12.317 -2.184 729 HG2 ARG 90 HG2 ARG 90 -0.105 -13.194 -3.025 730 HG3 ARG 90 HG3 ARG 90 0.740 -12.354 -1.700 731 HD2 ARG 90 HD2 ARG 90 -0.657 -13.642 -0.048 732 HD3 ARG 90 HD3 ARG 90 -1.383 -14.520 -1.392 733 HE ARG 90 HE ARG 90 0.594 -15.726 -1.729 734 HH11 ARG 90 HH11 ARG 90 2.563 -16.551 -1.145 735 HH12 ARG 90 HH12 ARG 90 3.474 -15.801 0.130 736 HH21 ARG 90 HH21 ARG 90 1.157 -13.388 0.868 737 HH22 ARG 90 HH22 ARG 90 2.718 -14.079 1.212 738 H TYR 91 H TYR 91 0.151 -8.946 -4.340 739 HA TYR 91 HA TYR 91 1.718 -7.694 -2.173 740 HB2 TYR 91 HB2 TYR 91 2.802 -8.961 -4.702 741 HB3 TYR 91 HB3 TYR 91 3.726 -7.928 -3.634 742 HD1 TYR 91 HD1 TYR 91 4.391 -8.690 -1.385 743 HD2 TYR 91 HD2 TYR 91 2.343 -11.297 -4.148 744 HE1 TYR 91 HE1 TYR 91 5.090 -10.660 -0.043 745 HE2 TYR 91 HE2 TYR 91 3.062 -13.269 -2.809 746 HH TYR 91 HH TYR 91 5.110 -12.932 0.126 747 H PHE 92 H PHE 92 2.124 -5.579 -2.488 748 HA PHE 92 HA PHE 92 1.536 -4.264 -5.099 749 HB2 PHE 92 HB2 PHE 92 0.486 -3.344 -2.393 750 HB3 PHE 92 HB3 PHE 92 0.312 -2.478 -3.906 751 HD1 PHE 92 HD1 PHE 92 -1.109 -3.430 -5.757 752 HD2 PHE 92 HD2 PHE 92 -1.005 -5.125 -1.806 753 HE1 PHE 92 HE1 PHE 92 -3.198 -4.712 -6.240 754 HE2 PHE 92 HE2 PHE 92 -3.122 -6.315 -2.249 755 HZ PHE 92 HZ PHE 92 -4.207 -6.147 -4.499 756 H VAL 93 H VAL 93 2.364 -2.041 -5.156 757 HA VAL 93 HA VAL 93 4.506 -1.411 -3.172 758 HB VAL 93 HB VAL 93 4.635 -0.928 -6.164 759 HG11 VAL 93 HG11 VAL 93 6.672 -0.127 -4.046 760 HG12 VAL 93 HG12 VAL 93 6.826 0.075 -5.799 761 HG13 VAL 93 HG13 VAL 93 5.604 0.990 -4.927 762 HG21 VAL 93 HG21 VAL 93 5.244 -3.202 -5.621 763 HG22 VAL 93 HG22 VAL 93 6.723 -2.315 -5.984 764 HG23 VAL 93 HG23 VAL 93 6.309 -2.662 -4.301 765 H ILE 94 H ILE 94 4.440 0.703 -2.377 766 HA ILE 94 HA ILE 94 2.535 2.545 -3.694 767 HB ILE 94 HB ILE 94 1.619 3.341 -1.648 768 HG12 ILE 94 HG12 ILE 94 3.456 2.540 -0.077 769 HG13 ILE 94 HG13 ILE 94 1.800 2.460 0.485 770 HG21 ILE 94 HG21 ILE 94 0.372 1.757 -2.948 771 HG22 ILE 94 HG22 ILE 94 1.062 0.388 -2.072 772 HG23 ILE 94 HG23 ILE 94 0.012 1.552 -1.230 773 HD11 ILE 94 HD11 ILE 94 3.394 0.056 -0.503 774 HD12 ILE 94 HD12 ILE 94 3.091 0.503 1.184 775 HD13 ILE 94 HD13 ILE 94 1.742 0.034 0.146 776 H ARG 95 H ARG 95 2.858 4.709 -3.463 777 HA ARG 95 HA ARG 95 5.688 5.425 -2.859 778 HB2 ARG 95 HB2 ARG 95 4.535 6.102 -5.039 779 HB3 ARG 95 HB3 ARG 95 3.666 7.312 -4.088 780 HG2 ARG 95 HG2 ARG 95 5.889 8.206 -3.292 781 HG3 ARG 95 HG3 ARG 95 6.692 6.999 -4.301 782 HD2 ARG 95 HD2 ARG 95 6.781 8.950 -5.568 783 HD3 ARG 95 HD3 ARG 95 5.462 8.022 -6.301 784 HE ARG 95 HE ARG 95 4.270 9.716 -4.386 785 HH11 ARG 95 HH11 ARG 95 3.609 11.853 -4.717 786 HH12 ARG 95 HH12 ARG 95 3.953 12.606 -6.247 787 HH21 ARG 95 HH21 ARG 95 6.012 10.131 -7.397 788 HH22 ARG 95 HH22 ARG 95 5.340 11.711 -7.678 789 H ILE 96 H ILE 96 5.718 5.360 -0.631 790 HA ILE 96 HA ILE 96 3.845 6.971 0.920 791 HB ILE 96 HB ILE 96 5.047 6.447 2.885 792 HG12 ILE 96 HG12 ILE 96 6.892 4.461 2.415 793 HG13 ILE 96 HG13 ILE 96 7.227 5.512 1.052 794 HG21 ILE 96 HG21 ILE 96 3.371 4.900 2.148 795 HG22 ILE 96 HG22 ILE 96 4.559 4.027 1.145 796 HG23 ILE 96 HG23 ILE 96 4.679 4.015 2.910 797 HD11 ILE 96 HD11 ILE 96 7.244 6.271 4.008 798 HD12 ILE 96 HD12 ILE 96 8.656 6.045 2.965 799 HD13 ILE 96 HD13 ILE 96 7.560 7.412 2.673 800 H GLN 97 H GLN 97 4.107 8.939 1.838 801 HA GLN 97 HA GLN 97 6.366 10.636 0.885 802 HB2 GLN 97 HB2 GLN 97 3.407 10.998 0.328 803 HB3 GLN 97 HB3 GLN 97 4.543 12.342 0.250 804 HG2 GLN 97 HG2 GLN 97 5.650 11.548 -1.606 805 HG3 GLN 97 HG3 GLN 97 5.183 9.867 -1.353 806 HE21 GLN 97 HE21 GLN 97 2.142 10.118 -3.160 807 HE22 GLN 97 HE22 GLN 97 3.166 9.107 -2.149 808 H ASP 98 H ASP 98 6.787 12.426 2.029 809 HA ASP 98 HA ASP 98 5.751 12.404 4.809 810 HB2 ASP 98 HB2 ASP 98 8.190 12.160 4.208 811 HB3 ASP 98 HB3 ASP 98 8.159 13.839 3.676 812 H GLY 99 H GLY 99 4.449 13.800 2.368 813 HA2 GLY 99 HA2 GLY 99 2.941 15.525 2.157 814 HA3 GLY 99 HA3 GLY 99 3.288 16.005 3.820 815 H THR 100 H THR 100 6.131 15.953 2.003 816 HA THR 100 HA THR 100 6.020 18.880 1.374 817 HB THR 100 HB THR 100 7.019 18.367 3.581 818 HG1 THR 100 HG1 THR 100 8.715 19.468 1.609 819 HG21 THR 100 HG21 THR 100 9.248 17.413 3.755 820 HG22 THR 100 HG22 THR 100 8.136 16.223 3.071 821 HG23 THR 100 HG23 THR 100 9.292 17.073 2.015 822 H GLY 101 H GLY 101 6.262 16.087 -0.201 823 HA2 GLY 101 HA2 GLY 101 6.837 15.859 -2.495 824 HA3 GLY 101 HA3 GLY 101 8.022 17.157 -2.352 825 H ARG 102 H ARG 102 8.637 15.433 0.302 826 HA ARG 102 HA ARG 102 10.794 13.723 -0.664 827 HB2 ARG 102 HB2 ARG 102 11.107 14.940 1.371 828 HB3 ARG 102 HB3 ARG 102 9.531 14.449 1.997 829 HG2 ARG 102 HG2 ARG 102 10.313 12.125 2.206 830 HG3 ARG 102 HG3 ARG 102 11.921 12.623 1.610 831 HD2 ARG 102 HD2 ARG 102 12.062 14.239 3.527 832 HD3 ARG 102 HD3 ARG 102 10.482 13.674 4.081 833 HE ARG 102 HE ARG 102 12.676 11.686 3.784 834 HH11 ARG 102 HH11 ARG 102 13.383 10.577 5.548 835 HH12 ARG 102 HH12 ARG 102 12.771 10.960 7.128 836 HH21 ARG 102 HH21 ARG 102 10.625 13.433 6.101 837 HH22 ARG 102 HH22 ARG 102 11.313 12.548 7.431 838 H SER 103 H SER 103 10.555 11.730 -1.178 839 HA SER 103 HA SER 103 8.187 10.103 -0.431 840 HB2 SER 103 HB2 SER 103 7.609 9.608 -2.716 841 HB3 SER 103 HB3 SER 103 7.593 11.362 -2.488 842 HG SER 103 HG SER 103 9.525 11.531 -3.571 843 H ALA 104 H ALA 104 8.275 7.880 -0.864 844 HA ALA 104 HA ALA 104 10.648 6.685 -2.125 845 HB1 ALA 104 HB1 ALA 104 10.996 5.101 -0.255 846 HB2 ALA 104 HB2 ALA 104 11.293 6.774 0.265 847 HB3 ALA 104 HB3 ALA 104 9.776 5.960 0.710 848 H PHE 105 H PHE 105 10.230 4.682 -3.052 849 HA PHE 105 HA PHE 105 7.404 3.721 -3.025 850 HB2 PHE 105 HB2 PHE 105 9.735 3.172 -4.870 851 HB3 PHE 105 HB3 PHE 105 8.305 2.159 -4.822 852 HD1 PHE 105 HD1 PHE 105 9.649 5.359 -5.993 853 HD2 PHE 105 HD2 PHE 105 6.052 3.062 -5.407 854 HE1 PHE 105 HE1 PHE 105 8.447 6.808 -7.618 855 HE2 PHE 105 HE2 PHE 105 4.864 4.472 -7.055 856 HZ PHE 105 HZ PHE 105 6.060 6.353 -8.167 857 H ILE 106 H ILE 106 6.880 2.210 -1.648 858 HA ILE 106 HA ILE 106 8.913 0.183 -0.784 859 HB ILE 106 HB ILE 106 7.992 0.030 1.371 860 HG12 ILE 106 HG12 ILE 106 5.943 2.175 0.681 861 HG13 ILE 106 HG13 ILE 106 5.594 0.455 0.864 862 HG21 ILE 106 HG21 ILE 106 8.312 2.998 0.787 863 HG22 ILE 106 HG22 ILE 106 8.705 2.148 2.298 864 HG23 ILE 106 HG23 ILE 106 9.664 1.848 0.840 865 HD11 ILE 106 HD11 ILE 106 6.552 2.275 3.093 866 HD12 ILE 106 HD12 ILE 106 4.945 1.563 2.882 867 HD13 ILE 106 HD13 ILE 106 6.333 0.518 3.219 868 H GLY 107 H GLY 107 8.249 -1.947 -0.545 869 HA2 GLY 107 HA2 GLY 107 5.826 -2.722 -2.085 870 HA3 GLY 107 HA3 GLY 107 7.151 -3.779 -1.609 871 H ILE 108 H ILE 108 4.174 -3.888 -1.135 872 HA ILE 108 HA ILE 108 4.450 -4.729 1.669 873 HB ILE 108 HB ILE 108 2.074 -4.311 2.126 874 HG12 ILE 108 HG12 ILE 108 2.109 -2.443 -0.282 875 HG13 ILE 108 HG13 ILE 108 1.278 -3.998 -0.219 876 HG21 ILE 108 HG21 ILE 108 2.430 -1.982 2.794 877 HG22 ILE 108 HG22 ILE 108 3.866 -2.970 3.032 878 HG23 ILE 108 HG23 ILE 108 3.788 -1.850 1.653 879 HD11 ILE 108 HD11 ILE 108 0.627 -1.570 1.505 880 HD12 ILE 108 HD12 ILE 108 -0.342 -2.267 0.201 881 HD13 ILE 108 HD13 ILE 108 -0.100 -3.175 1.707 882 H GLY 109 H GLY 109 3.667 -6.660 2.188 883 HA2 GLY 109 HA2 GLY 109 2.319 -8.312 0.075 884 HA3 GLY 109 HA3 GLY 109 3.545 -8.948 1.164 885 H PHE 110 H PHE 110 0.696 -9.585 0.623 886 HA PHE 110 HA PHE 110 -0.547 -9.335 3.328 887 HB2 PHE 110 HB2 PHE 110 -1.678 -9.815 0.554 888 HB3 PHE 110 HB3 PHE 110 -2.617 -10.039 2.012 889 HD1 PHE 110 HD1 PHE 110 -0.477 -7.370 0.366 890 HD2 PHE 110 HD2 PHE 110 -3.986 -8.300 2.704 891 HE1 PHE 110 HE1 PHE 110 -1.101 -4.978 0.396 892 HE2 PHE 110 HE2 PHE 110 -4.662 -5.920 2.621 893 HZ PHE 110 HZ PHE 110 -3.211 -4.254 1.466 894 H THR 111 H THR 111 -1.677 -11.183 4.159 895 HA THR 111 HA THR 111 -0.111 -13.597 4.054 896 HB THR 111 HB THR 111 -1.232 -12.708 6.063 897 HG1 THR 111 HG1 THR 111 -1.805 -14.715 6.834 898 HG21 THR 111 HG21 THR 111 -3.576 -13.130 6.524 899 HG22 THR 111 HG22 THR 111 -3.453 -12.093 5.100 900 HG23 THR 111 HG23 THR 111 -3.825 -13.820 4.909 901 H ASP 112 H ASP 112 -3.001 -12.573 2.334 902 HA ASP 112 HA ASP 112 -2.970 -15.003 0.744 903 HB2 ASP 112 HB2 ASP 112 -4.371 -15.532 2.828 904 HB3 ASP 112 HB3 ASP 112 -5.517 -14.315 2.268 905 H ARG 113 H ARG 113 -4.249 -14.859 -1.171 906 HA ARG 113 HA ARG 113 -4.454 -12.259 -2.424 907 HB2 ARG 113 HB2 ARG 113 -5.611 -14.990 -3.175 908 HB3 ARG 113 HB3 ARG 113 -5.633 -13.553 -4.224 909 HG2 ARG 113 HG2 ARG 113 -3.218 -13.395 -4.139 910 HG3 ARG 113 HG3 ARG 113 -3.129 -14.787 -3.040 911 HD2 ARG 113 HD2 ARG 113 -3.999 -16.277 -4.757 912 HD3 ARG 113 HD3 ARG 113 -4.221 -14.916 -5.871 913 HE ARG 113 HE ARG 113 -1.485 -14.977 -5.039 914 HH11 ARG 113 HH11 ARG 113 0.115 -15.718 -6.312 915 HH12 ARG 113 HH12 ARG 113 -0.229 -16.781 -7.659 916 HH21 ARG 113 HH21 ARG 113 -3.623 -16.838 -7.100 917 HH22 ARG 113 HH22 ARG 113 -2.309 -17.404 -8.095 918 H GLY 114 H GLY 114 -6.806 -14.290 -0.736 919 HA2 GLY 114 HA2 GLY 114 -9.088 -12.737 -1.463 920 HA3 GLY 114 HA3 GLY 114 -8.952 -13.888 -0.116 921 H ASP 115 H ASP 115 -6.523 -12.021 0.747 922 HA ASP 115 HA ASP 115 -8.126 -9.955 2.206 923 HB2 ASP 115 HB2 ASP 115 -5.442 -11.267 2.732 924 HB3 ASP 115 HB3 ASP 115 -5.853 -9.707 3.432 925 H ALA 116 H ALA 116 -5.470 -10.375 -0.125 926 HA ALA 116 HA ALA 116 -4.865 -7.556 -0.365 927 HB1 ALA 116 HB1 ALA 116 -3.722 -8.364 -2.445 928 HB2 ALA 116 HB2 ALA 116 -3.276 -9.249 -0.970 929 HB3 ALA 116 HB3 ALA 116 -4.401 -9.968 -2.151 930 H PHE 117 H PHE 117 -7.224 -9.686 -2.058 931 HA PHE 117 HA PHE 117 -8.024 -7.817 -4.046 932 HB2 PHE 117 HB2 PHE 117 -9.250 -10.205 -2.735 933 HB3 PHE 117 HB3 PHE 117 -10.358 -9.075 -3.482 934 HD1 PHE 117 HD1 PHE 117 -6.944 -10.406 -4.489 935 HD2 PHE 117 HD2 PHE 117 -11.071 -9.754 -5.573 936 HE1 PHE 117 HE1 PHE 117 -6.512 -11.382 -6.720 937 HE2 PHE 117 HE2 PHE 117 -10.628 -10.724 -7.813 938 HZ PHE 117 HZ PHE 117 -8.350 -11.544 -8.392 939 H ASP 118 H ASP 118 -8.850 -7.876 -0.588 940 HA ASP 118 HA ASP 118 -10.916 -5.867 -0.711 941 HB2 ASP 118 HB2 ASP 118 -9.014 -6.671 1.517 942 HB3 ASP 118 HB3 ASP 118 -10.341 -5.534 1.714 943 H PHE 119 H PHE 119 -7.358 -5.613 -0.674 944 HA PHE 119 HA PHE 119 -7.186 -2.819 -0.006 945 HB2 PHE 119 HB2 PHE 119 -5.304 -4.267 0.265 946 HB3 PHE 119 HB3 PHE 119 -5.308 -4.723 -1.423 947 HD1 PHE 119 HD1 PHE 119 -4.493 -3.272 -3.199 948 HD2 PHE 119 HD2 PHE 119 -4.221 -2.175 0.955 949 HE1 PHE 119 HE1 PHE 119 -2.861 -1.502 -3.772 950 HE2 PHE 119 HE2 PHE 119 -2.612 -0.406 0.389 951 HZ PHE 119 HZ PHE 119 -1.907 -0.055 -1.983 952 H ASN 120 H ASN 120 -6.977 -4.417 -3.237 953 HA ASN 120 HA ASN 120 -7.067 -1.844 -4.554 954 HB2 ASN 120 HB2 ASN 120 -7.064 -3.116 -6.635 955 HB3 ASN 120 HB3 ASN 120 -5.836 -3.700 -5.519 956 HD21 ASN 120 HD21 ASN 120 -8.883 -6.183 -6.647 957 HD22 ASN 120 HD22 ASN 120 -9.011 -4.468 -6.995 958 H VAL 121 H VAL 121 -9.673 -4.038 -3.614 959 HA VAL 121 HA VAL 121 -11.642 -2.652 -5.290 960 HB VAL 121 HB VAL 121 -11.916 -4.663 -3.040 961 HG11 VAL 121 HG11 VAL 121 -14.117 -3.416 -4.747 962 HG12 VAL 121 HG12 VAL 121 -14.310 -4.857 -3.724 963 HG13 VAL 121 HG13 VAL 121 -13.953 -3.300 -2.979 964 HG21 VAL 121 HG21 VAL 121 -11.047 -5.512 -5.226 965 HG22 VAL 121 HG22 VAL 121 -12.651 -6.151 -4.866 966 HG23 VAL 121 HG23 VAL 121 -12.465 -4.832 -6.045 967 H SER 122 H SER 122 -10.678 -2.446 -1.804 968 HA SER 122 HA SER 122 -12.688 -0.507 -1.154 969 HB2 SER 122 HB2 SER 122 -9.988 -0.933 0.178 970 HB3 SER 122 HB3 SER 122 -11.366 -0.040 0.845 971 HG SER 122 HG SER 122 -11.083 -2.789 0.342 972 H LEU 123 H LEU 123 -9.437 -0.110 -2.547 973 HA LEU 123 HA LEU 123 -9.436 2.783 -2.443 974 HB2 LEU 123 HB2 LEU 123 -7.960 0.737 -4.135 975 HB3 LEU 123 HB3 LEU 123 -7.741 2.471 -4.355 976 HG LEU 123 HG LEU 123 -7.247 1.085 -1.690 977 HD11 LEU 123 HD11 LEU 123 -4.857 1.236 -2.256 978 HD12 LEU 123 HD12 LEU 123 -5.713 0.211 -3.413 979 HD13 LEU 123 HD13 LEU 123 -5.265 1.870 -3.870 980 HD21 LEU 123 HD21 LEU 123 -7.646 3.524 -1.509 981 HD22 LEU 123 HD22 LEU 123 -5.956 3.139 -1.206 982 HD23 LEU 123 HD23 LEU 123 -6.435 3.823 -2.775 983 H GLN 124 H GLN 124 -10.215 0.564 -5.216 984 HA GLN 124 HA GLN 124 -10.915 2.744 -6.895 985 HB2 GLN 124 HB2 GLN 124 -11.505 1.176 -8.510 986 HB3 GLN 124 HB3 GLN 124 -10.263 0.375 -7.545 987 HG2 GLN 124 HG2 GLN 124 -12.123 -0.799 -6.298 988 HG3 GLN 124 HG3 GLN 124 -13.261 -0.143 -7.479 989 HE21 GLN 124 HE21 GLN 124 -10.559 -3.028 -8.685 990 HE22 GLN 124 HE22 GLN 124 -10.202 -2.038 -7.255 991 H ASP 125 H ASP 125 -12.935 0.967 -4.595 992 HA ASP 125 HA ASP 125 -15.411 2.098 -5.614 993 HB2 ASP 125 HB2 ASP 125 -15.208 -0.197 -4.638 994 HB3 ASP 125 HB3 ASP 125 -14.847 0.525 -3.066 995 H HIS 126 H HIS 126 -12.930 3.490 -3.834 996 HA HIS 126 HA HIS 126 -14.862 5.463 -2.750 997 HB2 HIS 126 HB2 HIS 126 -13.034 4.490 -1.227 998 HB3 HIS 126 HB3 HIS 126 -11.929 5.556 -2.100 999 HD2 HIS 126 HD2 HIS 126 -15.403 5.834 -0.299 1000 HE1 HIS 126 HE1 HIS 126 -13.322 9.475 0.463 1001 HE2 HIS 126 HE2 HIS 126 -15.464 8.173 0.908 1002 H PHE 127 H PHE 127 -13.080 4.944 -5.528 1003 HA PHE 127 HA PHE 127 -13.062 7.870 -6.158 1004 HB2 PHE 127 HB2 PHE 127 -11.452 5.566 -7.280 1005 HB3 PHE 127 HB3 PHE 127 -11.529 7.151 -8.038 1006 HD1 PHE 127 HD1 PHE 127 -11.085 9.231 -6.427 1007 HD2 PHE 127 HD2 PHE 127 -9.699 5.215 -5.714 1008 HE1 PHE 127 HE1 PHE 127 -9.228 10.114 -5.036 1009 HE2 PHE 127 HE2 PHE 127 -7.847 6.095 -4.323 1010 HZ PHE 127 HZ PHE 127 -7.600 8.552 -3.997 1011 H LYS 128 H LYS 128 -14.870 5.024 -6.953 1012 HA LYS 128 HA LYS 128 -15.442 5.449 -9.602 1013 HB2 LYS 128 HB2 LYS 128 -17.276 4.095 -9.490 1014 HB3 LYS 128 HB3 LYS 128 -16.202 3.501 -8.241 1015 HG2 LYS 128 HG2 LYS 128 -18.640 5.293 -7.724 1016 HG3 LYS 128 HG3 LYS 128 -18.655 3.530 -7.690 1017 HD2 LYS 128 HD2 LYS 128 -16.982 3.538 -5.882 1018 HD3 LYS 128 HD3 LYS 128 -16.969 5.302 -5.882 1019 HE2 LYS 128 HE2 LYS 128 -18.361 4.685 -4.099 1020 HE3 LYS 128 HE3 LYS 128 -19.439 5.256 -5.384 1021 HZ1 LYS 128 HZ1 LYS 128 -20.176 3.144 -4.311 1022 HZ2 LYS 128 HZ2 LYS 128 -19.925 2.932 -5.912 1023 HZ3 LYS 128 HZ3 LYS 128 -18.817 2.389 -4.836 1024 H TRP 129 H TRP 129 -16.810 7.347 -7.026 1025 HA TRP 129 HA TRP 129 -18.759 8.729 -8.704 1026 HB2 TRP 129 HB2 TRP 129 -19.265 9.968 -6.687 1027 HB3 TRP 129 HB3 TRP 129 -19.167 8.255 -6.316 1028 HD1 TRP 129 HD1 TRP 129 -16.836 7.448 -5.048 1029 HE1 TRP 129 HE1 TRP 129 -15.196 8.672 -3.546 1030 HE3 TRP 129 HE3 TRP 129 -18.444 12.258 -5.836 1031 HZ2 TRP 129 HZ2 TRP 129 -14.884 11.345 -2.468 1032 HZ3 TRP 129 HZ3 TRP 129 -17.510 14.114 -4.479 1033 HH2 TRP 129 HH2 TRP 129 -15.737 13.675 -2.791 1034 H VAL 130 H VAL 130 -15.417 9.240 -7.823 1035 HA VAL 130 HA VAL 130 -15.309 12.067 -8.626 1036 HB VAL 130 HB VAL 130 -13.008 10.123 -8.155 1037 HG11 VAL 130 HG11 VAL 130 -13.140 13.170 -8.113 1038 HG12 VAL 130 HG12 VAL 130 -11.723 12.190 -7.672 1039 HG13 VAL 130 HG13 VAL 130 -12.317 12.170 -9.331 1040 HG21 VAL 130 HG21 VAL 130 -14.302 10.198 -6.097 1041 HG22 VAL 130 HG22 VAL 130 -12.855 11.177 -5.885 1042 HG23 VAL 130 HG23 VAL 130 -14.420 11.968 -6.184 1043 H LYS 131 H LYS 131 -14.726 8.886 -10.053 1044 HA LYS 131 HA LYS 131 -13.832 10.087 -12.621 1045 HB2 LYS 131 HB2 LYS 131 -13.441 7.337 -11.389 1046 HB3 LYS 131 HB3 LYS 131 -13.068 7.674 -13.080 1047 HG2 LYS 131 HG2 LYS 131 -11.843 9.253 -10.781 1048 HG3 LYS 131 HG3 LYS 131 -11.102 7.813 -11.484 1049 HD2 LYS 131 HD2 LYS 131 -10.881 8.859 -13.656 1050 HD3 LYS 131 HD3 LYS 131 -11.833 10.260 -13.151 1051 HE2 LYS 131 HE2 LYS 131 -10.113 10.798 -11.431 1052 HE3 LYS 131 HE3 LYS 131 -9.101 9.492 -12.073 1053 HZ1 LYS 131 HZ1 LYS 131 -10.110 11.773 -13.708 1054 HZ2 LYS 131 HZ2 LYS 131 -8.610 11.739 -13.039 1055 HZ3 LYS 131 HZ3 LYS 131 -9.028 10.653 -14.190 1056 H GLN 132 H GLN 132 -16.260 10.650 -12.281 1057 HA GLN 132 HA GLN 132 -17.860 8.836 -13.972 1058 HB2 GLN 132 HB2 GLN 132 -18.536 11.380 -12.451 1059 HB3 GLN 132 HB3 GLN 132 -19.685 10.602 -13.537 1060 HG2 GLN 132 HG2 GLN 132 -18.470 9.261 -11.093 1061 HG3 GLN 132 HG3 GLN 132 -20.056 10.015 -11.148 1062 HE21 GLN 132 HE21 GLN 132 -19.754 6.206 -12.370 1063 HE22 GLN 132 HE22 GLN 132 -18.498 7.038 -11.449 1064 H GLU 133 H GLU 133 -15.499 10.523 -14.752 1065 HA GLU 133 HA GLU 133 -16.613 12.181 -16.912 1066 HB2 GLU 133 HB2 GLU 133 -14.411 13.087 -17.217 1067 HB3 GLU 133 HB3 GLU 133 -14.856 13.159 -15.514 1068 HG2 GLU 133 HG2 GLU 133 -13.463 11.128 -15.076 1069 HG3 GLU 133 HG3 GLU 133 -12.981 11.103 -16.774 Start of MODEL 20 1 H1 GLY -4 H1 GLY -4 -14.891 32.561 22.843 2 H2 GLY -4 H2 GLY -4 -15.534 33.205 21.482 3 H3 GLY -4 H3 GLY -4 -14.280 33.952 22.228 4 HA2 GLY -4 HA2 GLY -4 -13.505 32.815 20.255 5 HA3 GLY -4 HA3 GLY -4 -12.796 32.132 21.731 6 H SER -3 H SER -3 -13.254 30.900 19.082 7 HA SER -3 HA SER -3 -14.886 28.530 19.881 8 HB2 SER -3 HB2 SER -3 -14.964 29.943 17.189 9 HB3 SER -3 HB3 SER -3 -15.763 28.409 17.573 10 HG SER -3 HG SER -3 -17.178 30.219 17.766 11 HA PRO -2 HA PRO -2 -11.307 26.359 18.381 12 HB2 PRO -2 HB2 PRO -2 -12.220 23.813 18.117 13 HB3 PRO -2 HB3 PRO -2 -12.131 24.635 19.704 14 HG2 PRO -2 HG2 PRO -2 -14.552 24.378 17.883 15 HG3 PRO -2 HG3 PRO -2 -14.441 23.990 19.631 16 HD2 PRO -2 HD2 PRO -2 -15.388 26.390 18.746 17 HD3 PRO -2 HD3 PRO -2 -14.400 26.267 20.232 18 H ASN -1 H ASN -1 -14.115 26.609 16.339 19 HA ASN -1 HA ASN -1 -13.035 25.187 14.042 20 HB2 ASN -1 HB2 ASN -1 -15.418 27.068 14.296 21 HB3 ASN -1 HB3 ASN -1 -15.074 26.028 12.919 22 HD21 ASN -1 HD21 ASN -1 -17.267 24.481 15.814 23 HD22 ASN -1 HD22 ASN -1 -17.075 26.199 15.506 24 H SER 0 H SER 0 -12.170 25.980 12.164 25 HA SER 0 HA SER 0 -10.875 28.619 12.231 26 HB2 SER 0 HB2 SER 0 -10.934 26.458 10.095 27 HB3 SER 0 HB3 SER 0 -9.944 27.929 10.045 28 HG SER 0 HG SER 0 -8.777 26.133 10.881 29 H MET 1 H MET 1 -13.697 27.208 10.644 30 HA MET 1 HA MET 1 -15.323 28.016 9.335 31 HB2 MET 1 HB2 MET 1 -14.794 30.635 10.776 32 HB3 MET 1 HB3 MET 1 -16.269 30.187 9.909 33 HG2 MET 1 HG2 MET 1 -16.576 28.257 11.465 34 HG3 MET 1 HG3 MET 1 -15.141 28.771 12.349 35 HE1 MET 1 HE1 MET 1 -18.254 30.885 10.884 36 HE2 MET 1 HE2 MET 1 -18.900 29.380 11.581 37 HE3 MET 1 HE3 MET 1 -19.236 30.940 12.361 38 H ALA 2 H ALA 2 -12.871 27.901 8.016 39 HA ALA 2 HA ALA 2 -13.251 29.853 5.810 40 HB1 ALA 2 HB1 ALA 2 -11.548 30.784 7.357 41 HB2 ALA 2 HB2 ALA 2 -10.592 29.294 7.199 42 HB3 ALA 2 HB3 ALA 2 -10.842 30.352 5.791 43 H THR 3 H THR 3 -13.995 27.118 6.051 44 HA THR 3 HA THR 3 -13.947 25.065 5.177 45 HB THR 3 HB THR 3 -11.777 25.875 3.225 46 HG1 THR 3 HG1 THR 3 -13.730 27.015 2.963 47 HG21 THR 3 HG21 THR 3 -11.894 23.439 3.512 48 HG22 THR 3 HG22 THR 3 -13.663 23.478 3.353 49 HG23 THR 3 HG23 THR 3 -12.626 23.900 1.970 50 H GLU 4 H GLU 4 -13.234 23.309 6.169 51 HA GLU 4 HA GLU 4 -10.537 22.863 7.043 52 HB2 GLU 4 HB2 GLU 4 -10.941 23.064 9.396 53 HB3 GLU 4 HB3 GLU 4 -11.428 24.591 8.657 54 HG2 GLU 4 HG2 GLU 4 -13.838 23.661 8.675 55 HG3 GLU 4 HG3 GLU 4 -13.225 22.391 9.739 56 H LEU 5 H LEU 5 -10.482 20.821 8.193 57 HA LEU 5 HA LEU 5 -12.851 19.073 8.000 58 HB2 LEU 5 HB2 LEU 5 -11.783 17.282 6.911 59 HB3 LEU 5 HB3 LEU 5 -11.794 18.737 5.921 60 HG LEU 5 HG LEU 5 -9.344 19.030 6.703 61 HD11 LEU 5 HD11 LEU 5 -9.258 17.294 8.453 62 HD12 LEU 5 HD12 LEU 5 -9.759 16.064 7.277 63 HD13 LEU 5 HD13 LEU 5 -8.173 16.868 7.134 64 HD21 LEU 5 HD21 LEU 5 -10.044 18.443 4.420 65 HD22 LEU 5 HD22 LEU 5 -8.557 17.596 4.873 66 HD23 LEU 5 HD23 LEU 5 -10.111 16.728 4.878 67 H GLU 6 H GLU 6 -12.891 17.236 9.203 68 HA GLU 6 HA GLU 6 -10.776 16.658 11.149 69 HB2 GLU 6 HB2 GLU 6 -12.379 18.374 12.192 70 HB3 GLU 6 HB3 GLU 6 -13.612 17.115 12.163 71 HG2 GLU 6 HG2 GLU 6 -12.109 15.680 13.589 72 HG3 GLU 6 HG3 GLU 6 -10.890 16.949 13.549 73 H TYR 7 H TYR 7 -11.137 15.242 8.988 74 HA TYR 7 HA TYR 7 -12.396 12.735 9.816 75 HB2 TYR 7 HB2 TYR 7 -13.461 12.567 7.506 76 HB3 TYR 7 HB3 TYR 7 -14.230 13.583 8.726 77 HD1 TYR 7 HD1 TYR 7 -14.914 15.722 8.175 78 HD2 TYR 7 HD2 TYR 7 -11.922 13.757 5.746 79 HE1 TYR 7 HE1 TYR 7 -15.150 17.509 6.464 80 HE2 TYR 7 HE2 TYR 7 -12.126 15.622 4.072 81 HH TYR 7 HH TYR 7 -14.468 18.286 4.414 82 H GLU 8 H GLU 8 -11.971 11.059 8.425 83 HA GLU 8 HA GLU 8 -9.804 10.708 6.626 84 HB2 GLU 8 HB2 GLU 8 -8.676 11.442 8.876 85 HB3 GLU 8 HB3 GLU 8 -9.063 9.789 9.410 86 HG2 GLU 8 HG2 GLU 8 -7.591 8.817 7.936 87 HG3 GLU 8 HG3 GLU 8 -7.640 10.148 6.783 88 H SER 9 H SER 9 -11.723 9.705 5.903 89 HA SER 9 HA SER 9 -13.316 7.982 7.515 90 HB2 SER 9 HB2 SER 9 -13.806 9.606 5.458 91 HB3 SER 9 HB3 SER 9 -13.479 8.162 4.502 92 HG SER 9 HG SER 9 -15.721 8.351 5.085 93 H VAL 10 H VAL 10 -12.952 5.892 7.929 94 HA VAL 10 HA VAL 10 -10.740 4.500 6.742 95 HB VAL 10 HB VAL 10 -12.875 3.457 8.644 96 HG11 VAL 10 HG11 VAL 10 -11.686 1.558 7.651 97 HG12 VAL 10 HG12 VAL 10 -10.114 2.343 7.960 98 HG13 VAL 10 HG13 VAL 10 -11.140 1.796 9.306 99 HG21 VAL 10 HG21 VAL 10 -11.623 5.382 9.593 100 HG22 VAL 10 HG22 VAL 10 -11.189 3.879 10.403 101 HG23 VAL 10 HG23 VAL 10 -10.090 4.581 9.195 102 H LEU 11 H LEU 11 -10.647 2.647 5.496 103 HA LEU 11 HA LEU 11 -13.063 1.940 3.852 104 HB2 LEU 11 HB2 LEU 11 -10.222 2.592 2.964 105 HB3 LEU 11 HB3 LEU 11 -11.378 1.769 1.940 106 HG LEU 11 HG LEU 11 -11.627 4.608 2.986 107 HD11 LEU 11 HD11 LEU 11 -11.420 5.132 0.542 108 HD12 LEU 11 HD12 LEU 11 -9.977 4.351 1.198 109 HD13 LEU 11 HD13 LEU 11 -11.129 3.418 0.218 110 HD21 LEU 11 HD21 LEU 11 -13.498 3.030 1.161 111 HD22 LEU 11 HD22 LEU 11 -13.887 3.672 2.778 112 HD23 LEU 11 HD23 LEU 11 -13.577 4.785 1.450 113 H CYS 12 H CYS 12 -9.822 0.916 4.961 114 HA CYS 12 HA CYS 12 -10.770 -1.859 5.207 115 HB2 CYS 12 HB2 CYS 12 -9.849 -1.610 2.848 116 HB3 CYS 12 HB3 CYS 12 -8.285 -1.201 3.590 117 HG CYS 12 HG CYS 12 -8.246 -3.676 2.719 118 H VAL 13 H VAL 13 -9.849 -2.843 6.874 119 HA VAL 13 HA VAL 13 -7.261 -1.875 7.980 120 HB VAL 13 HB VAL 13 -9.692 -2.488 9.705 121 HG11 VAL 13 HG11 VAL 13 -8.229 -1.829 11.597 122 HG12 VAL 13 HG12 VAL 13 -7.617 -3.274 10.794 123 HG13 VAL 13 HG13 VAL 13 -6.848 -1.697 10.490 124 HG21 VAL 13 HG21 VAL 13 -9.815 -0.226 8.723 125 HG22 VAL 13 HG22 VAL 13 -9.451 -0.129 10.448 126 HG23 VAL 13 HG23 VAL 13 -8.155 0.108 9.254 127 H LYS 14 H LYS 14 -5.871 -3.474 8.188 128 HA LYS 14 HA LYS 14 -6.814 -6.251 8.651 129 HB2 LYS 14 HB2 LYS 14 -4.629 -5.580 6.650 130 HB3 LYS 14 HB3 LYS 14 -5.150 -7.188 7.110 131 HG2 LYS 14 HG2 LYS 14 -6.947 -5.148 5.731 132 HG3 LYS 14 HG3 LYS 14 -6.006 -6.372 4.890 133 HD2 LYS 14 HD2 LYS 14 -7.270 -8.169 5.857 134 HD3 LYS 14 HD3 LYS 14 -8.096 -7.076 6.988 135 HE2 LYS 14 HE2 LYS 14 -9.116 -5.876 5.086 136 HE3 LYS 14 HE3 LYS 14 -8.319 -6.983 3.957 137 HZ1 LYS 14 HZ1 LYS 14 -9.576 -8.804 4.921 138 HZ2 LYS 14 HZ2 LYS 14 -10.273 -7.814 6.032 139 HZ3 LYS 14 HZ3 LYS 14 -10.626 -7.605 4.449 140 HA PRO 15 HA PRO 15 -3.964 -5.685 11.940 141 HB2 PRO 15 HB2 PRO 15 -3.807 -8.197 12.998 142 HB3 PRO 15 HB3 PRO 15 -5.287 -7.181 13.096 143 HG2 PRO 15 HG2 PRO 15 -4.639 -9.369 11.085 144 HG3 PRO 15 HG3 PRO 15 -6.149 -9.155 12.034 145 HD2 PRO 15 HD2 PRO 15 -5.940 -8.284 9.473 146 HD3 PRO 15 HD3 PRO 15 -6.834 -7.337 10.701 147 H ASP 16 H ASP 16 -3.101 -7.882 9.366 148 HA ASP 16 HA ASP 16 -0.246 -7.907 10.250 149 HB2 ASP 16 HB2 ASP 16 -1.364 -10.037 10.801 150 HB3 ASP 16 HB3 ASP 16 -1.848 -10.219 9.113 151 H VAL 17 H VAL 17 0.790 -6.724 8.892 152 HA VAL 17 HA VAL 17 0.871 -7.472 6.045 153 HB VAL 17 HB VAL 17 -0.782 -5.614 6.215 154 HG11 VAL 17 HG11 VAL 17 1.602 -3.859 6.953 155 HG12 VAL 17 HG12 VAL 17 -0.035 -3.309 6.555 156 HG13 VAL 17 HG13 VAL 17 0.239 -4.267 8.015 157 HG21 VAL 17 HG21 VAL 17 0.075 -4.338 4.336 158 HG22 VAL 17 HG22 VAL 17 1.727 -4.902 4.652 159 HG23 VAL 17 HG23 VAL 17 0.464 -6.049 4.134 160 H SER 18 H SER 18 2.860 -7.131 5.089 161 HA SER 18 HA SER 18 5.098 -6.420 6.966 162 HB2 SER 18 HB2 SER 18 5.027 -8.608 4.862 163 HB3 SER 18 HB3 SER 18 6.389 -8.201 5.922 164 HG SER 18 HG SER 18 3.849 -9.250 6.669 165 H VAL 19 H VAL 19 6.600 -5.035 6.272 166 HA VAL 19 HA VAL 19 6.472 -3.986 3.490 167 HB VAL 19 HB VAL 19 7.675 -2.837 6.015 168 HG11 VAL 19 HG11 VAL 19 7.808 -1.782 3.149 169 HG12 VAL 19 HG12 VAL 19 8.140 -0.801 4.598 170 HG13 VAL 19 HG13 VAL 19 9.178 -2.169 4.216 171 HG21 VAL 19 HG21 VAL 19 6.016 -1.138 5.786 172 HG22 VAL 19 HG22 VAL 19 5.546 -1.690 4.171 173 HG23 VAL 19 HG23 VAL 19 5.146 -2.665 5.599 174 H TYR 20 H TYR 20 7.898 -4.304 2.061 175 HA TYR 20 HA TYR 20 10.683 -4.992 2.841 176 HB2 TYR 20 HB2 TYR 20 9.876 -6.097 0.254 177 HB3 TYR 20 HB3 TYR 20 10.851 -6.791 1.534 178 HD1 TYR 20 HD1 TYR 20 9.777 -8.161 3.324 179 HD2 TYR 20 HD2 TYR 20 7.502 -6.479 0.083 180 HE1 TYR 20 HE1 TYR 20 7.894 -9.691 3.869 181 HE2 TYR 20 HE2 TYR 20 5.621 -8.038 0.601 182 HH TYR 20 HH TYR 20 5.812 -10.430 3.266 183 H ARG 21 H ARG 21 12.039 -3.569 2.115 184 HA ARG 21 HA ARG 21 11.401 -1.451 0.222 185 HB2 ARG 21 HB2 ARG 21 14.166 -2.396 1.077 186 HB3 ARG 21 HB3 ARG 21 13.751 -0.841 0.364 187 HG2 ARG 21 HG2 ARG 21 12.951 -1.846 3.130 188 HG3 ARG 21 HG3 ARG 21 14.171 -0.635 2.761 189 HD2 ARG 21 HD2 ARG 21 12.457 0.893 1.897 190 HD3 ARG 21 HD3 ARG 21 11.191 -0.317 2.198 191 HE ARG 21 HE ARG 21 12.220 -0.159 4.671 192 HH11 ARG 21 HH11 ARG 21 11.913 1.059 6.258 193 HH12 ARG 21 HH12 ARG 21 11.428 2.752 6.101 194 HH21 ARG 21 HH21 ARG 21 11.430 2.599 2.635 195 HH22 ARG 21 HH22 ARG 21 11.156 3.604 4.033 196 H ILE 22 H ILE 22 11.543 -1.402 -1.923 197 HA ILE 22 HA ILE 22 12.097 -3.966 -3.282 198 HB ILE 22 HB ILE 22 10.722 -3.165 -5.090 199 HG12 ILE 22 HG12 ILE 22 10.410 -0.556 -3.541 200 HG13 ILE 22 HG13 ILE 22 11.277 -0.767 -5.066 201 HG21 ILE 22 HG21 ILE 22 9.308 -2.629 -2.458 202 HG22 ILE 22 HG22 ILE 22 8.605 -3.259 -3.963 203 HG23 ILE 22 HG23 ILE 22 9.739 -4.245 -3.037 204 HD11 ILE 22 HD11 ILE 22 8.301 -1.024 -4.613 205 HD12 ILE 22 HD12 ILE 22 9.163 0.150 -5.620 206 HD13 ILE 22 HD13 ILE 22 9.111 -1.557 -6.108 207 HA PRO 23 HA PRO 23 15.427 -2.195 -5.808 208 HB2 PRO 23 HB2 PRO 23 15.344 -3.805 -8.007 209 HB3 PRO 23 HB3 PRO 23 15.965 -4.374 -6.426 210 HG2 PRO 23 HG2 PRO 23 13.185 -4.768 -7.586 211 HG3 PRO 23 HG3 PRO 23 14.263 -6.001 -6.856 212 HD2 PRO 23 HD2 PRO 23 12.274 -4.768 -5.448 213 HD3 PRO 23 HD3 PRO 23 13.818 -5.233 -4.676 214 HA PRO 24 HA PRO 24 13.040 0.494 -8.546 215 HB2 PRO 24 HB2 PRO 24 14.935 1.406 -10.291 216 HB3 PRO 24 HB3 PRO 24 14.881 1.901 -8.570 217 HG2 PRO 24 HG2 PRO 24 16.581 -0.282 -9.824 218 HG3 PRO 24 HG3 PRO 24 17.107 1.032 -8.725 219 HD2 PRO 24 HD2 PRO 24 16.549 -1.473 -7.812 220 HD3 PRO 24 HD3 PRO 24 16.134 -0.023 -6.848 221 H ARG 25 H ARG 25 12.038 0.475 -10.612 222 HA ARG 25 HA ARG 25 11.960 -2.130 -11.873 223 HB2 ARG 25 HB2 ARG 25 9.990 -0.522 -11.543 224 HB3 ARG 25 HB3 ARG 25 10.614 0.401 -12.907 225 HG2 ARG 25 HG2 ARG 25 10.341 -1.495 -14.404 226 HG3 ARG 25 HG3 ARG 25 9.972 -2.588 -13.063 227 HD2 ARG 25 HD2 ARG 25 8.272 -0.215 -13.906 228 HD3 ARG 25 HD3 ARG 25 8.038 -1.884 -14.459 229 HE ARG 25 HE ARG 25 8.087 -1.991 -11.641 230 HH11 ARG 25 HH11 ARG 25 6.244 -2.006 -10.332 231 HH12 ARG 25 HH12 ARG 25 4.754 -1.349 -11.016 232 HH21 ARG 25 HH21 ARG 25 5.917 -0.440 -13.984 233 HH22 ARG 25 HH22 ARG 25 4.594 -0.529 -12.813 234 H ALA 26 H ALA 26 12.380 -2.727 -13.929 235 HA ALA 26 HA ALA 26 14.502 -1.642 -15.529 236 HB1 ALA 26 HB1 ALA 26 12.200 -3.567 -16.101 237 HB2 ALA 26 HB2 ALA 26 13.577 -3.281 -17.200 238 HB3 ALA 26 HB3 ALA 26 13.849 -3.991 -15.596 239 H SER 27 H SER 27 11.248 -2.018 -16.841 240 HA SER 27 HA SER 27 10.537 0.761 -16.884 241 HB2 SER 27 HB2 SER 27 10.401 1.114 -19.310 242 HB3 SER 27 HB3 SER 27 12.072 0.855 -18.803 243 HG SER 27 HG SER 27 11.837 -0.425 -20.553 244 H ASN 28 H ASN 28 9.933 -2.189 -18.778 245 HA ASN 28 HA ASN 28 6.999 -2.041 -18.178 246 HB2 ASN 28 HB2 ASN 28 8.535 -2.916 -20.665 247 HB3 ASN 28 HB3 ASN 28 6.801 -3.121 -20.455 248 HD21 ASN 28 HD21 ASN 28 8.236 0.594 -21.337 249 HD22 ASN 28 HD22 ASN 28 9.361 -0.651 -20.800 250 H ARG 29 H ARG 29 9.543 -3.866 -17.190 251 HA ARG 29 HA ARG 29 8.504 -6.571 -17.657 252 HB2 ARG 29 HB2 ARG 29 10.772 -5.592 -15.848 253 HB3 ARG 29 HB3 ARG 29 10.416 -7.270 -16.239 254 HG2 ARG 29 HG2 ARG 29 11.409 -5.131 -18.166 255 HG3 ARG 29 HG3 ARG 29 12.272 -6.561 -17.588 256 HD2 ARG 29 HD2 ARG 29 10.441 -7.973 -18.667 257 HD3 ARG 29 HD3 ARG 29 9.795 -6.489 -19.355 258 HE ARG 29 HE ARG 29 11.549 -6.360 -20.881 259 HH11 ARG 29 HH11 ARG 29 13.211 -7.165 -22.102 260 HH12 ARG 29 HH12 ARG 29 14.095 -8.562 -21.561 261 HH21 ARG 29 HH21 ARG 29 12.304 -8.976 -18.668 262 HH22 ARG 29 HH22 ARG 29 13.600 -9.563 -19.672 263 H GLY 30 H GLY 30 8.522 -4.335 -14.906 264 HA2 GLY 30 HA2 GLY 30 6.824 -4.188 -13.337 265 HA3 GLY 30 HA3 GLY 30 6.175 -5.738 -13.878 266 H TYR 31 H TYR 31 6.566 -4.850 -11.184 267 HA TYR 31 HA TYR 31 8.744 -6.351 -9.956 268 HB2 TYR 31 HB2 TYR 31 6.157 -5.294 -8.766 269 HB3 TYR 31 HB3 TYR 31 7.619 -5.737 -7.896 270 HD1 TYR 31 HD1 TYR 31 9.618 -4.296 -9.854 271 HD2 TYR 31 HD2 TYR 31 5.893 -3.094 -8.021 272 HE1 TYR 31 HE1 TYR 31 10.417 -1.960 -9.781 273 HE2 TYR 31 HE2 TYR 31 6.674 -0.717 -8.032 274 HH TYR 31 HH TYR 31 8.386 0.732 -8.557 275 H ARG 32 H ARG 32 8.518 -8.346 -8.917 276 HA ARG 32 HA ARG 32 6.094 -9.968 -9.657 277 HB2 ARG 32 HB2 ARG 32 7.610 -11.867 -10.202 278 HB3 ARG 32 HB3 ARG 32 7.678 -10.527 -11.325 279 HG2 ARG 32 HG2 ARG 32 9.677 -10.597 -9.062 280 HG3 ARG 32 HG3 ARG 32 9.880 -11.736 -10.388 281 HD2 ARG 32 HD2 ARG 32 9.452 -8.791 -10.957 282 HD3 ARG 32 HD3 ARG 32 11.048 -9.381 -10.535 283 HE ARG 32 HE ARG 32 9.622 -9.735 -13.042 284 HH11 ARG 32 HH11 ARG 32 10.590 -10.786 -14.738 285 HH12 ARG 32 HH12 ARG 32 12.037 -11.716 -14.480 286 HH21 ARG 32 HH21 ARG 32 12.203 -11.151 -11.089 287 HH22 ARG 32 HH22 ARG 32 12.923 -11.918 -12.484 288 H ALA 33 H ALA 33 6.805 -8.784 -7.135 289 HA ALA 33 HA ALA 33 6.979 -9.137 -4.926 290 HB1 ALA 33 HB1 ALA 33 5.557 -10.888 -4.068 291 HB2 ALA 33 HB2 ALA 33 4.840 -10.194 -5.548 292 HB3 ALA 33 HB3 ALA 33 5.633 -11.766 -5.617 293 H SER 34 H SER 34 8.060 -12.203 -6.466 294 HA SER 34 HA SER 34 9.668 -13.115 -4.343 295 HB2 SER 34 HB2 SER 34 9.894 -13.697 -7.316 296 HB3 SER 34 HB3 SER 34 10.619 -14.660 -6.013 297 HG SER 34 HG SER 34 8.597 -15.514 -6.708 298 H ASP 35 H ASP 35 10.444 -10.588 -6.590 299 HA ASP 35 HA ASP 35 13.358 -10.776 -6.066 300 HB2 ASP 35 HB2 ASP 35 11.624 -9.092 -7.864 301 HB3 ASP 35 HB3 ASP 35 13.221 -8.512 -7.414 302 H TRP 36 H TRP 36 10.791 -9.699 -4.211 303 HA TRP 36 HA TRP 36 12.274 -7.481 -2.940 304 HB2 TRP 36 HB2 TRP 36 9.569 -8.642 -2.238 305 HB3 TRP 36 HB3 TRP 36 10.256 -7.126 -1.705 306 HD1 TRP 36 HD1 TRP 36 10.985 -6.704 -5.131 307 HE1 TRP 36 HE1 TRP 36 9.093 -5.543 -6.436 308 HE3 TRP 36 HE3 TRP 36 7.127 -7.492 -1.860 309 HZ2 TRP 36 HZ2 TRP 36 6.359 -4.849 -6.003 310 HZ3 TRP 36 HZ3 TRP 36 4.891 -6.472 -2.290 311 HH2 TRP 36 HH2 TRP 36 4.506 -5.154 -4.350 312 H LYS 37 H LYS 37 12.249 -7.561 -0.534 313 HA LYS 37 HA LYS 37 13.560 -9.998 0.404 314 HB2 LYS 37 HB2 LYS 37 13.331 -7.165 1.395 315 HB3 LYS 37 HB3 LYS 37 13.707 -8.423 2.571 316 HG2 LYS 37 HG2 LYS 37 15.519 -9.270 1.084 317 HG3 LYS 37 HG3 LYS 37 15.275 -7.869 0.030 318 HD2 LYS 37 HD2 LYS 37 16.056 -6.355 1.683 319 HD3 LYS 37 HD3 LYS 37 15.789 -7.512 3.010 320 HE2 LYS 37 HE2 LYS 37 17.527 -8.996 2.144 321 HE3 LYS 37 HE3 LYS 37 17.814 -7.918 0.772 322 HZ1 LYS 37 HZ1 LYS 37 18.531 -6.196 2.348 323 HZ2 LYS 37 HZ2 LYS 37 18.267 -7.184 3.623 324 HZ3 LYS 37 HZ3 LYS 37 19.440 -7.534 2.544 325 H LEU 38 H LEU 38 11.250 -10.951 -0.105 326 HA LEU 38 HA LEU 38 9.167 -10.813 1.770 327 HB2 LEU 38 HB2 LEU 38 10.019 -13.258 0.179 328 HB3 LEU 38 HB3 LEU 38 8.434 -12.970 0.890 329 HG LEU 38 HG LEU 38 9.703 -11.452 -1.409 330 HD11 LEU 38 HD11 LEU 38 7.252 -13.269 -1.213 331 HD12 LEU 38 HD12 LEU 38 7.792 -12.435 -2.676 332 HD13 LEU 38 HD13 LEU 38 8.810 -13.692 -1.958 333 HD21 LEU 38 HD21 LEU 38 8.386 -9.837 -0.166 334 HD22 LEU 38 HD22 LEU 38 7.477 -10.301 -1.606 335 HD23 LEU 38 HD23 LEU 38 7.034 -10.982 -0.025 336 H ASP 39 H ASP 39 12.189 -12.618 2.135 337 HA ASP 39 HA ASP 39 11.086 -14.167 4.408 338 HB2 ASP 39 HB2 ASP 39 12.494 -15.193 2.593 339 HB3 ASP 39 HB3 ASP 39 13.863 -14.266 3.200 340 H GLN 40 H GLN 40 12.375 -11.119 4.056 341 HA GLN 40 HA GLN 40 12.903 -10.870 6.925 342 HB2 GLN 40 HB2 GLN 40 15.097 -9.725 6.597 343 HB3 GLN 40 HB3 GLN 40 15.097 -11.464 6.480 344 HG2 GLN 40 HG2 GLN 40 15.004 -9.733 3.982 345 HG3 GLN 40 HG3 GLN 40 16.514 -10.080 4.804 346 HE21 GLN 40 HE21 GLN 40 15.490 -12.717 2.121 347 HE22 GLN 40 HE22 GLN 40 15.064 -11.013 2.110 348 HA PRO 41 HA PRO 41 10.720 -7.211 5.038 349 HB2 PRO 41 HB2 PRO 41 8.948 -6.886 7.174 350 HB3 PRO 41 HB3 PRO 41 8.626 -7.843 5.707 351 HG2 PRO 41 HG2 PRO 41 9.663 -8.820 8.380 352 HG3 PRO 41 HG3 PRO 41 8.364 -9.530 7.368 353 HD2 PRO 41 HD2 PRO 41 10.854 -10.549 7.344 354 HD3 PRO 41 HD3 PRO 41 9.937 -10.406 5.817 355 H ASP 42 H ASP 42 11.041 -5.131 5.548 356 HA ASP 42 HA ASP 42 13.159 -4.431 7.451 357 HB2 ASP 42 HB2 ASP 42 12.959 -3.422 5.201 358 HB3 ASP 42 HB3 ASP 42 11.374 -2.771 5.622 359 H TRP 43 H TRP 43 9.661 -4.333 7.337 360 HA TRP 43 HA TRP 43 9.456 -3.841 10.210 361 HB2 TRP 43 HB2 TRP 43 9.521 -1.541 9.450 362 HB3 TRP 43 HB3 TRP 43 8.385 -1.876 8.156 363 HD1 TRP 43 HD1 TRP 43 8.519 -1.009 11.831 364 HE1 TRP 43 HE1 TRP 43 6.155 -0.441 12.658 365 HE3 TRP 43 HE3 TRP 43 5.849 -2.696 7.820 366 HZ2 TRP 43 HZ2 TRP 43 3.464 -0.480 11.585 367 HZ3 TRP 43 HZ3 TRP 43 3.386 -2.310 7.696 368 HH2 TRP 43 HH2 TRP 43 2.184 -1.244 9.586 369 H THR 44 H THR 44 7.383 -4.475 11.037 370 HA THR 44 HA THR 44 5.344 -5.409 9.114 371 HB THR 44 HB THR 44 4.853 -7.416 10.403 372 HG1 THR 44 HG1 THR 44 7.353 -6.974 11.666 373 HG21 THR 44 HG21 THR 44 7.729 -7.482 9.455 374 HG22 THR 44 HG22 THR 44 6.586 -8.845 9.597 375 HG23 THR 44 HG23 THR 44 6.289 -7.562 8.418 376 H GLY 45 H GLY 45 3.234 -5.347 9.848 377 HA2 GLY 45 HA2 GLY 45 2.381 -4.778 12.498 378 HA3 GLY 45 HA3 GLY 45 2.675 -3.238 11.699 379 H ARG 46 H ARG 46 0.674 -2.503 11.533 380 HA ARG 46 HA ARG 46 -1.571 -4.155 10.467 381 HB2 ARG 46 HB2 ARG 46 -1.573 -1.525 12.004 382 HB3 ARG 46 HB3 ARG 46 -2.989 -2.469 11.548 383 HG2 ARG 46 HG2 ARG 46 -2.330 -4.281 13.054 384 HG3 ARG 46 HG3 ARG 46 -0.821 -3.446 13.481 385 HD2 ARG 46 HD2 ARG 46 -1.984 -1.645 14.538 386 HD3 ARG 46 HD3 ARG 46 -3.529 -2.109 13.832 387 HE ARG 46 HE ARG 46 -3.461 -4.174 15.243 388 HH11 ARG 46 HH11 ARG 46 -3.996 -4.513 17.355 389 HH12 ARG 46 HH12 ARG 46 -3.377 -3.463 18.589 390 HH21 ARG 46 HH21 ARG 46 -1.583 -1.461 16.471 391 HH22 ARG 46 HH22 ARG 46 -2.183 -1.701 18.094 392 H LEU 47 H LEU 47 -2.827 -3.483 8.847 393 HA LEU 47 HA LEU 47 -2.013 -1.207 7.107 394 HB2 LEU 47 HB2 LEU 47 -2.470 -3.390 6.015 395 HB3 LEU 47 HB3 LEU 47 -4.035 -3.458 6.822 396 HG LEU 47 HG LEU 47 -4.734 -1.374 5.529 397 HD11 LEU 47 HD11 LEU 47 -3.476 -0.837 3.491 398 HD12 LEU 47 HD12 LEU 47 -2.480 -0.534 4.917 399 HD13 LEU 47 HD13 LEU 47 -2.205 -1.995 3.942 400 HD21 LEU 47 HD21 LEU 47 -5.459 -3.596 4.912 401 HD22 LEU 47 HD22 LEU 47 -5.174 -2.619 3.480 402 HD23 LEU 47 HD23 LEU 47 -3.974 -3.847 3.974 403 H ARG 48 H ARG 48 -3.136 0.669 7.145 404 HA ARG 48 HA ARG 48 -6.069 0.502 7.603 405 HB2 ARG 48 HB2 ARG 48 -4.986 1.645 9.554 406 HB3 ARG 48 HB3 ARG 48 -4.339 2.864 8.449 407 HG2 ARG 48 HG2 ARG 48 -6.691 3.416 7.752 408 HG3 ARG 48 HG3 ARG 48 -7.290 2.263 8.946 409 HD2 ARG 48 HD2 ARG 48 -5.715 4.817 9.450 410 HD3 ARG 48 HD3 ARG 48 -7.412 4.543 9.836 411 HE ARG 48 HE ARG 48 -5.068 3.768 11.378 412 HH11 ARG 48 HH11 ARG 48 -5.167 2.604 13.183 413 HH12 ARG 48 HH12 ARG 48 -6.698 1.975 13.771 414 HH21 ARG 48 HH21 ARG 48 -8.479 2.995 11.003 415 HH22 ARG 48 HH22 ARG 48 -8.531 2.161 12.532 416 H ILE 49 H ILE 49 -7.161 1.163 5.904 417 HA ILE 49 HA ILE 49 -5.936 3.130 4.014 418 HB ILE 49 HB ILE 49 -8.235 1.291 3.326 419 HG12 ILE 49 HG12 ILE 49 -5.282 0.963 2.637 420 HG13 ILE 49 HG13 ILE 49 -6.264 -0.112 3.632 421 HG21 ILE 49 HG21 ILE 49 -7.852 2.122 1.043 422 HG22 ILE 49 HG22 ILE 49 -8.052 3.503 2.109 423 HG23 ILE 49 HG23 ILE 49 -6.427 3.037 1.582 424 HD11 ILE 49 HD11 ILE 49 -7.789 -0.328 1.495 425 HD12 ILE 49 HD12 ILE 49 -6.332 0.247 0.646 426 HD13 ILE 49 HD13 ILE 49 -6.280 -1.228 1.632 427 H THR 50 H THR 50 -6.850 4.983 3.923 428 HA THR 50 HA THR 50 -9.355 5.738 5.387 429 HB THR 50 HB THR 50 -7.647 7.672 6.097 430 HG1 THR 50 HG1 THR 50 -5.853 6.189 5.360 431 HG21 THR 50 HG21 THR 50 -8.250 5.056 7.526 432 HG22 THR 50 HG22 THR 50 -7.666 6.534 8.329 433 HG23 THR 50 HG23 THR 50 -9.252 6.509 7.531 434 H SER 51 H SER 51 -10.278 7.741 4.578 435 HA SER 51 HA SER 51 -9.053 9.002 2.215 436 HB2 SER 51 HB2 SER 51 -10.828 8.297 0.739 437 HB3 SER 51 HB3 SER 51 -10.047 6.859 1.396 438 HG SER 51 HG SER 51 -11.772 6.857 3.025 439 H LYS 52 H LYS 52 -10.191 10.861 1.487 440 HA LYS 52 HA LYS 52 -12.295 11.827 3.367 441 HB2 LYS 52 HB2 LYS 52 -9.861 13.355 2.493 442 HB3 LYS 52 HB3 LYS 52 -11.174 13.821 3.646 443 HG2 LYS 52 HG2 LYS 52 -10.431 12.200 5.225 444 HG3 LYS 52 HG3 LYS 52 -9.191 11.605 4.126 445 HD2 LYS 52 HD2 LYS 52 -8.208 13.993 4.124 446 HD3 LYS 52 HD3 LYS 52 -9.310 14.325 5.476 447 HE2 LYS 52 HE2 LYS 52 -8.366 12.247 6.599 448 HE3 LYS 52 HE3 LYS 52 -7.159 12.153 5.315 449 HZ1 LYS 52 HZ1 LYS 52 -6.327 13.219 7.275 450 HZ2 LYS 52 HZ2 LYS 52 -6.345 14.337 6.059 451 HZ3 LYS 52 HZ3 LYS 52 -7.491 14.373 7.249 452 H GLY 53 H GLY 53 -11.128 14.100 1.088 453 HA2 GLY 53 HA2 GLY 53 -13.642 14.097 -0.474 454 HA3 GLY 53 HA3 GLY 53 -12.258 15.166 -0.680 455 H LYS 54 H LYS 54 -11.455 14.909 -2.663 456 HA LYS 54 HA LYS 54 -11.445 12.358 -4.123 457 HB2 LYS 54 HB2 LYS 54 -10.201 15.039 -4.840 458 HB3 LYS 54 HB3 LYS 54 -10.380 13.644 -5.918 459 HG2 LYS 54 HG2 LYS 54 -12.825 13.782 -5.758 460 HG3 LYS 54 HG3 LYS 54 -12.702 15.149 -4.636 461 HD2 LYS 54 HD2 LYS 54 -11.507 16.455 -6.410 462 HD3 LYS 54 HD3 LYS 54 -11.812 15.115 -7.546 463 HE2 LYS 54 HE2 LYS 54 -14.246 15.326 -7.134 464 HE3 LYS 54 HE3 LYS 54 -13.950 16.614 -5.959 465 HZ1 LYS 54 HZ1 LYS 54 -13.029 17.965 -7.774 466 HZ2 LYS 54 HZ2 LYS 54 -13.300 16.775 -8.861 467 HZ3 LYS 54 HZ3 LYS 54 -14.555 17.523 -8.137 468 H THR 55 H THR 55 -10.046 12.172 -1.642 469 HA THR 55 HA THR 55 -7.325 11.495 -2.590 470 HB THR 55 HB THR 55 -7.641 13.050 -0.011 471 HG1 THR 55 HG1 THR 55 -6.969 14.065 -2.574 472 HG21 THR 55 HG21 THR 55 -5.257 12.533 -1.853 473 HG22 THR 55 HG22 THR 55 -5.230 13.509 -0.373 474 HG23 THR 55 HG23 THR 55 -5.543 11.771 -0.273 475 H ALA 56 H ALA 56 -6.564 9.692 -1.747 476 HA ALA 56 HA ALA 56 -7.786 8.545 0.710 477 HB1 ALA 56 HB1 ALA 56 -6.698 6.934 -1.606 478 HB2 ALA 56 HB2 ALA 56 -7.440 6.316 -0.124 479 HB3 ALA 56 HB3 ALA 56 -8.429 7.217 -1.287 480 H TYR 57 H TYR 57 -6.380 7.212 1.904 481 HA TYR 57 HA TYR 57 -3.490 7.942 1.913 482 HB2 TYR 57 HB2 TYR 57 -5.450 8.189 4.239 483 HB3 TYR 57 HB3 TYR 57 -3.736 8.568 4.265 484 HD1 TYR 57 HD1 TYR 57 -2.878 10.583 3.063 485 HD2 TYR 57 HD2 TYR 57 -7.117 9.768 3.339 486 HE1 TYR 57 HE1 TYR 57 -3.388 12.962 2.523 487 HE2 TYR 57 HE2 TYR 57 -7.606 12.102 2.717 488 HH TYR 57 HH TYR 57 -5.034 14.541 2.219 489 H ILE 58 H ILE 58 -2.553 5.937 1.753 490 HA ILE 58 HA ILE 58 -3.591 3.655 3.390 491 HB ILE 58 HB ILE 58 -1.270 3.775 1.425 492 HG12 ILE 58 HG12 ILE 58 -2.674 1.949 0.275 493 HG13 ILE 58 HG13 ILE 58 -4.036 2.502 1.244 494 HG21 ILE 58 HG21 ILE 58 -2.362 1.447 3.073 495 HG22 ILE 58 HG22 ILE 58 -1.120 1.322 1.806 496 HG23 ILE 58 HG23 ILE 58 -0.771 2.216 3.273 497 HD11 ILE 58 HD11 ILE 58 -2.418 4.238 -0.676 498 HD12 ILE 58 HD12 ILE 58 -3.915 3.388 -1.105 499 HD13 ILE 58 HD13 ILE 58 -3.967 4.677 0.102 500 H LYS 59 H LYS 59 -3.162 3.888 5.472 501 HA LYS 59 HA LYS 59 -0.486 4.937 6.329 502 HB2 LYS 59 HB2 LYS 59 -3.095 4.895 7.894 503 HB3 LYS 59 HB3 LYS 59 -1.536 5.534 8.428 504 HG2 LYS 59 HG2 LYS 59 -1.688 6.997 6.235 505 HG3 LYS 59 HG3 LYS 59 -3.406 6.607 6.289 506 HD2 LYS 59 HD2 LYS 59 -3.552 7.593 8.562 507 HD3 LYS 59 HD3 LYS 59 -1.805 7.947 8.516 508 HE2 LYS 59 HE2 LYS 59 -2.143 9.403 6.540 509 HE3 LYS 59 HE3 LYS 59 -3.880 9.057 6.584 510 HZ1 LYS 59 HZ1 LYS 59 -3.388 11.146 7.707 511 HZ2 LYS 59 HZ2 LYS 59 -3.998 10.082 8.764 512 HZ3 LYS 59 HZ3 LYS 59 -2.382 10.405 8.773 513 H LEU 60 H LEU 60 0.886 3.685 7.300 514 HA LEU 60 HA LEU 60 0.086 0.921 8.135 515 HB2 LEU 60 HB2 LEU 60 2.541 2.162 6.948 516 HB3 LEU 60 HB3 LEU 60 2.787 0.913 8.159 517 HG LEU 60 HG LEU 60 1.553 -0.722 6.926 518 HD11 LEU 60 HD11 LEU 60 0.992 1.456 4.863 519 HD12 LEU 60 HD12 LEU 60 0.716 -0.282 4.608 520 HD13 LEU 60 HD13 LEU 60 -0.214 0.580 5.833 521 HD21 LEU 60 HD21 LEU 60 3.937 -0.262 6.360 522 HD22 LEU 60 HD22 LEU 60 3.028 -0.940 5.003 523 HD23 LEU 60 HD23 LEU 60 3.406 0.797 5.039 524 H GLU 61 H GLU 61 0.186 0.289 10.193 525 HA GLU 61 HA GLU 61 1.207 2.231 12.235 526 HB2 GLU 61 HB2 GLU 61 -1.526 0.926 12.072 527 HB3 GLU 61 HB3 GLU 61 -0.882 1.675 13.543 528 HG2 GLU 61 HG2 GLU 61 -0.696 3.842 12.438 529 HG3 GLU 61 HG3 GLU 61 -1.209 3.146 10.897 530 H ASP 62 H ASP 62 1.814 1.406 14.265 531 HA ASP 62 HA ASP 62 2.980 -1.209 14.193 532 HB2 ASP 62 HB2 ASP 62 3.784 0.865 15.412 533 HB3 ASP 62 HB3 ASP 62 2.483 0.568 16.585 534 H LYS 63 H LYS 63 2.469 -3.070 15.163 535 HA LYS 63 HA LYS 63 -0.329 -3.557 15.765 536 HB2 LYS 63 HB2 LYS 63 0.495 -6.006 15.877 537 HB3 LYS 63 HB3 LYS 63 0.626 -5.173 14.330 538 HG2 LYS 63 HG2 LYS 63 2.959 -4.740 14.628 539 HG3 LYS 63 HG3 LYS 63 2.943 -5.321 16.302 540 HD2 LYS 63 HD2 LYS 63 2.698 -7.578 15.634 541 HD3 LYS 63 HD3 LYS 63 2.200 -7.127 13.979 542 HE2 LYS 63 HE2 LYS 63 4.437 -6.110 13.596 543 HE3 LYS 63 HE3 LYS 63 4.960 -6.632 15.196 544 HZ1 LYS 63 HZ1 LYS 63 4.808 -8.907 14.505 545 HZ2 LYS 63 HZ2 LYS 63 4.010 -8.537 13.123 546 HZ3 LYS 63 HZ3 LYS 63 5.573 -8.118 13.276 547 H VAL 64 H VAL 64 2.088 -2.614 17.777 548 HA VAL 64 HA VAL 64 0.660 -3.767 20.142 549 HB VAL 64 HB VAL 64 3.593 -3.072 19.768 550 HG11 VAL 64 HG11 VAL 64 2.150 -4.070 22.266 551 HG12 VAL 64 HG12 VAL 64 3.915 -3.974 22.073 552 HG13 VAL 64 HG13 VAL 64 2.956 -2.495 22.070 553 HG21 VAL 64 HG21 VAL 64 3.021 -5.235 18.777 554 HG22 VAL 64 HG22 VAL 64 3.964 -5.483 20.246 555 HG23 VAL 64 HG23 VAL 64 2.203 -5.737 20.275 556 H SER 65 H SER 65 2.414 -0.883 18.898 557 HA SER 65 HA SER 65 1.350 0.708 21.164 558 HB2 SER 65 HB2 SER 65 3.331 1.391 18.970 559 HB3 SER 65 HB3 SER 65 2.879 2.460 20.312 560 HG SER 65 HG SER 65 4.795 1.268 20.742 561 H GLY 66 H GLY 66 0.617 0.241 17.805 562 HA2 GLY 66 HA2 GLY 66 -1.112 1.091 16.503 563 HA3 GLY 66 HA3 GLY 66 -1.661 2.061 17.872 564 H GLU 67 H GLU 67 1.657 2.513 17.130 565 HA GLU 67 HA GLU 67 1.152 5.274 16.344 566 HB2 GLU 67 HB2 GLU 67 3.416 5.665 16.871 567 HB3 GLU 67 HB3 GLU 67 2.744 4.591 18.110 568 HG2 GLU 67 HG2 GLU 67 3.852 2.656 17.061 569 HG3 GLU 67 HG3 GLU 67 4.520 3.697 15.800 570 H LEU 68 H LEU 68 2.094 6.336 14.516 571 HA LEU 68 HA LEU 68 1.692 4.815 12.101 572 HB2 LEU 68 HB2 LEU 68 1.024 7.222 12.468 573 HB3 LEU 68 HB3 LEU 68 2.734 7.651 12.454 574 HG LEU 68 HG LEU 68 2.836 6.637 10.083 575 HD11 LEU 68 HD11 LEU 68 0.720 6.512 8.852 576 HD12 LEU 68 HD12 LEU 68 0.681 5.365 10.190 577 HD13 LEU 68 HD13 LEU 68 -0.198 6.896 10.328 578 HD21 LEU 68 HD21 LEU 68 2.808 9.062 10.494 579 HD22 LEU 68 HD22 LEU 68 1.886 8.648 9.041 580 HD23 LEU 68 HD23 LEU 68 1.031 9.044 10.551 581 H PHE 69 H PHE 69 3.098 3.741 10.897 582 HA PHE 69 HA PHE 69 6.033 4.023 11.238 583 HB2 PHE 69 HB2 PHE 69 5.261 1.778 11.111 584 HB3 PHE 69 HB3 PHE 69 4.235 2.109 9.726 585 HD1 PHE 69 HD1 PHE 69 7.870 2.190 10.719 586 HD2 PHE 69 HD2 PHE 69 5.001 1.565 7.557 587 HE1 PHE 69 HE1 PHE 69 9.704 1.536 9.176 588 HE2 PHE 69 HE2 PHE 69 6.840 0.979 6.009 589 HZ PHE 69 HZ PHE 69 9.188 0.927 6.818 590 H ALA 70 H ALA 70 3.636 4.196 8.563 591 HA ALA 70 HA ALA 70 5.005 6.457 7.305 592 HB1 ALA 70 HB1 ALA 70 4.841 3.734 5.917 593 HB2 ALA 70 HB2 ALA 70 5.440 5.247 5.204 594 HB3 ALA 70 HB3 ALA 70 6.333 4.487 6.525 595 H GLN 71 H GLN 71 3.761 7.325 5.465 596 HA GLN 71 HA GLN 71 1.097 6.142 5.030 597 HB2 GLN 71 HB2 GLN 71 -0.105 8.174 5.341 598 HB3 GLN 71 HB3 GLN 71 0.764 7.767 6.808 599 HG2 GLN 71 HG2 GLN 71 1.285 9.969 6.803 600 HG3 GLN 71 HG3 GLN 71 2.585 9.475 5.734 601 HE21 GLN 71 HE21 GLN 71 1.355 11.886 3.430 602 HE22 GLN 71 HE22 GLN 71 2.755 11.112 4.180 603 H ALA 72 H ALA 72 0.343 6.236 3.018 604 HA ALA 72 HA ALA 72 1.857 7.789 0.957 605 HB1 ALA 72 HB1 ALA 72 0.492 5.092 0.766 606 HB2 ALA 72 HB2 ALA 72 1.196 5.989 -0.595 607 HB3 ALA 72 HB3 ALA 72 2.234 5.425 0.724 608 HA PRO 73 HA PRO 73 -2.323 9.590 0.501 609 HB2 PRO 73 HB2 PRO 73 -1.619 12.015 -0.472 610 HB3 PRO 73 HB3 PRO 73 -1.435 11.597 1.260 611 HG2 PRO 73 HG2 PRO 73 0.686 11.542 -0.902 612 HG3 PRO 73 HG3 PRO 73 0.800 12.241 0.742 613 HD2 PRO 73 HD2 PRO 73 1.716 9.723 0.084 614 HD3 PRO 73 HD3 PRO 73 1.109 10.129 1.714 615 H VAL 74 H VAL 74 -3.595 9.594 -1.255 616 HA VAL 74 HA VAL 74 -2.468 9.043 -3.981 617 HB VAL 74 HB VAL 74 -4.839 7.602 -2.735 618 HG11 VAL 74 HG11 VAL 74 -3.092 6.954 -5.146 619 HG12 VAL 74 HG12 VAL 74 -4.412 5.941 -4.531 620 HG13 VAL 74 HG13 VAL 74 -4.772 7.542 -5.168 621 HG21 VAL 74 HG21 VAL 74 -2.989 6.916 -1.346 622 HG22 VAL 74 HG22 VAL 74 -3.424 5.613 -2.447 623 HG23 VAL 74 HG23 VAL 74 -1.977 6.589 -2.769 624 H GLU 75 H GLU 75 -3.426 10.280 -5.554 625 HA GLU 75 HA GLU 75 -5.838 11.859 -4.875 626 HB2 GLU 75 HB2 GLU 75 -4.414 12.141 -7.499 627 HB3 GLU 75 HB3 GLU 75 -5.199 13.334 -6.490 628 HG2 GLU 75 HG2 GLU 75 -3.047 13.977 -6.220 629 HG3 GLU 75 HG3 GLU 75 -3.147 12.881 -4.851 630 H GLN 76 H GLN 76 -5.048 9.088 -6.711 631 HA GLN 76 HA GLN 76 -7.735 8.593 -7.651 632 HB2 GLN 76 HB2 GLN 76 -7.332 8.591 -9.994 633 HB3 GLN 76 HB3 GLN 76 -6.895 10.179 -9.408 634 HG2 GLN 76 HG2 GLN 76 -4.955 7.957 -10.200 635 HG3 GLN 76 HG3 GLN 76 -5.368 9.367 -11.149 636 HE21 GLN 76 HE21 GLN 76 -2.733 9.819 -8.014 637 HE22 GLN 76 HE22 GLN 76 -3.636 8.303 -8.217 638 H TYR 77 H TYR 77 -8.015 6.386 -8.211 639 HA TYR 77 HA TYR 77 -5.602 4.669 -8.267 640 HB2 TYR 77 HB2 TYR 77 -6.570 4.616 -5.995 641 HB3 TYR 77 HB3 TYR 77 -8.092 4.037 -6.693 642 HD1 TYR 77 HD1 TYR 77 -4.430 3.253 -6.678 643 HD2 TYR 77 HD2 TYR 77 -8.447 1.723 -6.835 644 HE1 TYR 77 HE1 TYR 77 -3.542 0.934 -6.768 645 HE2 TYR 77 HE2 TYR 77 -7.562 -0.614 -6.828 646 HH TYR 77 HH TYR 77 -4.048 -1.306 -6.809 647 HA PRO 78 HA PRO 78 -4.811 2.849 -9.369 648 HB2 PRO 78 HB2 PRO 78 -3.974 2.422 -11.934 649 HB3 PRO 78 HB3 PRO 78 -4.892 1.221 -10.975 650 HG2 PRO 78 HG2 PRO 78 -5.986 3.211 -12.996 651 HG3 PRO 78 HG3 PRO 78 -6.292 1.445 -12.907 652 HD2 PRO 78 HD2 PRO 78 -8.038 3.215 -11.838 653 HD3 PRO 78 HD3 PRO 78 -7.665 1.688 -10.987 654 H GLY 79 H GLY 79 -2.869 3.973 -9.573 655 HA2 GLY 79 HA2 GLY 79 -2.475 6.360 -11.173 656 HA3 GLY 79 HA3 GLY 79 -2.943 6.731 -9.515 657 H ILE 80 H ILE 80 -0.848 7.784 -9.357 658 HA ILE 80 HA ILE 80 1.595 6.325 -9.757 659 HB ILE 80 HB ILE 80 1.454 8.686 -10.187 660 HG12 ILE 80 HG12 ILE 80 3.416 9.565 -8.983 661 HG13 ILE 80 HG13 ILE 80 3.348 8.223 -7.840 662 HG21 ILE 80 HG21 ILE 80 -0.186 9.380 -8.442 663 HG22 ILE 80 HG22 ILE 80 1.069 9.186 -7.200 664 HG23 ILE 80 HG23 ILE 80 1.243 10.401 -8.470 665 HD11 ILE 80 HD11 ILE 80 5.072 7.944 -9.593 666 HD12 ILE 80 HD12 ILE 80 3.882 6.633 -9.631 667 HD13 ILE 80 HD13 ILE 80 3.806 7.943 -10.839 668 H ALA 81 H ALA 81 -0.196 7.083 -6.768 669 HA ALA 81 HA ALA 81 2.078 6.280 -5.081 670 HB1 ALA 81 HB1 ALA 81 0.831 8.319 -4.613 671 HB2 ALA 81 HB2 ALA 81 -0.668 7.388 -4.440 672 HB3 ALA 81 HB3 ALA 81 0.661 7.167 -3.277 673 H VAL 82 H VAL 82 0.136 4.305 -6.622 674 HA VAL 82 HA VAL 82 0.358 2.185 -4.623 675 HB VAL 82 HB VAL 82 -2.340 2.734 -5.846 676 HG11 VAL 82 HG11 VAL 82 -1.455 0.828 -3.623 677 HG12 VAL 82 HG12 VAL 82 -3.119 1.017 -4.203 678 HG13 VAL 82 HG13 VAL 82 -1.881 0.345 -5.267 679 HG21 VAL 82 HG21 VAL 82 -2.091 4.495 -4.238 680 HG22 VAL 82 HG22 VAL 82 -3.232 3.299 -3.635 681 HG23 VAL 82 HG23 VAL 82 -1.581 3.344 -2.983 682 H GLU 83 H GLU 83 0.918 0.360 -5.650 683 HA GLU 83 HA GLU 83 0.291 -0.107 -8.519 684 HB2 GLU 83 HB2 GLU 83 2.866 0.774 -7.415 685 HB3 GLU 83 HB3 GLU 83 3.040 -0.803 -8.166 686 HG2 GLU 83 HG2 GLU 83 1.645 1.501 -9.569 687 HG3 GLU 83 HG3 GLU 83 3.396 1.276 -9.614 688 H THR 84 H THR 84 0.948 -2.255 -9.281 689 HA THR 84 HA THR 84 0.610 -4.391 -7.171 690 HB THR 84 HB THR 84 -0.572 -5.674 -8.846 691 HG1 THR 84 HG1 THR 84 -1.094 -4.763 -10.835 692 HG21 THR 84 HG21 THR 84 -1.729 -2.848 -8.723 693 HG22 THR 84 HG22 THR 84 -2.623 -4.348 -9.080 694 HG23 THR 84 HG23 THR 84 -1.920 -4.108 -7.482 695 H VAL 85 H VAL 85 1.496 -6.502 -7.709 696 HA VAL 85 HA VAL 85 4.006 -6.438 -9.274 697 HB VAL 85 HB VAL 85 4.441 -8.629 -8.309 698 HG11 VAL 85 HG11 VAL 85 3.548 -6.675 -6.157 699 HG12 VAL 85 HG12 VAL 85 4.747 -7.960 -5.991 700 HG13 VAL 85 HG13 VAL 85 5.072 -6.591 -7.065 701 HG21 VAL 85 HG21 VAL 85 2.102 -9.472 -8.166 702 HG22 VAL 85 HG22 VAL 85 3.003 -9.655 -6.668 703 HG23 VAL 85 HG23 VAL 85 1.806 -8.356 -6.822 704 H THR 86 H THR 86 4.302 -8.611 -10.539 705 HA THR 86 HA THR 86 2.034 -9.049 -12.391 706 HB THR 86 HB THR 86 3.707 -10.035 -13.850 707 HG1 THR 86 HG1 THR 86 5.851 -10.148 -13.181 708 HG21 THR 86 HG21 THR 86 3.557 -7.530 -13.753 709 HG22 THR 86 HG22 THR 86 4.870 -7.529 -12.562 710 HG23 THR 86 HG23 THR 86 5.177 -8.112 -14.207 711 H ASP 87 H ASP 87 3.997 -10.865 -10.083 712 HA ASP 87 HA ASP 87 3.151 -13.438 -11.123 713 HB2 ASP 87 HB2 ASP 87 5.424 -12.924 -10.265 714 HB3 ASP 87 HB3 ASP 87 4.746 -12.786 -8.635 715 H SER 88 H SER 88 2.447 -11.700 -8.061 716 HA SER 88 HA SER 88 0.110 -13.530 -7.627 717 HB2 SER 88 HB2 SER 88 1.952 -14.568 -6.435 718 HB3 SER 88 HB3 SER 88 2.271 -13.060 -5.557 719 HG SER 88 HG SER 88 0.879 -14.705 -4.491 720 H SER 89 H SER 89 -1.689 -12.446 -7.163 721 HA SER 89 HA SER 89 -1.638 -9.638 -6.953 722 HB2 SER 89 HB2 SER 89 -4.100 -11.141 -6.159 723 HB3 SER 89 HB3 SER 89 -3.939 -9.683 -7.132 724 HG SER 89 HG SER 89 -3.073 -11.006 -8.817 725 H ARG 90 H ARG 90 -0.888 -11.588 -4.358 726 HA ARG 90 HA ARG 90 -2.248 -9.942 -2.348 727 HB2 ARG 90 HB2 ARG 90 -1.812 -11.475 -0.733 728 HB3 ARG 90 HB3 ARG 90 -2.196 -12.424 -2.160 729 HG2 ARG 90 HG2 ARG 90 0.213 -12.841 -2.540 730 HG3 ARG 90 HG3 ARG 90 0.604 -11.857 -1.113 731 HD2 ARG 90 HD2 ARG 90 -0.761 -13.435 0.283 732 HD3 ARG 90 HD3 ARG 90 -0.906 -14.486 -1.140 733 HE ARG 90 HE ARG 90 1.848 -13.855 -0.745 734 HH11 ARG 90 HH11 ARG 90 3.281 -15.223 0.081 735 HH12 ARG 90 HH12 ARG 90 2.788 -16.522 1.142 736 HH21 ARG 90 HH21 ARG 90 -0.542 -15.662 1.093 737 HH22 ARG 90 HH22 ARG 90 0.656 -16.768 1.690 738 H TYR 91 H TYR 91 -0.019 -8.855 -4.130 739 HA TYR 91 HA TYR 91 1.607 -7.661 -1.964 740 HB2 TYR 91 HB2 TYR 91 2.630 -8.872 -4.550 741 HB3 TYR 91 HB3 TYR 91 3.590 -7.935 -3.430 742 HD1 TYR 91 HD1 TYR 91 4.150 -8.830 -1.174 743 HD2 TYR 91 HD2 TYR 91 2.150 -11.224 -4.147 744 HE1 TYR 91 HE1 TYR 91 4.691 -10.890 0.120 745 HE2 TYR 91 HE2 TYR 91 2.766 -13.288 -2.900 746 HH TYR 91 HH TYR 91 4.553 -13.165 0.202 747 H PHE 92 H PHE 92 1.923 -5.518 -2.185 748 HA PHE 92 HA PHE 92 1.319 -4.162 -4.773 749 HB2 PHE 92 HB2 PHE 92 0.327 -3.293 -2.030 750 HB3 PHE 92 HB3 PHE 92 0.120 -2.399 -3.523 751 HD1 PHE 92 HD1 PHE 92 -1.174 -3.540 -5.452 752 HD2 PHE 92 HD2 PHE 92 -1.307 -4.863 -1.368 753 HE1 PHE 92 HE1 PHE 92 -3.257 -4.837 -5.931 754 HE2 PHE 92 HE2 PHE 92 -3.404 -6.085 -1.820 755 HZ PHE 92 HZ PHE 92 -4.351 -6.111 -4.146 756 H VAL 93 H VAL 93 2.204 -2.022 -4.925 757 HA VAL 93 HA VAL 93 4.352 -1.348 -2.951 758 HB VAL 93 HB VAL 93 4.247 -0.739 -5.923 759 HG11 VAL 93 HG11 VAL 93 5.117 1.228 -4.753 760 HG12 VAL 93 HG12 VAL 93 6.282 0.218 -3.868 761 HG13 VAL 93 HG13 VAL 93 6.401 0.405 -5.632 762 HG21 VAL 93 HG21 VAL 93 5.057 -2.966 -5.473 763 HG22 VAL 93 HG22 VAL 93 6.454 -1.961 -5.863 764 HG23 VAL 93 HG23 VAL 93 6.128 -2.384 -4.179 765 H ILE 94 H ILE 94 4.277 0.757 -2.072 766 HA ILE 94 HA ILE 94 2.302 2.605 -3.272 767 HB ILE 94 HB ILE 94 1.519 3.450 -1.203 768 HG12 ILE 94 HG12 ILE 94 3.379 2.569 0.302 769 HG13 ILE 94 HG13 ILE 94 1.744 2.531 0.931 770 HG21 ILE 94 HG21 ILE 94 0.810 0.529 -1.611 771 HG22 ILE 94 HG22 ILE 94 -0.139 1.717 -0.686 772 HG23 ILE 94 HG23 ILE 94 0.128 1.946 -2.418 773 HD11 ILE 94 HD11 ILE 94 3.245 0.097 -0.133 774 HD12 ILE 94 HD12 ILE 94 2.977 0.524 1.563 775 HD13 ILE 94 HD13 ILE 94 1.604 0.103 0.538 776 H ARG 95 H ARG 95 2.671 4.772 -3.026 777 HA ARG 95 HA ARG 95 5.542 5.436 -2.559 778 HB2 ARG 95 HB2 ARG 95 4.344 6.070 -4.709 779 HB3 ARG 95 HB3 ARG 95 3.480 7.294 -3.768 780 HG2 ARG 95 HG2 ARG 95 5.669 8.258 -3.057 781 HG3 ARG 95 HG3 ARG 95 6.511 7.038 -4.035 782 HD2 ARG 95 HD2 ARG 95 5.359 7.920 -6.063 783 HD3 ARG 95 HD3 ARG 95 4.602 9.178 -5.066 784 HE ARG 95 HE ARG 95 7.356 9.389 -4.569 785 HH11 ARG 95 HH11 ARG 95 8.683 10.768 -5.475 786 HH12 ARG 95 HH12 ARG 95 8.389 11.422 -7.074 787 HH21 ARG 95 HH21 ARG 95 5.383 9.769 -7.444 788 HH22 ARG 95 HH22 ARG 95 6.532 10.861 -8.170 789 H ILE 96 H ILE 96 5.569 5.335 -0.328 790 HA ILE 96 HA ILE 96 3.843 7.032 1.287 791 HB ILE 96 HB ILE 96 5.107 6.472 3.199 792 HG12 ILE 96 HG12 ILE 96 6.910 4.479 2.690 793 HG13 ILE 96 HG13 ILE 96 7.195 5.481 1.281 794 HG21 ILE 96 HG21 ILE 96 4.537 4.049 1.489 795 HG22 ILE 96 HG22 ILE 96 4.713 4.055 3.251 796 HG23 ILE 96 HG23 ILE 96 3.388 4.940 2.520 797 HD11 ILE 96 HD11 ILE 96 8.716 6.044 3.121 798 HD12 ILE 96 HD12 ILE 96 7.642 7.424 2.819 799 HD13 ILE 96 HD13 ILE 96 7.348 6.344 4.205 800 H GLN 97 H GLN 97 4.231 8.952 2.267 801 HA GLN 97 HA GLN 97 6.466 10.646 1.238 802 HB2 GLN 97 HB2 GLN 97 3.484 11.032 0.822 803 HB3 GLN 97 HB3 GLN 97 4.621 12.379 0.744 804 HG2 GLN 97 HG2 GLN 97 5.683 11.614 -1.164 805 HG3 GLN 97 HG3 GLN 97 5.153 9.946 -0.967 806 HE21 GLN 97 HE21 GLN 97 2.230 10.356 -2.872 807 HE22 GLN 97 HE22 GLN 97 3.237 9.266 -1.920 808 H ASP 98 H ASP 98 6.840 12.510 2.358 809 HA ASP 98 HA ASP 98 5.878 12.537 5.180 810 HB2 ASP 98 HB2 ASP 98 8.340 12.495 4.517 811 HB3 ASP 98 HB3 ASP 98 8.105 14.147 3.939 812 H GLY 99 H GLY 99 4.809 13.910 2.414 813 HA2 GLY 99 HA2 GLY 99 3.130 15.488 2.106 814 HA3 GLY 99 HA3 GLY 99 3.302 16.013 3.780 815 H THR 100 H THR 100 6.263 15.999 2.106 816 HA THR 100 HA THR 100 6.150 18.914 1.453 817 HB THR 100 HB THR 100 6.916 18.417 3.777 818 HG1 THR 100 HG1 THR 100 8.592 19.873 3.686 819 HG21 THR 100 HG21 THR 100 8.247 16.355 3.257 820 HG22 THR 100 HG22 THR 100 9.465 17.388 2.473 821 HG23 THR 100 HG23 THR 100 9.122 17.564 4.205 822 H GLY 101 H GLY 101 6.424 16.232 -0.137 823 HA2 GLY 101 HA2 GLY 101 7.240 15.970 -2.325 824 HA3 GLY 101 HA3 GLY 101 8.454 17.217 -2.058 825 H ARG 102 H ARG 102 8.770 15.314 0.589 826 HA ARG 102 HA ARG 102 10.914 13.537 -0.340 827 HB2 ARG 102 HB2 ARG 102 9.354 13.709 2.270 828 HB3 ARG 102 HB3 ARG 102 10.716 12.622 1.995 829 HG2 ARG 102 HG2 ARG 102 12.236 14.452 1.741 830 HG3 ARG 102 HG3 ARG 102 10.908 15.638 1.782 831 HD2 ARG 102 HD2 ARG 102 10.342 14.942 4.081 832 HD3 ARG 102 HD3 ARG 102 11.700 13.806 4.087 833 HE ARG 102 HE ARG 102 13.043 16.032 3.545 834 HH11 ARG 102 HH11 ARG 102 13.823 17.616 4.857 835 HH12 ARG 102 HH12 ARG 102 12.994 18.028 6.329 836 HH21 ARG 102 HH21 ARG 102 10.441 15.756 5.963 837 HH22 ARG 102 HH22 ARG 102 11.169 17.005 6.932 838 H SER 103 H SER 103 10.601 11.568 -1.051 839 HA SER 103 HA SER 103 8.300 10.039 -0.152 840 HB2 SER 103 HB2 SER 103 7.388 9.465 -2.306 841 HB3 SER 103 HB3 SER 103 7.493 11.228 -2.218 842 HG SER 103 HG SER 103 9.555 10.996 -3.345 843 H ALA 104 H ALA 104 8.280 7.788 -0.608 844 HA ALA 104 HA ALA 104 10.575 6.565 -1.990 845 HB1 ALA 104 HB1 ALA 104 11.303 6.627 0.380 846 HB2 ALA 104 HB2 ALA 104 9.796 5.817 0.866 847 HB3 ALA 104 HB3 ALA 104 10.979 4.965 -0.149 848 H PHE 105 H PHE 105 10.078 4.593 -2.930 849 HA PHE 105 HA PHE 105 7.239 3.679 -2.814 850 HB2 PHE 105 HB2 PHE 105 9.522 3.039 -4.698 851 HB3 PHE 105 HB3 PHE 105 8.033 2.117 -4.637 852 HD1 PHE 105 HD1 PHE 105 9.592 5.121 -5.950 853 HD2 PHE 105 HD2 PHE 105 5.806 3.258 -5.079 854 HE1 PHE 105 HE1 PHE 105 8.468 6.618 -7.586 855 HE2 PHE 105 HE2 PHE 105 4.692 4.706 -6.752 856 HZ PHE 105 HZ PHE 105 6.028 6.391 -8.011 857 H ILE 106 H ILE 106 6.744 2.186 -1.379 858 HA ILE 106 HA ILE 106 8.799 0.155 -0.574 859 HB ILE 106 HB ILE 106 7.891 -0.015 1.593 860 HG12 ILE 106 HG12 ILE 106 5.872 2.169 0.927 861 HG13 ILE 106 HG13 ILE 106 5.494 0.455 1.109 862 HG21 ILE 106 HG21 ILE 106 8.266 2.945 1.004 863 HG22 ILE 106 HG22 ILE 106 8.650 2.086 2.514 864 HG23 ILE 106 HG23 ILE 106 9.591 1.760 1.049 865 HD11 ILE 106 HD11 ILE 106 6.510 2.258 3.329 866 HD12 ILE 106 HD12 ILE 106 4.890 1.571 3.141 867 HD13 ILE 106 HD13 ILE 106 6.268 0.504 3.460 868 H GLY 107 H GLY 107 8.190 -1.992 -0.382 869 HA2 GLY 107 HA2 GLY 107 5.739 -2.763 -1.884 870 HA3 GLY 107 HA3 GLY 107 7.125 -3.792 -1.529 871 H ILE 108 H ILE 108 4.121 -3.910 -0.903 872 HA ILE 108 HA ILE 108 4.489 -4.847 1.869 873 HB ILE 108 HB ILE 108 2.156 -4.342 2.407 874 HG12 ILE 108 HG12 ILE 108 2.136 -2.487 -0.010 875 HG13 ILE 108 HG13 ILE 108 1.291 -4.034 0.067 876 HG21 ILE 108 HG21 ILE 108 3.888 -1.917 1.810 877 HG22 ILE 108 HG22 ILE 108 2.588 -2.018 3.017 878 HG23 ILE 108 HG23 ILE 108 4.031 -3.014 3.202 879 HD11 ILE 108 HD11 ILE 108 -0.028 -3.216 2.026 880 HD12 ILE 108 HD12 ILE 108 0.717 -1.621 1.836 881 HD13 ILE 108 HD13 ILE 108 -0.292 -2.280 0.542 882 H GLY 109 H GLY 109 3.676 -6.767 2.400 883 HA2 GLY 109 HA2 GLY 109 2.237 -8.354 0.295 884 HA3 GLY 109 HA3 GLY 109 3.488 -9.028 1.328 885 H PHE 110 H PHE 110 0.578 -9.589 0.850 886 HA PHE 110 HA PHE 110 -0.586 -9.287 3.577 887 HB2 PHE 110 HB2 PHE 110 -1.752 -9.838 0.833 888 HB3 PHE 110 HB3 PHE 110 -2.677 -10.043 2.302 889 HD1 PHE 110 HD1 PHE 110 -4.087 -8.314 2.909 890 HD2 PHE 110 HD2 PHE 110 -0.488 -7.366 0.717 891 HE1 PHE 110 HE1 PHE 110 -4.725 -5.920 2.869 892 HE2 PHE 110 HE2 PHE 110 -1.070 -4.974 0.805 893 HZ PHE 110 HZ PHE 110 -3.196 -4.243 1.838 894 H THR 111 H THR 111 -1.843 -11.087 4.433 895 HA THR 111 HA THR 111 -0.375 -13.594 4.386 896 HB THR 111 HB THR 111 -1.409 -12.630 6.401 897 HG1 THR 111 HG1 THR 111 -2.124 -14.594 7.175 898 HG21 THR 111 HG21 THR 111 -3.772 -12.886 6.887 899 HG22 THR 111 HG22 THR 111 -3.594 -11.860 5.461 900 HG23 THR 111 HG23 THR 111 -4.087 -13.560 5.277 901 H ASP 112 H ASP 112 -3.224 -12.392 2.695 902 HA ASP 112 HA ASP 112 -3.473 -14.901 1.205 903 HB2 ASP 112 HB2 ASP 112 -4.840 -15.202 3.310 904 HB3 ASP 112 HB3 ASP 112 -5.822 -13.823 2.817 905 H ARG 113 H ARG 113 -4.586 -14.713 -0.731 906 HA ARG 113 HA ARG 113 -4.496 -12.176 -2.041 907 HB2 ARG 113 HB2 ARG 113 -4.190 -14.465 -3.051 908 HB3 ARG 113 HB3 ARG 113 -5.938 -14.721 -2.912 909 HG2 ARG 113 HG2 ARG 113 -6.347 -12.797 -4.411 910 HG3 ARG 113 HG3 ARG 113 -4.605 -12.452 -4.445 911 HD2 ARG 113 HD2 ARG 113 -4.200 -14.692 -5.464 912 HD3 ARG 113 HD3 ARG 113 -5.935 -15.005 -5.472 913 HE ARG 113 HE ARG 113 -4.445 -13.007 -7.142 914 HH11 ARG 113 HH11 ARG 113 -5.272 -12.286 -8.933 915 HH12 ARG 113 HH12 ARG 113 -6.867 -12.771 -9.478 916 HH21 ARG 113 HH21 ARG 113 -7.521 -14.639 -6.648 917 HH22 ARG 113 HH22 ARG 113 -8.141 -14.051 -8.166 918 H GLY 114 H GLY 114 -7.211 -13.815 -0.428 919 HA2 GLY 114 HA2 GLY 114 -9.308 -12.136 -1.502 920 HA3 GLY 114 HA3 GLY 114 -9.370 -13.125 -0.039 921 H ASP 115 H ASP 115 -6.996 -11.706 1.143 922 HA ASP 115 HA ASP 115 -8.449 -9.368 2.255 923 HB2 ASP 115 HB2 ASP 115 -5.879 -10.783 3.034 924 HB3 ASP 115 HB3 ASP 115 -6.407 -9.267 3.764 925 H ALA 116 H ALA 116 -5.574 -10.022 0.235 926 HA ALA 116 HA ALA 116 -4.863 -7.259 -0.168 927 HB1 ALA 116 HB1 ALA 116 -3.733 -8.227 -2.168 928 HB2 ALA 116 HB2 ALA 116 -3.392 -9.115 -0.667 929 HB3 ALA 116 HB3 ALA 116 -4.543 -9.766 -1.862 930 H PHE 117 H PHE 117 -7.223 -9.422 -1.843 931 HA PHE 117 HA PHE 117 -8.100 -7.476 -3.744 932 HB2 PHE 117 HB2 PHE 117 -9.183 -10.011 -2.644 933 HB3 PHE 117 HB3 PHE 117 -10.380 -8.868 -3.218 934 HD1 PHE 117 HD1 PHE 117 -6.965 -9.994 -4.429 935 HD2 PHE 117 HD2 PHE 117 -11.101 -9.233 -5.395 936 HE1 PHE 117 HE1 PHE 117 -6.530 -10.606 -6.791 937 HE2 PHE 117 HE2 PHE 117 -10.660 -9.856 -7.755 938 HZ PHE 117 HZ PHE 117 -8.374 -10.538 -8.460 939 H ASP 118 H ASP 118 -8.998 -7.845 -0.294 940 HA ASP 118 HA ASP 118 -11.042 -5.868 -0.321 941 HB2 ASP 118 HB2 ASP 118 -10.150 -7.618 1.521 942 HB3 ASP 118 HB3 ASP 118 -9.270 -6.217 2.104 943 H PHE 119 H PHE 119 -7.501 -5.540 0.030 944 HA PHE 119 HA PHE 119 -7.355 -2.709 0.455 945 HB2 PHE 119 HB2 PHE 119 -5.485 -4.115 0.885 946 HB3 PHE 119 HB3 PHE 119 -5.418 -4.690 -0.756 947 HD1 PHE 119 HD1 PHE 119 -4.253 -2.156 1.512 948 HD2 PHE 119 HD2 PHE 119 -4.731 -3.147 -2.651 949 HE1 PHE 119 HE1 PHE 119 -2.650 -0.394 0.917 950 HE2 PHE 119 HE2 PHE 119 -3.109 -1.388 -3.252 951 HZ PHE 119 HZ PHE 119 -2.056 0.011 -1.473 952 H ASN 120 H ASN 120 -7.105 -4.499 -2.709 953 HA ASN 120 HA ASN 120 -7.134 -1.938 -4.069 954 HB2 ASN 120 HB2 ASN 120 -6.930 -3.144 -6.125 955 HB3 ASN 120 HB3 ASN 120 -5.809 -3.773 -4.929 956 HD21 ASN 120 HD21 ASN 120 -8.805 -6.215 -6.315 957 HD22 ASN 120 HD22 ASN 120 -9.072 -4.483 -6.385 958 H VAL 121 H VAL 121 -9.766 -4.158 -3.300 959 HA VAL 121 HA VAL 121 -11.623 -2.896 -5.171 960 HB VAL 121 HB VAL 121 -12.021 -4.793 -2.845 961 HG11 VAL 121 HG11 VAL 121 -14.123 -3.712 -4.771 962 HG12 VAL 121 HG12 VAL 121 -14.348 -5.106 -3.689 963 HG13 VAL 121 HG13 VAL 121 -14.093 -3.504 -3.003 964 HG21 VAL 121 HG21 VAL 121 -10.973 -5.743 -4.905 965 HG22 VAL 121 HG22 VAL 121 -12.583 -6.402 -4.629 966 HG23 VAL 121 HG23 VAL 121 -12.340 -5.148 -5.866 967 H SER 122 H SER 122 -10.981 -2.521 -1.615 968 HA SER 122 HA SER 122 -13.127 -0.628 -1.347 969 HB2 SER 122 HB2 SER 122 -11.981 -2.038 0.479 970 HB3 SER 122 HB3 SER 122 -10.784 -0.725 0.558 971 HG SER 122 HG SER 122 -12.682 -0.515 1.966 972 H LEU 123 H LEU 123 -9.709 -0.192 -2.224 973 HA LEU 123 HA LEU 123 -9.756 2.700 -2.274 974 HB2 LEU 123 HB2 LEU 123 -8.117 0.582 -3.715 975 HB3 LEU 123 HB3 LEU 123 -7.921 2.292 -4.071 976 HG LEU 123 HG LEU 123 -7.549 1.155 -1.274 977 HD11 LEU 123 HD11 LEU 123 -5.906 0.187 -2.843 978 HD12 LEU 123 HD12 LEU 123 -5.475 1.815 -3.411 979 HD13 LEU 123 HD13 LEU 123 -5.137 1.324 -1.733 980 HD21 LEU 123 HD21 LEU 123 -8.012 3.588 -1.319 981 HD22 LEU 123 HD22 LEU 123 -6.326 3.279 -0.905 982 HD23 LEU 123 HD23 LEU 123 -6.743 3.813 -2.545 983 H GLN 124 H GLN 124 -10.310 0.318 -4.978 984 HA GLN 124 HA GLN 124 -10.859 2.447 -6.800 985 HB2 GLN 124 HB2 GLN 124 -11.210 0.850 -8.435 986 HB3 GLN 124 HB3 GLN 124 -10.062 0.099 -7.329 987 HG2 GLN 124 HG2 GLN 124 -12.036 -1.109 -6.280 988 HG3 GLN 124 HG3 GLN 124 -13.030 -0.510 -7.609 989 HE21 GLN 124 HE21 GLN 124 -10.070 -3.277 -8.442 990 HE22 GLN 124 HE22 GLN 124 -9.914 -2.222 -7.021 991 H ASP 125 H ASP 125 -13.059 0.715 -4.634 992 HA ASP 125 HA ASP 125 -15.421 1.853 -5.918 993 HB2 ASP 125 HB2 ASP 125 -15.387 -0.422 -4.896 994 HB3 ASP 125 HB3 ASP 125 -15.173 0.323 -3.308 995 H HIS 126 H HIS 126 -13.091 3.145 -3.853 996 HA HIS 126 HA HIS 126 -14.982 5.267 -2.969 997 HB2 HIS 126 HB2 HIS 126 -13.332 4.481 -1.296 998 HB3 HIS 126 HB3 HIS 126 -12.017 4.955 -2.375 999 HD2 HIS 126 HD2 HIS 126 -15.005 6.574 -0.455 1000 HE1 HIS 126 HE1 HIS 126 -12.031 9.587 -0.931 1001 HE2 HIS 126 HE2 HIS 126 -14.289 9.053 0.097 1002 H PHE 127 H PHE 127 -12.294 4.683 -5.214 1003 HA PHE 127 HA PHE 127 -12.378 7.462 -6.159 1004 HB2 PHE 127 HB2 PHE 127 -10.653 5.046 -6.737 1005 HB3 PHE 127 HB3 PHE 127 -10.562 6.481 -7.737 1006 HD1 PHE 127 HD1 PHE 127 -9.056 4.965 -4.983 1007 HD2 PHE 127 HD2 PHE 127 -10.486 8.806 -6.310 1008 HE1 PHE 127 HE1 PHE 127 -7.287 6.075 -3.666 1009 HE2 PHE 127 HE2 PHE 127 -8.780 9.926 -4.905 1010 HZ PHE 127 HZ PHE 127 -7.164 8.570 -3.609 1011 H LYS 128 H LYS 128 -14.214 4.742 -7.176 1012 HA LYS 128 HA LYS 128 -14.121 4.925 -9.880 1013 HB2 LYS 128 HB2 LYS 128 -16.137 3.833 -10.117 1014 HB3 LYS 128 HB3 LYS 128 -15.405 3.229 -8.649 1015 HG2 LYS 128 HG2 LYS 128 -17.669 5.290 -8.758 1016 HG3 LYS 128 HG3 LYS 128 -17.869 3.548 -8.553 1017 HD2 LYS 128 HD2 LYS 128 -16.452 3.685 -6.479 1018 HD3 LYS 128 HD3 LYS 128 -16.448 5.443 -6.640 1019 HE2 LYS 128 HE2 LYS 128 -18.122 4.950 -5.076 1020 HE3 LYS 128 HE3 LYS 128 -18.947 5.414 -6.574 1021 HZ1 LYS 128 HZ1 LYS 128 -19.913 3.411 -5.504 1022 HZ2 LYS 128 HZ2 LYS 128 -19.355 3.047 -6.993 1023 HZ3 LYS 128 HZ3 LYS 128 -18.505 2.594 -5.670 1024 H TRP 129 H TRP 129 -15.685 7.366 -7.969 1025 HA TRP 129 HA TRP 129 -16.942 8.681 -10.296 1026 HB2 TRP 129 HB2 TRP 129 -17.762 10.279 -8.716 1027 HB3 TRP 129 HB3 TRP 129 -18.078 8.653 -8.127 1028 HD1 TRP 129 HD1 TRP 129 -16.323 7.773 -6.142 1029 HE1 TRP 129 HE1 TRP 129 -15.080 9.010 -4.324 1030 HE3 TRP 129 HE3 TRP 129 -16.962 12.560 -7.864 1031 HZ2 TRP 129 HZ2 TRP 129 -14.690 11.773 -3.495 1032 HZ3 TRP 129 HZ3 TRP 129 -16.242 14.486 -6.469 1033 HH2 TRP 129 HH2 TRP 129 -15.107 14.108 -4.289 1034 H VAL 130 H VAL 130 -13.899 8.875 -8.619 1035 HA VAL 130 HA VAL 130 -13.193 11.538 -9.694 1036 HB VAL 130 HB VAL 130 -11.414 9.568 -8.226 1037 HG11 VAL 130 HG11 VAL 130 -11.210 12.585 -8.631 1038 HG12 VAL 130 HG12 VAL 130 -10.101 11.587 -7.664 1039 HG13 VAL 130 HG13 VAL 130 -10.187 11.355 -9.409 1040 HG21 VAL 130 HG21 VAL 130 -11.850 10.991 -6.199 1041 HG22 VAL 130 HG22 VAL 130 -13.159 11.795 -7.094 1042 HG23 VAL 130 HG23 VAL 130 -13.253 10.061 -6.717 1043 H LYS 131 H LYS 131 -12.427 8.118 -10.159 1044 HA LYS 131 HA LYS 131 -10.649 8.644 -12.462 1045 HB2 LYS 131 HB2 LYS 131 -9.912 7.307 -10.474 1046 HB3 LYS 131 HB3 LYS 131 -11.140 6.107 -10.848 1047 HG2 LYS 131 HG2 LYS 131 -8.907 5.423 -11.556 1048 HG3 LYS 131 HG3 LYS 131 -9.982 5.521 -12.935 1049 HD2 LYS 131 HD2 LYS 131 -8.966 7.662 -13.615 1050 HD3 LYS 131 HD3 LYS 131 -7.945 7.657 -12.152 1051 HE2 LYS 131 HE2 LYS 131 -6.912 5.533 -12.875 1052 HE3 LYS 131 HE3 LYS 131 -7.974 5.495 -14.297 1053 HZ1 LYS 131 HZ1 LYS 131 -6.930 7.504 -15.099 1054 HZ2 LYS 131 HZ2 LYS 131 -5.951 7.608 -13.778 1055 HZ3 LYS 131 HZ3 LYS 131 -5.772 6.379 -14.843 1056 H GLN 132 H GLN 132 -13.085 9.300 -13.168 1057 HA GLN 132 HA GLN 132 -14.502 7.108 -14.511 1058 HB2 GLN 132 HB2 GLN 132 -14.886 10.113 -14.595 1059 HB3 GLN 132 HB3 GLN 132 -15.835 8.935 -15.521 1060 HG2 GLN 132 HG2 GLN 132 -16.580 7.849 -13.429 1061 HG3 GLN 132 HG3 GLN 132 -15.644 9.013 -12.487 1062 HE21 GLN 132 HE21 GLN 132 -18.182 11.505 -12.680 1063 HE22 GLN 132 HE22 GLN 132 -16.646 11.005 -11.970 1064 H GLU 133 H GLU 133 -12.989 6.217 -15.770 1065 HA GLU 133 HA GLU 133 -12.502 7.453 -18.433 1066 HB2 GLU 133 HB2 GLU 133 -10.326 6.149 -16.743 1067 HB3 GLU 133 HB3 GLU 133 -10.211 6.445 -18.480 1068 HG2 GLU 133 HG2 GLU 133 -10.608 8.906 -18.026 1069 HG3 GLU 133 HG3 GLU 133 -10.466 8.553 -16.300 Start of MODEL 21 1 H1 GLY -4 H1 GLY -4 -5.023 26.228 -0.450 2 H2 GLY -4 H2 GLY -4 -4.037 27.398 0.135 3 H3 GLY -4 H3 GLY -4 -5.655 27.640 0.089 4 HA2 GLY -4 HA2 GLY -4 -6.030 25.883 1.697 5 HA3 GLY -4 HA3 GLY -4 -4.276 25.642 1.763 6 H SER -3 H SER -3 -4.012 26.164 3.911 7 HA SER -3 HA SER -3 -4.420 29.014 4.735 8 HB2 SER -3 HB2 SER -3 -6.177 27.517 5.679 9 HB3 SER -3 HB3 SER -3 -4.915 26.476 6.349 10 HG SER -3 HG SER -3 -5.639 29.112 7.072 11 HA PRO -2 HA PRO -2 -0.180 28.600 6.472 12 HB2 PRO -2 HB2 PRO -2 -1.449 30.054 8.802 13 HB3 PRO -2 HB3 PRO -2 0.150 30.328 8.040 14 HG2 PRO -2 HG2 PRO -2 -1.903 31.977 7.449 15 HG3 PRO -2 HG3 PRO -2 -0.870 31.355 6.118 16 HD2 PRO -2 HD2 PRO -2 -3.573 30.342 7.032 17 HD3 PRO -2 HD3 PRO -2 -3.001 30.667 5.367 18 H ASN -1 H ASN -1 -3.168 27.689 8.117 19 HA ASN -1 HA ASN -1 -1.965 25.973 10.133 20 HB2 ASN -1 HB2 ASN -1 -4.810 26.121 9.038 21 HB3 ASN -1 HB3 ASN -1 -4.308 25.223 10.465 22 HD21 ASN -1 HD21 ASN -1 -4.940 29.221 10.764 23 HD22 ASN -1 HD22 ASN -1 -5.076 28.393 9.212 24 H SER 0 H SER 0 -2.467 25.523 6.726 25 HA SER 0 HA SER 0 -2.838 22.642 6.762 26 HB2 SER 0 HB2 SER 0 -1.921 24.411 4.470 27 HB3 SER 0 HB3 SER 0 -2.618 22.790 4.357 28 HG SER 0 HG SER 0 -4.579 23.624 5.159 29 H MET 1 H MET 1 -0.106 24.513 7.376 30 HA MET 1 HA MET 1 2.113 24.205 7.447 31 HB2 MET 1 HB2 MET 1 1.361 21.318 7.985 32 HB3 MET 1 HB3 MET 1 2.897 22.098 8.386 33 HG2 MET 1 HG2 MET 1 0.159 22.804 9.502 34 HG3 MET 1 HG3 MET 1 1.430 21.921 10.333 35 HE1 MET 1 HE1 MET 1 1.086 25.358 12.254 36 HE2 MET 1 HE2 MET 1 -0.214 24.487 11.409 37 HE3 MET 1 HE3 MET 1 0.970 23.589 12.388 38 H ALA 2 H ALA 2 2.011 20.973 6.122 39 HA ALA 2 HA ALA 2 2.781 21.761 3.424 40 HB1 ALA 2 HB1 ALA 2 4.885 20.468 5.234 41 HB2 ALA 2 HB2 ALA 2 5.029 20.700 3.478 42 HB3 ALA 2 HB3 ALA 2 4.948 22.107 4.552 43 H THR 3 H THR 3 2.945 19.087 5.799 44 HA THR 3 HA THR 3 1.038 17.523 4.162 45 HB THR 3 HB THR 3 3.325 16.248 5.704 46 HG1 THR 3 HG1 THR 3 3.944 17.262 3.701 47 HG21 THR 3 HG21 THR 3 1.186 15.089 3.859 48 HG22 THR 3 HG22 THR 3 2.559 14.181 4.524 49 HG23 THR 3 HG23 THR 3 1.322 14.825 5.614 50 H GLU 4 H GLU 4 -0.723 17.340 5.368 51 HA GLU 4 HA GLU 4 -0.647 17.321 8.335 52 HB2 GLU 4 HB2 GLU 4 -0.629 19.663 7.460 53 HB3 GLU 4 HB3 GLU 4 -2.165 19.372 6.648 54 HG2 GLU 4 HG2 GLU 4 -1.730 19.040 9.644 55 HG3 GLU 4 HG3 GLU 4 -2.148 20.580 8.904 56 H LEU 5 H LEU 5 -1.868 15.693 8.916 57 HA LEU 5 HA LEU 5 -4.253 14.862 7.364 58 HB2 LEU 5 HB2 LEU 5 -1.633 13.472 7.640 59 HB3 LEU 5 HB3 LEU 5 -3.011 12.421 7.892 60 HG LEU 5 HG LEU 5 -2.852 14.258 5.490 61 HD11 LEU 5 HD11 LEU 5 -0.898 12.766 5.442 62 HD12 LEU 5 HD12 LEU 5 -1.943 11.354 5.718 63 HD13 LEU 5 HD13 LEU 5 -2.077 12.287 4.212 64 HD21 LEU 5 HD21 LEU 5 -4.525 12.787 4.563 65 HD22 LEU 5 HD22 LEU 5 -4.375 11.642 5.903 66 HD23 LEU 5 HD23 LEU 5 -5.097 13.234 6.174 67 H GLU 6 H GLU 6 -4.417 16.233 9.747 68 HA GLU 6 HA GLU 6 -5.159 14.330 11.855 69 HB2 GLU 6 HB2 GLU 6 -4.244 16.726 12.133 70 HB3 GLU 6 HB3 GLU 6 -5.890 17.267 11.791 71 HG2 GLU 6 HG2 GLU 6 -6.682 15.880 13.749 72 HG3 GLU 6 HG3 GLU 6 -5.023 15.361 14.021 73 H TYR 7 H TYR 7 -6.399 13.720 9.414 74 HA TYR 7 HA TYR 7 -9.253 13.606 9.983 75 HB2 TYR 7 HB2 TYR 7 -9.916 14.667 7.899 76 HB3 TYR 7 HB3 TYR 7 -9.104 15.816 8.946 77 HD1 TYR 7 HD1 TYR 7 -7.187 17.026 8.196 78 HD2 TYR 7 HD2 TYR 7 -8.568 13.598 5.964 79 HE1 TYR 7 HE1 TYR 7 -5.633 17.597 6.349 80 HE2 TYR 7 HE2 TYR 7 -7.030 14.178 4.117 81 HH TYR 7 HH TYR 7 -4.785 16.972 4.324 82 H GLU 8 H GLU 8 -10.277 11.976 8.865 83 HA GLU 8 HA GLU 8 -9.305 10.782 6.519 84 HB2 GLU 8 HB2 GLU 8 -8.855 8.541 7.486 85 HB3 GLU 8 HB3 GLU 8 -7.598 9.705 7.869 86 HG2 GLU 8 HG2 GLU 8 -8.682 9.948 10.169 87 HG3 GLU 8 HG3 GLU 8 -9.768 8.627 9.701 88 H SER 9 H SER 9 -10.989 9.888 5.628 89 HA SER 9 HA SER 9 -13.126 8.699 7.340 90 HB2 SER 9 HB2 SER 9 -12.930 9.191 4.357 91 HB3 SER 9 HB3 SER 9 -14.175 8.149 5.064 92 HG SER 9 HG SER 9 -15.120 9.850 6.023 93 H VAL 10 H VAL 10 -12.511 6.682 7.997 94 HA VAL 10 HA VAL 10 -10.557 5.066 6.583 95 HB VAL 10 HB VAL 10 -10.870 5.099 9.042 96 HG11 VAL 10 HG11 VAL 10 -13.272 3.293 8.540 97 HG12 VAL 10 HG12 VAL 10 -12.550 3.697 10.109 98 HG13 VAL 10 HG13 VAL 10 -13.348 4.957 9.156 99 HG21 VAL 10 HG21 VAL 10 -9.587 3.309 7.894 100 HG22 VAL 10 HG22 VAL 10 -10.336 2.797 9.412 101 HG23 VAL 10 HG23 VAL 10 -11.058 2.302 7.871 102 H LEU 11 H LEU 11 -10.641 3.161 5.561 103 HA LEU 11 HA LEU 11 -13.218 2.473 4.182 104 HB2 LEU 11 HB2 LEU 11 -10.448 2.824 2.956 105 HB3 LEU 11 HB3 LEU 11 -11.867 2.235 2.106 106 HG LEU 11 HG LEU 11 -11.567 5.038 3.269 107 HD11 LEU 11 HD11 LEU 11 -11.386 3.972 0.425 108 HD12 LEU 11 HD12 LEU 11 -11.477 5.687 0.858 109 HD13 LEU 11 HD13 LEU 11 -10.085 4.723 1.376 110 HD21 LEU 11 HD21 LEU 11 -13.731 3.864 1.466 111 HD22 LEU 11 HD22 LEU 11 -13.946 4.327 3.170 112 HD23 LEU 11 HD23 LEU 11 -13.585 5.564 1.969 113 H CYS 12 H CYS 12 -9.928 1.382 5.104 114 HA CYS 12 HA CYS 12 -10.985 -1.320 5.597 115 HB2 CYS 12 HB2 CYS 12 -10.245 -1.203 3.144 116 HB3 CYS 12 HB3 CYS 12 -8.592 -0.966 3.758 117 HG CYS 12 HG CYS 12 -9.075 -3.457 2.956 118 H VAL 13 H VAL 13 -10.057 -2.166 7.353 119 HA VAL 13 HA VAL 13 -7.274 -1.415 8.079 120 HB VAL 13 HB VAL 13 -9.604 -1.537 10.022 121 HG11 VAL 13 HG11 VAL 13 -6.626 -1.214 10.614 122 HG12 VAL 13 HG12 VAL 13 -7.944 -1.020 11.786 123 HG13 VAL 13 HG13 VAL 13 -7.639 -2.604 11.073 124 HG21 VAL 13 HG21 VAL 13 -8.947 0.784 10.553 125 HG22 VAL 13 HG22 VAL 13 -7.655 0.709 9.335 126 HG23 VAL 13 HG23 VAL 13 -9.357 0.632 8.839 127 H LYS 14 H LYS 14 -6.025 -3.131 8.324 128 HA LYS 14 HA LYS 14 -7.215 -5.777 8.940 129 HB2 LYS 14 HB2 LYS 14 -5.268 -5.285 6.654 130 HB3 LYS 14 HB3 LYS 14 -5.755 -6.865 7.258 131 HG2 LYS 14 HG2 LYS 14 -8.137 -6.316 6.728 132 HG3 LYS 14 HG3 LYS 14 -7.593 -4.794 5.992 133 HD2 LYS 14 HD2 LYS 14 -6.150 -6.085 4.427 134 HD3 LYS 14 HD3 LYS 14 -6.751 -7.597 5.123 135 HE2 LYS 14 HE2 LYS 14 -8.439 -5.466 3.741 136 HE3 LYS 14 HE3 LYS 14 -7.842 -6.928 2.961 137 HZ1 LYS 14 HZ1 LYS 14 -9.632 -6.963 5.324 138 HZ2 LYS 14 HZ2 LYS 14 -10.156 -7.085 3.785 139 HZ3 LYS 14 HZ3 LYS 14 -9.162 -8.261 4.423 140 HA PRO 15 HA PRO 15 -3.821 -5.985 11.755 141 HB2 PRO 15 HB2 PRO 15 -3.900 -8.593 12.518 142 HB3 PRO 15 HB3 PRO 15 -5.233 -7.453 12.880 143 HG2 PRO 15 HG2 PRO 15 -5.032 -9.373 10.521 144 HG3 PRO 15 HG3 PRO 15 -6.385 -9.216 11.698 145 HD2 PRO 15 HD2 PRO 15 -6.435 -7.967 9.308 146 HD3 PRO 15 HD3 PRO 15 -7.051 -7.156 10.781 147 H ASP 16 H ASP 16 -3.628 -7.625 8.728 148 HA ASP 16 HA ASP 16 -0.800 -8.496 9.190 149 HB2 ASP 16 HB2 ASP 16 -2.287 -10.375 8.851 150 HB3 ASP 16 HB3 ASP 16 -2.988 -9.629 7.414 151 H VAL 17 H VAL 17 0.510 -6.952 8.402 152 HA VAL 17 HA VAL 17 0.713 -6.941 5.545 153 HB VAL 17 HB VAL 17 -0.781 -5.009 5.729 154 HG11 VAL 17 HG11 VAL 17 1.398 -3.619 7.325 155 HG12 VAL 17 HG12 VAL 17 -0.127 -2.921 6.734 156 HG13 VAL 17 HG13 VAL 17 -0.157 -4.194 7.960 157 HG21 VAL 17 HG21 VAL 17 2.004 -4.118 4.916 158 HG22 VAL 17 HG22 VAL 17 0.897 -5.104 3.925 159 HG23 VAL 17 HG23 VAL 17 0.451 -3.454 4.386 160 H SER 18 H SER 18 2.757 -6.708 4.871 161 HA SER 18 HA SER 18 4.926 -6.150 6.876 162 HB2 SER 18 HB2 SER 18 4.934 -8.196 4.626 163 HB3 SER 18 HB3 SER 18 6.277 -7.844 5.731 164 HG SER 18 HG SER 18 4.989 -9.704 6.331 165 H VAL 19 H VAL 19 6.685 -4.932 6.133 166 HA VAL 19 HA VAL 19 6.469 -3.789 3.372 167 HB VAL 19 HB VAL 19 7.489 -2.498 5.905 168 HG11 VAL 19 HG11 VAL 19 7.682 -1.530 3.012 169 HG12 VAL 19 HG12 VAL 19 7.910 -0.487 4.441 170 HG13 VAL 19 HG13 VAL 19 9.024 -1.813 4.143 171 HG21 VAL 19 HG21 VAL 19 5.732 -0.923 5.626 172 HG22 VAL 19 HG22 VAL 19 5.392 -1.448 3.975 173 HG23 VAL 19 HG23 VAL 19 4.955 -2.484 5.349 174 H TYR 20 H TYR 20 7.989 -4.161 2.025 175 HA TYR 20 HA TYR 20 10.796 -4.556 2.899 176 HB2 TYR 20 HB2 TYR 20 10.542 -6.269 0.703 177 HB3 TYR 20 HB3 TYR 20 10.834 -6.697 2.372 178 HD1 TYR 20 HD1 TYR 20 8.008 -6.009 -0.009 179 HD2 TYR 20 HD2 TYR 20 9.340 -8.096 3.518 180 HE1 TYR 20 HE1 TYR 20 5.835 -7.225 0.093 181 HE2 TYR 20 HE2 TYR 20 7.165 -9.313 3.621 182 HH TYR 20 HH TYR 20 4.569 -8.751 1.246 183 H ARG 21 H ARG 21 11.923 -3.056 2.038 184 HA ARG 21 HA ARG 21 10.937 -1.363 -0.089 185 HB2 ARG 21 HB2 ARG 21 13.689 -1.411 1.206 186 HB3 ARG 21 HB3 ARG 21 13.031 -0.121 0.186 187 HG2 ARG 21 HG2 ARG 21 11.171 0.209 1.849 188 HG3 ARG 21 HG3 ARG 21 11.909 -1.028 2.878 189 HD2 ARG 21 HD2 ARG 21 14.028 0.393 2.863 190 HD3 ARG 21 HD3 ARG 21 13.056 1.681 2.143 191 HE ARG 21 HE ARG 21 12.671 0.419 4.856 192 HH11 ARG 21 HH11 ARG 21 11.707 1.358 6.356 193 HH12 ARG 21 HH12 ARG 21 10.998 2.969 6.196 194 HH21 ARG 21 HH21 ARG 21 11.893 3.201 2.849 195 HH22 ARG 21 HH22 ARG 21 11.091 3.988 4.183 196 H ILE 22 H ILE 22 11.412 -1.233 -2.143 197 HA ILE 22 HA ILE 22 12.276 -3.756 -3.311 198 HB ILE 22 HB ILE 22 11.137 -3.057 -5.316 199 HG12 ILE 22 HG12 ILE 22 10.654 -0.370 -3.954 200 HG13 ILE 22 HG13 ILE 22 11.705 -0.655 -5.349 201 HG21 ILE 22 HG21 ILE 22 9.396 -2.331 -2.931 202 HG22 ILE 22 HG22 ILE 22 8.919 -3.130 -4.442 203 HG23 ILE 22 HG23 ILE 22 9.926 -3.987 -3.272 204 HD11 ILE 22 HD11 ILE 22 8.691 -0.959 -5.263 205 HD12 ILE 22 HD12 ILE 22 9.632 0.241 -6.159 206 HD13 ILE 22 HD13 ILE 22 9.702 -1.472 -6.631 207 HA PRO 23 HA PRO 23 16.071 -2.312 -5.197 208 HB2 PRO 23 HB2 PRO 23 16.420 -4.099 -7.231 209 HB3 PRO 23 HB3 PRO 23 16.545 -4.570 -5.507 210 HG2 PRO 23 HG2 PRO 23 14.138 -4.840 -7.344 211 HG3 PRO 23 HG3 PRO 23 14.883 -6.093 -6.294 212 HD2 PRO 23 HD2 PRO 23 12.720 -4.630 -5.510 213 HD3 PRO 23 HD3 PRO 23 13.983 -5.129 -4.345 214 HA PRO 24 HA PRO 24 14.948 0.297 -8.683 215 HB2 PRO 24 HB2 PRO 24 17.269 0.492 -10.136 216 HB3 PRO 24 HB3 PRO 24 17.013 1.289 -8.554 217 HG2 PRO 24 HG2 PRO 24 18.416 -1.346 -9.100 218 HG3 PRO 24 HG3 PRO 24 18.978 0.020 -8.087 219 HD2 PRO 24 HD2 PRO 24 17.759 -2.149 -7.005 220 HD3 PRO 24 HD3 PRO 24 17.452 -0.509 -6.363 221 H ARG 25 H ARG 25 13.526 -0.505 -10.046 222 HA ARG 25 HA ARG 25 14.175 -2.304 -12.289 223 HB2 ARG 25 HB2 ARG 25 13.879 -3.868 -10.441 224 HB3 ARG 25 HB3 ARG 25 12.414 -3.065 -9.933 225 HG2 ARG 25 HG2 ARG 25 11.851 -5.136 -10.910 226 HG3 ARG 25 HG3 ARG 25 11.229 -3.867 -11.926 227 HD2 ARG 25 HD2 ARG 25 12.156 -5.655 -13.325 228 HD3 ARG 25 HD3 ARG 25 13.118 -4.205 -13.525 229 HE ARG 25 HE ARG 25 14.953 -5.327 -12.670 230 HH11 ARG 25 HH11 ARG 25 16.098 -6.802 -11.429 231 HH12 ARG 25 HH12 ARG 25 15.236 -8.068 -10.597 232 HH21 ARG 25 HH21 ARG 25 12.120 -7.191 -11.655 233 HH22 ARG 25 HH22 ARG 25 13.102 -8.177 -10.600 234 H ALA 26 H ALA 26 12.453 -2.499 -13.780 235 HA ALA 26 HA ALA 26 10.895 -0.240 -14.361 236 HB1 ALA 26 HB1 ALA 26 11.602 -1.932 -15.992 237 HB2 ALA 26 HB2 ALA 26 10.567 -3.144 -15.200 238 HB3 ALA 26 HB3 ALA 26 9.832 -1.736 -16.013 239 H SER 27 H SER 27 8.921 0.406 -13.939 240 HA SER 27 HA SER 27 7.599 -0.478 -11.551 241 HB2 SER 27 HB2 SER 27 6.169 1.537 -12.087 242 HB3 SER 27 HB3 SER 27 7.908 1.842 -11.970 243 HG SER 27 HG SER 27 6.982 2.845 -13.819 244 H ASN 28 H ASN 28 6.477 -0.127 -14.892 245 HA ASN 28 HA ASN 28 3.916 -1.325 -14.316 246 HB2 ASN 28 HB2 ASN 28 3.432 -0.813 -16.674 247 HB3 ASN 28 HB3 ASN 28 4.141 0.561 -15.838 248 HD21 ASN 28 HD21 ASN 28 6.984 0.689 -17.960 249 HD22 ASN 28 HD22 ASN 28 6.189 1.361 -16.547 250 H ARG 29 H ARG 29 6.852 -2.802 -15.112 251 HA ARG 29 HA ARG 29 5.504 -5.350 -15.899 252 HB2 ARG 29 HB2 ARG 29 6.849 -5.612 -17.874 253 HB3 ARG 29 HB3 ARG 29 5.942 -4.115 -17.944 254 HG2 ARG 29 HG2 ARG 29 7.956 -3.400 -18.766 255 HG3 ARG 29 HG3 ARG 29 8.157 -2.998 -17.071 256 HD2 ARG 29 HD2 ARG 29 10.187 -3.998 -17.726 257 HD3 ARG 29 HD3 ARG 29 9.376 -5.260 -16.818 258 HE ARG 29 HE ARG 29 9.762 -5.094 -19.773 259 HH11 ARG 29 HH11 ARG 29 9.872 -6.946 -20.936 260 HH12 ARG 29 HH12 ARG 29 9.428 -8.464 -20.214 261 HH21 ARG 29 HH21 ARG 29 8.595 -7.174 -17.151 262 HH22 ARG 29 HH22 ARG 29 8.777 -8.593 -18.142 263 H GLY 30 H GLY 30 7.901 -4.091 -13.855 264 HA2 GLY 30 HA2 GLY 30 9.678 -6.429 -14.353 265 HA3 GLY 30 HA3 GLY 30 10.128 -4.857 -13.706 266 H TYR 31 H TYR 31 7.732 -5.212 -11.659 267 HA TYR 31 HA TYR 31 9.378 -6.628 -9.682 268 HB2 TYR 31 HB2 TYR 31 6.587 -5.593 -9.217 269 HB3 TYR 31 HB3 TYR 31 7.886 -5.872 -8.072 270 HD1 TYR 31 HD1 TYR 31 10.145 -4.333 -9.418 271 HD2 TYR 31 HD2 TYR 31 5.963 -3.400 -8.855 272 HE1 TYR 31 HE1 TYR 31 10.655 -1.916 -9.552 273 HE2 TYR 31 HE2 TYR 31 6.485 -0.986 -8.968 274 HH TYR 31 HH TYR 31 9.838 0.214 -9.495 275 H ARG 32 H ARG 32 9.125 -8.748 -9.174 276 HA ARG 32 HA ARG 32 6.509 -10.119 -9.822 277 HB2 ARG 32 HB2 ARG 32 7.749 -12.242 -10.197 278 HB3 ARG 32 HB3 ARG 32 7.941 -11.029 -11.442 279 HG2 ARG 32 HG2 ARG 32 10.018 -11.136 -9.277 280 HG3 ARG 32 HG3 ARG 32 9.963 -12.475 -10.439 281 HD2 ARG 32 HD2 ARG 32 10.158 -10.974 -12.335 282 HD3 ARG 32 HD3 ARG 32 9.992 -9.567 -11.278 283 HE ARG 32 HE ARG 32 12.084 -9.956 -10.302 284 HH11 ARG 32 HH11 ARG 32 14.051 -10.553 -10.218 285 HH12 ARG 32 HH12 ARG 32 14.754 -11.717 -11.341 286 HH21 ARG 32 HH21 ARG 32 11.734 -12.215 -12.978 287 HH22 ARG 32 HH22 ARG 32 13.416 -12.665 -12.896 288 H ALA 33 H ALA 33 7.185 -8.870 -7.431 289 HA ALA 33 HA ALA 33 7.277 -9.028 -5.189 290 HB1 ALA 33 HB1 ALA 33 5.889 -10.712 -4.222 291 HB2 ALA 33 HB2 ALA 33 5.217 -10.308 -5.833 292 HB3 ALA 33 HB3 ALA 33 6.130 -11.799 -5.613 293 H SER 34 H SER 34 8.637 -12.039 -6.595 294 HA SER 34 HA SER 34 10.225 -12.799 -4.384 295 HB2 SER 34 HB2 SER 34 11.300 -14.316 -5.976 296 HB3 SER 34 HB3 SER 34 9.534 -14.315 -6.156 297 HG SER 34 HG SER 34 10.635 -14.199 -8.177 298 H ASP 35 H ASP 35 10.825 -10.292 -6.721 299 HA ASP 35 HA ASP 35 13.675 -10.000 -6.402 300 HB2 ASP 35 HB2 ASP 35 11.541 -7.848 -6.698 301 HB3 ASP 35 HB3 ASP 35 13.271 -7.636 -6.980 302 H TRP 36 H TRP 36 11.024 -9.352 -4.169 303 HA TRP 36 HA TRP 36 12.524 -7.351 -2.641 304 HB2 TRP 36 HB2 TRP 36 9.734 -8.366 -2.116 305 HB3 TRP 36 HB3 TRP 36 10.443 -6.848 -1.613 306 HD1 TRP 36 HD1 TRP 36 11.398 -6.491 -4.944 307 HE1 TRP 36 HE1 TRP 36 9.560 -5.605 -6.545 308 HE3 TRP 36 HE3 TRP 36 7.282 -7.182 -1.978 309 HZ2 TRP 36 HZ2 TRP 36 6.824 -4.986 -6.425 310 HZ3 TRP 36 HZ3 TRP 36 5.071 -6.288 -2.703 311 HH2 TRP 36 HH2 TRP 36 4.837 -5.175 -4.904 312 H LYS 37 H LYS 37 12.461 -7.446 -0.310 313 HA LYS 37 HA LYS 37 13.468 -9.964 0.739 314 HB2 LYS 37 HB2 LYS 37 13.222 -7.153 1.874 315 HB3 LYS 37 HB3 LYS 37 13.729 -8.531 2.860 316 HG2 LYS 37 HG2 LYS 37 15.457 -9.090 1.143 317 HG3 LYS 37 HG3 LYS 37 15.108 -7.554 0.334 318 HD2 LYS 37 HD2 LYS 37 16.022 -6.283 2.121 319 HD3 LYS 37 HD3 LYS 37 15.743 -7.573 3.298 320 HE2 LYS 37 HE2 LYS 37 18.058 -7.641 2.967 321 HE3 LYS 37 HE3 LYS 37 17.384 -9.010 2.065 322 HZ1 LYS 37 HZ1 LYS 37 18.208 -6.405 0.869 323 HZ2 LYS 37 HZ2 LYS 37 19.057 -7.791 0.762 324 HZ3 LYS 37 HZ3 LYS 37 17.608 -7.670 0.024 325 H LEU 38 H LEU 38 11.169 -10.783 0.098 326 HA LEU 38 HA LEU 38 8.999 -10.569 1.902 327 HB2 LEU 38 HB2 LEU 38 9.799 -13.031 0.307 328 HB3 LEU 38 HB3 LEU 38 8.195 -12.636 0.917 329 HG LEU 38 HG LEU 38 9.717 -11.220 -1.296 330 HD11 LEU 38 HD11 LEU 38 8.699 -13.374 -1.917 331 HD12 LEU 38 HD12 LEU 38 7.133 -12.841 -1.265 332 HD13 LEU 38 HD13 LEU 38 7.823 -12.040 -2.684 333 HD21 LEU 38 HD21 LEU 38 7.610 -9.894 -1.627 334 HD22 LEU 38 HD22 LEU 38 7.025 -10.524 -0.070 335 HD23 LEU 38 HD23 LEU 38 8.470 -9.498 -0.135 336 H ASP 39 H ASP 39 11.986 -12.397 2.326 337 HA ASP 39 HA ASP 39 10.810 -13.975 4.551 338 HB2 ASP 39 HB2 ASP 39 12.196 -15.019 2.726 339 HB3 ASP 39 HB3 ASP 39 13.589 -14.143 3.354 340 H GLN 40 H GLN 40 12.252 -10.972 4.223 341 HA GLN 40 HA GLN 40 12.632 -10.748 7.104 342 HB2 GLN 40 HB2 GLN 40 14.896 -9.713 6.938 343 HB3 GLN 40 HB3 GLN 40 14.823 -11.452 6.809 344 HG2 GLN 40 HG2 GLN 40 15.047 -9.672 4.351 345 HG3 GLN 40 HG3 GLN 40 16.445 -10.180 5.275 346 HE21 GLN 40 HE21 GLN 40 15.358 -12.638 2.432 347 HE22 GLN 40 HE22 GLN 40 15.047 -10.910 2.457 348 HA PRO 41 HA PRO 41 10.632 -7.067 5.125 349 HB2 PRO 41 HB2 PRO 41 9.320 -7.165 7.839 350 HB3 PRO 41 HB3 PRO 41 8.584 -6.760 6.267 351 HG2 PRO 41 HG2 PRO 41 8.191 -9.208 7.354 352 HG3 PRO 41 HG3 PRO 41 8.545 -9.062 5.604 353 HD2 PRO 41 HD2 PRO 41 10.441 -9.789 7.847 354 HD3 PRO 41 HD3 PRO 41 10.248 -10.542 6.234 355 H ASP 42 H ASP 42 10.983 -4.899 5.553 356 HA ASP 42 HA ASP 42 13.097 -4.110 7.444 357 HB2 ASP 42 HB2 ASP 42 12.845 -3.104 5.177 358 HB3 ASP 42 HB3 ASP 42 11.259 -2.483 5.637 359 H TRP 43 H TRP 43 9.593 -4.157 7.283 360 HA TRP 43 HA TRP 43 9.303 -3.613 10.143 361 HB2 TRP 43 HB2 TRP 43 9.344 -1.341 9.287 362 HB3 TRP 43 HB3 TRP 43 8.231 -1.748 7.995 363 HD1 TRP 43 HD1 TRP 43 8.322 -0.806 11.660 364 HE1 TRP 43 HE1 TRP 43 5.951 -0.193 12.435 365 HE3 TRP 43 HE3 TRP 43 5.692 -2.480 7.605 366 HZ2 TRP 43 HZ2 TRP 43 3.286 -0.203 11.310 367 HZ3 TRP 43 HZ3 TRP 43 3.233 -2.052 7.445 368 HH2 TRP 43 HH2 TRP 43 2.018 -1.016 9.334 369 H THR 44 H THR 44 7.208 -4.229 10.926 370 HA THR 44 HA THR 44 5.220 -5.267 9.007 371 HB THR 44 HB THR 44 4.699 -7.202 10.467 372 HG1 THR 44 HG1 THR 44 7.276 -6.723 11.548 373 HG21 THR 44 HG21 THR 44 6.383 -8.702 9.640 374 HG22 THR 44 HG22 THR 44 6.008 -7.498 8.400 375 HG23 THR 44 HG23 THR 44 7.511 -7.356 9.339 376 H GLY 45 H GLY 45 3.086 -5.163 9.713 377 HA2 GLY 45 HA2 GLY 45 2.254 -4.462 12.355 378 HA3 GLY 45 HA3 GLY 45 2.482 -2.984 11.425 379 H ARG 46 H ARG 46 0.462 -2.325 11.183 380 HA ARG 46 HA ARG 46 -1.637 -4.143 10.055 381 HB2 ARG 46 HB2 ARG 46 -1.975 -1.802 11.954 382 HB3 ARG 46 HB3 ARG 46 -3.254 -2.858 11.346 383 HG2 ARG 46 HG2 ARG 46 -2.085 -4.795 12.495 384 HG3 ARG 46 HG3 ARG 46 -0.966 -3.636 13.218 385 HD2 ARG 46 HD2 ARG 46 -4.002 -3.557 13.577 386 HD3 ARG 46 HD3 ARG 46 -2.879 -4.310 14.700 387 HE ARG 46 HE ARG 46 -1.995 -2.203 15.331 388 HH11 ARG 46 HH11 ARG 46 -2.003 -0.118 15.604 389 HH12 ARG 46 HH12 ARG 46 -3.226 0.913 14.864 390 HH21 ARG 46 HH21 ARG 46 -4.624 -1.655 13.056 391 HH22 ARG 46 HH22 ARG 46 -4.515 0.076 13.275 392 H LEU 47 H LEU 47 -3.099 -3.337 8.654 393 HA LEU 47 HA LEU 47 -2.212 -1.148 6.872 394 HB2 LEU 47 HB2 LEU 47 -2.910 -3.364 5.966 395 HB3 LEU 47 HB3 LEU 47 -4.466 -3.193 6.776 396 HG LEU 47 HG LEU 47 -4.947 -1.175 5.320 397 HD11 LEU 47 HD11 LEU 47 -2.481 -2.167 3.820 398 HD12 LEU 47 HD12 LEU 47 -3.633 -0.945 3.240 399 HD13 LEU 47 HD13 LEU 47 -2.628 -0.604 4.653 400 HD21 LEU 47 HD21 LEU 47 -5.887 -3.373 4.852 401 HD22 LEU 47 HD22 LEU 47 -5.499 -2.532 3.350 402 HD23 LEU 47 HD23 LEU 47 -4.428 -3.820 3.940 403 H ARG 48 H ARG 48 -3.281 0.810 6.672 404 HA ARG 48 HA ARG 48 -6.116 0.996 7.515 405 HB2 ARG 48 HB2 ARG 48 -4.931 1.831 9.464 406 HB3 ARG 48 HB3 ARG 48 -3.959 2.923 8.475 407 HG2 ARG 48 HG2 ARG 48 -5.977 4.199 7.842 408 HG3 ARG 48 HG3 ARG 48 -7.004 3.079 8.746 409 HD2 ARG 48 HD2 ARG 48 -4.808 4.830 9.935 410 HD3 ARG 48 HD3 ARG 48 -6.518 5.247 9.886 411 HE ARG 48 HE ARG 48 -5.393 2.875 11.355 412 HH11 ARG 48 HH11 ARG 48 -6.134 2.322 13.152 413 HH12 ARG 48 HH12 ARG 48 -7.561 3.054 13.886 414 HH21 ARG 48 HH21 ARG 48 -7.848 5.452 11.384 415 HH22 ARG 48 HH22 ARG 48 -8.517 4.801 12.859 416 H ILE 49 H ILE 49 -6.821 1.045 5.495 417 HA ILE 49 HA ILE 49 -5.882 3.148 3.622 418 HB ILE 49 HB ILE 49 -8.173 1.209 3.219 419 HG12 ILE 49 HG12 ILE 49 -5.254 1.003 2.325 420 HG13 ILE 49 HG13 ILE 49 -6.070 -0.041 3.493 421 HG21 ILE 49 HG21 ILE 49 -7.955 1.917 0.859 422 HG22 ILE 49 HG22 ILE 49 -8.251 3.311 1.881 423 HG23 ILE 49 HG23 ILE 49 -6.602 2.991 1.294 424 HD11 ILE 49 HD11 ILE 49 -6.598 0.095 0.521 425 HD12 ILE 49 HD12 ILE 49 -6.013 -1.260 1.493 426 HD13 ILE 49 HD13 ILE 49 -7.675 -0.720 1.689 427 H THR 50 H THR 50 -6.771 5.024 3.495 428 HA THR 50 HA THR 50 -9.412 5.684 4.674 429 HB THR 50 HB THR 50 -8.210 7.763 5.643 430 HG1 THR 50 HG1 THR 50 -6.029 6.118 5.086 431 HG21 THR 50 HG21 THR 50 -7.931 5.010 6.849 432 HG22 THR 50 HG22 THR 50 -7.344 6.467 7.670 433 HG23 THR 50 HG23 THR 50 -9.053 6.327 7.256 434 H SER 51 H SER 51 -10.006 8.023 4.074 435 HA SER 51 HA SER 51 -8.639 9.215 1.749 436 HB2 SER 51 HB2 SER 51 -10.128 7.505 0.746 437 HB3 SER 51 HB3 SER 51 -11.511 8.228 1.588 438 HG SER 51 HG SER 51 -11.269 8.913 -0.595 439 H LYS 52 H LYS 52 -9.210 11.292 1.283 440 HA LYS 52 HA LYS 52 -11.547 12.471 2.439 441 HB2 LYS 52 HB2 LYS 52 -9.747 12.672 4.294 442 HB3 LYS 52 HB3 LYS 52 -8.995 13.857 3.238 443 HG2 LYS 52 HG2 LYS 52 -10.323 14.975 4.897 444 HG3 LYS 52 HG3 LYS 52 -11.033 15.241 3.305 445 HD2 LYS 52 HD2 LYS 52 -12.788 14.907 4.926 446 HD3 LYS 52 HD3 LYS 52 -12.785 13.505 3.857 447 HE2 LYS 52 HE2 LYS 52 -11.459 12.241 5.567 448 HE3 LYS 52 HE3 LYS 52 -11.492 13.668 6.618 449 HZ1 LYS 52 HZ1 LYS 52 -13.987 13.457 6.544 450 HZ2 LYS 52 HZ2 LYS 52 -13.807 12.003 5.791 451 HZ3 LYS 52 HZ3 LYS 52 -13.248 12.209 7.296 452 H GLY 53 H GLY 53 -12.367 13.600 0.865 453 HA2 GLY 53 HA2 GLY 53 -12.654 15.289 -0.692 454 HA3 GLY 53 HA3 GLY 53 -11.060 15.893 -0.241 455 H LYS 54 H LYS 54 -12.043 12.840 -1.806 456 HA LYS 54 HA LYS 54 -11.481 11.773 -3.716 457 HB2 LYS 54 HB2 LYS 54 -11.068 14.515 -4.943 458 HB3 LYS 54 HB3 LYS 54 -11.183 12.991 -5.821 459 HG2 LYS 54 HG2 LYS 54 -13.465 12.628 -4.997 460 HG3 LYS 54 HG3 LYS 54 -13.420 14.160 -4.113 461 HD2 LYS 54 HD2 LYS 54 -13.129 13.873 -7.133 462 HD3 LYS 54 HD3 LYS 54 -14.627 14.288 -6.286 463 HE2 LYS 54 HE2 LYS 54 -13.528 16.315 -5.340 464 HE3 LYS 54 HE3 LYS 54 -12.051 15.925 -6.230 465 HZ1 LYS 54 HZ1 LYS 54 -14.681 16.518 -7.480 466 HZ2 LYS 54 HZ2 LYS 54 -13.406 17.534 -7.434 467 HZ3 LYS 54 HZ3 LYS 54 -13.313 16.157 -8.302 468 H THR 55 H THR 55 -9.499 12.336 -1.706 469 HA THR 55 HA THR 55 -7.196 11.287 -3.256 470 HB THR 55 HB THR 55 -6.939 13.233 -0.938 471 HG1 THR 55 HG1 THR 55 -6.122 14.633 -2.482 472 HG21 THR 55 HG21 THR 55 -4.847 11.957 -2.751 473 HG22 THR 55 HG22 THR 55 -4.533 13.186 -1.501 474 HG23 THR 55 HG23 THR 55 -5.106 11.585 -1.031 475 H ALA 56 H ALA 56 -6.747 9.313 -2.523 476 HA ALA 56 HA ALA 56 -7.778 8.397 0.102 477 HB1 ALA 56 HB1 ALA 56 -6.596 6.829 -2.200 478 HB2 ALA 56 HB2 ALA 56 -7.263 6.155 -0.701 479 HB3 ALA 56 HB3 ALA 56 -8.324 7.022 -1.829 480 H TYR 57 H TYR 57 -6.352 7.191 1.515 481 HA TYR 57 HA TYR 57 -3.445 7.755 1.300 482 HB2 TYR 57 HB2 TYR 57 -5.029 8.210 3.841 483 HB3 TYR 57 HB3 TYR 57 -3.321 8.497 3.588 484 HD1 TYR 57 HD1 TYR 57 -6.681 9.868 3.386 485 HD2 TYR 57 HD2 TYR 57 -2.611 10.390 2.052 486 HE1 TYR 57 HE1 TYR 57 -7.232 12.161 2.612 487 HE2 TYR 57 HE2 TYR 57 -3.170 12.707 1.288 488 HH TYR 57 HH TYR 57 -6.474 14.054 1.553 489 H ILE 58 H ILE 58 -2.550 5.753 1.254 490 HA ILE 58 HA ILE 58 -3.625 3.578 3.020 491 HB ILE 58 HB ILE 58 -1.292 3.504 1.073 492 HG12 ILE 58 HG12 ILE 58 -2.807 1.735 -0.057 493 HG13 ILE 58 HG13 ILE 58 -4.146 2.487 0.808 494 HG21 ILE 58 HG21 ILE 58 -2.614 1.276 2.688 495 HG22 ILE 58 HG22 ILE 58 -1.280 1.086 1.524 496 HG23 ILE 58 HG23 ILE 58 -1.009 1.964 3.016 497 HD11 ILE 58 HD11 ILE 58 -3.763 3.225 -1.581 498 HD12 ILE 58 HD12 ILE 58 -3.804 4.565 -0.428 499 HD13 ILE 58 HD13 ILE 58 -2.245 3.971 -1.065 500 H LYS 59 H LYS 59 -3.346 4.418 5.016 501 HA LYS 59 HA LYS 59 -0.631 5.198 5.906 502 HB2 LYS 59 HB2 LYS 59 -3.124 4.932 7.607 503 HB3 LYS 59 HB3 LYS 59 -1.637 5.809 7.966 504 HG2 LYS 59 HG2 LYS 59 -2.240 7.343 5.967 505 HG3 LYS 59 HG3 LYS 59 -3.802 6.531 5.944 506 HD2 LYS 59 HD2 LYS 59 -4.094 7.198 8.371 507 HD3 LYS 59 HD3 LYS 59 -2.598 8.158 8.217 508 HE2 LYS 59 HE2 LYS 59 -3.642 9.521 6.450 509 HE3 LYS 59 HE3 LYS 59 -5.100 8.521 6.515 510 HZ1 LYS 59 HZ1 LYS 59 -5.416 9.221 8.826 511 HZ2 LYS 59 HZ2 LYS 59 -4.106 10.199 8.763 512 HZ3 LYS 59 HZ3 LYS 59 -5.419 10.527 7.840 513 H LEU 60 H LEU 60 0.616 4.024 7.250 514 HA LEU 60 HA LEU 60 -0.155 1.193 7.885 515 HB2 LEU 60 HB2 LEU 60 2.519 2.564 7.421 516 HB3 LEU 60 HB3 LEU 60 2.389 1.061 8.283 517 HG LEU 60 HG LEU 60 3.040 0.407 6.233 518 HD11 LEU 60 HD11 LEU 60 1.322 -0.952 5.274 519 HD12 LEU 60 HD12 LEU 60 1.068 -0.889 7.027 520 HD13 LEU 60 HD13 LEU 60 0.036 0.073 5.942 521 HD21 LEU 60 HD21 LEU 60 2.649 2.526 5.001 522 HD22 LEU 60 HD22 LEU 60 2.123 1.112 4.074 523 HD23 LEU 60 HD23 LEU 60 0.921 2.136 4.882 524 H GLU 61 H GLU 61 -0.128 0.446 9.925 525 HA GLU 61 HA GLU 61 0.512 2.389 12.127 526 HB2 GLU 61 HB2 GLU 61 -1.780 0.420 11.930 527 HB3 GLU 61 HB3 GLU 61 -1.248 1.217 13.408 528 HG2 GLU 61 HG2 GLU 61 -1.761 3.435 12.343 529 HG3 GLU 61 HG3 GLU 61 -2.506 2.547 10.994 530 H ASP 62 H ASP 62 1.500 1.591 14.005 531 HA ASP 62 HA ASP 62 2.771 -0.994 13.968 532 HB2 ASP 62 HB2 ASP 62 3.606 1.033 15.143 533 HB3 ASP 62 HB3 ASP 62 2.267 0.833 16.299 534 H LYS 63 H LYS 63 2.325 -2.817 15.066 535 HA LYS 63 HA LYS 63 -0.472 -3.394 15.608 536 HB2 LYS 63 HB2 LYS 63 0.474 -5.803 15.836 537 HB3 LYS 63 HB3 LYS 63 0.566 -5.030 14.257 538 HG2 LYS 63 HG2 LYS 63 2.878 -4.484 14.524 539 HG3 LYS 63 HG3 LYS 63 2.890 -4.994 16.223 540 HD2 LYS 63 HD2 LYS 63 2.716 -7.292 15.639 541 HD3 LYS 63 HD3 LYS 63 2.227 -6.915 13.964 542 HE2 LYS 63 HE2 LYS 63 4.428 -5.848 13.559 543 HE3 LYS 63 HE3 LYS 63 4.950 -6.266 15.190 544 HZ1 LYS 63 HZ1 LYS 63 5.635 -7.821 13.343 545 HZ2 LYS 63 HZ2 LYS 63 4.913 -8.571 14.620 546 HZ3 LYS 63 HZ3 LYS 63 4.094 -8.319 13.223 547 H VAL 64 H VAL 64 1.890 -2.325 17.662 548 HA VAL 64 HA VAL 64 0.446 -3.501 20.003 549 HB VAL 64 HB VAL 64 3.371 -2.722 19.718 550 HG11 VAL 64 HG11 VAL 64 3.656 -3.715 21.992 551 HG12 VAL 64 HG12 VAL 64 2.645 -2.272 22.025 552 HG13 VAL 64 HG13 VAL 64 1.892 -3.882 22.125 553 HG21 VAL 64 HG21 VAL 64 3.807 -5.142 20.122 554 HG22 VAL 64 HG22 VAL 64 2.057 -5.451 20.068 555 HG23 VAL 64 HG23 VAL 64 2.918 -4.865 18.627 556 H SER 65 H SER 65 2.049 -0.576 18.724 557 HA SER 65 HA SER 65 0.829 1.006 20.962 558 HB2 SER 65 HB2 SER 65 3.337 1.410 19.318 559 HB3 SER 65 HB3 SER 65 2.688 2.622 20.440 560 HG SER 65 HG SER 65 4.268 1.256 21.424 561 H GLY 66 H GLY 66 0.492 0.569 17.589 562 HA2 GLY 66 HA2 GLY 66 -0.983 1.599 16.127 563 HA3 GLY 66 HA3 GLY 66 -1.548 2.633 17.443 564 H GLU 67 H GLU 67 1.843 2.620 16.718 565 HA GLU 67 HA GLU 67 2.010 5.406 16.163 566 HB2 GLU 67 HB2 GLU 67 4.034 3.221 15.557 567 HB3 GLU 67 HB3 GLU 67 4.359 4.957 15.732 568 HG2 GLU 67 HG2 GLU 67 3.444 4.673 18.144 569 HG3 GLU 67 HG3 GLU 67 3.549 2.932 17.825 570 H LEU 68 H LEU 68 2.155 6.530 14.222 571 HA LEU 68 HA LEU 68 1.432 5.229 11.716 572 HB2 LEU 68 HB2 LEU 68 0.700 7.505 12.230 573 HB3 LEU 68 HB3 LEU 68 2.372 8.045 12.376 574 HG LEU 68 HG LEU 68 2.739 7.590 9.954 575 HD11 LEU 68 HD11 LEU 68 0.754 7.227 8.494 576 HD12 LEU 68 HD12 LEU 68 1.095 5.836 9.516 577 HD13 LEU 68 HD13 LEU 68 -0.240 6.931 9.939 578 HD21 LEU 68 HD21 LEU 68 1.387 9.456 9.113 579 HD22 LEU 68 HD22 LEU 68 0.320 9.349 10.532 580 HD23 LEU 68 HD23 LEU 68 2.023 9.824 10.724 581 H PHE 69 H PHE 69 2.841 3.947 10.677 582 HA PHE 69 HA PHE 69 5.759 4.270 10.913 583 HB2 PHE 69 HB2 PHE 69 4.960 2.045 10.816 584 HB3 PHE 69 HB3 PHE 69 3.949 2.366 9.421 585 HD1 PHE 69 HD1 PHE 69 4.747 1.871 7.225 586 HD2 PHE 69 HD2 PHE 69 7.560 2.316 10.468 587 HE1 PHE 69 HE1 PHE 69 6.595 1.223 5.716 588 HE2 PHE 69 HE2 PHE 69 9.401 1.605 8.960 589 HZ PHE 69 HZ PHE 69 8.919 1.051 6.581 590 H ALA 70 H ALA 70 3.460 4.402 8.181 591 HA ALA 70 HA ALA 70 4.775 6.680 6.928 592 HB1 ALA 70 HB1 ALA 70 6.198 4.762 6.176 593 HB2 ALA 70 HB2 ALA 70 4.746 3.930 5.576 594 HB3 ALA 70 HB3 ALA 70 5.274 5.454 4.838 595 H GLN 71 H GLN 71 3.491 7.341 4.935 596 HA GLN 71 HA GLN 71 0.999 5.910 4.506 597 HB2 GLN 71 HB2 GLN 71 -0.478 7.851 4.719 598 HB3 GLN 71 HB3 GLN 71 0.244 7.355 6.237 599 HG2 GLN 71 HG2 GLN 71 0.307 9.683 6.335 600 HG3 GLN 71 HG3 GLN 71 1.957 9.238 5.938 601 HE21 GLN 71 HE21 GLN 71 1.675 11.759 3.444 602 HE22 GLN 71 HE22 GLN 71 2.516 11.191 4.886 603 H ALA 72 H ALA 72 0.150 6.065 2.502 604 HA ALA 72 HA ALA 72 1.687 7.637 0.469 605 HB1 ALA 72 HB1 ALA 72 1.068 5.778 -1.060 606 HB2 ALA 72 HB2 ALA 72 2.104 5.280 0.286 607 HB3 ALA 72 HB3 ALA 72 0.370 4.908 0.320 608 HA PRO 73 HA PRO 73 -2.400 9.555 -0.207 609 HB2 PRO 73 HB2 PRO 73 -0.666 11.457 -1.750 610 HB3 PRO 73 HB3 PRO 73 -1.964 11.814 -0.576 611 HG2 PRO 73 HG2 PRO 73 0.658 12.104 0.094 612 HG3 PRO 73 HG3 PRO 73 -0.511 11.410 1.262 613 HD2 PRO 73 HD2 PRO 73 1.400 9.924 -0.580 614 HD3 PRO 73 HD3 PRO 73 1.123 9.695 1.170 615 H VAL 74 H VAL 74 -3.702 9.326 -2.002 616 HA VAL 74 HA VAL 74 -2.515 8.704 -4.677 617 HB VAL 74 HB VAL 74 -4.885 7.173 -3.558 618 HG11 VAL 74 HG11 VAL 74 -4.275 5.551 -5.301 619 HG12 VAL 74 HG12 VAL 74 -4.556 7.152 -5.988 620 HG13 VAL 74 HG13 VAL 74 -2.892 6.560 -5.778 621 HG21 VAL 74 HG21 VAL 74 -3.119 6.601 -2.005 622 HG22 VAL 74 HG22 VAL 74 -3.442 5.261 -3.094 623 HG23 VAL 74 HG23 VAL 74 -1.997 6.270 -3.343 624 H GLU 75 H GLU 75 -3.346 10.164 -6.120 625 HA GLU 75 HA GLU 75 -5.776 11.679 -5.452 626 HB2 GLU 75 HB2 GLU 75 -3.940 11.741 -7.878 627 HB3 GLU 75 HB3 GLU 75 -5.294 12.845 -7.602 628 HG2 GLU 75 HG2 GLU 75 -4.242 13.596 -5.469 629 HG3 GLU 75 HG3 GLU 75 -2.852 12.560 -5.798 630 H GLN 76 H GLN 76 -5.047 8.961 -7.508 631 HA GLN 76 HA GLN 76 -7.820 8.271 -7.680 632 HB2 GLN 76 HB2 GLN 76 -8.165 8.179 -10.011 633 HB3 GLN 76 HB3 GLN 76 -7.680 9.821 -9.647 634 HG2 GLN 76 HG2 GLN 76 -5.956 7.668 -10.950 635 HG3 GLN 76 HG3 GLN 76 -6.729 9.017 -11.752 636 HE21 GLN 76 HE21 GLN 76 -3.168 9.614 -9.840 637 HE22 GLN 76 HE22 GLN 76 -4.078 8.111 -9.584 638 H TYR 77 H TYR 77 -8.082 6.046 -8.042 639 HA TYR 77 HA TYR 77 -5.601 4.451 -8.439 640 HB2 TYR 77 HB2 TYR 77 -6.364 4.309 -6.144 641 HB3 TYR 77 HB3 TYR 77 -7.969 3.818 -6.683 642 HD1 TYR 77 HD1 TYR 77 -4.360 2.821 -6.994 643 HD2 TYR 77 HD2 TYR 77 -8.466 1.536 -6.896 644 HE1 TYR 77 HE1 TYR 77 -3.624 0.450 -7.179 645 HE2 TYR 77 HE2 TYR 77 -7.726 -0.844 -6.990 646 HH TYR 77 HH TYR 77 -4.267 -1.745 -7.235 647 HA PRO 78 HA PRO 78 -4.829 2.590 -9.514 648 HB2 PRO 78 HB2 PRO 78 -4.035 2.089 -12.072 649 HB3 PRO 78 HB3 PRO 78 -4.963 0.924 -11.079 650 HG2 PRO 78 HG2 PRO 78 -6.043 2.887 -13.133 651 HG3 PRO 78 HG3 PRO 78 -6.378 1.129 -13.001 652 HD2 PRO 78 HD2 PRO 78 -8.075 2.969 -11.954 653 HD3 PRO 78 HD3 PRO 78 -7.743 1.440 -11.090 654 H GLY 79 H GLY 79 -2.945 3.720 -9.675 655 HA2 GLY 79 HA2 GLY 79 -2.542 6.050 -11.413 656 HA3 GLY 79 HA3 GLY 79 -2.804 6.426 -9.708 657 H ILE 80 H ILE 80 -0.620 7.339 -9.751 658 HA ILE 80 HA ILE 80 1.661 5.600 -10.247 659 HB ILE 80 HB ILE 80 1.796 7.952 -10.760 660 HG12 ILE 80 HG12 ILE 80 3.694 7.237 -8.481 661 HG13 ILE 80 HG13 ILE 80 3.838 6.669 -10.147 662 HG21 ILE 80 HG21 ILE 80 1.676 8.606 -7.779 663 HG22 ILE 80 HG22 ILE 80 1.814 9.740 -9.133 664 HG23 ILE 80 HG23 ILE 80 0.322 8.848 -8.906 665 HD11 ILE 80 HD11 ILE 80 4.096 9.543 -9.176 666 HD12 ILE 80 HD12 ILE 80 5.387 8.481 -9.748 667 HD13 ILE 80 HD13 ILE 80 4.140 9.040 -10.887 668 H ALA 81 H ALA 81 0.017 6.673 -7.278 669 HA ALA 81 HA ALA 81 2.242 5.822 -5.584 670 HB1 ALA 81 HB1 ALA 81 1.028 7.918 -5.200 671 HB2 ALA 81 HB2 ALA 81 -0.478 7.011 -4.944 672 HB3 ALA 81 HB3 ALA 81 0.876 6.834 -3.808 673 H VAL 82 H VAL 82 0.298 3.847 -7.044 674 HA VAL 82 HA VAL 82 0.447 1.771 -5.023 675 HB VAL 82 HB VAL 82 -2.266 2.405 -6.192 676 HG11 VAL 82 HG11 VAL 82 -1.396 0.378 -4.065 677 HG12 VAL 82 HG12 VAL 82 -3.063 0.633 -4.611 678 HG13 VAL 82 HG13 VAL 82 -1.859 -0.026 -5.724 679 HG21 VAL 82 HG21 VAL 82 -1.915 4.074 -4.501 680 HG22 VAL 82 HG22 VAL 82 -3.096 2.893 -3.943 681 HG23 VAL 82 HG23 VAL 82 -1.436 2.841 -3.314 682 H GLU 83 H GLU 83 1.129 0.028 -6.112 683 HA GLU 83 HA GLU 83 0.298 -0.472 -8.927 684 HB2 GLU 83 HB2 GLU 83 2.756 0.778 -8.176 685 HB3 GLU 83 HB3 GLU 83 3.173 -0.889 -8.593 686 HG2 GLU 83 HG2 GLU 83 2.032 -0.657 -10.755 687 HG3 GLU 83 HG3 GLU 83 1.491 0.977 -10.319 688 H THR 84 H THR 84 0.717 -2.614 -9.709 689 HA THR 84 HA THR 84 0.839 -4.708 -7.573 690 HB THR 84 HB THR 84 -0.119 -6.133 -9.463 691 HG1 THR 84 HG1 THR 84 -1.173 -4.989 -11.086 692 HG21 THR 84 HG21 THR 84 -1.742 -3.799 -8.359 693 HG22 THR 84 HG22 THR 84 -2.421 -5.262 -9.115 694 HG23 THR 84 HG23 THR 84 -1.490 -5.396 -7.618 695 H VAL 85 H VAL 85 1.983 -6.600 -7.878 696 HA VAL 85 HA VAL 85 4.451 -6.570 -9.477 697 HB VAL 85 HB VAL 85 4.815 -8.776 -8.529 698 HG11 VAL 85 HG11 VAL 85 5.411 -6.736 -7.269 699 HG12 VAL 85 HG12 VAL 85 3.856 -6.813 -6.411 700 HG13 VAL 85 HG13 VAL 85 5.047 -8.098 -6.199 701 HG21 VAL 85 HG21 VAL 85 2.443 -9.574 -8.459 702 HG22 VAL 85 HG22 VAL 85 3.302 -9.786 -6.935 703 HG23 VAL 85 HG23 VAL 85 2.135 -8.465 -7.114 704 H THR 86 H THR 86 4.841 -8.691 -10.786 705 HA THR 86 HA THR 86 2.705 -9.002 -12.799 706 HB THR 86 HB THR 86 4.419 -10.100 -14.125 707 HG1 THR 86 HG1 THR 86 6.470 -10.393 -13.288 708 HG21 THR 86 HG21 THR 86 5.579 -7.650 -12.727 709 HG22 THR 86 HG22 THR 86 6.125 -8.312 -14.267 710 HG23 THR 86 HG23 THR 86 4.484 -7.628 -14.119 711 H ASP 87 H ASP 87 4.259 -10.942 -10.315 712 HA ASP 87 HA ASP 87 3.325 -13.442 -11.499 713 HB2 ASP 87 HB2 ASP 87 5.652 -13.084 -10.822 714 HB3 ASP 87 HB3 ASP 87 5.140 -12.897 -9.140 715 H SER 88 H SER 88 2.752 -11.728 -8.386 716 HA SER 88 HA SER 88 0.488 -13.641 -7.882 717 HB2 SER 88 HB2 SER 88 2.381 -14.584 -6.719 718 HB3 SER 88 HB3 SER 88 2.666 -13.055 -5.869 719 HG SER 88 HG SER 88 1.355 -14.736 -4.754 720 H SER 89 H SER 89 -1.346 -12.700 -7.369 721 HA SER 89 HA SER 89 -1.641 -9.930 -7.274 722 HB2 SER 89 HB2 SER 89 -3.718 -11.707 -6.020 723 HB3 SER 89 HB3 SER 89 -3.938 -10.302 -7.063 724 HG SER 89 HG SER 89 -3.254 -11.546 -8.819 725 H ARG 90 H ARG 90 -0.636 -11.824 -4.610 726 HA ARG 90 HA ARG 90 -1.923 -10.195 -2.555 727 HB2 ARG 90 HB2 ARG 90 -1.357 -11.725 -0.994 728 HB3 ARG 90 HB3 ARG 90 -1.722 -12.658 -2.446 729 HG2 ARG 90 HG2 ARG 90 0.763 -12.752 -2.891 730 HG3 ARG 90 HG3 ARG 90 0.993 -12.046 -1.270 731 HD2 ARG 90 HD2 ARG 90 -0.326 -13.985 -0.330 732 HD3 ARG 90 HD3 ARG 90 -0.342 -14.694 -1.959 733 HE ARG 90 HE ARG 90 2.339 -13.995 -1.065 734 HH11 ARG 90 HH11 ARG 90 3.811 -15.496 -0.662 735 HH12 ARG 90 HH12 ARG 90 3.355 -17.149 -0.313 736 HH21 ARG 90 HH21 ARG 90 -0.025 -16.556 -0.667 737 HH22 ARG 90 HH22 ARG 90 1.206 -17.740 -0.325 738 H TYR 91 H TYR 91 0.333 -9.069 -4.416 739 HA TYR 91 HA TYR 91 1.871 -7.751 -2.247 740 HB2 TYR 91 HB2 TYR 91 3.008 -8.958 -4.786 741 HB3 TYR 91 HB3 TYR 91 3.903 -8.018 -3.612 742 HD1 TYR 91 HD1 TYR 91 4.272 -8.914 -1.295 743 HD2 TYR 91 HD2 TYR 91 2.623 -11.318 -4.468 744 HE1 TYR 91 HE1 TYR 91 4.780 -10.982 0.008 745 HE2 TYR 91 HE2 TYR 91 3.268 -13.385 -3.232 746 HH TYR 91 HH TYR 91 4.756 -13.261 0.026 747 H PHE 92 H PHE 92 2.396 -5.630 -2.594 748 HA PHE 92 HA PHE 92 1.746 -4.335 -5.183 749 HB2 PHE 92 HB2 PHE 92 0.755 -3.326 -2.488 750 HB3 PHE 92 HB3 PHE 92 0.479 -2.575 -4.048 751 HD1 PHE 92 HD1 PHE 92 -1.024 -3.708 -5.744 752 HD2 PHE 92 HD2 PHE 92 -0.621 -5.098 -1.691 753 HE1 PHE 92 HE1 PHE 92 -3.108 -5.049 -5.993 754 HE2 PHE 92 HE2 PHE 92 -2.721 -6.390 -1.920 755 HZ PHE 92 HZ PHE 92 -3.965 -6.384 -4.083 756 H VAL 93 H VAL 93 2.655 -2.215 -5.388 757 HA VAL 93 HA VAL 93 4.721 -1.431 -3.366 758 HB VAL 93 HB VAL 93 4.619 -0.682 -6.311 759 HG11 VAL 93 HG11 VAL 93 6.711 -0.009 -4.194 760 HG12 VAL 93 HG12 VAL 93 6.762 0.420 -5.922 761 HG13 VAL 93 HG13 VAL 93 5.537 1.133 -4.874 762 HG21 VAL 93 HG21 VAL 93 5.407 -2.964 -6.080 763 HG22 VAL 93 HG22 VAL 93 6.807 -1.934 -6.383 764 HG23 VAL 93 HG23 VAL 93 6.484 -2.511 -4.737 765 H ILE 94 H ILE 94 4.442 0.621 -2.419 766 HA ILE 94 HA ILE 94 2.444 2.390 -3.690 767 HB ILE 94 HB ILE 94 1.491 3.154 -1.675 768 HG12 ILE 94 HG12 ILE 94 3.368 2.512 -0.081 769 HG13 ILE 94 HG13 ILE 94 1.718 2.349 0.483 770 HG21 ILE 94 HG21 ILE 94 1.100 0.159 -2.001 771 HG22 ILE 94 HG22 ILE 94 -0.007 1.279 -1.169 772 HG23 ILE 94 HG23 ILE 94 0.311 1.456 -2.898 773 HD11 ILE 94 HD11 ILE 94 3.125 0.490 1.225 774 HD12 ILE 94 HD12 ILE 94 1.794 -0.082 0.219 775 HD13 ILE 94 HD13 ILE 94 3.434 0.011 -0.456 776 H ARG 95 H ARG 95 2.705 4.588 -3.431 777 HA ARG 95 HA ARG 95 5.530 5.376 -2.829 778 HB2 ARG 95 HB2 ARG 95 4.504 5.960 -5.058 779 HB3 ARG 95 HB3 ARG 95 3.448 7.088 -4.200 780 HG2 ARG 95 HG2 ARG 95 5.537 8.181 -3.243 781 HG3 ARG 95 HG3 ARG 95 6.499 7.133 -4.298 782 HD2 ARG 95 HD2 ARG 95 5.392 8.101 -6.278 783 HD3 ARG 95 HD3 ARG 95 4.351 9.085 -5.231 784 HE ARG 95 HE ARG 95 7.075 9.644 -4.573 785 HH11 ARG 95 HH11 ARG 95 8.039 11.458 -5.140 786 HH12 ARG 95 HH12 ARG 95 7.509 12.395 -6.523 787 HH21 ARG 95 HH21 ARG 95 4.858 10.304 -7.210 788 HH22 ARG 95 HH22 ARG 95 5.716 11.751 -7.668 789 H ILE 96 H ILE 96 5.612 5.502 -0.666 790 HA ILE 96 HA ILE 96 3.634 7.040 0.856 791 HB ILE 96 HB ILE 96 4.830 6.563 2.836 792 HG12 ILE 96 HG12 ILE 96 6.751 4.689 2.503 793 HG13 ILE 96 HG13 ILE 96 7.040 5.592 1.029 794 HG21 ILE 96 HG21 ILE 96 4.458 4.099 1.130 795 HG22 ILE 96 HG22 ILE 96 4.562 4.132 2.899 796 HG23 ILE 96 HG23 ILE 96 3.228 4.941 2.109 797 HD11 ILE 96 HD11 ILE 96 8.473 6.335 2.882 798 HD12 ILE 96 HD12 ILE 96 7.387 7.657 2.416 799 HD13 ILE 96 HD13 ILE 96 7.053 6.689 3.877 800 H GLN 97 H GLN 97 4.037 8.917 2.090 801 HA GLN 97 HA GLN 97 6.342 10.611 1.207 802 HB2 GLN 97 HB2 GLN 97 3.423 11.334 1.535 803 HB3 GLN 97 HB3 GLN 97 4.653 12.485 2.033 804 HG2 GLN 97 HG2 GLN 97 4.276 13.181 -0.093 805 HG3 GLN 97 HG3 GLN 97 5.707 12.194 -0.305 806 HE21 GLN 97 HE21 GLN 97 3.775 9.649 -2.146 807 HE22 GLN 97 HE22 GLN 97 5.150 9.773 -1.061 808 H ASP 98 H ASP 98 7.476 11.660 2.748 809 HA ASP 98 HA ASP 98 7.218 10.455 5.425 810 HB2 ASP 98 HB2 ASP 98 9.259 10.250 3.981 811 HB3 ASP 98 HB3 ASP 98 9.525 11.980 4.194 812 H GLY 99 H GLY 99 5.433 12.641 4.808 813 HA2 GLY 99 HA2 GLY 99 4.404 14.267 6.049 814 HA3 GLY 99 HA3 GLY 99 5.578 13.973 7.326 815 H THR 100 H THR 100 7.157 14.913 4.480 816 HA THR 100 HA THR 100 7.220 17.811 5.253 817 HB THR 100 HB THR 100 9.044 16.549 6.324 818 HG1 THR 100 HG1 THR 100 10.621 18.007 5.742 819 HG21 THR 100 HG21 THR 100 9.519 14.866 4.542 820 HG22 THR 100 HG22 THR 100 10.181 16.170 3.519 821 HG23 THR 100 HG23 THR 100 10.957 15.752 5.057 822 H GLY 101 H GLY 101 7.395 15.491 2.609 823 HA2 GLY 101 HA2 GLY 101 6.400 16.624 0.539 824 HA3 GLY 101 HA3 GLY 101 7.804 17.690 0.623 825 H ARG 102 H ARG 102 9.215 14.987 1.633 826 HA ARG 102 HA ARG 102 9.929 13.998 -1.053 827 HB2 ARG 102 HB2 ARG 102 11.982 13.253 -0.154 828 HB3 ARG 102 HB3 ARG 102 11.702 14.901 0.375 829 HG2 ARG 102 HG2 ARG 102 12.581 13.969 2.260 830 HG3 ARG 102 HG3 ARG 102 10.859 13.850 2.612 831 HD2 ARG 102 HD2 ARG 102 10.869 11.469 2.038 832 HD3 ARG 102 HD3 ARG 102 12.531 11.569 1.452 833 HE ARG 102 HE ARG 102 11.603 11.586 4.281 834 HH11 ARG 102 HH11 ARG 102 12.880 11.233 5.832 835 HH12 ARG 102 HH12 ARG 102 14.636 11.217 5.646 836 HH21 ARG 102 HH21 ARG 102 14.461 11.875 2.246 837 HH22 ARG 102 HH22 ARG 102 15.511 11.579 3.605 838 H SER 103 H SER 103 10.290 11.776 -1.292 839 HA SER 103 HA SER 103 8.204 10.073 -0.014 840 HB2 SER 103 HB2 SER 103 7.140 9.642 -2.161 841 HB3 SER 103 HB3 SER 103 7.150 11.381 -1.825 842 HG SER 103 HG SER 103 9.097 11.455 -3.167 843 H ALA 104 H ALA 104 8.106 7.862 -0.745 844 HA ALA 104 HA ALA 104 10.449 6.757 -2.157 845 HB1 ALA 104 HB1 ALA 104 9.676 5.890 0.668 846 HB2 ALA 104 HB2 ALA 104 10.899 5.116 -0.363 847 HB3 ALA 104 HB3 ALA 104 11.154 6.773 0.219 848 H PHE 105 H PHE 105 10.048 4.787 -3.142 849 HA PHE 105 HA PHE 105 7.251 3.752 -3.121 850 HB2 PHE 105 HB2 PHE 105 9.612 3.296 -4.960 851 HB3 PHE 105 HB3 PHE 105 8.197 2.265 -4.960 852 HD1 PHE 105 HD1 PHE 105 9.468 5.611 -5.883 853 HD2 PHE 105 HD2 PHE 105 5.994 3.067 -5.718 854 HE1 PHE 105 HE1 PHE 105 8.295 7.089 -7.494 855 HE2 PHE 105 HE2 PHE 105 4.831 4.518 -7.333 856 HZ PHE 105 HZ PHE 105 5.993 6.533 -8.250 857 H ILE 106 H ILE 106 6.795 2.244 -1.678 858 HA ILE 106 HA ILE 106 8.923 0.340 -0.777 859 HB ILE 106 HB ILE 106 7.968 0.200 1.375 860 HG12 ILE 106 HG12 ILE 106 5.852 2.242 0.574 861 HG13 ILE 106 HG13 ILE 106 5.565 0.516 0.805 862 HG21 ILE 106 HG21 ILE 106 8.190 3.155 0.691 863 HG22 ILE 106 HG22 ILE 106 8.586 2.370 2.236 864 HG23 ILE 106 HG23 ILE 106 9.581 2.055 0.808 865 HD11 ILE 106 HD11 ILE 106 6.419 2.441 2.996 866 HD12 ILE 106 HD12 ILE 106 4.833 1.686 2.779 867 HD13 ILE 106 HD13 ILE 106 6.235 0.685 3.175 868 H GLY 107 H GLY 107 8.380 -1.845 -0.480 869 HA2 GLY 107 HA2 GLY 107 6.064 -2.762 -2.111 870 HA3 GLY 107 HA3 GLY 107 7.454 -3.724 -1.624 871 H ILE 108 H ILE 108 4.401 -3.886 -1.197 872 HA ILE 108 HA ILE 108 4.652 -4.895 1.545 873 HB ILE 108 HB ILE 108 2.400 -4.309 2.173 874 HG12 ILE 108 HG12 ILE 108 2.127 -2.586 -0.316 875 HG13 ILE 108 HG13 ILE 108 1.397 -4.185 -0.136 876 HG21 ILE 108 HG21 ILE 108 2.762 -1.968 2.680 877 HG22 ILE 108 HG22 ILE 108 4.278 -2.869 2.753 878 HG23 ILE 108 HG23 ILE 108 3.945 -1.831 1.355 879 HD11 ILE 108 HD11 ILE 108 0.100 -3.434 1.822 880 HD12 ILE 108 HD12 ILE 108 0.754 -1.792 1.638 881 HD13 ILE 108 HD13 ILE 108 -0.260 -2.489 0.368 882 H GLY 109 H GLY 109 3.148 -6.594 2.117 883 HA2 GLY 109 HA2 GLY 109 1.436 -7.631 0.013 884 HA3 GLY 109 HA3 GLY 109 2.745 -8.739 0.405 885 H PHE 110 H PHE 110 0.472 -9.725 0.606 886 HA PHE 110 HA PHE 110 -0.504 -9.684 3.437 887 HB2 PHE 110 HB2 PHE 110 -1.995 -10.089 0.812 888 HB3 PHE 110 HB3 PHE 110 -2.700 -10.305 2.405 889 HD1 PHE 110 HD1 PHE 110 -3.428 -8.466 3.734 890 HD2 PHE 110 HD2 PHE 110 -1.246 -7.743 0.079 891 HE1 PHE 110 HE1 PHE 110 -3.987 -6.057 3.862 892 HE2 PHE 110 HE2 PHE 110 -1.859 -5.339 0.200 893 HZ PHE 110 HZ PHE 110 -3.281 -4.507 2.029 894 H THR 111 H THR 111 -1.028 -11.671 4.379 895 HA THR 111 HA THR 111 0.336 -14.009 3.375 896 HB THR 111 HB THR 111 -0.084 -13.265 5.760 897 HG1 THR 111 HG1 THR 111 -0.595 -15.951 5.020 898 HG21 THR 111 HG21 THR 111 -2.577 -13.068 5.655 899 HG22 THR 111 HG22 THR 111 -2.680 -14.836 5.505 900 HG23 THR 111 HG23 THR 111 -1.986 -14.103 6.964 901 H ASP 112 H ASP 112 -2.688 -12.810 2.509 902 HA ASP 112 HA ASP 112 -4.000 -15.497 2.479 903 HB2 ASP 112 HB2 ASP 112 -4.720 -13.753 4.100 904 HB3 ASP 112 HB3 ASP 112 -5.205 -12.745 2.736 905 H ARG 113 H ARG 113 -3.243 -12.930 0.309 906 HA ARG 113 HA ARG 113 -3.845 -12.278 -1.770 907 HB2 ARG 113 HB2 ARG 113 -3.157 -14.653 -2.273 908 HB3 ARG 113 HB3 ARG 113 -4.870 -15.090 -2.272 909 HG2 ARG 113 HG2 ARG 113 -5.292 -13.474 -4.095 910 HG3 ARG 113 HG3 ARG 113 -3.583 -12.995 -4.073 911 HD2 ARG 113 HD2 ARG 113 -2.945 -15.352 -4.620 912 HD3 ARG 113 HD3 ARG 113 -4.665 -15.779 -4.675 913 HE ARG 113 HE ARG 113 -3.865 -13.591 -6.488 914 HH11 ARG 113 HH11 ARG 113 -3.975 -13.834 -8.606 915 HH12 ARG 113 HH12 ARG 113 -4.223 -15.410 -9.331 916 HH21 ARG 113 HH21 ARG 113 -4.268 -17.075 -6.315 917 HH22 ARG 113 HH22 ARG 113 -4.377 -17.216 -8.048 918 H GLY 114 H GLY 114 -6.580 -14.041 -0.281 919 HA2 GLY 114 HA2 GLY 114 -8.672 -12.568 -1.592 920 HA3 GLY 114 HA3 GLY 114 -8.779 -13.398 -0.037 921 H ASP 115 H ASP 115 -6.608 -11.772 1.181 922 HA ASP 115 HA ASP 115 -8.122 -9.343 1.890 923 HB2 ASP 115 HB2 ASP 115 -5.486 -10.502 2.831 924 HB3 ASP 115 HB3 ASP 115 -6.011 -8.890 3.278 925 H ALA 116 H ALA 116 -5.183 -10.064 -0.054 926 HA ALA 116 HA ALA 116 -4.678 -7.317 -0.744 927 HB1 ALA 116 HB1 ALA 116 -3.493 -8.355 -2.665 928 HB2 ALA 116 HB2 ALA 116 -3.078 -9.095 -1.105 929 HB3 ALA 116 HB3 ALA 116 -4.184 -9.918 -2.240 930 H PHE 117 H PHE 117 -6.815 -9.796 -2.185 931 HA PHE 117 HA PHE 117 -8.018 -8.023 -4.111 932 HB2 PHE 117 HB2 PHE 117 -8.544 -10.793 -3.135 933 HB3 PHE 117 HB3 PHE 117 -9.868 -9.960 -3.914 934 HD1 PHE 117 HD1 PHE 117 -9.361 -8.704 -6.151 935 HD2 PHE 117 HD2 PHE 117 -7.016 -11.954 -4.568 936 HE1 PHE 117 HE1 PHE 117 -8.464 -9.167 -8.429 937 HE2 PHE 117 HE2 PHE 117 -6.141 -12.432 -6.848 938 HZ PHE 117 HZ PHE 117 -6.848 -11.029 -8.774 939 H ASP 118 H ASP 118 -8.097 -7.448 -0.976 940 HA ASP 118 HA ASP 118 -10.755 -6.112 -1.182 941 HB2 ASP 118 HB2 ASP 118 -10.650 -7.995 0.490 942 HB3 ASP 118 HB3 ASP 118 -9.410 -7.094 1.357 943 H PHE 119 H PHE 119 -7.354 -5.827 -0.105 944 HA PHE 119 HA PHE 119 -7.144 -3.065 0.478 945 HB2 PHE 119 HB2 PHE 119 -5.284 -4.532 0.707 946 HB3 PHE 119 HB3 PHE 119 -5.362 -5.050 -0.963 947 HD1 PHE 119 HD1 PHE 119 -4.514 -3.662 -2.812 948 HD2 PHE 119 HD2 PHE 119 -4.153 -2.415 1.294 949 HE1 PHE 119 HE1 PHE 119 -2.909 -1.911 -3.492 950 HE2 PHE 119 HE2 PHE 119 -2.601 -0.620 0.609 951 HZ PHE 119 HZ PHE 119 -1.954 -0.364 -1.781 952 H ASN 120 H ASN 120 -7.105 -4.643 -2.727 953 HA ASN 120 HA ASN 120 -6.979 -2.101 -4.144 954 HB2 ASN 120 HB2 ASN 120 -7.011 -3.423 -6.156 955 HB3 ASN 120 HB3 ASN 120 -5.885 -4.122 -5.000 956 HD21 ASN 120 HD21 ASN 120 -7.760 -6.919 -6.506 957 HD22 ASN 120 HD22 ASN 120 -6.623 -5.699 -7.071 958 H VAL 121 H VAL 121 -9.676 -4.229 -3.275 959 HA VAL 121 HA VAL 121 -11.585 -2.877 -4.999 960 HB VAL 121 HB VAL 121 -11.885 -4.919 -2.792 961 HG11 VAL 121 HG11 VAL 121 -14.273 -5.131 -3.493 962 HG12 VAL 121 HG12 VAL 121 -13.951 -3.595 -2.695 963 HG13 VAL 121 HG13 VAL 121 -14.104 -3.653 -4.466 964 HG21 VAL 121 HG21 VAL 121 -12.589 -6.348 -4.671 965 HG22 VAL 121 HG22 VAL 121 -12.408 -4.989 -5.803 966 HG23 VAL 121 HG23 VAL 121 -10.991 -5.676 -4.987 967 H SER 122 H SER 122 -10.831 -2.643 -1.497 968 HA SER 122 HA SER 122 -12.814 -0.662 -0.915 969 HB2 SER 122 HB2 SER 122 -11.473 -0.217 1.100 970 HB3 SER 122 HB3 SER 122 -11.757 -1.953 0.833 971 HG SER 122 HG SER 122 -9.708 -2.222 0.180 972 H LEU 123 H LEU 123 -9.594 -0.330 -2.334 973 HA LEU 123 HA LEU 123 -9.590 2.581 -2.323 974 HB2 LEU 123 HB2 LEU 123 -8.066 0.444 -3.839 975 HB3 LEU 123 HB3 LEU 123 -7.876 2.153 -4.227 976 HG LEU 123 HG LEU 123 -7.371 1.026 -1.451 977 HD11 LEU 123 HD11 LEU 123 -4.979 1.165 -2.022 978 HD12 LEU 123 HD12 LEU 123 -5.810 0.042 -3.099 979 HD13 LEU 123 HD13 LEU 123 -5.389 1.666 -3.682 980 HD21 LEU 123 HD21 LEU 123 -7.814 3.463 -1.480 981 HD22 LEU 123 HD22 LEU 123 -6.118 3.139 -1.140 982 HD23 LEU 123 HD23 LEU 123 -6.601 3.676 -2.763 983 H GLN 124 H GLN 124 -10.235 0.239 -5.028 984 HA GLN 124 HA GLN 124 -10.926 2.352 -6.796 985 HB2 GLN 124 HB2 GLN 124 -11.420 0.713 -8.394 986 HB3 GLN 124 HB3 GLN 124 -10.153 0.024 -7.379 987 HG2 GLN 124 HG2 GLN 124 -12.026 -1.169 -6.106 988 HG3 GLN 124 HG3 GLN 124 -13.103 -0.697 -7.419 989 HE21 GLN 124 HE21 GLN 124 -10.156 -3.512 -8.113 990 HE22 GLN 124 HE22 GLN 124 -9.983 -2.382 -6.764 991 H ASP 125 H ASP 125 -12.998 0.606 -4.526 992 HA ASP 125 HA ASP 125 -15.464 1.639 -5.665 993 HB2 ASP 125 HB2 ASP 125 -15.259 -0.583 -4.536 994 HB3 ASP 125 HB3 ASP 125 -14.936 0.246 -3.010 995 H HIS 126 H HIS 126 -13.034 3.157 -3.906 996 HA HIS 126 HA HIS 126 -14.986 5.172 -2.949 997 HB2 HIS 126 HB2 HIS 126 -13.126 4.283 -1.395 998 HB3 HIS 126 HB3 HIS 126 -12.051 5.337 -2.320 999 HD2 HIS 126 HD2 HIS 126 -15.457 5.552 -0.402 1000 HE1 HIS 126 HE1 HIS 126 -13.573 9.352 0.017 1001 HE2 HIS 126 HE2 HIS 126 -15.603 7.957 0.662 1002 H PHE 127 H PHE 127 -13.212 4.513 -5.699 1003 HA PHE 127 HA PHE 127 -13.214 7.401 -6.511 1004 HB2 PHE 127 HB2 PHE 127 -11.544 5.060 -7.468 1005 HB3 PHE 127 HB3 PHE 127 -11.609 6.611 -8.288 1006 HD1 PHE 127 HD1 PHE 127 -9.852 4.770 -5.826 1007 HD2 PHE 127 HD2 PHE 127 -11.163 8.757 -6.794 1008 HE1 PHE 127 HE1 PHE 127 -8.023 5.705 -4.433 1009 HE2 PHE 127 HE2 PHE 127 -9.325 9.694 -5.409 1010 HZ PHE 127 HZ PHE 127 -7.749 8.172 -4.237 1011 H LYS 128 H LYS 128 -14.950 4.472 -7.163 1012 HA LYS 128 HA LYS 128 -15.459 4.710 -9.854 1013 HB2 LYS 128 HB2 LYS 128 -17.276 3.334 -9.692 1014 HB3 LYS 128 HB3 LYS 128 -16.224 2.843 -8.381 1015 HG2 LYS 128 HG2 LYS 128 -18.695 4.629 -8.041 1016 HG3 LYS 128 HG3 LYS 128 -18.690 2.873 -7.890 1017 HD2 LYS 128 HD2 LYS 128 -17.060 3.026 -6.048 1018 HD3 LYS 128 HD3 LYS 128 -17.072 4.788 -6.165 1019 HE2 LYS 128 HE2 LYS 128 -18.497 4.268 -4.378 1020 HE3 LYS 128 HE3 LYS 128 -19.552 4.737 -5.724 1021 HZ1 LYS 128 HZ1 LYS 128 -20.284 2.688 -4.528 1022 HZ2 LYS 128 HZ2 LYS 128 -19.994 2.375 -6.105 1023 HZ3 LYS 128 HZ3 LYS 128 -18.903 1.922 -4.971 1024 H TRP 129 H TRP 129 -16.908 6.752 -7.439 1025 HA TRP 129 HA TRP 129 -18.870 7.953 -9.211 1026 HB2 TRP 129 HB2 TRP 129 -19.359 9.395 -7.321 1027 HB3 TRP 129 HB3 TRP 129 -19.272 7.718 -6.811 1028 HD1 TRP 129 HD1 TRP 129 -17.009 6.992 -5.434 1029 HE1 TRP 129 HE1 TRP 129 -15.362 8.312 -4.019 1030 HE3 TRP 129 HE3 TRP 129 -18.407 11.749 -6.762 1031 HZ2 TRP 129 HZ2 TRP 129 -15.033 11.064 -3.158 1032 HZ3 TRP 129 HZ3 TRP 129 -17.463 13.702 -5.555 1033 HH2 TRP 129 HH2 TRP 129 -15.802 13.375 -3.737 1034 H VAL 130 H VAL 130 -15.518 8.581 -8.487 1035 HA VAL 130 HA VAL 130 -15.473 11.332 -9.500 1036 HB VAL 130 HB VAL 130 -13.142 9.452 -8.956 1037 HG11 VAL 130 HG11 VAL 130 -11.878 11.577 -8.637 1038 HG12 VAL 130 HG12 VAL 130 -12.462 11.385 -10.287 1039 HG13 VAL 130 HG13 VAL 130 -13.308 12.486 -9.178 1040 HG21 VAL 130 HG21 VAL 130 -14.407 9.686 -6.876 1041 HG22 VAL 130 HG22 VAL 130 -12.950 10.669 -6.775 1042 HG23 VAL 130 HG23 VAL 130 -14.516 11.444 -7.101 1043 H LYS 131 H LYS 131 -15.173 8.109 -10.786 1044 HA LYS 131 HA LYS 131 -14.129 9.014 -13.401 1045 HB2 LYS 131 HB2 LYS 131 -13.038 7.179 -12.141 1046 HB3 LYS 131 HB3 LYS 131 -14.509 6.230 -12.224 1047 HG2 LYS 131 HG2 LYS 131 -12.652 5.582 -13.795 1048 HG3 LYS 131 HG3 LYS 131 -14.224 5.782 -14.532 1049 HD2 LYS 131 HD2 LYS 131 -12.451 6.674 -15.950 1050 HD3 LYS 131 HD3 LYS 131 -13.577 7.944 -15.474 1051 HE2 LYS 131 HE2 LYS 131 -11.981 8.722 -13.738 1052 HE3 LYS 131 HE3 LYS 131 -10.859 7.426 -14.176 1053 HZ1 LYS 131 HZ1 LYS 131 -10.363 9.606 -15.260 1054 HZ2 LYS 131 HZ2 LYS 131 -10.610 8.415 -16.352 1055 HZ3 LYS 131 HZ3 LYS 131 -11.783 9.516 -16.086 1056 H GLN 132 H GLN 132 -16.825 9.718 -12.586 1057 HA GLN 132 HA GLN 132 -18.576 8.208 -14.413 1058 HB2 GLN 132 HB2 GLN 132 -19.103 10.574 -12.593 1059 HB3 GLN 132 HB3 GLN 132 -20.283 9.887 -13.724 1060 HG2 GLN 132 HG2 GLN 132 -20.143 7.697 -12.596 1061 HG3 GLN 132 HG3 GLN 132 -18.961 8.346 -11.458 1062 HE21 GLN 132 HE21 GLN 132 -21.434 10.300 -9.653 1063 HE22 GLN 132 HE22 GLN 132 -19.725 10.282 -10.099 1064 H GLU 133 H GLU 133 -17.776 8.540 -16.367 1065 HA GLU 133 HA GLU 133 -18.299 11.118 -17.710 1066 HB2 GLU 133 HB2 GLU 133 -16.168 11.223 -18.835 1067 HB3 GLU 133 HB3 GLU 133 -15.946 11.306 -17.092 1068 HG2 GLU 133 HG2 GLU 133 -15.273 8.893 -17.078 1069 HG3 GLU 133 HG3 GLU 133 -15.458 8.846 -18.833 Start of MODEL 22 1 H1 GLY -4 H1 GLY -4 6.662 30.500 14.653 2 H2 GLY -4 H2 GLY -4 6.836 30.529 13.026 3 H3 GLY -4 H3 GLY -4 8.154 30.363 13.987 4 HA2 GLY -4 HA2 GLY -4 7.611 28.245 13.002 5 HA3 GLY -4 HA3 GLY -4 7.400 28.215 14.762 6 H SER -3 H SER -3 5.969 26.397 14.404 7 HA SER -3 HA SER -3 3.160 27.217 14.036 8 HB2 SER -3 HB2 SER -3 3.706 26.514 11.798 9 HB3 SER -3 HB3 SER -3 4.517 25.053 12.387 10 HG SER -3 HG SER -3 2.325 24.755 11.583 11 HA PRO -2 HA PRO -2 2.824 24.187 17.382 12 HB2 PRO -2 HB2 PRO -2 0.121 23.838 17.503 13 HB3 PRO -2 HB3 PRO -2 0.920 25.352 18.023 14 HG2 PRO -2 HG2 PRO -2 -0.357 24.765 15.326 15 HG3 PRO -2 HG3 PRO -2 -0.652 26.170 16.402 16 HD2 PRO -2 HD2 PRO -2 1.096 26.312 14.337 17 HD3 PRO -2 HD3 PRO -2 1.455 27.118 15.891 18 H ASN -1 H ASN -1 1.996 23.599 14.070 19 HA ASN -1 HA ASN -1 1.556 21.769 12.811 20 HB2 ASN -1 HB2 ASN -1 3.526 20.600 14.807 21 HB3 ASN -1 HB3 ASN -1 2.972 19.731 13.384 22 HD21 ASN -1 HD21 ASN -1 5.613 22.789 12.844 23 HD22 ASN -1 HD22 ASN -1 4.746 22.713 14.368 24 H SER 0 H SER 0 -0.509 22.313 14.612 25 HA SER 0 HA SER 0 -1.362 19.903 15.980 26 HB2 SER 0 HB2 SER 0 -3.259 21.355 16.686 27 HB3 SER 0 HB3 SER 0 -1.661 22.037 17.026 28 HG SER 0 HG SER 0 -3.138 23.559 16.069 29 H MET 1 H MET 1 -1.751 20.764 12.755 30 HA MET 1 HA MET 1 -4.140 19.003 12.437 31 HB2 MET 1 HB2 MET 1 -3.707 21.706 11.095 32 HB3 MET 1 HB3 MET 1 -4.947 20.533 10.634 33 HG2 MET 1 HG2 MET 1 -5.885 20.651 12.944 34 HG3 MET 1 HG3 MET 1 -4.724 21.931 13.321 35 HE1 MET 1 HE1 MET 1 -8.160 23.815 13.159 36 HE2 MET 1 HE2 MET 1 -7.882 22.154 13.727 37 HE3 MET 1 HE3 MET 1 -6.728 23.443 14.143 38 H ALA 2 H ALA 2 -4.398 18.104 10.313 39 HA ALA 2 HA ALA 2 -2.009 17.968 8.561 40 HB1 ALA 2 HB1 ALA 2 -1.786 16.135 10.205 41 HB2 ALA 2 HB2 ALA 2 -3.412 15.549 9.788 42 HB3 ALA 2 HB3 ALA 2 -2.108 15.504 8.580 43 H THR 3 H THR 3 -4.139 19.476 8.045 44 HA THR 3 HA THR 3 -5.970 19.979 6.809 45 HB THR 3 HB THR 3 -5.538 17.459 5.202 46 HG1 THR 3 HG1 THR 3 -3.761 18.902 5.152 47 HG21 THR 3 HG21 THR 3 -7.082 20.030 4.657 48 HG22 THR 3 HG22 THR 3 -6.777 18.744 3.462 49 HG23 THR 3 HG23 THR 3 -7.775 18.408 4.884 50 H GLU 4 H GLU 4 -6.813 19.688 8.875 51 HA GLU 4 HA GLU 4 -8.093 17.125 9.569 52 HB2 GLU 4 HB2 GLU 4 -6.431 18.308 11.061 53 HB3 GLU 4 HB3 GLU 4 -7.658 19.547 11.353 54 HG2 GLU 4 HG2 GLU 4 -9.212 17.733 12.144 55 HG3 GLU 4 HG3 GLU 4 -7.935 16.553 11.831 56 H LEU 5 H LEU 5 -9.880 17.132 8.305 57 HA LEU 5 HA LEU 5 -11.821 19.307 8.233 58 HB2 LEU 5 HB2 LEU 5 -12.111 16.485 7.204 59 HB3 LEU 5 HB3 LEU 5 -12.966 17.926 6.650 60 HG LEU 5 HG LEU 5 -10.016 17.325 6.217 61 HD11 LEU 5 HD11 LEU 5 -12.293 17.383 4.235 62 HD12 LEU 5 HD12 LEU 5 -10.617 16.849 3.964 63 HD13 LEU 5 HD13 LEU 5 -11.694 15.916 5.043 64 HD21 LEU 5 HD21 LEU 5 -10.369 19.757 6.319 65 HD22 LEU 5 HD22 LEU 5 -10.102 19.254 4.641 66 HD23 LEU 5 HD23 LEU 5 -11.748 19.621 5.202 67 H GLU 6 H GLU 6 -11.324 17.301 10.653 68 HA GLU 6 HA GLU 6 -12.366 15.934 12.079 69 HB2 GLU 6 HB2 GLU 6 -13.757 18.109 12.419 70 HB3 GLU 6 HB3 GLU 6 -15.038 17.253 11.574 71 HG2 GLU 6 HG2 GLU 6 -15.409 17.041 13.923 72 HG3 GLU 6 HG3 GLU 6 -14.934 15.456 13.349 73 H TYR 7 H TYR 7 -12.159 15.274 9.215 74 HA TYR 7 HA TYR 7 -13.390 12.734 9.523 75 HB2 TYR 7 HB2 TYR 7 -14.650 12.492 7.608 76 HB3 TYR 7 HB3 TYR 7 -15.207 13.955 8.384 77 HD1 TYR 7 HD1 TYR 7 -13.474 12.565 5.349 78 HD2 TYR 7 HD2 TYR 7 -14.903 16.150 7.346 79 HE1 TYR 7 HE1 TYR 7 -13.662 13.721 3.184 80 HE2 TYR 7 HE2 TYR 7 -15.031 17.300 5.144 81 HH TYR 7 HH TYR 7 -14.311 15.632 2.059 82 H GLU 8 H GLU 8 -12.395 11.171 8.636 83 HA GLU 8 HA GLU 8 -10.761 11.164 6.266 84 HB2 GLU 8 HB2 GLU 8 -9.182 11.967 8.132 85 HB3 GLU 8 HB3 GLU 8 -9.419 10.354 8.867 86 HG2 GLU 8 HG2 GLU 8 -8.644 9.273 6.886 87 HG3 GLU 8 HG3 GLU 8 -8.413 10.784 6.036 88 H SER 9 H SER 9 -12.386 9.722 5.639 89 HA SER 9 HA SER 9 -13.543 7.887 7.534 90 HB2 SER 9 HB2 SER 9 -14.705 9.112 5.627 91 HB3 SER 9 HB3 SER 9 -13.959 7.931 4.530 92 HG SER 9 HG SER 9 -16.084 7.303 5.243 93 H VAL 10 H VAL 10 -13.010 5.825 7.955 94 HA VAL 10 HA VAL 10 -10.720 4.632 6.662 95 HB VAL 10 HB VAL 10 -11.216 4.467 9.079 96 HG11 VAL 10 HG11 VAL 10 -13.287 2.364 8.322 97 HG12 VAL 10 HG12 VAL 10 -12.752 2.802 9.954 98 HG13 VAL 10 HG13 VAL 10 -13.654 3.972 8.981 99 HG21 VAL 10 HG21 VAL 10 -10.895 1.767 7.729 100 HG22 VAL 10 HG22 VAL 10 -9.599 2.959 8.007 101 HG23 VAL 10 HG23 VAL 10 -10.422 2.212 9.380 102 H LEU 11 H LEU 11 -10.604 2.701 5.488 103 HA LEU 11 HA LEU 11 -13.068 1.937 3.944 104 HB2 LEU 11 HB2 LEU 11 -10.292 2.628 2.899 105 HB3 LEU 11 HB3 LEU 11 -11.565 1.906 1.931 106 HG LEU 11 HG LEU 11 -11.666 4.676 3.181 107 HD11 LEU 11 HD11 LEU 11 -10.113 4.547 1.304 108 HD12 LEU 11 HD12 LEU 11 -11.319 3.695 0.314 109 HD13 LEU 11 HD13 LEU 11 -11.583 5.382 0.783 110 HD21 LEU 11 HD21 LEU 11 -13.947 3.737 3.010 111 HD22 LEU 11 HD22 LEU 11 -13.693 4.992 1.802 112 HD23 LEU 11 HD23 LEU 11 -13.642 3.279 1.316 113 H CYS 12 H CYS 12 -9.815 0.978 5.001 114 HA CYS 12 HA CYS 12 -10.706 -1.810 5.216 115 HB2 CYS 12 HB2 CYS 12 -9.732 -1.598 2.892 116 HB3 CYS 12 HB3 CYS 12 -8.196 -1.108 3.641 117 HG CYS 12 HG CYS 12 -8.050 -3.611 2.861 118 H VAL 13 H VAL 13 -9.812 -2.763 6.933 119 HA VAL 13 HA VAL 13 -7.228 -1.806 8.023 120 HB VAL 13 HB VAL 13 -9.648 -2.379 9.777 121 HG11 VAL 13 HG11 VAL 13 -8.177 -1.707 11.648 122 HG12 VAL 13 HG12 VAL 13 -7.551 -3.147 10.846 123 HG13 VAL 13 HG13 VAL 13 -6.805 -1.562 10.532 124 HG21 VAL 13 HG21 VAL 13 -9.804 -0.139 8.780 125 HG22 VAL 13 HG22 VAL 13 -9.395 -0.010 10.492 126 HG23 VAL 13 HG23 VAL 13 -8.133 0.221 9.259 127 H LYS 14 H LYS 14 -5.865 -3.444 8.266 128 HA LYS 14 HA LYS 14 -6.880 -6.205 8.691 129 HB2 LYS 14 HB2 LYS 14 -4.670 -5.524 6.714 130 HB3 LYS 14 HB3 LYS 14 -5.153 -7.137 7.181 131 HG2 LYS 14 HG2 LYS 14 -7.014 -5.161 5.790 132 HG3 LYS 14 HG3 LYS 14 -6.028 -6.367 4.963 133 HD2 LYS 14 HD2 LYS 14 -7.168 -8.181 6.178 134 HD3 LYS 14 HD3 LYS 14 -8.200 -6.995 7.009 135 HE2 LYS 14 HE2 LYS 14 -9.152 -6.258 4.898 136 HE3 LYS 14 HE3 LYS 14 -8.034 -7.288 3.990 137 HZ1 LYS 14 HZ1 LYS 14 -10.109 -8.299 5.860 138 HZ2 LYS 14 HZ2 LYS 14 -10.196 -8.345 4.219 139 HZ3 LYS 14 HZ3 LYS 14 -9.050 -9.228 5.009 140 HA PRO 15 HA PRO 15 -3.968 -5.881 11.979 141 HB2 PRO 15 HB2 PRO 15 -3.918 -8.431 12.931 142 HB3 PRO 15 HB3 PRO 15 -5.359 -7.370 13.067 143 HG2 PRO 15 HG2 PRO 15 -4.781 -9.480 10.954 144 HG3 PRO 15 HG3 PRO 15 -6.281 -9.272 11.922 145 HD2 PRO 15 HD2 PRO 15 -6.053 -8.282 9.408 146 HD3 PRO 15 HD3 PRO 15 -6.919 -7.376 10.687 147 H ASP 16 H ASP 16 -3.203 -7.857 9.232 148 HA ASP 16 HA ASP 16 -0.359 -8.123 10.109 149 HB2 ASP 16 HB2 ASP 16 -1.559 -10.238 10.487 150 HB3 ASP 16 HB3 ASP 16 -2.101 -10.242 8.805 151 H VAL 17 H VAL 17 0.664 -6.781 8.861 152 HA VAL 17 HA VAL 17 0.812 -7.416 5.991 153 HB VAL 17 HB VAL 17 -0.824 -5.542 6.181 154 HG11 VAL 17 HG11 VAL 17 1.567 -3.836 6.993 155 HG12 VAL 17 HG12 VAL 17 -0.069 -3.269 6.613 156 HG13 VAL 17 HG13 VAL 17 0.205 -4.275 8.043 157 HG21 VAL 17 HG21 VAL 17 1.724 -4.828 4.680 158 HG22 VAL 17 HG22 VAL 17 0.452 -5.941 4.112 159 HG23 VAL 17 HG23 VAL 17 0.087 -4.230 4.355 160 H SER 18 H SER 18 2.813 -7.074 5.093 161 HA SER 18 HA SER 18 5.038 -6.369 6.992 162 HB2 SER 18 HB2 SER 18 5.042 -8.518 4.848 163 HB3 SER 18 HB3 SER 18 6.373 -8.102 5.944 164 HG SER 18 HG SER 18 3.838 -9.216 6.625 165 H VAL 19 H VAL 19 6.628 -5.062 6.253 166 HA VAL 19 HA VAL 19 6.417 -3.970 3.483 167 HB VAL 19 HB VAL 19 7.658 -2.819 5.989 168 HG11 VAL 19 HG11 VAL 19 7.700 -1.731 3.132 169 HG12 VAL 19 HG12 VAL 19 8.078 -0.774 4.585 170 HG13 VAL 19 HG13 VAL 19 9.105 -2.133 4.144 171 HG21 VAL 19 HG21 VAL 19 5.107 -2.672 5.619 172 HG22 VAL 19 HG22 VAL 19 5.973 -1.148 5.846 173 HG23 VAL 19 HG23 VAL 19 5.483 -1.646 4.221 174 H TYR 20 H TYR 20 7.881 -4.245 2.037 175 HA TYR 20 HA TYR 20 10.668 -4.908 2.812 176 HB2 TYR 20 HB2 TYR 20 9.963 -6.174 0.288 177 HB3 TYR 20 HB3 TYR 20 10.823 -6.806 1.671 178 HD1 TYR 20 HD1 TYR 20 9.617 -8.055 3.451 179 HD2 TYR 20 HD2 TYR 20 7.592 -6.532 -0.027 180 HE1 TYR 20 HE1 TYR 20 7.687 -9.554 3.929 181 HE2 TYR 20 HE2 TYR 20 5.651 -8.033 0.452 182 HH TYR 20 HH TYR 20 5.655 -10.308 3.227 183 H ARG 21 H ARG 21 11.926 -3.378 2.088 184 HA ARG 21 HA ARG 21 11.148 -1.417 0.097 185 HB2 ARG 21 HB2 ARG 21 13.934 -2.018 1.173 186 HB3 ARG 21 HB3 ARG 21 13.444 -0.591 0.245 187 HG2 ARG 21 HG2 ARG 21 11.765 -0.064 2.088 188 HG3 ARG 21 HG3 ARG 21 12.483 -1.387 3.027 189 HD2 ARG 21 HD2 ARG 21 14.729 -0.208 2.755 190 HD3 ARG 21 HD3 ARG 21 13.825 1.169 2.086 191 HE ARG 21 HE ARG 21 12.827 0.198 4.684 192 HH11 ARG 21 HH11 ARG 21 13.062 1.173 6.452 193 HH12 ARG 21 HH12 ARG 21 14.057 2.620 6.631 194 HH21 ARG 21 HH21 ARG 21 15.146 2.472 3.337 195 HH22 ARG 21 HH22 ARG 21 15.255 3.330 4.852 196 H ILE 22 H ILE 22 11.401 -1.364 -2.017 197 HA ILE 22 HA ILE 22 11.961 -3.932 -3.285 198 HB ILE 22 HB ILE 22 10.827 -3.020 -5.245 199 HG12 ILE 22 HG12 ILE 22 10.566 -0.435 -3.648 200 HG13 ILE 22 HG13 ILE 22 11.481 -0.670 -5.141 201 HG21 ILE 22 HG21 ILE 22 9.207 -2.468 -2.738 202 HG22 ILE 22 HG22 ILE 22 8.634 -3.062 -4.314 203 HG23 ILE 22 HG23 ILE 22 9.634 -4.096 -3.293 204 HD11 ILE 22 HD11 ILE 22 9.298 -1.308 -6.271 205 HD12 ILE 22 HD12 ILE 22 8.472 -0.751 -4.798 206 HD13 ILE 22 HD13 ILE 22 9.436 0.388 -5.751 207 HA PRO 23 HA PRO 23 15.668 -2.668 -5.576 208 HB2 PRO 23 HB2 PRO 23 15.529 -4.343 -7.733 209 HB3 PRO 23 HB3 PRO 23 15.941 -4.925 -6.090 210 HG2 PRO 23 HG2 PRO 23 13.228 -4.961 -7.460 211 HG3 PRO 23 HG3 PRO 23 14.071 -6.312 -6.631 212 HD2 PRO 23 HD2 PRO 23 12.185 -4.798 -5.386 213 HD3 PRO 23 HD3 PRO 23 13.609 -5.419 -4.501 214 HA PRO 24 HA PRO 24 14.150 0.286 -8.548 215 HB2 PRO 24 HB2 PRO 24 16.020 0.301 -10.577 216 HB3 PRO 24 HB3 PRO 24 16.279 1.024 -8.960 217 HG2 PRO 24 HG2 PRO 24 17.121 -1.730 -9.922 218 HG3 PRO 24 HG3 PRO 24 18.113 -0.505 -9.064 219 HD2 PRO 24 HD2 PRO 24 16.966 -2.540 -7.720 220 HD3 PRO 24 HD3 PRO 24 16.982 -0.899 -7.012 221 H ARG 25 H ARG 25 12.812 0.425 -10.277 222 HA ARG 25 HA ARG 25 11.709 -2.034 -11.350 223 HB2 ARG 25 HB2 ARG 25 10.540 0.207 -10.669 224 HB3 ARG 25 HB3 ARG 25 11.046 0.779 -12.254 225 HG2 ARG 25 HG2 ARG 25 9.688 -1.779 -12.589 226 HG3 ARG 25 HG3 ARG 25 8.758 -0.795 -11.485 227 HD2 ARG 25 HD2 ARG 25 8.985 1.120 -13.218 228 HD3 ARG 25 HD3 ARG 25 9.543 -0.134 -14.329 229 HE ARG 25 HE ARG 25 7.351 -0.891 -14.520 230 HH11 ARG 25 HH11 ARG 25 5.119 -0.919 -14.137 231 HH12 ARG 25 HH12 ARG 25 4.493 -0.058 -12.736 232 HH21 ARG 25 HH21 ARG 25 7.461 1.101 -11.619 233 HH22 ARG 25 HH22 ARG 25 5.732 0.994 -11.372 234 H ALA 26 H ALA 26 11.251 -2.431 -13.567 235 HA ALA 26 HA ALA 26 12.468 -0.769 -15.618 236 HB1 ALA 26 HB1 ALA 26 14.239 -2.355 -15.324 237 HB2 ALA 26 HB2 ALA 26 13.122 -3.725 -15.391 238 HB3 ALA 26 HB3 ALA 26 13.412 -2.737 -16.851 239 H SER 27 H SER 27 11.623 -1.374 -17.766 240 HA SER 27 HA SER 27 8.751 -1.096 -17.484 241 HB2 SER 27 HB2 SER 27 8.928 -0.292 -19.818 242 HB3 SER 27 HB3 SER 27 10.091 0.497 -18.727 243 HG SER 27 HG SER 27 11.149 -0.100 -20.619 244 H ASN 28 H ASN 28 10.893 -3.244 -19.290 245 HA ASN 28 HA ASN 28 8.645 -4.967 -20.182 246 HB2 ASN 28 HB2 ASN 28 11.609 -4.839 -20.890 247 HB3 ASN 28 HB3 ASN 28 10.549 -6.137 -21.429 248 HD21 ASN 28 HD21 ASN 28 9.997 -2.431 -23.111 249 HD22 ASN 28 HD22 ASN 28 10.724 -2.499 -21.513 250 H ARG 29 H ARG 29 9.424 -4.641 -17.394 251 HA ARG 29 HA ARG 29 9.868 -7.472 -16.554 252 HB2 ARG 29 HB2 ARG 29 11.257 -4.950 -15.543 253 HB3 ARG 29 HB3 ARG 29 11.186 -6.427 -14.601 254 HG2 ARG 29 HG2 ARG 29 12.494 -6.179 -17.345 255 HG3 ARG 29 HG3 ARG 29 13.317 -6.158 -15.785 256 HD2 ARG 29 HD2 ARG 29 13.545 -8.392 -16.178 257 HD3 ARG 29 HD3 ARG 29 11.948 -8.413 -15.383 258 HE ARG 29 HE ARG 29 11.422 -8.071 -18.108 259 HH11 ARG 29 HH11 ARG 29 10.794 -9.628 -19.452 260 HH12 ARG 29 HH12 ARG 29 11.232 -11.293 -19.174 261 HH21 ARG 29 HH21 ARG 29 12.947 -10.631 -16.257 262 HH22 ARG 29 HH22 ARG 29 12.425 -11.856 -17.382 263 H GLY 30 H GLY 30 9.261 -4.294 -14.913 264 HA2 GLY 30 HA2 GLY 30 7.557 -3.746 -13.503 265 HA3 GLY 30 HA3 GLY 30 6.706 -5.254 -13.905 266 H TYR 31 H TYR 31 6.698 -4.478 -11.414 267 HA TYR 31 HA TYR 31 8.654 -5.841 -9.747 268 HB2 TYR 31 HB2 TYR 31 5.826 -4.927 -9.110 269 HB3 TYR 31 HB3 TYR 31 7.116 -5.309 -7.974 270 HD1 TYR 31 HD1 TYR 31 5.345 -2.724 -8.367 271 HD2 TYR 31 HD2 TYR 31 9.358 -3.758 -9.635 272 HE1 TYR 31 HE1 TYR 31 6.022 -0.361 -8.178 273 HE2 TYR 31 HE2 TYR 31 10.072 -1.433 -9.208 274 HH TYR 31 HH TYR 31 7.742 1.162 -8.355 275 H ARG 32 H ARG 32 8.549 -7.950 -9.061 276 HA ARG 32 HA ARG 32 6.190 -9.627 -9.851 277 HB2 ARG 32 HB2 ARG 32 7.779 -11.431 -10.493 278 HB3 ARG 32 HB3 ARG 32 7.746 -10.046 -11.564 279 HG2 ARG 32 HG2 ARG 32 9.863 -10.254 -9.402 280 HG3 ARG 32 HG3 ARG 32 10.010 -11.158 -10.916 281 HD2 ARG 32 HD2 ARG 32 9.813 -9.069 -12.222 282 HD3 ARG 32 HD3 ARG 32 9.720 -8.141 -10.717 283 HE ARG 32 HE ARG 32 12.054 -9.787 -10.684 284 HH11 ARG 32 HH11 ARG 32 14.040 -8.797 -10.692 285 HH12 ARG 32 HH12 ARG 32 14.252 -7.268 -11.510 286 HH21 ARG 32 HH21 ARG 32 10.898 -6.784 -12.118 287 HH22 ARG 32 HH22 ARG 32 12.512 -6.116 -12.204 288 H ALA 33 H ALA 33 6.900 -8.550 -7.272 289 HA ALA 33 HA ALA 33 7.086 -9.015 -5.087 290 HB1 ALA 33 HB1 ALA 33 5.677 -10.833 -4.318 291 HB2 ALA 33 HB2 ALA 33 4.944 -10.011 -5.716 292 HB3 ALA 33 HB3 ALA 33 5.714 -11.582 -5.938 293 H SER 34 H SER 34 8.128 -12.022 -6.759 294 HA SER 34 HA SER 34 9.674 -13.064 -4.661 295 HB2 SER 34 HB2 SER 34 9.952 -13.506 -7.653 296 HB3 SER 34 HB3 SER 34 10.641 -14.543 -6.387 297 HG SER 34 HG SER 34 8.614 -15.326 -7.158 298 H ASP 35 H ASP 35 10.550 -10.480 -6.811 299 HA ASP 35 HA ASP 35 13.448 -10.721 -6.252 300 HB2 ASP 35 HB2 ASP 35 11.732 -8.842 -7.881 301 HB3 ASP 35 HB3 ASP 35 13.368 -8.389 -7.428 302 H TRP 36 H TRP 36 10.803 -9.565 -4.428 303 HA TRP 36 HA TRP 36 12.345 -7.482 -3.024 304 HB2 TRP 36 HB2 TRP 36 9.603 -8.553 -2.365 305 HB3 TRP 36 HB3 TRP 36 10.335 -7.047 -1.858 306 HD1 TRP 36 HD1 TRP 36 11.003 -6.687 -5.318 307 HE1 TRP 36 HE1 TRP 36 9.109 -5.468 -6.584 308 HE3 TRP 36 HE3 TRP 36 7.178 -7.434 -2.003 309 HZ2 TRP 36 HZ2 TRP 36 6.422 -4.641 -6.051 310 HZ3 TRP 36 HZ3 TRP 36 4.951 -6.384 -2.400 311 HH2 TRP 36 HH2 TRP 36 4.582 -4.994 -4.418 312 H LYS 37 H LYS 37 12.241 -7.638 -0.621 313 HA LYS 37 HA LYS 37 13.373 -10.190 0.283 314 HB2 LYS 37 HB2 LYS 37 13.005 -7.601 1.835 315 HB3 LYS 37 HB3 LYS 37 13.922 -9.027 2.312 316 HG2 LYS 37 HG2 LYS 37 15.205 -8.628 0.033 317 HG3 LYS 37 HG3 LYS 37 14.588 -6.980 0.228 318 HD2 LYS 37 HD2 LYS 37 16.439 -8.566 2.031 319 HD3 LYS 37 HD3 LYS 37 16.746 -7.020 1.220 320 HE2 LYS 37 HE2 LYS 37 14.978 -5.989 2.735 321 HE3 LYS 37 HE3 LYS 37 14.880 -7.543 3.585 322 HZ1 LYS 37 HZ1 LYS 37 17.327 -5.864 3.378 323 HZ2 LYS 37 HZ2 LYS 37 16.401 -6.030 4.712 324 HZ3 LYS 37 HZ3 LYS 37 17.245 -7.306 4.143 325 H LEU 38 H LEU 38 11.015 -10.991 -0.287 326 HA LEU 38 HA LEU 38 8.807 -10.580 1.355 327 HB2 LEU 38 HB2 LEU 38 9.688 -13.167 0.017 328 HB3 LEU 38 HB3 LEU 38 8.052 -12.812 0.579 329 HG LEU 38 HG LEU 38 9.537 -11.462 -1.698 330 HD11 LEU 38 HD11 LEU 38 6.983 -13.129 -1.582 331 HD12 LEU 38 HD12 LEU 38 7.685 -12.416 -3.044 332 HD13 LEU 38 HD13 LEU 38 8.565 -13.685 -2.177 333 HD21 LEU 38 HD21 LEU 38 6.842 -10.774 -0.475 334 HD22 LEU 38 HD22 LEU 38 8.246 -9.705 -0.654 335 HD23 LEU 38 HD23 LEU 38 7.359 -10.232 -2.086 336 H ASP 39 H ASP 39 11.533 -12.690 2.099 337 HA ASP 39 HA ASP 39 10.164 -13.897 4.433 338 HB2 ASP 39 HB2 ASP 39 11.556 -15.211 2.820 339 HB3 ASP 39 HB3 ASP 39 12.971 -14.294 3.337 340 H GLN 40 H GLN 40 11.812 -11.030 3.903 341 HA GLN 40 HA GLN 40 13.063 -10.868 6.631 342 HB2 GLN 40 HB2 GLN 40 14.283 -10.335 3.903 343 HB3 GLN 40 HB3 GLN 40 15.025 -9.777 5.408 344 HG2 GLN 40 HG2 GLN 40 15.538 -11.899 6.112 345 HG3 GLN 40 HG3 GLN 40 14.337 -12.676 5.076 346 HE21 GLN 40 HE21 GLN 40 16.375 -12.670 2.119 347 HE22 GLN 40 HE22 GLN 40 14.706 -12.651 2.667 348 HA PRO 41 HA PRO 41 10.630 -7.295 5.263 349 HB2 PRO 41 HB2 PRO 41 9.424 -7.238 8.033 350 HB3 PRO 41 HB3 PRO 41 8.592 -7.038 6.470 351 HG2 PRO 41 HG2 PRO 41 8.446 -9.402 7.822 352 HG3 PRO 41 HG3 PRO 41 8.661 -9.394 6.043 353 HD2 PRO 41 HD2 PRO 41 10.792 -9.721 8.179 354 HD3 PRO 41 HD3 PRO 41 10.494 -10.711 6.724 355 H ASP 42 H ASP 42 10.867 -5.060 5.618 356 HA ASP 42 HA ASP 42 13.049 -4.142 7.375 357 HB2 ASP 42 HB2 ASP 42 12.613 -3.195 5.104 358 HB3 ASP 42 HB3 ASP 42 11.048 -2.607 5.668 359 H TRP 43 H TRP 43 9.550 -4.329 7.395 360 HA TRP 43 HA TRP 43 9.361 -3.859 10.262 361 HB2 TRP 43 HB2 TRP 43 9.344 -1.549 9.530 362 HB3 TRP 43 HB3 TRP 43 8.215 -1.905 8.237 363 HD1 TRP 43 HD1 TRP 43 8.335 -1.127 11.945 364 HE1 TRP 43 HE1 TRP 43 5.962 -0.573 12.760 365 HE3 TRP 43 HE3 TRP 43 5.707 -2.697 7.861 366 HZ2 TRP 43 HZ2 TRP 43 3.292 -0.514 11.627 367 HZ3 TRP 43 HZ3 TRP 43 3.248 -2.259 7.703 368 HH2 TRP 43 HH2 TRP 43 2.036 -1.210 9.591 369 H THR 44 H THR 44 7.285 -4.516 11.091 370 HA THR 44 HA THR 44 5.252 -5.467 9.173 371 HB THR 44 HB THR 44 4.710 -7.431 10.523 372 HG1 THR 44 HG1 THR 44 7.223 -7.007 11.764 373 HG21 THR 44 HG21 THR 44 6.163 -7.633 8.522 374 HG22 THR 44 HG22 THR 44 7.590 -7.595 9.579 375 HG23 THR 44 HG23 THR 44 6.400 -8.915 9.717 376 H GLY 45 H GLY 45 3.149 -5.353 9.877 377 HA2 GLY 45 HA2 GLY 45 2.281 -4.759 12.527 378 HA3 GLY 45 HA3 GLY 45 2.551 -3.234 11.689 379 H ARG 46 H ARG 46 0.539 -2.522 11.421 380 HA ARG 46 HA ARG 46 -1.587 -4.287 10.273 381 HB2 ARG 46 HB2 ARG 46 -1.856 -1.805 12.007 382 HB3 ARG 46 HB3 ARG 46 -3.167 -2.853 11.452 383 HG2 ARG 46 HG2 ARG 46 -2.154 -4.745 12.751 384 HG3 ARG 46 HG3 ARG 46 -0.928 -3.643 13.382 385 HD2 ARG 46 HD2 ARG 46 -3.933 -3.271 13.769 386 HD3 ARG 46 HD3 ARG 46 -2.865 -4.068 14.921 387 HE ARG 46 HE ARG 46 -1.717 -2.011 15.358 388 HH11 ARG 46 HH11 ARG 46 -1.590 0.096 15.535 389 HH12 ARG 46 HH12 ARG 46 -2.784 1.133 14.715 390 HH21 ARG 46 HH21 ARG 46 -4.493 -1.323 13.236 391 HH22 ARG 46 HH22 ARG 46 -4.205 0.404 13.482 392 H LEU 47 H LEU 47 -2.882 -3.588 8.699 393 HA LEU 47 HA LEU 47 -2.095 -1.258 7.034 394 HB2 LEU 47 HB2 LEU 47 -2.657 -3.402 5.898 395 HB3 LEU 47 HB3 LEU 47 -4.211 -3.413 6.734 396 HG LEU 47 HG LEU 47 -4.828 -1.269 5.517 397 HD11 LEU 47 HD11 LEU 47 -2.378 -1.970 3.846 398 HD12 LEU 47 HD12 LEU 47 -3.590 -0.723 3.476 399 HD13 LEU 47 HD13 LEU 47 -2.542 -0.535 4.882 400 HD21 LEU 47 HD21 LEU 47 -5.418 -2.394 3.461 401 HD22 LEU 47 HD22 LEU 47 -4.265 -3.698 3.827 402 HD23 LEU 47 HD23 LEU 47 -5.684 -3.437 4.856 403 H ARG 48 H ARG 48 -3.209 0.602 7.025 404 HA ARG 48 HA ARG 48 -6.111 0.543 7.594 405 HB2 ARG 48 HB2 ARG 48 -5.636 1.667 9.513 406 HB3 ARG 48 HB3 ARG 48 -4.091 2.254 8.948 407 HG2 ARG 48 HG2 ARG 48 -5.249 3.998 7.570 408 HG3 ARG 48 HG3 ARG 48 -6.802 3.465 8.269 409 HD2 ARG 48 HD2 ARG 48 -5.974 3.944 10.519 410 HD3 ARG 48 HD3 ARG 48 -4.356 4.295 9.887 411 HE ARG 48 HE ARG 48 -6.071 6.110 8.608 412 HH11 ARG 48 HH11 ARG 48 -6.334 8.258 9.412 413 HH12 ARG 48 HH12 ARG 48 -6.070 8.546 11.108 414 HH21 ARG 48 HH21 ARG 48 -4.853 5.443 11.854 415 HH22 ARG 48 HH22 ARG 48 -5.253 7.041 12.431 416 H ILE 49 H ILE 49 -7.250 1.425 6.022 417 HA ILE 49 HA ILE 49 -5.944 3.321 4.121 418 HB ILE 49 HB ILE 49 -8.186 1.426 3.356 419 HG12 ILE 49 HG12 ILE 49 -5.197 1.262 2.773 420 HG13 ILE 49 HG13 ILE 49 -6.179 0.103 3.665 421 HG21 ILE 49 HG21 ILE 49 -6.470 3.323 1.679 422 HG22 ILE 49 HG22 ILE 49 -7.808 2.309 1.092 423 HG23 ILE 49 HG23 ILE 49 -8.141 3.642 2.174 424 HD11 ILE 49 HD11 ILE 49 -6.211 0.634 0.686 425 HD12 ILE 49 HD12 ILE 49 -5.885 -0.870 1.557 426 HD13 ILE 49 HD13 ILE 49 -7.529 -0.236 1.515 427 H THR 50 H THR 50 -6.890 5.169 3.953 428 HA THR 50 HA THR 50 -9.427 5.861 5.372 429 HB THR 50 HB THR 50 -7.606 7.823 6.018 430 HG1 THR 50 HG1 THR 50 -5.897 6.213 5.604 431 HG21 THR 50 HG21 THR 50 -7.986 7.017 8.293 432 HG22 THR 50 HG22 THR 50 -9.485 6.785 7.376 433 HG23 THR 50 HG23 THR 50 -8.398 5.400 7.674 434 H SER 51 H SER 51 -10.157 8.167 4.792 435 HA SER 51 HA SER 51 -9.190 9.165 2.186 436 HB2 SER 51 HB2 SER 51 -11.247 8.680 1.017 437 HB3 SER 51 HB3 SER 51 -10.439 7.194 1.513 438 HG SER 51 HG SER 51 -11.899 7.181 3.363 439 H LYS 52 H LYS 52 -9.575 11.131 1.809 440 HA LYS 52 HA LYS 52 -11.933 12.442 2.516 441 HB2 LYS 52 HB2 LYS 52 -10.880 14.310 3.821 442 HB3 LYS 52 HB3 LYS 52 -11.463 12.797 4.550 443 HG2 LYS 52 HG2 LYS 52 -9.770 12.926 5.767 444 HG3 LYS 52 HG3 LYS 52 -8.967 12.135 4.461 445 HD2 LYS 52 HD2 LYS 52 -8.100 14.413 3.743 446 HD3 LYS 52 HD3 LYS 52 -8.993 15.123 5.142 447 HE2 LYS 52 HE2 LYS 52 -8.003 13.419 6.605 448 HE3 LYS 52 HE3 LYS 52 -7.077 12.794 5.244 449 HZ1 LYS 52 HZ1 LYS 52 -5.883 14.944 5.153 450 HZ2 LYS 52 HZ2 LYS 52 -6.759 15.532 6.415 451 HZ3 LYS 52 HZ3 LYS 52 -5.717 14.298 6.645 452 H GLY 53 H GLY 53 -12.374 14.040 1.348 453 HA2 GLY 53 HA2 GLY 53 -12.338 15.786 -0.204 454 HA3 GLY 53 HA3 GLY 53 -10.677 16.087 0.322 455 H LYS 54 H LYS 54 -12.227 13.396 -1.449 456 HA LYS 54 HA LYS 54 -11.664 12.207 -3.309 457 HB2 LYS 54 HB2 LYS 54 -10.902 14.917 -4.445 458 HB3 LYS 54 HB3 LYS 54 -11.162 13.437 -5.379 459 HG2 LYS 54 HG2 LYS 54 -13.489 13.301 -4.591 460 HG3 LYS 54 HG3 LYS 54 -13.294 14.797 -3.669 461 HD2 LYS 54 HD2 LYS 54 -13.061 14.529 -6.692 462 HD3 LYS 54 HD3 LYS 54 -14.460 15.149 -5.800 463 HE2 LYS 54 HE2 LYS 54 -13.050 16.982 -4.870 464 HE3 LYS 54 HE3 LYS 54 -11.675 16.396 -5.816 465 HZ1 LYS 54 HZ1 LYS 54 -12.965 16.832 -7.840 466 HZ2 LYS 54 HZ2 LYS 54 -14.235 17.378 -6.965 467 HZ3 LYS 54 HZ3 LYS 54 -12.826 18.198 -6.960 468 H THR 55 H THR 55 -9.756 12.412 -1.256 469 HA THR 55 HA THR 55 -7.336 11.458 -2.682 470 HB THR 55 HB THR 55 -7.287 13.102 -0.117 471 HG1 THR 55 HG1 THR 55 -7.821 14.455 -1.811 472 HG21 THR 55 HG21 THR 55 -5.061 12.276 -2.014 473 HG22 THR 55 HG22 THR 55 -4.893 13.255 -0.543 474 HG23 THR 55 HG23 THR 55 -5.376 11.558 -0.412 475 H ALA 56 H ALA 56 -6.641 9.529 -1.919 476 HA ALA 56 HA ALA 56 -7.910 8.386 0.534 477 HB1 ALA 56 HB1 ALA 56 -8.399 7.090 -1.497 478 HB2 ALA 56 HB2 ALA 56 -6.649 6.884 -1.775 479 HB3 ALA 56 HB3 ALA 56 -7.412 6.185 -0.337 480 H TYR 57 H TYR 57 -6.561 7.131 1.870 481 HA TYR 57 HA TYR 57 -3.747 8.099 2.132 482 HB2 TYR 57 HB2 TYR 57 -6.048 8.279 4.144 483 HB3 TYR 57 HB3 TYR 57 -4.374 8.683 4.465 484 HD1 TYR 57 HD1 TYR 57 -3.288 10.491 2.956 485 HD2 TYR 57 HD2 TYR 57 -7.571 10.115 3.536 486 HE1 TYR 57 HE1 TYR 57 -3.613 12.869 2.286 487 HE2 TYR 57 HE2 TYR 57 -7.878 12.416 2.733 488 HH TYR 57 HH TYR 57 -5.108 14.555 1.926 489 H ILE 58 H ILE 58 -2.890 5.987 1.758 490 HA ILE 58 HA ILE 58 -3.779 3.746 3.501 491 HB ILE 58 HB ILE 58 -1.406 3.882 1.596 492 HG12 ILE 58 HG12 ILE 58 -2.830 2.020 0.429 493 HG13 ILE 58 HG13 ILE 58 -4.203 2.731 1.268 494 HG21 ILE 58 HG21 ILE 58 -1.269 1.446 1.977 495 HG22 ILE 58 HG22 ILE 58 -1.020 2.324 3.473 496 HG23 ILE 58 HG23 ILE 58 -2.590 1.551 3.165 497 HD11 ILE 58 HD11 ILE 58 -3.872 3.493 -1.089 498 HD12 ILE 58 HD12 ILE 58 -3.846 4.846 0.051 499 HD13 ILE 58 HD13 ILE 58 -2.320 4.210 -0.625 500 H LYS 59 H LYS 59 -3.300 3.946 5.610 501 HA LYS 59 HA LYS 59 -0.592 5.020 6.365 502 HB2 LYS 59 HB2 LYS 59 -3.139 5.072 8.017 503 HB3 LYS 59 HB3 LYS 59 -1.559 5.715 8.471 504 HG2 LYS 59 HG2 LYS 59 -1.734 7.148 6.311 505 HG3 LYS 59 HG3 LYS 59 -3.437 6.700 6.287 506 HD2 LYS 59 HD2 LYS 59 -3.753 7.716 8.505 507 HD3 LYS 59 HD3 LYS 59 -2.022 8.154 8.564 508 HE2 LYS 59 HE2 LYS 59 -2.243 9.637 6.677 509 HE3 LYS 59 HE3 LYS 59 -3.882 9.054 6.342 510 HZ1 LYS 59 HZ1 LYS 59 -3.195 10.497 8.835 511 HZ2 LYS 59 HZ2 LYS 59 -3.876 11.196 7.512 512 HZ3 LYS 59 HZ3 LYS 59 -4.699 10.055 8.289 513 H LEU 60 H LEU 60 0.794 3.722 7.290 514 HA LEU 60 HA LEU 60 -0.057 0.978 8.120 515 HB2 LEU 60 HB2 LEU 60 2.429 2.201 6.985 516 HB3 LEU 60 HB3 LEU 60 2.648 0.946 8.192 517 HG LEU 60 HG LEU 60 1.420 -0.672 6.938 518 HD11 LEU 60 HD11 LEU 60 0.909 1.514 4.869 519 HD12 LEU 60 HD12 LEU 60 0.600 -0.219 4.619 520 HD13 LEU 60 HD13 LEU 60 -0.323 0.667 5.833 521 HD21 LEU 60 HD21 LEU 60 3.814 -0.253 6.384 522 HD22 LEU 60 HD22 LEU 60 2.902 -0.893 5.011 523 HD23 LEU 60 HD23 LEU 60 3.311 0.836 5.078 524 H GLU 61 H GLU 61 -0.020 0.320 10.171 525 HA GLU 61 HA GLU 61 0.978 2.233 12.263 526 HB2 GLU 61 HB2 GLU 61 -1.644 0.730 12.305 527 HB3 GLU 61 HB3 GLU 61 -0.977 1.784 13.569 528 HG2 GLU 61 HG2 GLU 61 -1.160 3.721 12.038 529 HG3 GLU 61 HG3 GLU 61 -1.942 2.678 10.838 530 H ASP 62 H ASP 62 1.630 1.387 14.256 531 HA ASP 62 HA ASP 62 2.755 -1.251 14.134 532 HB2 ASP 62 HB2 ASP 62 3.651 0.864 15.257 533 HB3 ASP 62 HB3 ASP 62 2.474 0.539 16.546 534 H LYS 63 H LYS 63 2.327 -3.038 15.285 535 HA LYS 63 HA LYS 63 -0.454 -3.525 16.077 536 HB2 LYS 63 HB2 LYS 63 0.379 -5.957 16.123 537 HB3 LYS 63 HB3 LYS 63 0.426 -5.143 14.562 538 HG2 LYS 63 HG2 LYS 63 2.799 -4.722 14.741 539 HG3 LYS 63 HG3 LYS 63 2.851 -5.345 16.397 540 HD2 LYS 63 HD2 LYS 63 2.474 -7.586 15.662 541 HD3 LYS 63 HD3 LYS 63 1.989 -7.049 14.031 542 HE2 LYS 63 HE2 LYS 63 4.258 -6.112 13.666 543 HE3 LYS 63 HE3 LYS 63 4.768 -6.686 15.253 544 HZ1 LYS 63 HZ1 LYS 63 5.343 -8.147 13.315 545 HZ2 LYS 63 HZ2 LYS 63 4.540 -8.938 14.516 546 HZ3 LYS 63 HZ3 LYS 63 3.766 -8.512 13.136 547 H VAL 64 H VAL 64 2.214 -2.594 17.807 548 HA VAL 64 HA VAL 64 1.015 -3.665 20.331 549 HB VAL 64 HB VAL 64 3.917 -3.083 19.640 550 HG11 VAL 64 HG11 VAL 64 2.711 -4.032 22.279 551 HG12 VAL 64 HG12 VAL 64 4.448 -4.003 21.901 552 HG13 VAL 64 HG13 VAL 64 3.552 -2.489 21.993 553 HG21 VAL 64 HG21 VAL 64 2.500 -5.701 20.306 554 HG22 VAL 64 HG22 VAL 64 3.171 -5.233 18.728 555 HG23 VAL 64 HG23 VAL 64 4.255 -5.509 20.089 556 H SER 65 H SER 65 2.738 -0.871 18.848 557 HA SER 65 HA SER 65 2.106 0.755 21.244 558 HB2 SER 65 HB2 SER 65 3.741 1.358 18.761 559 HB3 SER 65 HB3 SER 65 3.549 2.448 20.147 560 HG SER 65 HG SER 65 5.457 1.186 20.291 561 H GLY 66 H GLY 66 0.868 0.354 18.017 562 HA2 GLY 66 HA2 GLY 66 -1.045 1.251 17.050 563 HA3 GLY 66 HA3 GLY 66 -1.297 2.274 18.464 564 H GLU 67 H GLU 67 1.864 2.603 17.286 565 HA GLU 67 HA GLU 67 1.351 5.345 16.478 566 HB2 GLU 67 HB2 GLU 67 3.681 5.658 16.695 567 HB3 GLU 67 HB3 GLU 67 3.145 4.631 18.034 568 HG2 GLU 67 HG2 GLU 67 4.021 2.634 16.871 569 HG3 GLU 67 HG3 GLU 67 4.563 3.639 15.523 570 H LEU 68 H LEU 68 2.212 6.342 14.552 571 HA LEU 68 HA LEU 68 1.629 4.818 12.146 572 HB2 LEU 68 HB2 LEU 68 1.042 7.244 12.501 573 HB3 LEU 68 HB3 LEU 68 2.762 7.621 12.481 574 HG LEU 68 HG LEU 68 2.823 6.598 10.111 575 HD11 LEU 68 HD11 LEU 68 0.708 6.537 8.888 576 HD12 LEU 68 HD12 LEU 68 0.617 5.411 10.241 577 HD13 LEU 68 HD13 LEU 68 -0.195 6.980 10.355 578 HD21 LEU 68 HD21 LEU 68 1.949 8.641 9.070 579 HD22 LEU 68 HD22 LEU 68 1.112 9.072 10.580 580 HD23 LEU 68 HD23 LEU 68 2.889 9.022 10.520 581 H PHE 69 H PHE 69 3.004 3.699 10.911 582 HA PHE 69 HA PHE 69 5.952 3.912 11.229 583 HB2 PHE 69 HB2 PHE 69 5.122 1.689 11.083 584 HB3 PHE 69 HB3 PHE 69 4.115 2.058 9.692 585 HD1 PHE 69 HD1 PHE 69 4.909 1.594 7.505 586 HD2 PHE 69 HD2 PHE 69 7.730 2.012 10.743 587 HE1 PHE 69 HE1 PHE 69 6.765 1.021 5.968 588 HE2 PHE 69 HE2 PHE 69 9.578 1.383 9.208 589 HZ PHE 69 HZ PHE 69 9.100 0.889 6.818 590 H ALA 70 H ALA 70 3.556 4.149 8.558 591 HA ALA 70 HA ALA 70 4.945 6.417 7.338 592 HB1 ALA 70 HB1 ALA 70 4.761 3.720 5.903 593 HB2 ALA 70 HB2 ALA 70 5.386 5.239 5.226 594 HB3 ALA 70 HB3 ALA 70 6.258 4.441 6.538 595 H GLN 71 H GLN 71 3.715 7.290 5.473 596 HA GLN 71 HA GLN 71 1.003 6.190 5.097 597 HB2 GLN 71 HB2 GLN 71 -0.111 8.284 5.433 598 HB3 GLN 71 HB3 GLN 71 0.734 7.791 6.887 599 HG2 GLN 71 HG2 GLN 71 1.400 9.945 6.961 600 HG3 GLN 71 HG3 GLN 71 2.638 9.442 5.826 601 HE21 GLN 71 HE21 GLN 71 1.454 11.992 3.660 602 HE22 GLN 71 HE22 GLN 71 2.838 11.119 4.327 603 H ALA 72 H ALA 72 0.214 6.300 3.121 604 HA ALA 72 HA ALA 72 1.700 7.797 1.000 605 HB1 ALA 72 HB1 ALA 72 1.036 5.937 -0.489 606 HB2 ALA 72 HB2 ALA 72 2.116 5.438 0.820 607 HB3 ALA 72 HB3 ALA 72 0.386 5.067 0.916 608 HA PRO 73 HA PRO 73 -2.519 9.506 0.513 609 HB2 PRO 73 HB2 PRO 73 -1.821 11.974 -0.396 610 HB3 PRO 73 HB3 PRO 73 -1.814 11.539 1.342 611 HG2 PRO 73 HG2 PRO 73 0.526 11.581 -0.566 612 HG3 PRO 73 HG3 PRO 73 0.432 12.276 1.081 613 HD2 PRO 73 HD2 PRO 73 1.535 9.822 0.591 614 HD3 PRO 73 HD3 PRO 73 0.632 10.158 2.092 615 H VAL 74 H VAL 74 -3.674 9.474 -1.306 616 HA VAL 74 HA VAL 74 -2.388 9.059 -3.985 617 HB VAL 74 HB VAL 74 -4.770 7.507 -2.892 618 HG11 VAL 74 HG11 VAL 74 -4.263 5.944 -4.742 619 HG12 VAL 74 HG12 VAL 74 -4.622 7.565 -5.331 620 HG13 VAL 74 HG13 VAL 74 -2.937 6.997 -5.273 621 HG21 VAL 74 HG21 VAL 74 -2.931 6.834 -1.475 622 HG22 VAL 74 HG22 VAL 74 -3.328 5.554 -2.611 623 HG23 VAL 74 HG23 VAL 74 -1.888 6.558 -2.885 624 H GLU 75 H GLU 75 -3.314 10.410 -5.532 625 HA GLU 75 HA GLU 75 -5.767 11.914 -4.776 626 HB2 GLU 75 HB2 GLU 75 -3.837 12.190 -7.112 627 HB3 GLU 75 HB3 GLU 75 -5.235 13.234 -6.819 628 HG2 GLU 75 HG2 GLU 75 -4.297 13.865 -4.598 629 HG3 GLU 75 HG3 GLU 75 -2.864 12.893 -4.934 630 H GLN 76 H GLN 76 -4.960 9.270 -6.861 631 HA GLN 76 HA GLN 76 -7.721 8.689 -7.377 632 HB2 GLN 76 HB2 GLN 76 -7.800 8.777 -9.734 633 HB3 GLN 76 HB3 GLN 76 -7.290 10.365 -9.210 634 HG2 GLN 76 HG2 GLN 76 -5.506 8.211 -10.438 635 HG3 GLN 76 HG3 GLN 76 -6.141 9.628 -11.248 636 HE21 GLN 76 HE21 GLN 76 -2.824 10.019 -8.889 637 HE22 GLN 76 HE22 GLN 76 -3.801 8.539 -8.794 638 H TYR 77 H TYR 77 -8.009 6.510 -8.079 639 HA TYR 77 HA TYR 77 -5.546 4.886 -8.410 640 HB2 TYR 77 HB2 TYR 77 -6.440 4.689 -6.110 641 HB3 TYR 77 HB3 TYR 77 -7.959 4.096 -6.796 642 HD1 TYR 77 HD1 TYR 77 -4.273 3.395 -7.033 643 HD2 TYR 77 HD2 TYR 77 -8.263 1.789 -6.854 644 HE1 TYR 77 HE1 TYR 77 -3.356 1.094 -7.232 645 HE2 TYR 77 HE2 TYR 77 -7.336 -0.527 -6.933 646 HH TYR 77 HH TYR 77 -3.823 -1.150 -7.266 647 HA PRO 78 HA PRO 78 -4.813 2.979 -9.533 648 HB2 PRO 78 HB2 PRO 78 -4.787 2.944 -12.533 649 HB3 PRO 78 HB3 PRO 78 -4.068 1.784 -11.369 650 HG2 PRO 78 HG2 PRO 78 -6.383 1.170 -12.629 651 HG3 PRO 78 HG3 PRO 78 -6.217 0.844 -10.871 652 HD2 PRO 78 HD2 PRO 78 -7.534 3.230 -12.214 653 HD3 PRO 78 HD3 PRO 78 -8.168 2.189 -10.907 654 H GLY 79 H GLY 79 -2.893 4.133 -9.597 655 HA2 GLY 79 HA2 GLY 79 -2.455 6.528 -11.213 656 HA3 GLY 79 HA3 GLY 79 -2.809 6.846 -9.511 657 H ILE 80 H ILE 80 -0.634 7.750 -9.331 658 HA ILE 80 HA ILE 80 1.658 5.998 -9.821 659 HB ILE 80 HB ILE 80 1.830 8.329 -10.360 660 HG12 ILE 80 HG12 ILE 80 3.685 7.674 -8.030 661 HG13 ILE 80 HG13 ILE 80 3.818 6.951 -9.634 662 HG21 ILE 80 HG21 ILE 80 0.349 9.272 -8.551 663 HG22 ILE 80 HG22 ILE 80 1.659 8.993 -7.381 664 HG23 ILE 80 HG23 ILE 80 1.875 10.126 -8.724 665 HD11 ILE 80 HD11 ILE 80 5.426 8.741 -9.374 666 HD12 ILE 80 HD12 ILE 80 4.229 9.190 -10.611 667 HD13 ILE 80 HD13 ILE 80 4.150 9.903 -8.979 668 H ALA 81 H ALA 81 -0.046 7.080 -6.882 669 HA ALA 81 HA ALA 81 2.131 6.205 -5.140 670 HB1 ALA 81 HB1 ALA 81 -0.610 7.376 -4.570 671 HB2 ALA 81 HB2 ALA 81 0.681 7.140 -3.371 672 HB3 ALA 81 HB3 ALA 81 0.914 8.271 -4.714 673 H VAL 82 H VAL 82 0.225 4.247 -6.707 674 HA VAL 82 HA VAL 82 0.388 2.109 -4.735 675 HB VAL 82 HB VAL 82 -2.290 2.751 -5.970 676 HG11 VAL 82 HG11 VAL 82 -1.489 0.689 -3.850 677 HG12 VAL 82 HG12 VAL 82 -3.135 0.949 -4.457 678 HG13 VAL 82 HG13 VAL 82 -1.892 0.313 -5.533 679 HG21 VAL 82 HG21 VAL 82 -3.194 3.193 -3.736 680 HG22 VAL 82 HG22 VAL 82 -1.551 3.160 -3.066 681 HG23 VAL 82 HG23 VAL 82 -2.021 4.395 -4.256 682 H GLU 83 H GLU 83 1.056 0.341 -5.837 683 HA GLU 83 HA GLU 83 0.126 -0.191 -8.617 684 HB2 GLU 83 HB2 GLU 83 3.040 0.054 -7.768 685 HB3 GLU 83 HB3 GLU 83 2.548 -0.996 -9.097 686 HG2 GLU 83 HG2 GLU 83 1.326 1.015 -10.081 687 HG3 GLU 83 HG3 GLU 83 2.258 2.002 -8.935 688 H THR 84 H THR 84 0.429 -2.334 -9.358 689 HA THR 84 HA THR 84 0.382 -4.436 -7.239 690 HB THR 84 HB THR 84 -0.689 -5.816 -8.990 691 HG1 THR 84 HG1 THR 84 0.015 -4.945 -10.886 692 HG21 THR 84 HG21 THR 84 -2.837 -4.655 -9.087 693 HG22 THR 84 HG22 THR 84 -2.101 -4.443 -7.492 694 HG23 THR 84 HG23 THR 84 -2.066 -3.109 -8.666 695 H VAL 85 H VAL 85 1.489 -6.461 -7.651 696 HA VAL 85 HA VAL 85 3.928 -6.309 -9.307 697 HB VAL 85 HB VAL 85 4.451 -8.488 -8.394 698 HG11 VAL 85 HG11 VAL 85 3.526 -6.600 -6.192 699 HG12 VAL 85 HG12 VAL 85 4.792 -7.824 -6.075 700 HG13 VAL 85 HG13 VAL 85 5.019 -6.428 -7.135 701 HG21 VAL 85 HG21 VAL 85 2.137 -9.411 -8.227 702 HG22 VAL 85 HG22 VAL 85 3.062 -9.598 -6.745 703 HG23 VAL 85 HG23 VAL 85 1.829 -8.335 -6.855 704 H THR 86 H THR 86 4.318 -8.355 -10.684 705 HA THR 86 HA THR 86 2.046 -8.803 -12.514 706 HB THR 86 HB THR 86 3.746 -9.714 -14.008 707 HG1 THR 86 HG1 THR 86 5.901 -9.730 -13.339 708 HG21 THR 86 HG21 THR 86 3.481 -7.231 -13.870 709 HG22 THR 86 HG22 THR 86 4.782 -7.181 -12.667 710 HG23 THR 86 HG23 THR 86 5.133 -7.723 -14.317 711 H ASP 87 H ASP 87 4.004 -10.656 -10.251 712 HA ASP 87 HA ASP 87 3.210 -13.198 -11.444 713 HB2 ASP 87 HB2 ASP 87 5.536 -12.630 -10.752 714 HB3 ASP 87 HB3 ASP 87 4.997 -12.648 -9.068 715 H SER 88 H SER 88 2.657 -11.617 -8.274 716 HA SER 88 HA SER 88 0.613 -13.743 -7.657 717 HB2 SER 88 HB2 SER 88 2.736 -14.330 -6.567 718 HB3 SER 88 HB3 SER 88 2.754 -12.760 -5.754 719 HG SER 88 HG SER 88 0.993 -14.958 -5.399 720 H SER 89 H SER 89 -1.292 -12.930 -7.251 721 HA SER 89 HA SER 89 -1.757 -10.154 -7.115 722 HB2 SER 89 HB2 SER 89 -3.750 -12.390 -6.667 723 HB3 SER 89 HB3 SER 89 -4.094 -10.743 -7.234 724 HG SER 89 HG SER 89 -3.985 -12.230 -8.974 725 H ARG 90 H ARG 90 -0.400 -11.122 -4.664 726 HA ARG 90 HA ARG 90 -2.151 -9.900 -2.603 727 HB2 ARG 90 HB2 ARG 90 -1.292 -11.590 -0.930 728 HB3 ARG 90 HB3 ARG 90 -2.504 -12.101 -2.090 729 HG2 ARG 90 HG2 ARG 90 -0.887 -13.239 -3.455 730 HG3 ARG 90 HG3 ARG 90 0.464 -12.602 -2.508 731 HD2 ARG 90 HD2 ARG 90 -1.679 -14.417 -1.340 732 HD3 ARG 90 HD3 ARG 90 -0.238 -15.027 -2.159 733 HE ARG 90 HE ARG 90 0.104 -13.145 0.140 734 HH11 ARG 90 HH11 ARG 90 1.477 -13.663 1.665 735 HH12 ARG 90 HH12 ARG 90 2.221 -15.252 1.751 736 HH21 ARG 90 HH21 ARG 90 0.568 -16.432 -1.030 737 HH22 ARG 90 HH22 ARG 90 1.682 -16.799 0.257 738 H TYR 91 H TYR 91 0.053 -8.838 -4.221 739 HA TYR 91 HA TYR 91 1.650 -7.665 -2.023 740 HB2 TYR 91 HB2 TYR 91 2.783 -8.850 -4.580 741 HB3 TYR 91 HB3 TYR 91 3.689 -7.913 -3.416 742 HD1 TYR 91 HD1 TYR 91 2.334 -11.198 -4.222 743 HD2 TYR 91 HD2 TYR 91 4.127 -8.815 -1.124 744 HE1 TYR 91 HE1 TYR 91 2.904 -13.272 -2.973 745 HE2 TYR 91 HE2 TYR 91 4.620 -10.892 0.182 746 HH TYR 91 HH TYR 91 3.855 -14.153 -1.082 747 H PHE 92 H PHE 92 2.128 -5.515 -2.304 748 HA PHE 92 HA PHE 92 1.517 -4.179 -4.898 749 HB2 PHE 92 HB2 PHE 92 0.473 -3.241 -2.198 750 HB3 PHE 92 HB3 PHE 92 0.226 -2.445 -3.738 751 HD1 PHE 92 HD1 PHE 92 -0.743 -5.226 -1.586 752 HD2 PHE 92 HD2 PHE 92 -1.369 -3.363 -5.410 753 HE1 PHE 92 HE1 PHE 92 -2.816 -6.523 -1.857 754 HE2 PHE 92 HE2 PHE 92 -3.432 -4.736 -5.730 755 HZ PHE 92 HZ PHE 92 -4.154 -6.321 -3.973 756 H VAL 93 H VAL 93 2.313 -1.986 -4.995 757 HA VAL 93 HA VAL 93 4.438 -1.280 -3.012 758 HB VAL 93 HB VAL 93 4.376 -0.653 -5.982 759 HG11 VAL 93 HG11 VAL 93 6.362 0.335 -3.894 760 HG12 VAL 93 HG12 VAL 93 6.490 0.544 -5.653 761 HG13 VAL 93 HG13 VAL 93 5.184 1.334 -4.777 762 HG21 VAL 93 HG21 VAL 93 6.614 -1.825 -5.882 763 HG22 VAL 93 HG22 VAL 93 6.250 -2.268 -4.209 764 HG23 VAL 93 HG23 VAL 93 5.218 -2.848 -5.538 765 H ILE 94 H ILE 94 4.287 0.791 -2.116 766 HA ILE 94 HA ILE 94 2.314 2.613 -3.345 767 HB ILE 94 HB ILE 94 1.423 3.391 -1.306 768 HG12 ILE 94 HG12 ILE 94 3.289 2.613 0.255 769 HG13 ILE 94 HG13 ILE 94 1.642 2.506 0.838 770 HG21 ILE 94 HG21 ILE 94 0.881 0.429 -1.685 771 HG22 ILE 94 HG22 ILE 94 -0.160 1.595 -0.831 772 HG23 ILE 94 HG23 ILE 94 0.161 1.781 -2.561 773 HD11 ILE 94 HD11 ILE 94 1.610 0.080 0.498 774 HD12 ILE 94 HD12 ILE 94 3.247 0.120 -0.185 775 HD13 ILE 94 HD13 ILE 94 2.974 0.562 1.510 776 H ARG 95 H ARG 95 2.628 4.789 -3.053 777 HA ARG 95 HA ARG 95 5.469 5.518 -2.511 778 HB2 ARG 95 HB2 ARG 95 4.324 6.231 -4.646 779 HB3 ARG 95 HB3 ARG 95 3.333 7.329 -3.672 780 HG2 ARG 95 HG2 ARG 95 5.471 8.364 -2.798 781 HG3 ARG 95 HG3 ARG 95 6.372 7.301 -3.885 782 HD2 ARG 95 HD2 ARG 95 6.254 9.347 -5.014 783 HD3 ARG 95 HD3 ARG 95 5.034 8.335 -5.807 784 HE ARG 95 HE ARG 95 3.712 9.780 -3.753 785 HH11 ARG 95 HH11 ARG 95 2.819 11.850 -3.960 786 HH12 ARG 95 HH12 ARG 95 2.997 12.684 -5.472 787 HH21 ARG 95 HH21 ARG 95 5.280 10.511 -6.795 788 HH22 ARG 95 HH22 ARG 95 4.415 12.010 -6.990 789 H ILE 96 H ILE 96 5.559 5.414 -0.301 790 HA ILE 96 HA ILE 96 3.742 7.026 1.344 791 HB ILE 96 HB ILE 96 5.011 6.492 3.256 792 HG12 ILE 96 HG12 ILE 96 6.845 4.531 2.767 793 HG13 ILE 96 HG13 ILE 96 7.116 5.520 1.345 794 HG21 ILE 96 HG21 ILE 96 4.461 4.064 1.539 795 HG22 ILE 96 HG22 ILE 96 4.654 4.058 3.297 796 HG23 ILE 96 HG23 ILE 96 3.313 4.938 2.587 797 HD11 ILE 96 HD11 ILE 96 7.244 6.426 4.259 798 HD12 ILE 96 HD12 ILE 96 8.622 6.132 3.187 799 HD13 ILE 96 HD13 ILE 96 7.528 7.491 2.857 800 H GLN 97 H GLN 97 4.127 8.966 2.328 801 HA GLN 97 HA GLN 97 6.312 10.651 1.177 802 HB2 GLN 97 HB2 GLN 97 3.313 11.089 1.054 803 HB3 GLN 97 HB3 GLN 97 4.462 12.415 0.872 804 HG2 GLN 97 HG2 GLN 97 5.239 11.721 -1.167 805 HG3 GLN 97 HG3 GLN 97 4.899 10.016 -0.889 806 HE21 GLN 97 HE21 GLN 97 1.610 10.134 -2.224 807 HE22 GLN 97 HE22 GLN 97 2.834 9.156 -1.436 808 H ASP 98 H ASP 98 6.906 12.420 2.321 809 HA ASP 98 HA ASP 98 6.300 12.267 5.225 810 HB2 ASP 98 HB2 ASP 98 8.623 12.019 4.258 811 HB3 ASP 98 HB3 ASP 98 8.546 13.725 3.826 812 H GLY 99 H GLY 99 4.726 13.805 3.029 813 HA2 GLY 99 HA2 GLY 99 3.194 15.524 3.147 814 HA3 GLY 99 HA3 GLY 99 3.779 15.911 4.766 815 H THR 100 H THR 100 6.323 15.969 2.561 816 HA THR 100 HA THR 100 6.157 18.929 2.124 817 HB THR 100 HB THR 100 7.451 18.233 4.128 818 HG1 THR 100 HG1 THR 100 9.157 19.594 3.706 819 HG21 THR 100 HG21 THR 100 8.472 16.151 3.258 820 HG22 THR 100 HG22 THR 100 9.475 17.115 2.143 821 HG23 THR 100 HG23 THR 100 9.674 17.275 3.898 822 H GLY 101 H GLY 101 6.181 16.175 0.413 823 HA2 GLY 101 HA2 GLY 101 6.403 16.037 -1.952 824 HA3 GLY 101 HA3 GLY 101 7.594 17.337 -1.940 825 H ARG 102 H ARG 102 8.563 15.505 0.546 826 HA ARG 102 HA ARG 102 10.557 13.838 -0.788 827 HB2 ARG 102 HB2 ARG 102 11.172 15.023 1.218 828 HB3 ARG 102 HB3 ARG 102 9.723 14.475 2.063 829 HG2 ARG 102 HG2 ARG 102 10.566 12.153 2.029 830 HG3 ARG 102 HG3 ARG 102 12.062 12.730 1.243 831 HD2 ARG 102 HD2 ARG 102 12.419 14.254 3.215 832 HD3 ARG 102 HD3 ARG 102 10.949 13.596 3.942 833 HE ARG 102 HE ARG 102 13.159 11.730 3.234 834 HH11 ARG 102 HH11 ARG 102 14.114 10.537 4.817 835 HH12 ARG 102 HH12 ARG 102 13.683 10.783 6.483 836 HH21 ARG 102 HH21 ARG 102 11.342 13.226 5.895 837 HH22 ARG 102 HH22 ARG 102 12.215 12.282 7.069 838 H SER 103 H SER 103 10.302 11.800 -1.194 839 HA SER 103 HA SER 103 8.102 10.168 -0.067 840 HB2 SER 103 HB2 SER 103 7.190 9.577 -2.206 841 HB3 SER 103 HB3 SER 103 7.168 11.337 -2.054 842 HG SER 103 HG SER 103 8.933 11.472 -3.422 843 H ALA 104 H ALA 104 8.131 7.928 -0.568 844 HA ALA 104 HA ALA 104 10.459 6.777 -1.957 845 HB1 ALA 104 HB1 ALA 104 11.192 6.879 0.409 846 HB2 ALA 104 HB2 ALA 104 9.715 6.024 0.908 847 HB3 ALA 104 HB3 ALA 104 10.920 5.202 -0.105 848 H PHE 105 H PHE 105 10.024 4.780 -2.884 849 HA PHE 105 HA PHE 105 7.197 3.827 -2.817 850 HB2 PHE 105 HB2 PHE 105 9.497 3.326 -4.722 851 HB3 PHE 105 HB3 PHE 105 8.023 2.377 -4.723 852 HD1 PHE 105 HD1 PHE 105 5.859 3.328 -5.400 853 HD2 PHE 105 HD2 PHE 105 9.465 5.684 -5.560 854 HE1 PHE 105 HE1 PHE 105 4.743 4.908 -6.921 855 HE2 PHE 105 HE2 PHE 105 8.336 7.293 -7.068 856 HZ PHE 105 HZ PHE 105 5.984 6.901 -7.776 857 H ILE 106 H ILE 106 6.734 2.321 -1.376 858 HA ILE 106 HA ILE 106 8.820 0.310 -0.601 859 HB ILE 106 HB ILE 106 7.917 0.118 1.562 860 HG12 ILE 106 HG12 ILE 106 5.834 2.246 0.915 861 HG13 ILE 106 HG13 ILE 106 5.501 0.520 1.059 862 HG21 ILE 106 HG21 ILE 106 8.201 3.088 0.971 863 HG22 ILE 106 HG22 ILE 106 8.597 2.248 2.487 864 HG23 ILE 106 HG23 ILE 106 9.561 1.946 1.038 865 HD11 ILE 106 HD11 ILE 106 4.859 1.581 3.111 866 HD12 ILE 106 HD12 ILE 106 6.253 0.531 3.411 867 HD13 ILE 106 HD13 ILE 106 6.466 2.291 3.326 868 H GLY 107 H GLY 107 8.242 -1.859 -0.392 869 HA2 GLY 107 HA2 GLY 107 5.822 -2.678 -1.911 870 HA3 GLY 107 HA3 GLY 107 7.210 -3.688 -1.518 871 H ILE 108 H ILE 108 4.218 -3.877 -0.959 872 HA ILE 108 HA ILE 108 4.552 -4.800 1.815 873 HB ILE 108 HB ILE 108 2.218 -4.321 2.353 874 HG12 ILE 108 HG12 ILE 108 2.139 -2.478 -0.073 875 HG13 ILE 108 HG13 ILE 108 1.373 -4.065 -0.020 876 HG21 ILE 108 HG21 ILE 108 4.051 -2.930 3.128 877 HG22 ILE 108 HG22 ILE 108 3.876 -1.855 1.725 878 HG23 ILE 108 HG23 ILE 108 2.579 -1.979 2.934 879 HD11 ILE 108 HD11 ILE 108 -0.291 -2.379 0.441 880 HD12 ILE 108 HD12 ILE 108 -0.030 -3.347 1.904 881 HD13 ILE 108 HD13 ILE 108 0.654 -1.714 1.781 882 H GLY 109 H GLY 109 3.546 -6.676 2.389 883 HA2 GLY 109 HA2 GLY 109 2.182 -8.236 0.219 884 HA3 GLY 109 HA3 GLY 109 3.432 -8.944 1.229 885 H PHE 110 H PHE 110 0.643 -9.611 0.735 886 HA PHE 110 HA PHE 110 -0.540 -9.560 3.479 887 HB2 PHE 110 HB2 PHE 110 -1.776 -9.907 0.719 888 HB3 PHE 110 HB3 PHE 110 -2.646 -10.182 2.215 889 HD1 PHE 110 HD1 PHE 110 -0.894 -7.555 0.209 890 HD2 PHE 110 HD2 PHE 110 -3.489 -8.395 3.549 891 HE1 PHE 110 HE1 PHE 110 -1.372 -5.123 0.467 892 HE2 PHE 110 HE2 PHE 110 -4.003 -5.978 3.753 893 HZ PHE 110 HZ PHE 110 -2.944 -4.344 2.182 894 H THR 111 H THR 111 -1.662 -11.534 4.150 895 HA THR 111 HA THR 111 -0.012 -13.895 3.759 896 HB THR 111 HB THR 111 -1.028 -13.180 5.907 897 HG1 THR 111 HG1 THR 111 -1.436 -15.275 6.551 898 HG21 THR 111 HG21 THR 111 -3.306 -13.783 6.480 899 HG22 THR 111 HG22 THR 111 -3.339 -12.642 5.130 900 HG23 THR 111 HG23 THR 111 -3.620 -14.373 4.837 901 H ASP 112 H ASP 112 -2.937 -12.725 2.262 902 HA ASP 112 HA ASP 112 -3.085 -15.034 0.494 903 HB2 ASP 112 HB2 ASP 112 -4.361 -15.768 2.543 904 HB3 ASP 112 HB3 ASP 112 -5.430 -14.381 2.336 905 H ARG 113 H ARG 113 -4.554 -14.676 -1.319 906 HA ARG 113 HA ARG 113 -4.688 -11.987 -2.293 907 HB2 ARG 113 HB2 ARG 113 -4.668 -14.043 -3.719 908 HB3 ARG 113 HB3 ARG 113 -6.328 -14.393 -3.196 909 HG2 ARG 113 HG2 ARG 113 -7.066 -12.201 -4.139 910 HG3 ARG 113 HG3 ARG 113 -5.399 -11.863 -4.639 911 HD2 ARG 113 HD2 ARG 113 -5.486 -13.783 -6.184 912 HD3 ARG 113 HD3 ARG 113 -7.129 -14.166 -5.623 913 HE ARG 113 HE ARG 113 -7.150 -11.461 -6.433 914 HH11 ARG 113 HH11 ARG 113 -8.032 -10.786 -8.329 915 HH12 ARG 113 HH12 ARG 113 -8.147 -11.873 -9.683 916 HH21 ARG 113 HH21 ARG 113 -6.770 -14.554 -8.034 917 HH22 ARG 113 HH22 ARG 113 -7.456 -13.965 -9.524 918 H GLY 114 H GLY 114 -7.067 -13.843 -0.385 919 HA2 GLY 114 HA2 GLY 114 -9.352 -12.256 -0.863 920 HA3 GLY 114 HA3 GLY 114 -9.022 -13.180 0.609 921 H ASP 115 H ASP 115 -6.607 -11.583 1.323 922 HA ASP 115 HA ASP 115 -7.982 -9.249 2.517 923 HB2 ASP 115 HB2 ASP 115 -5.191 -10.376 2.925 924 HB3 ASP 115 HB3 ASP 115 -5.881 -9.005 3.801 925 H ALA 116 H ALA 116 -5.328 -9.872 0.188 926 HA ALA 116 HA ALA 116 -4.706 -7.144 -0.411 927 HB1 ALA 116 HB1 ALA 116 -3.928 -8.263 -2.577 928 HB2 ALA 116 HB2 ALA 116 -3.289 -8.944 -1.061 929 HB3 ALA 116 HB3 ALA 116 -4.593 -9.767 -1.955 930 H PHE 117 H PHE 117 -7.298 -9.271 -1.546 931 HA PHE 117 HA PHE 117 -8.518 -7.106 -3.139 932 HB2 PHE 117 HB2 PHE 117 -9.013 -10.057 -2.969 933 HB3 PHE 117 HB3 PHE 117 -10.251 -8.988 -3.594 934 HD1 PHE 117 HD1 PHE 117 -6.545 -9.622 -4.039 935 HD2 PHE 117 HD2 PHE 117 -10.255 -8.357 -5.841 936 HE1 PHE 117 HE1 PHE 117 -5.386 -9.280 -6.195 937 HE2 PHE 117 HE2 PHE 117 -9.094 -8.057 -8.011 938 HZ PHE 117 HZ PHE 117 -6.650 -8.505 -8.192 939 H ASP 118 H ASP 118 -8.383 -7.227 -0.033 940 HA ASP 118 HA ASP 118 -10.880 -5.575 -0.091 941 HB2 ASP 118 HB2 ASP 118 -9.232 -6.495 2.284 942 HB3 ASP 118 HB3 ASP 118 -10.336 -5.127 2.343 943 H PHE 119 H PHE 119 -7.295 -5.502 0.425 944 HA PHE 119 HA PHE 119 -6.970 -2.748 0.726 945 HB2 PHE 119 HB2 PHE 119 -5.155 -4.266 1.062 946 HB3 PHE 119 HB3 PHE 119 -5.200 -4.826 -0.598 947 HD1 PHE 119 HD1 PHE 119 -4.311 -3.462 -2.459 948 HD2 PHE 119 HD2 PHE 119 -4.027 -2.155 1.626 949 HE1 PHE 119 HE1 PHE 119 -2.738 -1.676 -3.147 950 HE2 PHE 119 HE2 PHE 119 -2.465 -0.351 0.941 951 HZ PHE 119 HZ PHE 119 -1.822 -0.105 -1.449 952 H ASN 120 H ASN 120 -6.794 -4.442 -2.464 953 HA ASN 120 HA ASN 120 -6.685 -1.844 -3.791 954 HB2 ASN 120 HB2 ASN 120 -6.240 -2.921 -5.759 955 HB3 ASN 120 HB3 ASN 120 -5.477 -3.948 -4.553 956 HD21 ASN 120 HD21 ASN 120 -7.549 -6.736 -5.407 957 HD22 ASN 120 HD22 ASN 120 -6.607 -6.063 -4.078 958 H VAL 121 H VAL 121 -9.292 -3.982 -2.999 959 HA VAL 121 HA VAL 121 -11.092 -2.925 -5.044 960 HB VAL 121 HB VAL 121 -11.573 -4.792 -2.712 961 HG11 VAL 121 HG11 VAL 121 -13.426 -4.041 -5.022 962 HG12 VAL 121 HG12 VAL 121 -13.702 -5.376 -3.880 963 HG13 VAL 121 HG13 VAL 121 -13.708 -3.712 -3.296 964 HG21 VAL 121 HG21 VAL 121 -10.116 -5.744 -4.476 965 HG22 VAL 121 HG22 VAL 121 -11.700 -6.517 -4.504 966 HG23 VAL 121 HG23 VAL 121 -11.297 -5.283 -5.718 967 H SER 122 H SER 122 -10.628 -2.456 -1.512 968 HA SER 122 HA SER 122 -12.819 -0.647 -1.152 969 HB2 SER 122 HB2 SER 122 -11.731 -0.030 0.915 970 HB3 SER 122 HB3 SER 122 -11.648 -1.788 0.696 971 HG SER 122 HG SER 122 -9.550 -1.665 0.211 972 H LEU 123 H LEU 123 -9.489 -0.094 -2.266 973 HA LEU 123 HA LEU 123 -9.669 2.783 -2.423 974 HB2 LEU 123 HB2 LEU 123 -7.944 0.696 -3.799 975 HB3 LEU 123 HB3 LEU 123 -7.776 2.416 -4.137 976 HG LEU 123 HG LEU 123 -7.458 1.239 -1.345 977 HD11 LEU 123 HD11 LEU 123 -5.338 1.986 -3.406 978 HD12 LEU 123 HD12 LEU 123 -5.037 1.470 -1.727 979 HD13 LEU 123 HD13 LEU 123 -5.746 0.339 -2.880 980 HD21 LEU 123 HD21 LEU 123 -6.299 3.377 -0.889 981 HD22 LEU 123 HD22 LEU 123 -6.678 3.942 -2.529 982 HD23 LEU 123 HD23 LEU 123 -7.978 3.656 -1.351 983 H GLN 124 H GLN 124 -10.034 0.301 -5.056 984 HA GLN 124 HA GLN 124 -10.703 2.312 -6.959 985 HB2 GLN 124 HB2 GLN 124 -10.986 0.600 -8.523 986 HB3 GLN 124 HB3 GLN 124 -9.757 0.019 -7.401 987 HG2 GLN 124 HG2 GLN 124 -11.650 -1.242 -6.218 988 HG3 GLN 124 HG3 GLN 124 -12.656 -0.868 -7.618 989 HE21 GLN 124 HE21 GLN 124 -9.515 -3.546 -7.970 990 HE22 GLN 124 HE22 GLN 124 -9.489 -2.332 -6.705 991 H ASP 125 H ASP 125 -12.847 0.457 -4.805 992 HA ASP 125 HA ASP 125 -15.235 1.480 -6.152 993 HB2 ASP 125 HB2 ASP 125 -15.086 -0.830 -5.207 994 HB3 ASP 125 HB3 ASP 125 -14.984 -0.129 -3.587 995 H HIS 126 H HIS 126 -13.064 2.846 -3.975 996 HA HIS 126 HA HIS 126 -15.122 4.771 -3.017 997 HB2 HIS 126 HB2 HIS 126 -13.422 3.965 -1.381 998 HB3 HIS 126 HB3 HIS 126 -12.153 4.688 -2.377 999 HD2 HIS 126 HD2 HIS 126 -15.298 5.693 -0.319 1000 HE1 HIS 126 HE1 HIS 126 -12.810 9.146 -0.542 1001 HE2 HIS 126 HE2 HIS 126 -14.930 8.178 0.477 1002 H PHE 127 H PHE 127 -12.387 4.496 -5.258 1003 HA PHE 127 HA PHE 127 -12.633 7.307 -6.049 1004 HB2 PHE 127 HB2 PHE 127 -10.807 5.010 -6.772 1005 HB3 PHE 127 HB3 PHE 127 -10.810 6.475 -7.725 1006 HD1 PHE 127 HD1 PHE 127 -10.887 8.750 -6.117 1007 HD2 PHE 127 HD2 PHE 127 -9.074 4.957 -5.175 1008 HE1 PHE 127 HE1 PHE 127 -9.124 9.911 -4.815 1009 HE2 PHE 127 HE2 PHE 127 -7.286 6.115 -3.923 1010 HZ PHE 127 HZ PHE 127 -7.314 8.602 -3.745 1011 H LYS 128 H LYS 128 -14.264 4.503 -7.242 1012 HA LYS 128 HA LYS 128 -14.158 4.865 -9.929 1013 HB2 LYS 128 HB2 LYS 128 -16.020 3.564 -10.267 1014 HB3 LYS 128 HB3 LYS 128 -15.278 2.974 -8.799 1015 HG2 LYS 128 HG2 LYS 128 -17.748 4.784 -8.914 1016 HG3 LYS 128 HG3 LYS 128 -17.765 3.025 -8.788 1017 HD2 LYS 128 HD2 LYS 128 -16.473 3.196 -6.655 1018 HD3 LYS 128 HD3 LYS 128 -16.596 4.954 -6.744 1019 HE2 LYS 128 HE2 LYS 128 -18.285 4.263 -5.268 1020 HE3 LYS 128 HE3 LYS 128 -19.087 4.739 -6.774 1021 HZ1 LYS 128 HZ1 LYS 128 -19.934 2.617 -5.834 1022 HZ2 LYS 128 HZ2 LYS 128 -19.306 2.376 -7.321 1023 HZ3 LYS 128 HZ3 LYS 128 -18.462 1.920 -5.997 1024 H TRP 129 H TRP 129 -15.946 7.039 -7.912 1025 HA TRP 129 HA TRP 129 -17.324 8.344 -10.185 1026 HB2 TRP 129 HB2 TRP 129 -18.321 9.755 -8.522 1027 HB3 TRP 129 HB3 TRP 129 -18.489 8.069 -8.050 1028 HD1 TRP 129 HD1 TRP 129 -16.730 7.216 -6.080 1029 HE1 TRP 129 HE1 TRP 129 -15.533 8.429 -4.213 1030 HE3 TRP 129 HE3 TRP 129 -17.624 12.055 -7.544 1031 HZ2 TRP 129 HZ2 TRP 129 -15.375 11.148 -3.191 1032 HZ3 TRP 129 HZ3 TRP 129 -17.005 13.936 -6.049 1033 HH2 TRP 129 HH2 TRP 129 -15.905 13.499 -3.865 1034 H VAL 130 H VAL 130 -14.408 8.812 -8.287 1035 HA VAL 130 HA VAL 130 -13.922 11.580 -9.148 1036 HB VAL 130 HB VAL 130 -11.992 9.599 -7.888 1037 HG11 VAL 130 HG11 VAL 130 -11.924 12.643 -8.052 1038 HG12 VAL 130 HG12 VAL 130 -10.765 11.623 -7.169 1039 HG13 VAL 130 HG13 VAL 130 -10.853 11.524 -8.925 1040 HG21 VAL 130 HG21 VAL 130 -12.466 10.817 -5.746 1041 HG22 VAL 130 HG22 VAL 130 -13.813 11.645 -6.558 1042 HG23 VAL 130 HG23 VAL 130 -13.835 9.882 -6.339 1043 H LYS 131 H LYS 131 -12.723 8.319 -9.910 1044 HA LYS 131 HA LYS 131 -11.603 9.301 -12.508 1045 HB2 LYS 131 HB2 LYS 131 -9.963 8.423 -10.722 1046 HB3 LYS 131 HB3 LYS 131 -10.636 6.822 -11.045 1047 HG2 LYS 131 HG2 LYS 131 -10.153 7.348 -13.558 1048 HG3 LYS 131 HG3 LYS 131 -9.226 8.731 -12.960 1049 HD2 LYS 131 HD2 LYS 131 -7.819 7.085 -11.610 1050 HD3 LYS 131 HD3 LYS 131 -8.722 5.777 -12.409 1051 HE2 LYS 131 HE2 LYS 131 -8.062 6.947 -14.637 1052 HE3 LYS 131 HE3 LYS 131 -6.903 7.874 -13.673 1053 HZ1 LYS 131 HZ1 LYS 131 -7.019 4.932 -14.018 1054 HZ2 LYS 131 HZ2 LYS 131 -5.843 5.919 -14.575 1055 HZ3 LYS 131 HZ3 LYS 131 -5.973 5.682 -12.955 1056 H GLN 132 H GLN 132 -13.798 9.140 -13.240 1057 HA GLN 132 HA GLN 132 -15.030 6.540 -13.693 1058 HB2 GLN 132 HB2 GLN 132 -15.538 9.266 -14.925 1059 HB3 GLN 132 HB3 GLN 132 -16.509 7.806 -15.201 1060 HG2 GLN 132 HG2 GLN 132 -17.217 7.733 -12.890 1061 HG3 GLN 132 HG3 GLN 132 -16.055 8.976 -12.428 1062 HE21 GLN 132 HE21 GLN 132 -18.573 11.414 -12.747 1063 HE22 GLN 132 HE22 GLN 132 -17.252 10.743 -11.790 1064 H GLU 133 H GLU 133 -13.476 5.325 -14.559 1065 HA GLU 133 HA GLU 133 -12.025 5.916 -17.023 1066 HB2 GLU 133 HB2 GLU 133 -12.274 3.327 -15.451 1067 HB3 GLU 133 HB3 GLU 133 -11.219 3.579 -16.847 1068 HG2 GLU 133 HG2 GLU 133 -10.092 5.455 -15.594 1069 HG3 GLU 133 HG3 GLU 133 -11.023 5.007 -14.165 Start of MODEL 23 1 H1 GLY -4 H1 GLY -4 7.638 21.438 20.945 2 H2 GLY -4 H2 GLY -4 8.653 22.705 20.733 3 H3 GLY -4 H3 GLY -4 9.192 21.176 20.495 4 HA2 GLY -4 HA2 GLY -4 8.830 22.262 18.378 5 HA3 GLY -4 HA3 GLY -4 7.749 20.876 18.602 6 H SER -3 H SER -3 7.303 23.114 16.841 7 HA SER -3 HA SER -3 5.540 25.063 17.904 8 HB2 SER -3 HB2 SER -3 5.823 24.007 15.083 9 HB3 SER -3 HB3 SER -3 4.924 25.472 15.546 10 HG SER -3 HG SER -3 7.096 25.923 14.892 11 HA PRO -2 HA PRO -2 1.934 22.513 18.381 12 HB2 PRO -2 HB2 PRO -2 0.172 24.269 19.433 13 HB3 PRO -2 HB3 PRO -2 1.730 23.923 20.230 14 HG2 PRO -2 HG2 PRO -2 1.112 26.223 18.333 15 HG3 PRO -2 HG3 PRO -2 1.803 26.321 19.986 16 HD2 PRO -2 HD2 PRO -2 3.385 26.275 17.754 17 HD3 PRO -2 HD3 PRO -2 3.873 25.478 19.281 18 H ASN -1 H ASN -1 2.320 23.069 15.616 19 HA ASN -1 HA ASN -1 0.219 24.535 14.392 20 HB2 ASN -1 HB2 ASN -1 1.850 22.249 13.203 21 HB3 ASN -1 HB3 ASN -1 0.962 23.477 12.299 22 HD21 ASN -1 HD21 ASN -1 3.394 26.069 13.076 23 HD22 ASN -1 HD22 ASN -1 1.666 25.859 12.841 24 H SER 0 H SER 0 0.287 21.112 15.325 25 HA SER 0 HA SER 0 -2.105 20.245 14.068 26 HB2 SER 0 HB2 SER 0 -0.938 19.322 16.722 27 HB3 SER 0 HB3 SER 0 -2.051 18.417 15.677 28 HG SER 0 HG SER 0 0.133 17.779 15.361 29 H MET 1 H MET 1 -1.768 22.451 16.714 30 HA MET 1 HA MET 1 -4.658 22.212 17.443 31 HB2 MET 1 HB2 MET 1 -2.368 23.558 18.926 32 HB3 MET 1 HB3 MET 1 -4.055 23.493 19.450 33 HG2 MET 1 HG2 MET 1 -3.939 21.025 19.566 34 HG3 MET 1 HG3 MET 1 -2.259 21.076 19.033 35 HE1 MET 1 HE1 MET 1 -3.789 22.399 23.205 36 HE2 MET 1 HE2 MET 1 -4.214 23.331 21.757 37 HE3 MET 1 HE3 MET 1 -4.783 21.654 21.936 38 H ALA 2 H ALA 2 -3.004 23.729 15.166 39 HA ALA 2 HA ALA 2 -4.414 26.361 15.422 40 HB1 ALA 2 HB1 ALA 2 -2.525 27.368 14.269 41 HB2 ALA 2 HB2 ALA 2 -1.963 26.524 15.724 42 HB3 ALA 2 HB3 ALA 2 -1.724 25.793 14.121 43 H THR 3 H THR 3 -3.114 24.037 12.951 44 HA THR 3 HA THR 3 -5.204 24.866 11.031 45 HB THR 3 HB THR 3 -2.923 24.070 10.333 46 HG1 THR 3 HG1 THR 3 -3.786 23.093 8.533 47 HG21 THR 3 HG21 THR 3 -4.074 21.274 10.756 48 HG22 THR 3 HG22 THR 3 -2.516 21.706 10.028 49 HG23 THR 3 HG23 THR 3 -2.784 21.986 11.750 50 H GLU 4 H GLU 4 -4.663 22.400 13.394 51 HA GLU 4 HA GLU 4 -5.930 20.781 14.333 52 HB2 GLU 4 HB2 GLU 4 -6.573 23.118 15.197 53 HB3 GLU 4 HB3 GLU 4 -8.116 22.857 14.371 54 HG2 GLU 4 HG2 GLU 4 -8.294 20.646 15.651 55 HG3 GLU 4 HG3 GLU 4 -6.797 21.083 16.475 56 H LEU 5 H LEU 5 -5.871 19.902 11.909 57 HA LEU 5 HA LEU 5 -8.620 19.026 11.204 58 HB2 LEU 5 HB2 LEU 5 -7.847 18.235 9.215 59 HB3 LEU 5 HB3 LEU 5 -7.136 19.812 9.453 60 HG LEU 5 HG LEU 5 -5.071 18.352 10.360 61 HD11 LEU 5 HD11 LEU 5 -6.258 16.152 10.017 62 HD12 LEU 5 HD12 LEU 5 -6.384 16.520 8.294 63 HD13 LEU 5 HD13 LEU 5 -4.788 16.292 9.043 64 HD21 LEU 5 HD21 LEU 5 -4.985 19.939 8.492 65 HD22 LEU 5 HD22 LEU 5 -4.112 18.451 8.088 66 HD23 LEU 5 HD23 LEU 5 -5.734 18.738 7.416 67 H GLU 6 H GLU 6 -9.492 17.275 11.829 68 HA GLU 6 HA GLU 6 -7.892 14.931 12.715 69 HB2 GLU 6 HB2 GLU 6 -8.579 16.380 14.681 70 HB3 GLU 6 HB3 GLU 6 -10.260 16.005 14.302 71 HG2 GLU 6 HG2 GLU 6 -9.726 13.558 14.604 72 HG3 GLU 6 HG3 GLU 6 -8.054 13.987 14.950 73 H TYR 7 H TYR 7 -8.594 14.739 10.319 74 HA TYR 7 HA TYR 7 -11.151 13.259 10.144 75 HB2 TYR 7 HB2 TYR 7 -11.563 14.137 7.981 76 HB3 TYR 7 HB3 TYR 7 -11.416 15.454 9.112 77 HD1 TYR 7 HD1 TYR 7 -10.088 17.319 8.531 78 HD2 TYR 7 HD2 TYR 7 -9.365 13.557 6.540 79 HE1 TYR 7 HE1 TYR 7 -8.574 18.445 6.909 80 HE2 TYR 7 HE2 TYR 7 -8.035 14.693 4.830 81 HH TYR 7 HH TYR 7 -7.335 18.230 4.988 82 H GLU 8 H GLU 8 -11.121 11.423 9.044 83 HA GLU 8 HA GLU 8 -9.162 10.389 7.246 84 HB2 GLU 8 HB2 GLU 8 -8.448 10.262 10.090 85 HB3 GLU 8 HB3 GLU 8 -8.694 8.628 9.469 86 HG2 GLU 8 HG2 GLU 8 -7.053 8.935 7.737 87 HG3 GLU 8 HG3 GLU 8 -6.879 10.641 8.112 88 H SER 9 H SER 9 -11.054 9.663 6.115 89 HA SER 9 HA SER 9 -13.061 8.066 7.576 90 HB2 SER 9 HB2 SER 9 -13.479 9.748 5.634 91 HB3 SER 9 HB3 SER 9 -13.017 8.393 4.588 92 HG SER 9 HG SER 9 -15.268 8.377 4.997 93 H VAL 10 H VAL 10 -12.660 5.995 7.990 94 HA VAL 10 HA VAL 10 -10.517 4.552 6.687 95 HB VAL 10 HB VAL 10 -11.030 4.354 9.070 96 HG11 VAL 10 HG11 VAL 10 -13.508 4.218 8.993 97 HG12 VAL 10 HG12 VAL 10 -13.389 2.608 8.248 98 HG13 VAL 10 HG13 VAL 10 -12.785 2.878 9.894 99 HG21 VAL 10 HG21 VAL 10 -9.665 2.658 7.879 100 HG22 VAL 10 HG22 VAL 10 -10.520 2.023 9.294 101 HG23 VAL 10 HG23 VAL 10 -11.127 1.661 7.669 102 H LEU 11 H LEU 11 -10.488 2.730 5.443 103 HA LEU 11 HA LEU 11 -12.972 2.119 3.866 104 HB2 LEU 11 HB2 LEU 11 -10.150 2.641 2.843 105 HB3 LEU 11 HB3 LEU 11 -11.480 2.038 1.865 106 HG LEU 11 HG LEU 11 -11.386 4.777 3.190 107 HD11 LEU 11 HD11 LEU 11 -9.818 4.632 1.344 108 HD12 LEU 11 HD12 LEU 11 -11.039 3.860 0.307 109 HD13 LEU 11 HD13 LEU 11 -11.238 5.543 0.807 110 HD21 LEU 11 HD21 LEU 11 -13.724 3.990 2.949 111 HD22 LEU 11 HD22 LEU 11 -13.367 5.272 1.798 112 HD23 LEU 11 HD23 LEU 11 -13.415 3.583 1.244 113 H CYS 12 H CYS 12 -9.708 0.960 4.797 114 HA CYS 12 HA CYS 12 -10.772 -1.770 5.071 115 HB2 CYS 12 HB2 CYS 12 -9.940 -1.556 2.668 116 HB3 CYS 12 HB3 CYS 12 -8.324 -1.258 3.343 117 HG CYS 12 HG CYS 12 -10.320 -3.877 3.705 118 H VAL 13 H VAL 13 -9.885 -2.749 6.765 119 HA VAL 13 HA VAL 13 -7.187 -1.931 7.729 120 HB VAL 13 HB VAL 13 -9.621 -2.450 9.464 121 HG11 VAL 13 HG11 VAL 13 -6.724 -1.968 10.301 122 HG12 VAL 13 HG12 VAL 13 -8.123 -2.004 11.391 123 HG13 VAL 13 HG13 VAL 13 -7.645 -3.472 10.538 124 HG21 VAL 13 HG21 VAL 13 -9.201 -0.161 10.291 125 HG22 VAL 13 HG22 VAL 13 -7.839 0.002 9.162 126 HG23 VAL 13 HG23 VAL 13 -9.497 -0.148 8.549 127 H LYS 14 H LYS 14 -5.835 -3.548 7.878 128 HA LYS 14 HA LYS 14 -6.813 -6.329 8.261 129 HB2 LYS 14 HB2 LYS 14 -4.618 -5.576 6.299 130 HB3 LYS 14 HB3 LYS 14 -5.067 -7.207 6.745 131 HG2 LYS 14 HG2 LYS 14 -6.947 -5.244 5.355 132 HG3 LYS 14 HG3 LYS 14 -5.950 -6.448 4.539 133 HD2 LYS 14 HD2 LYS 14 -7.114 -8.266 5.741 134 HD3 LYS 14 HD3 LYS 14 -8.150 -7.067 6.551 135 HE2 LYS 14 HE2 LYS 14 -9.000 -6.312 4.363 136 HE3 LYS 14 HE3 LYS 14 -7.956 -7.489 3.547 137 HZ1 LYS 14 HZ1 LYS 14 -10.143 -8.177 5.440 138 HZ2 LYS 14 HZ2 LYS 14 -10.186 -8.381 3.810 139 HZ3 LYS 14 HZ3 LYS 14 -9.145 -9.265 4.717 140 HA PRO 15 HA PRO 15 -4.033 -5.838 11.617 141 HB2 PRO 15 HB2 PRO 15 -4.012 -8.333 12.709 142 HB3 PRO 15 HB3 PRO 15 -5.464 -7.275 12.720 143 HG2 PRO 15 HG2 PRO 15 -4.782 -9.499 10.761 144 HG3 PRO 15 HG3 PRO 15 -6.326 -9.242 11.642 145 HD2 PRO 15 HD2 PRO 15 -5.981 -8.393 9.087 146 HD3 PRO 15 HD3 PRO 15 -6.909 -7.421 10.271 147 H ASP 16 H ASP 16 -3.125 -7.992 9.044 148 HA ASP 16 HA ASP 16 -0.314 -8.121 10.055 149 HB2 ASP 16 HB2 ASP 16 -1.493 -10.243 10.505 150 HB3 ASP 16 HB3 ASP 16 -1.915 -10.372 8.794 151 H VAL 17 H VAL 17 0.734 -6.836 8.768 152 HA VAL 17 HA VAL 17 0.919 -7.534 5.911 153 HB VAL 17 HB VAL 17 -0.763 -5.700 6.062 154 HG11 VAL 17 HG11 VAL 17 1.575 -3.931 6.896 155 HG12 VAL 17 HG12 VAL 17 -0.058 -3.397 6.466 156 HG13 VAL 17 HG13 VAL 17 0.193 -4.382 7.915 157 HG21 VAL 17 HG21 VAL 17 0.557 -6.082 4.011 158 HG22 VAL 17 HG22 VAL 17 0.126 -4.383 4.233 159 HG23 VAL 17 HG23 VAL 17 1.780 -4.919 4.587 160 H SER 18 H SER 18 2.907 -7.172 5.015 161 HA SER 18 HA SER 18 5.109 -6.451 6.924 162 HB2 SER 18 HB2 SER 18 5.049 -8.665 4.848 163 HB3 SER 18 HB3 SER 18 6.406 -8.261 5.921 164 HG SER 18 HG SER 18 5.079 -10.027 6.677 165 H VAL 19 H VAL 19 6.607 -5.070 6.237 166 HA VAL 19 HA VAL 19 6.480 -4.021 3.454 167 HB VAL 19 HB VAL 19 7.643 -2.862 5.993 168 HG11 VAL 19 HG11 VAL 19 9.154 -2.167 4.212 169 HG12 VAL 19 HG12 VAL 19 7.790 -1.804 3.132 170 HG13 VAL 19 HG13 VAL 19 8.089 -0.814 4.583 171 HG21 VAL 19 HG21 VAL 19 5.117 -2.726 5.551 172 HG22 VAL 19 HG22 VAL 19 5.960 -1.182 5.739 173 HG23 VAL 19 HG23 VAL 19 5.516 -1.753 4.123 174 H TYR 20 H TYR 20 7.951 -4.226 2.047 175 HA TYR 20 HA TYR 20 10.728 -4.903 2.836 176 HB2 TYR 20 HB2 TYR 20 9.905 -6.066 0.257 177 HB3 TYR 20 HB3 TYR 20 10.903 -6.725 1.534 178 HD1 TYR 20 HD1 TYR 20 7.593 -6.638 0.030 179 HD2 TYR 20 HD2 TYR 20 9.840 -7.957 3.448 180 HE1 TYR 20 HE1 TYR 20 5.790 -8.266 0.585 181 HE2 TYR 20 HE2 TYR 20 8.029 -9.569 4.030 182 HH TYR 20 HH TYR 20 5.108 -9.957 2.020 183 H ARG 21 H ARG 21 12.030 -3.380 2.127 184 HA ARG 21 HA ARG 21 11.328 -1.450 0.064 185 HB2 ARG 21 HB2 ARG 21 14.062 -2.231 1.158 186 HB3 ARG 21 HB3 ARG 21 13.779 -0.912 0.031 187 HG2 ARG 21 HG2 ARG 21 12.823 -1.107 2.903 188 HG3 ARG 21 HG3 ARG 21 14.003 0.004 2.232 189 HD2 ARG 21 HD2 ARG 21 10.993 -0.008 1.873 190 HD3 ARG 21 HD3 ARG 21 11.977 1.236 2.620 191 HE ARG 21 HE ARG 21 11.245 1.071 -0.139 192 HH11 ARG 21 HH11 ARG 21 11.898 2.424 -1.611 193 HH12 ARG 21 HH12 ARG 21 13.369 3.361 -1.411 194 HH21 ARG 21 HH21 ARG 21 14.019 2.121 1.739 195 HH22 ARG 21 HH22 ARG 21 14.526 3.217 0.484 196 H ILE 22 H ILE 22 11.641 -1.388 -2.013 197 HA ILE 22 HA ILE 22 12.233 -3.944 -3.379 198 HB ILE 22 HB ILE 22 10.941 -3.116 -5.232 199 HG12 ILE 22 HG12 ILE 22 10.626 -0.511 -3.674 200 HG13 ILE 22 HG13 ILE 22 11.474 -0.740 -5.208 201 HG21 ILE 22 HG21 ILE 22 9.363 -2.563 -2.698 202 HG22 ILE 22 HG22 ILE 22 8.791 -3.254 -4.233 203 HG23 ILE 22 HG23 ILE 22 9.867 -4.186 -3.189 204 HD11 ILE 22 HD11 ILE 22 9.372 0.189 -5.769 205 HD12 ILE 22 HD12 ILE 22 9.259 -1.537 -6.190 206 HD13 ILE 22 HD13 ILE 22 8.497 -0.925 -4.704 207 HA PRO 23 HA PRO 23 15.827 -2.234 -5.508 208 HB2 PRO 23 HB2 PRO 23 15.920 -3.779 -7.762 209 HB3 PRO 23 HB3 PRO 23 16.303 -4.426 -6.138 210 HG2 PRO 23 HG2 PRO 23 13.653 -4.584 -7.624 211 HG3 PRO 23 HG3 PRO 23 14.574 -5.919 -6.853 212 HD2 PRO 23 HD2 PRO 23 12.530 -4.653 -5.589 213 HD3 PRO 23 HD3 PRO 23 13.976 -5.193 -4.685 214 HA PRO 24 HA PRO 24 14.143 0.620 -8.607 215 HB2 PRO 24 HB2 PRO 24 16.260 1.021 -10.305 216 HB3 PRO 24 HB3 PRO 24 16.168 1.711 -8.658 217 HG2 PRO 24 HG2 PRO 24 17.613 -0.806 -9.539 218 HG3 PRO 24 HG3 PRO 24 18.228 0.523 -8.508 219 HD2 PRO 24 HD2 PRO 24 17.246 -1.780 -7.448 220 HD3 PRO 24 HD3 PRO 24 16.964 -0.204 -6.653 221 H ARG 25 H ARG 25 12.613 -0.185 -9.874 222 HA ARG 25 HA ARG 25 13.135 -2.113 -12.070 223 HB2 ARG 25 HB2 ARG 25 11.811 -2.675 -9.418 224 HB3 ARG 25 HB3 ARG 25 10.981 -3.297 -10.832 225 HG2 ARG 25 HG2 ARG 25 13.861 -3.956 -10.118 226 HG3 ARG 25 HG3 ARG 25 12.430 -4.946 -9.786 227 HD2 ARG 25 HD2 ARG 25 11.937 -4.739 -12.324 228 HD3 ARG 25 HD3 ARG 25 13.621 -4.227 -12.476 229 HE ARG 25 HE ARG 25 13.302 -6.689 -10.901 230 HH11 ARG 25 HH11 ARG 25 13.996 -8.504 -11.508 231 HH12 ARG 25 HH12 ARG 25 14.436 -8.863 -13.183 232 HH21 ARG 25 HH21 ARG 25 13.652 -5.658 -14.251 233 HH22 ARG 25 HH22 ARG 25 14.206 -7.239 -14.727 234 H ALA 26 H ALA 26 11.245 -2.623 -13.347 235 HA ALA 26 HA ALA 26 9.674 -0.285 -13.980 236 HB1 ALA 26 HB1 ALA 26 10.554 -1.745 -15.715 237 HB2 ALA 26 HB2 ALA 26 9.594 -3.108 -15.105 238 HB3 ALA 26 HB3 ALA 26 8.787 -1.675 -15.790 239 H SER 27 H SER 27 7.936 0.286 -13.185 240 HA SER 27 HA SER 27 6.902 -0.546 -10.871 241 HB2 SER 27 HB2 SER 27 5.311 1.160 -12.801 242 HB3 SER 27 HB3 SER 27 5.294 1.220 -11.026 243 HG SER 27 HG SER 27 6.606 2.875 -11.940 244 H ASN 28 H ASN 28 5.513 -1.585 -13.912 245 HA ASN 28 HA ASN 28 3.754 -3.456 -12.420 246 HB2 ASN 28 HB2 ASN 28 1.871 -2.982 -14.024 247 HB3 ASN 28 HB3 ASN 28 2.239 -1.706 -12.888 248 HD21 ASN 28 HD21 ASN 28 2.864 0.692 -15.371 249 HD22 ASN 28 HD22 ASN 28 2.660 0.325 -13.649 250 H ARG 29 H ARG 29 6.298 -3.499 -14.070 251 HA ARG 29 HA ARG 29 5.620 -5.820 -15.870 252 HB2 ARG 29 HB2 ARG 29 7.570 -3.588 -16.508 253 HB3 ARG 29 HB3 ARG 29 7.267 -5.037 -17.470 254 HG2 ARG 29 HG2 ARG 29 4.867 -4.298 -17.742 255 HG3 ARG 29 HG3 ARG 29 5.300 -2.776 -16.917 256 HD2 ARG 29 HD2 ARG 29 7.104 -2.421 -18.590 257 HD3 ARG 29 HD3 ARG 29 6.571 -3.894 -19.431 258 HE ARG 29 HE ARG 29 4.332 -2.139 -19.118 259 HH11 ARG 29 HH11 ARG 29 3.520 -0.924 -20.791 260 HH12 ARG 29 HH12 ARG 29 4.514 -0.568 -22.173 261 HH21 ARG 29 HH21 ARG 29 7.268 -2.266 -21.027 262 HH22 ARG 29 HH22 ARG 29 6.584 -1.305 -22.311 263 H GLY 30 H GLY 30 7.913 -4.305 -13.676 264 HA2 GLY 30 HA2 GLY 30 9.634 -6.744 -13.760 265 HA3 GLY 30 HA3 GLY 30 10.208 -5.081 -13.508 266 H TYR 31 H TYR 31 7.641 -4.840 -11.618 267 HA TYR 31 HA TYR 31 8.731 -6.004 -9.159 268 HB2 TYR 31 HB2 TYR 31 5.991 -4.884 -9.877 269 HB3 TYR 31 HB3 TYR 31 6.511 -5.347 -8.272 270 HD1 TYR 31 HD1 TYR 31 9.413 -3.803 -9.384 271 HD2 TYR 31 HD2 TYR 31 5.307 -2.900 -8.426 272 HE1 TYR 31 HE1 TYR 31 10.004 -1.407 -9.058 273 HE2 TYR 31 HE2 TYR 31 5.913 -0.525 -8.059 274 HH TYR 31 HH TYR 31 9.243 0.699 -8.574 275 H ARG 32 H ARG 32 8.826 -8.251 -9.141 276 HA ARG 32 HA ARG 32 6.334 -9.776 -9.887 277 HB2 ARG 32 HB2 ARG 32 7.766 -11.738 -10.410 278 HB3 ARG 32 HB3 ARG 32 7.930 -10.410 -11.524 279 HG2 ARG 32 HG2 ARG 32 9.885 -10.432 -9.249 280 HG3 ARG 32 HG3 ARG 32 10.041 -11.746 -10.416 281 HD2 ARG 32 HD2 ARG 32 9.633 -8.980 -11.489 282 HD3 ARG 32 HD3 ARG 32 11.198 -9.317 -10.788 283 HE ARG 32 HE ARG 32 10.107 -10.362 -13.293 284 HH11 ARG 32 HH11 ARG 32 11.355 -11.624 -14.613 285 HH12 ARG 32 HH12 ARG 32 12.845 -12.299 -14.026 286 HH21 ARG 32 HH21 ARG 32 12.624 -10.944 -10.869 287 HH22 ARG 32 HH22 ARG 32 13.522 -11.956 -11.972 288 H ALA 33 H ALA 33 6.930 -8.631 -7.361 289 HA ALA 33 HA ALA 33 7.130 -8.973 -5.148 290 HB1 ALA 33 HB1 ALA 33 5.857 -10.800 -4.262 291 HB2 ALA 33 HB2 ALA 33 5.080 -10.245 -5.775 292 HB3 ALA 33 HB3 ALA 33 6.034 -11.728 -5.770 293 H SER 34 H SER 34 8.419 -11.950 -6.714 294 HA SER 34 HA SER 34 10.132 -12.722 -4.615 295 HB2 SER 34 HB2 SER 34 10.363 -13.319 -7.586 296 HB3 SER 34 HB3 SER 34 11.152 -14.222 -6.277 297 HG SER 34 HG SER 34 9.188 -15.211 -6.947 298 H ASP 35 H ASP 35 10.665 -10.138 -6.816 299 HA ASP 35 HA ASP 35 13.593 -10.093 -6.621 300 HB2 ASP 35 HB2 ASP 35 11.447 -8.269 -7.721 301 HB3 ASP 35 HB3 ASP 35 13.040 -7.614 -7.391 302 H TRP 36 H TRP 36 11.079 -9.328 -4.384 303 HA TRP 36 HA TRP 36 12.547 -7.158 -3.053 304 HB2 TRP 36 HB2 TRP 36 9.887 -8.392 -2.330 305 HB3 TRP 36 HB3 TRP 36 10.508 -6.822 -1.867 306 HD1 TRP 36 HD1 TRP 36 11.185 -6.458 -5.299 307 HE1 TRP 36 HE1 TRP 36 9.210 -5.465 -6.629 308 HE3 TRP 36 HE3 TRP 36 7.383 -7.446 -2.012 309 HZ2 TRP 36 HZ2 TRP 36 6.475 -4.879 -6.176 310 HZ3 TRP 36 HZ3 TRP 36 5.085 -6.577 -2.464 311 HH2 TRP 36 HH2 TRP 36 4.635 -5.288 -4.529 312 H LYS 37 H LYS 37 12.431 -7.222 -0.646 313 HA LYS 37 HA LYS 37 13.833 -9.534 0.450 314 HB2 LYS 37 HB2 LYS 37 13.148 -6.784 1.440 315 HB3 LYS 37 HB3 LYS 37 13.673 -8.025 2.576 316 HG2 LYS 37 HG2 LYS 37 15.727 -8.427 1.349 317 HG3 LYS 37 HG3 LYS 37 15.224 -7.296 0.080 318 HD2 LYS 37 HD2 LYS 37 16.784 -6.221 1.551 319 HD3 LYS 37 HD3 LYS 37 15.172 -5.473 1.702 320 HE2 LYS 37 HE2 LYS 37 14.829 -6.838 3.801 321 HE3 LYS 37 HE3 LYS 37 16.491 -7.425 3.638 322 HZ1 LYS 37 HZ1 LYS 37 15.590 -4.649 4.204 323 HZ2 LYS 37 HZ2 LYS 37 16.507 -5.598 5.135 324 HZ3 LYS 37 HZ3 LYS 37 17.141 -4.991 3.756 325 H LEU 38 H LEU 38 11.530 -10.609 -0.278 326 HA LEU 38 HA LEU 38 9.270 -10.448 1.363 327 HB2 LEU 38 HB2 LEU 38 10.306 -12.917 -0.084 328 HB3 LEU 38 HB3 LEU 38 8.670 -12.696 0.527 329 HG LEU 38 HG LEU 38 9.987 -11.163 -1.742 330 HD11 LEU 38 HD11 LEU 38 7.591 -13.056 -1.594 331 HD12 LEU 38 HD12 LEU 38 8.168 -12.242 -3.055 332 HD13 LEU 38 HD13 LEU 38 9.191 -13.449 -2.262 333 HD21 LEU 38 HD21 LEU 38 7.711 -10.111 -2.037 334 HD22 LEU 38 HD22 LEU 38 7.263 -10.759 -0.444 335 HD23 LEU 38 HD23 LEU 38 8.570 -9.566 -0.594 336 H ASP 39 H ASP 39 12.125 -12.443 2.025 337 HA ASP 39 HA ASP 39 10.855 -13.602 4.457 338 HB2 ASP 39 HB2 ASP 39 13.488 -14.161 3.054 339 HB3 ASP 39 HB3 ASP 39 12.973 -14.941 4.549 340 H GLN 40 H GLN 40 12.387 -10.777 3.777 341 HA GLN 40 HA GLN 40 13.713 -10.476 6.444 342 HB2 GLN 40 HB2 GLN 40 14.717 -9.721 3.659 343 HB3 GLN 40 HB3 GLN 40 15.304 -8.934 5.123 344 HG2 GLN 40 HG2 GLN 40 16.872 -10.448 4.665 345 HG3 GLN 40 HG3 GLN 40 15.952 -11.071 6.054 346 HE21 GLN 40 HE21 GLN 40 15.652 -13.092 2.430 347 HE22 GLN 40 HE22 GLN 40 15.882 -11.351 2.404 348 HA PRO 41 HA PRO 41 10.778 -7.202 5.183 349 HB2 PRO 41 HB2 PRO 41 8.949 -7.037 7.319 350 HB3 PRO 41 HB3 PRO 41 8.742 -8.076 5.885 351 HG2 PRO 41 HG2 PRO 41 9.951 -8.839 8.563 352 HG3 PRO 41 HG3 PRO 41 8.747 -9.748 7.597 353 HD2 PRO 41 HD2 PRO 41 11.401 -10.383 7.538 354 HD3 PRO 41 HD3 PRO 41 10.395 -10.473 6.058 355 H ASP 42 H ASP 42 11.075 -5.143 5.523 356 HA ASP 42 HA ASP 42 13.098 -4.246 7.415 357 HB2 ASP 42 HB2 ASP 42 11.313 -2.792 5.419 358 HB3 ASP 42 HB3 ASP 42 12.638 -2.039 6.316 359 H TRP 43 H TRP 43 9.624 -4.344 7.345 360 HA TRP 43 HA TRP 43 9.419 -3.787 10.181 361 HB2 TRP 43 HB2 TRP 43 9.382 -1.485 9.456 362 HB3 TRP 43 HB3 TRP 43 8.291 -1.849 8.135 363 HD1 TRP 43 HD1 TRP 43 8.304 -0.967 11.804 364 HE1 TRP 43 HE1 TRP 43 5.901 -0.445 12.549 365 HE3 TRP 43 HE3 TRP 43 5.805 -2.811 7.757 366 HZ2 TRP 43 HZ2 TRP 43 3.251 -0.517 11.367 367 HZ3 TRP 43 HZ3 TRP 43 3.343 -2.419 7.514 368 HH2 TRP 43 HH2 TRP 43 2.062 -1.320 9.328 369 H THR 44 H THR 44 7.320 -4.455 11.016 370 HA THR 44 HA THR 44 5.317 -5.422 9.075 371 HB THR 44 HB THR 44 4.774 -7.394 10.384 372 HG1 THR 44 HG1 THR 44 7.236 -6.964 11.718 373 HG21 THR 44 HG21 THR 44 6.264 -7.602 8.438 374 HG22 THR 44 HG22 THR 44 7.678 -7.516 9.512 375 HG23 THR 44 HG23 THR 44 6.515 -8.863 9.652 376 H GLY 45 H GLY 45 3.196 -5.358 9.768 377 HA2 GLY 45 HA2 GLY 45 2.294 -4.743 12.401 378 HA3 GLY 45 HA3 GLY 45 2.557 -3.225 11.554 379 H ARG 46 H ARG 46 0.541 -2.534 11.279 380 HA ARG 46 HA ARG 46 -1.568 -4.290 10.087 381 HB2 ARG 46 HB2 ARG 46 -1.859 -1.755 11.739 382 HB3 ARG 46 HB3 ARG 46 -3.166 -2.794 11.163 383 HG2 ARG 46 HG2 ARG 46 -2.269 -4.656 12.576 384 HG3 ARG 46 HG3 ARG 46 -1.036 -3.563 13.217 385 HD2 ARG 46 HD2 ARG 46 -4.047 -3.096 13.446 386 HD3 ARG 46 HD3 ARG 46 -3.053 -3.854 14.685 387 HE ARG 46 HE ARG 46 -1.878 -1.802 15.070 388 HH11 ARG 46 HH11 ARG 46 -1.721 0.307 15.164 389 HH12 ARG 46 HH12 ARG 46 -2.851 1.332 14.247 390 HH21 ARG 46 HH21 ARG 46 -4.537 -1.154 12.788 391 HH22 ARG 46 HH22 ARG 46 -4.219 0.577 12.969 392 H LEU 47 H LEU 47 -2.860 -3.556 8.514 393 HA LEU 47 HA LEU 47 -2.073 -1.199 6.866 394 HB2 LEU 47 HB2 LEU 47 -2.495 -3.382 5.730 395 HB3 LEU 47 HB3 LEU 47 -4.072 -3.462 6.511 396 HG LEU 47 HG LEU 47 -4.724 -1.338 5.248 397 HD11 LEU 47 HD11 LEU 47 -2.202 -2.020 3.675 398 HD12 LEU 47 HD12 LEU 47 -3.441 -0.838 3.205 399 HD13 LEU 47 HD13 LEU 47 -2.455 -0.550 4.643 400 HD21 LEU 47 HD21 LEU 47 -4.026 -3.834 3.694 401 HD22 LEU 47 HD22 LEU 47 -5.511 -3.539 4.620 402 HD23 LEU 47 HD23 LEU 47 -5.184 -2.577 3.184 403 H ARG 48 H ARG 48 -3.296 0.647 6.911 404 HA ARG 48 HA ARG 48 -6.180 0.455 7.507 405 HB2 ARG 48 HB2 ARG 48 -5.285 0.986 9.682 406 HB3 ARG 48 HB3 ARG 48 -4.337 2.333 9.040 407 HG2 ARG 48 HG2 ARG 48 -6.221 3.677 8.689 408 HG3 ARG 48 HG3 ARG 48 -7.349 2.315 8.672 409 HD2 ARG 48 HD2 ARG 48 -7.255 2.026 11.023 410 HD3 ARG 48 HD3 ARG 48 -5.811 3.010 11.189 411 HE ARG 48 HE ARG 48 -8.575 3.959 10.974 412 HH11 ARG 48 HH11 ARG 48 -8.985 6.210 10.990 413 HH12 ARG 48 HH12 ARG 48 -7.585 7.283 10.877 414 HH21 ARG 48 HH21 ARG 48 -5.165 5.012 10.972 415 HH22 ARG 48 HH22 ARG 48 -5.699 6.694 10.785 416 H ILE 49 H ILE 49 -6.656 0.761 5.453 417 HA ILE 49 HA ILE 49 -5.673 3.058 3.894 418 HB ILE 49 HB ILE 49 -8.047 1.289 3.233 419 HG12 ILE 49 HG12 ILE 49 -5.113 0.892 2.499 420 HG13 ILE 49 HG13 ILE 49 -6.124 -0.175 3.484 421 HG21 ILE 49 HG21 ILE 49 -6.243 3.029 1.483 422 HG22 ILE 49 HG22 ILE 49 -7.668 2.114 0.939 423 HG23 ILE 49 HG23 ILE 49 -7.871 3.481 2.022 424 HD11 ILE 49 HD11 ILE 49 -6.221 0.253 0.503 425 HD12 ILE 49 HD12 ILE 49 -6.132 -1.244 1.445 426 HD13 ILE 49 HD13 ILE 49 -7.652 -0.354 1.375 427 H THR 50 H THR 50 -6.499 4.994 3.934 428 HA THR 50 HA THR 50 -9.184 5.569 5.064 429 HB THR 50 HB THR 50 -7.925 7.704 5.976 430 HG1 THR 50 HG1 THR 50 -5.889 5.761 6.016 431 HG21 THR 50 HG21 THR 50 -7.851 4.981 7.325 432 HG22 THR 50 HG22 THR 50 -7.499 6.520 8.141 433 HG23 THR 50 HG23 THR 50 -9.109 6.232 7.469 434 H SER 51 H SER 51 -9.953 7.822 4.419 435 HA SER 51 HA SER 51 -8.593 9.182 2.186 436 HB2 SER 51 HB2 SER 51 -9.793 7.289 1.077 437 HB3 SER 51 HB3 SER 51 -11.315 7.884 1.772 438 HG SER 51 HG SER 51 -10.946 8.620 -0.371 439 H LYS 52 H LYS 52 -9.225 11.199 1.839 440 HA LYS 52 HA LYS 52 -11.861 12.116 2.497 441 HB2 LYS 52 HB2 LYS 52 -9.577 13.100 4.150 442 HB3 LYS 52 HB3 LYS 52 -10.833 14.251 3.668 443 HG2 LYS 52 HG2 LYS 52 -11.114 11.877 5.494 444 HG3 LYS 52 HG3 LYS 52 -11.399 13.581 5.783 445 HD2 LYS 52 HD2 LYS 52 -13.376 13.547 4.288 446 HD3 LYS 52 HD3 LYS 52 -13.215 11.768 4.196 447 HE2 LYS 52 HE2 LYS 52 -13.243 11.633 6.660 448 HE3 LYS 52 HE3 LYS 52 -13.353 13.390 6.772 449 HZ1 LYS 52 HZ1 LYS 52 -15.528 13.275 5.662 450 HZ2 LYS 52 HZ2 LYS 52 -15.441 11.648 5.540 451 HZ3 LYS 52 HZ3 LYS 52 -15.555 12.355 7.006 452 H GLY 53 H GLY 53 -12.521 13.339 0.990 453 HA2 GLY 53 HA2 GLY 53 -12.710 15.119 -0.476 454 HA3 GLY 53 HA3 GLY 53 -11.198 15.736 0.191 455 H LYS 54 H LYS 54 -11.890 12.799 -1.703 456 HA LYS 54 HA LYS 54 -11.069 11.892 -3.601 457 HB2 LYS 54 HB2 LYS 54 -10.521 14.708 -4.581 458 HB3 LYS 54 HB3 LYS 54 -10.537 13.240 -5.557 459 HG2 LYS 54 HG2 LYS 54 -12.915 12.865 -5.018 460 HG3 LYS 54 HG3 LYS 54 -12.955 14.364 -4.080 461 HD2 LYS 54 HD2 LYS 54 -12.325 14.166 -7.056 462 HD3 LYS 54 HD3 LYS 54 -13.890 14.611 -6.359 463 HE2 LYS 54 HE2 LYS 54 -12.833 16.568 -5.235 464 HE3 LYS 54 HE3 LYS 54 -11.284 16.152 -5.981 465 HZ1 LYS 54 HZ1 LYS 54 -12.320 16.489 -8.163 466 HZ2 LYS 54 HZ2 LYS 54 -13.751 16.875 -7.473 467 HZ3 LYS 54 HZ3 LYS 54 -12.456 17.843 -7.265 468 H THR 55 H THR 55 -9.332 12.585 -1.276 469 HA THR 55 HA THR 55 -6.836 11.609 -2.570 470 HB THR 55 HB THR 55 -6.906 13.331 -0.080 471 HG1 THR 55 HG1 THR 55 -6.030 14.918 -1.397 472 HG21 THR 55 HG21 THR 55 -4.452 13.412 -0.471 473 HG22 THR 55 HG22 THR 55 -5.018 11.758 -0.195 474 HG23 THR 55 HG23 THR 55 -4.648 12.296 -1.848 475 H ALA 56 H ALA 56 -6.655 9.561 -2.084 476 HA ALA 56 HA ALA 56 -7.669 8.446 0.473 477 HB1 ALA 56 HB1 ALA 56 -8.252 7.223 -1.559 478 HB2 ALA 56 HB2 ALA 56 -6.523 7.061 -1.962 479 HB3 ALA 56 HB3 ALA 56 -7.179 6.270 -0.514 480 H TYR 57 H TYR 57 -6.223 7.085 1.693 481 HA TYR 57 HA TYR 57 -3.334 7.794 1.630 482 HB2 TYR 57 HB2 TYR 57 -5.128 7.929 4.079 483 HB3 TYR 57 HB3 TYR 57 -3.421 8.319 3.996 484 HD1 TYR 57 HD1 TYR 57 -2.741 10.355 2.528 485 HD2 TYR 57 HD2 TYR 57 -6.788 9.620 3.862 486 HE1 TYR 57 HE1 TYR 57 -3.301 12.757 2.187 487 HE2 TYR 57 HE2 TYR 57 -7.341 12.011 3.497 488 HH TYR 57 HH TYR 57 -4.914 14.377 2.334 489 H ILE 58 H ILE 58 -2.447 5.765 1.324 490 HA ILE 58 HA ILE 58 -3.491 3.433 2.875 491 HB ILE 58 HB ILE 58 -1.111 3.641 0.995 492 HG12 ILE 58 HG12 ILE 58 -2.453 1.910 -0.310 493 HG13 ILE 58 HG13 ILE 58 -3.854 2.341 0.667 494 HG21 ILE 58 HG21 ILE 58 -2.256 1.237 2.489 495 HG22 ILE 58 HG22 ILE 58 -0.961 1.181 1.271 496 HG23 ILE 58 HG23 ILE 58 -0.678 1.995 2.792 497 HD11 ILE 58 HD11 ILE 58 -3.672 3.407 -1.626 498 HD12 ILE 58 HD12 ILE 58 -3.878 4.574 -0.318 499 HD13 ILE 58 HD13 ILE 58 -2.266 4.310 -1.039 500 H LYS 59 H LYS 59 -3.301 4.109 4.999 501 HA LYS 59 HA LYS 59 -0.567 4.798 5.945 502 HB2 LYS 59 HB2 LYS 59 -3.170 4.825 7.506 503 HB3 LYS 59 HB3 LYS 59 -1.585 5.402 8.030 504 HG2 LYS 59 HG2 LYS 59 -1.674 6.891 5.862 505 HG3 LYS 59 HG3 LYS 59 -3.403 6.547 5.883 506 HD2 LYS 59 HD2 LYS 59 -3.570 7.548 8.154 507 HD3 LYS 59 HD3 LYS 59 -1.814 7.845 8.139 508 HE2 LYS 59 HE2 LYS 59 -2.166 9.180 5.989 509 HE3 LYS 59 HE3 LYS 59 -3.909 9.038 6.274 510 HZ1 LYS 59 HZ1 LYS 59 -1.948 10.346 8.082 511 HZ2 LYS 59 HZ2 LYS 59 -3.064 11.109 7.173 512 HZ3 LYS 59 HZ3 LYS 59 -3.552 10.163 8.422 513 H LEU 60 H LEU 60 0.677 3.632 7.128 514 HA LEU 60 HA LEU 60 -0.080 0.827 7.865 515 HB2 LEU 60 HB2 LEU 60 2.396 2.110 6.738 516 HB3 LEU 60 HB3 LEU 60 2.615 0.857 7.950 517 HG LEU 60 HG LEU 60 1.455 -0.788 6.661 518 HD11 LEU 60 HD11 LEU 60 0.980 1.399 4.584 519 HD12 LEU 60 HD12 LEU 60 0.758 -0.342 4.292 520 HD13 LEU 60 HD13 LEU 60 -0.261 0.481 5.471 521 HD21 LEU 60 HD21 LEU 60 3.401 0.775 4.909 522 HD22 LEU 60 HD22 LEU 60 3.858 -0.309 6.237 523 HD23 LEU 60 HD23 LEU 60 3.042 -0.963 4.813 524 H GLU 61 H GLU 61 0.105 0.205 9.948 525 HA GLU 61 HA GLU 61 1.057 2.211 11.971 526 HB2 GLU 61 HB2 GLU 61 -1.620 0.810 11.980 527 HB3 GLU 61 HB3 GLU 61 -0.978 1.932 13.204 528 HG2 GLU 61 HG2 GLU 61 -1.044 3.769 11.574 529 HG3 GLU 61 HG3 GLU 61 -1.722 2.676 10.356 530 H ASP 62 H ASP 62 1.517 1.430 14.060 531 HA ASP 62 HA ASP 62 2.663 -1.195 14.028 532 HB2 ASP 62 HB2 ASP 62 3.476 0.941 15.179 533 HB3 ASP 62 HB3 ASP 62 2.248 0.597 16.417 534 H LYS 63 H LYS 63 2.172 -2.982 15.136 535 HA LYS 63 HA LYS 63 -0.639 -3.476 15.802 536 HB2 LYS 63 HB2 LYS 63 0.194 -5.908 15.875 537 HB3 LYS 63 HB3 LYS 63 0.315 -5.088 14.322 538 HG2 LYS 63 HG2 LYS 63 2.680 -4.661 14.628 539 HG3 LYS 63 HG3 LYS 63 2.648 -5.321 16.269 540 HD2 LYS 63 HD2 LYS 63 2.312 -7.543 15.469 541 HD3 LYS 63 HD3 LYS 63 1.888 -6.972 13.832 542 HE2 LYS 63 HE2 LYS 63 4.178 -6.029 13.577 543 HE3 LYS 63 HE3 LYS 63 4.624 -6.662 15.162 544 HZ1 LYS 63 HZ1 LYS 63 5.258 -8.063 13.198 545 HZ2 LYS 63 HZ2 LYS 63 4.399 -8.884 14.338 546 HZ3 LYS 63 HZ3 LYS 63 3.685 -8.403 12.945 547 H VAL 64 H VAL 64 1.939 -2.534 17.641 548 HA VAL 64 HA VAL 64 0.639 -3.599 20.118 549 HB VAL 64 HB VAL 64 3.565 -3.038 19.525 550 HG11 VAL 64 HG11 VAL 64 3.135 -2.392 21.850 551 HG12 VAL 64 HG12 VAL 64 2.272 -3.921 22.145 552 HG13 VAL 64 HG13 VAL 64 4.020 -3.914 21.820 553 HG21 VAL 64 HG21 VAL 64 3.875 -5.455 20.030 554 HG22 VAL 64 HG22 VAL 64 2.114 -5.634 20.204 555 HG23 VAL 64 HG23 VAL 64 2.829 -5.203 18.634 556 H SER 65 H SER 65 2.442 -0.821 18.698 557 HA SER 65 HA SER 65 1.733 0.817 21.054 558 HB2 SER 65 HB2 SER 65 3.397 1.427 18.592 559 HB3 SER 65 HB3 SER 65 3.165 2.527 19.964 560 HG SER 65 HG SER 65 5.089 1.300 20.157 561 H GLY 66 H GLY 66 0.592 0.415 17.771 562 HA2 GLY 66 HA2 GLY 66 -1.354 1.260 16.808 563 HA3 GLY 66 HA3 GLY 66 -1.631 2.284 18.215 564 H GLU 67 H GLU 67 1.536 2.664 17.093 565 HA GLU 67 HA GLU 67 0.988 5.393 16.263 566 HB2 GLU 67 HB2 GLU 67 3.315 5.748 16.503 567 HB3 GLU 67 HB3 GLU 67 2.763 4.744 17.854 568 HG2 GLU 67 HG2 GLU 67 3.687 2.734 16.753 569 HG3 GLU 67 HG3 GLU 67 4.243 3.715 15.394 570 H LEU 68 H LEU 68 1.815 6.396 14.342 571 HA LEU 68 HA LEU 68 1.329 4.850 11.933 572 HB2 LEU 68 HB2 LEU 68 0.663 7.245 12.269 573 HB3 LEU 68 HB3 LEU 68 2.368 7.686 12.318 574 HG LEU 68 HG LEU 68 2.580 6.767 9.941 575 HD11 LEU 68 HD11 LEU 68 -0.469 6.836 10.089 576 HD12 LEU 68 HD12 LEU 68 0.511 6.587 8.623 577 HD13 LEU 68 HD13 LEU 68 0.514 5.376 9.903 578 HD21 LEU 68 HD21 LEU 68 1.534 8.757 8.920 579 HD22 LEU 68 HD22 LEU 68 0.630 9.059 10.421 580 HD23 LEU 68 HD23 LEU 68 2.405 9.174 10.404 581 H PHE 69 H PHE 69 2.764 3.718 10.772 582 HA PHE 69 HA PHE 69 5.695 4.008 11.164 583 HB2 PHE 69 HB2 PHE 69 4.934 1.757 11.037 584 HB3 PHE 69 HB3 PHE 69 3.951 2.073 9.617 585 HD1 PHE 69 HD1 PHE 69 4.802 1.524 7.476 586 HD2 PHE 69 HD2 PHE 69 7.550 2.224 10.729 587 HE1 PHE 69 HE1 PHE 69 6.705 0.980 5.990 588 HE2 PHE 69 HE2 PHE 69 9.449 1.623 9.246 589 HZ PHE 69 HZ PHE 69 9.030 1.005 6.872 590 H ALA 70 H ALA 70 3.369 4.112 8.421 591 HA ALA 70 HA ALA 70 4.720 6.413 7.218 592 HB1 ALA 70 HB1 ALA 70 5.272 5.252 5.141 593 HB2 ALA 70 HB2 ALA 70 6.118 4.472 6.479 594 HB3 ALA 70 HB3 ALA 70 4.666 3.711 5.788 595 H GLN 71 H GLN 71 3.594 7.165 5.261 596 HA GLN 71 HA GLN 71 0.841 6.142 4.839 597 HB2 GLN 71 HB2 GLN 71 0.035 8.529 4.813 598 HB3 GLN 71 HB3 GLN 71 0.412 7.872 6.408 599 HG2 GLN 71 HG2 GLN 71 2.306 9.212 6.697 600 HG3 GLN 71 HG3 GLN 71 2.570 9.416 4.979 601 HE21 GLN 71 HE21 GLN 71 1.167 12.599 5.100 602 HE22 GLN 71 HE22 GLN 71 2.468 11.528 4.553 603 H ALA 72 H ALA 72 0.268 6.078 2.729 604 HA ALA 72 HA ALA 72 1.857 7.670 0.735 605 HB1 ALA 72 HB1 ALA 72 1.334 5.850 -0.844 606 HB2 ALA 72 HB2 ALA 72 2.336 5.335 0.522 607 HB3 ALA 72 HB3 ALA 72 0.613 4.923 0.487 608 HA PRO 73 HA PRO 73 -2.294 9.462 0.167 609 HB2 PRO 73 HB2 PRO 73 -0.701 11.625 -1.140 610 HB3 PRO 73 HB3 PRO 73 -1.994 11.754 0.088 611 HG2 PRO 73 HG2 PRO 73 0.625 12.123 0.740 612 HG3 PRO 73 HG3 PRO 73 -0.485 11.241 1.846 613 HD2 PRO 73 HD2 PRO 73 1.457 10.077 -0.176 614 HD3 PRO 73 HD3 PRO 73 1.242 9.655 1.554 615 H VAL 74 H VAL 74 -3.559 9.244 -1.612 616 HA VAL 74 HA VAL 74 -2.364 8.930 -4.335 617 HB VAL 74 HB VAL 74 -4.606 7.248 -3.147 618 HG11 VAL 74 HG11 VAL 74 -3.165 7.038 -5.815 619 HG12 VAL 74 HG12 VAL 74 -4.328 5.855 -5.178 620 HG13 VAL 74 HG13 VAL 74 -4.870 7.484 -5.539 621 HG21 VAL 74 HG21 VAL 74 -1.775 6.328 -3.756 622 HG22 VAL 74 HG22 VAL 74 -2.466 6.544 -2.135 623 HG23 VAL 74 HG23 VAL 74 -3.122 5.320 -3.222 624 H GLU 75 H GLU 75 -3.420 10.165 -5.870 625 HA GLU 75 HA GLU 75 -5.929 11.576 -5.040 626 HB2 GLU 75 HB2 GLU 75 -3.922 12.158 -7.240 627 HB3 GLU 75 HB3 GLU 75 -5.389 13.093 -6.929 628 HG2 GLU 75 HG2 GLU 75 -4.589 13.587 -4.623 629 HG3 GLU 75 HG3 GLU 75 -3.089 12.721 -4.962 630 H GLN 76 H GLN 76 -4.995 9.012 -7.126 631 HA GLN 76 HA GLN 76 -7.697 8.513 -7.926 632 HB2 GLN 76 HB2 GLN 76 -6.956 8.397 -10.474 633 HB3 GLN 76 HB3 GLN 76 -7.683 9.821 -9.770 634 HG2 GLN 76 HG2 GLN 76 -5.828 10.367 -11.279 635 HG3 GLN 76 HG3 GLN 76 -5.594 10.994 -9.662 636 HE21 GLN 76 HE21 GLN 76 -2.451 9.410 -9.343 637 HE22 GLN 76 HE22 GLN 76 -3.562 10.635 -8.763 638 H TYR 77 H TYR 77 -7.954 6.390 -8.851 639 HA TYR 77 HA TYR 77 -5.585 4.658 -8.369 640 HB2 TYR 77 HB2 TYR 77 -7.259 4.696 -6.557 641 HB3 TYR 77 HB3 TYR 77 -8.451 3.999 -7.663 642 HD1 TYR 77 HD1 TYR 77 -5.244 3.548 -5.951 643 HD2 TYR 77 HD2 TYR 77 -8.290 1.587 -8.247 644 HE1 TYR 77 HE1 TYR 77 -4.114 1.366 -5.530 645 HE2 TYR 77 HE2 TYR 77 -7.248 -0.628 -7.739 646 HH TYR 77 HH TYR 77 -4.227 -0.918 -5.837 647 HA PRO 78 HA PRO 78 -4.520 2.871 -8.899 648 HB2 PRO 78 HB2 PRO 78 -2.969 1.853 -10.876 649 HB3 PRO 78 HB3 PRO 78 -4.247 0.899 -10.060 650 HG2 PRO 78 HG2 PRO 78 -4.436 2.382 -12.705 651 HG3 PRO 78 HG3 PRO 78 -4.914 0.690 -12.350 652 HD2 PRO 78 HD2 PRO 78 -6.723 2.733 -12.347 653 HD3 PRO 78 HD3 PRO 78 -6.846 1.381 -11.184 654 H GLY 79 H GLY 79 -2.578 4.071 -8.769 655 HA2 GLY 79 HA2 GLY 79 -2.059 6.229 -10.768 656 HA3 GLY 79 HA3 GLY 79 -2.508 6.683 -9.130 657 H ILE 80 H ILE 80 -0.354 7.820 -9.566 658 HA ILE 80 HA ILE 80 2.092 6.471 -9.802 659 HB ILE 80 HB ILE 80 1.804 8.843 -10.232 660 HG12 ILE 80 HG12 ILE 80 3.798 9.804 -9.186 661 HG13 ILE 80 HG13 ILE 80 3.848 8.505 -7.997 662 HG21 ILE 80 HG21 ILE 80 0.247 9.453 -8.380 663 HG22 ILE 80 HG22 ILE 80 1.582 9.290 -7.217 664 HG23 ILE 80 HG23 ILE 80 1.633 10.536 -8.473 665 HD11 ILE 80 HD11 ILE 80 4.184 8.148 -11.004 666 HD12 ILE 80 HD12 ILE 80 5.495 8.212 -9.805 667 HD13 ILE 80 HD13 ILE 80 4.343 6.870 -9.771 668 H ALA 81 H ALA 81 0.203 6.906 -6.888 669 HA ALA 81 HA ALA 81 2.488 6.174 -5.147 670 HB1 ALA 81 HB1 ALA 81 -0.184 7.520 -4.657 671 HB2 ALA 81 HB2 ALA 81 0.980 7.100 -3.371 672 HB3 ALA 81 HB3 ALA 81 1.418 8.261 -4.638 673 H VAL 82 H VAL 82 0.495 4.318 -6.821 674 HA VAL 82 HA VAL 82 0.677 2.172 -4.908 675 HB VAL 82 HB VAL 82 -1.340 3.143 -4.007 676 HG11 VAL 82 HG11 VAL 82 -2.727 2.853 -6.641 677 HG12 VAL 82 HG12 VAL 82 -3.319 3.501 -5.077 678 HG13 VAL 82 HG13 VAL 82 -2.104 4.380 -5.983 679 HG21 VAL 82 HG21 VAL 82 -0.976 0.678 -4.065 680 HG22 VAL 82 HG22 VAL 82 -2.650 1.200 -3.900 681 HG23 VAL 82 HG23 VAL 82 -2.041 0.605 -5.471 682 H GLU 83 H GLU 83 0.925 0.324 -5.837 683 HA GLU 83 HA GLU 83 0.219 -0.215 -8.669 684 HB2 GLU 83 HB2 GLU 83 2.972 0.412 -7.609 685 HB3 GLU 83 HB3 GLU 83 2.860 -0.859 -8.811 686 HG2 GLU 83 HG2 GLU 83 1.590 1.843 -9.272 687 HG3 GLU 83 HG3 GLU 83 3.288 1.531 -9.611 688 H THR 84 H THR 84 1.008 -2.302 -9.430 689 HA THR 84 HA THR 84 0.676 -4.463 -7.353 690 HB THR 84 HB THR 84 -0.666 -5.654 -8.956 691 HG1 THR 84 HG1 THR 84 -1.206 -4.725 -10.941 692 HG21 THR 84 HG21 THR 84 -1.860 -3.943 -7.585 693 HG22 THR 84 HG22 THR 84 -1.649 -2.755 -8.886 694 HG23 THR 84 HG23 THR 84 -2.638 -4.215 -9.141 695 H VAL 85 H VAL 85 1.614 -6.532 -7.827 696 HA VAL 85 HA VAL 85 4.090 -6.433 -9.408 697 HB VAL 85 HB VAL 85 4.571 -8.606 -8.487 698 HG11 VAL 85 HG11 VAL 85 3.515 -6.772 -6.302 699 HG12 VAL 85 HG12 VAL 85 4.778 -8.001 -6.146 700 HG13 VAL 85 HG13 VAL 85 5.053 -6.576 -7.155 701 HG21 VAL 85 HG21 VAL 85 2.262 -9.543 -8.450 702 HG22 VAL 85 HG22 VAL 85 3.133 -9.743 -6.929 703 HG23 VAL 85 HG23 VAL 85 1.887 -8.487 -7.077 704 H THR 86 H THR 86 4.572 -8.474 -10.725 705 HA THR 86 HA THR 86 2.468 -8.894 -12.754 706 HB THR 86 HB THR 86 4.219 -9.972 -14.041 707 HG1 THR 86 HG1 THR 86 6.252 -10.245 -13.192 708 HG21 THR 86 HG21 THR 86 5.860 -8.176 -14.252 709 HG22 THR 86 HG22 THR 86 4.236 -7.474 -14.023 710 HG23 THR 86 HG23 THR 86 5.402 -7.512 -12.684 711 H ASP 87 H ASP 87 4.176 -10.765 -10.301 712 HA ASP 87 HA ASP 87 3.328 -13.296 -11.413 713 HB2 ASP 87 HB2 ASP 87 5.593 -12.837 -10.541 714 HB3 ASP 87 HB3 ASP 87 4.923 -12.676 -8.914 715 H SER 88 H SER 88 2.599 -11.605 -8.330 716 HA SER 88 HA SER 88 0.273 -13.463 -7.928 717 HB2 SER 88 HB2 SER 88 2.186 -14.508 -6.834 718 HB3 SER 88 HB3 SER 88 2.445 -13.051 -5.860 719 HG SER 88 HG SER 88 1.131 -14.824 -4.912 720 H SER 89 H SER 89 -1.526 -12.375 -7.473 721 HA SER 89 HA SER 89 -1.499 -9.593 -7.134 722 HB2 SER 89 HB2 SER 89 -3.941 -11.160 -6.391 723 HB3 SER 89 HB3 SER 89 -3.809 -9.655 -7.294 724 HG SER 89 HG SER 89 -2.923 -10.885 -9.041 725 H ARG 90 H ARG 90 -0.777 -11.632 -4.625 726 HA ARG 90 HA ARG 90 -1.975 -9.951 -2.511 727 HB2 ARG 90 HB2 ARG 90 -1.094 -11.648 -0.917 728 HB3 ARG 90 HB3 ARG 90 -2.362 -12.168 -2.007 729 HG2 ARG 90 HG2 ARG 90 -0.827 -13.381 -3.396 730 HG3 ARG 90 HG3 ARG 90 0.579 -12.734 -2.536 731 HD2 ARG 90 HD2 ARG 90 -1.568 -14.428 -1.195 732 HD3 ARG 90 HD3 ARG 90 -0.162 -15.126 -1.991 733 HE ARG 90 HE ARG 90 -0.012 -13.236 0.353 734 HH11 ARG 90 HH11 ARG 90 1.512 -13.498 1.779 735 HH12 ARG 90 HH12 ARG 90 2.726 -14.757 1.625 736 HH21 ARG 90 HH21 ARG 90 1.376 -16.032 -1.275 737 HH22 ARG 90 HH22 ARG 90 2.605 -16.201 -0.054 738 H TYR 91 H TYR 91 0.152 -8.941 -4.318 739 HA TYR 91 HA TYR 91 1.817 -7.802 -2.171 740 HB2 TYR 91 HB2 TYR 91 2.872 -8.960 -4.766 741 HB3 TYR 91 HB3 TYR 91 3.808 -8.024 -3.622 742 HD1 TYR 91 HD1 TYR 91 2.376 -11.313 -4.378 743 HD2 TYR 91 HD2 TYR 91 4.396 -8.954 -1.389 744 HE1 TYR 91 HE1 TYR 91 3.026 -13.391 -3.189 745 HE2 TYR 91 HE2 TYR 91 5.005 -11.051 -0.163 746 HH TYR 91 HH TYR 91 4.149 -14.292 -1.406 747 H PHE 92 H PHE 92 2.092 -5.665 -2.373 748 HA PHE 92 HA PHE 92 1.468 -4.269 -4.941 749 HB2 PHE 92 HB2 PHE 92 0.478 -3.485 -2.170 750 HB3 PHE 92 HB3 PHE 92 0.258 -2.548 -3.636 751 HD1 PHE 92 HD1 PHE 92 -1.093 -3.537 -5.554 752 HD2 PHE 92 HD2 PHE 92 -1.067 -5.202 -1.597 753 HE1 PHE 92 HE1 PHE 92 -3.181 -4.815 -6.072 754 HE2 PHE 92 HE2 PHE 92 -3.184 -6.385 -2.069 755 HZ PHE 92 HZ PHE 92 -4.206 -6.240 -4.357 756 H VAL 93 H VAL 93 2.284 -2.073 -5.026 757 HA VAL 93 HA VAL 93 4.443 -1.412 -3.065 758 HB VAL 93 HB VAL 93 4.445 -0.958 -6.063 759 HG11 VAL 93 HG11 VAL 93 6.560 0.301 -5.760 760 HG12 VAL 93 HG12 VAL 93 5.171 1.145 -5.086 761 HG13 VAL 93 HG13 VAL 93 6.309 0.303 -4.003 762 HG21 VAL 93 HG21 VAL 93 5.317 -3.090 -5.343 763 HG22 VAL 93 HG22 VAL 93 6.680 -2.087 -5.836 764 HG23 VAL 93 HG23 VAL 93 6.354 -2.326 -4.115 765 H ILE 94 H ILE 94 4.388 0.651 -2.229 766 HA ILE 94 HA ILE 94 2.509 2.562 -3.457 767 HB ILE 94 HB ILE 94 1.693 3.380 -1.364 768 HG12 ILE 94 HG12 ILE 94 3.477 2.423 0.164 769 HG13 ILE 94 HG13 ILE 94 1.822 2.396 0.738 770 HG21 ILE 94 HG21 ILE 94 0.900 0.515 -1.915 771 HG22 ILE 94 HG22 ILE 94 -0.016 1.676 -0.927 772 HG23 ILE 94 HG23 ILE 94 0.262 2.003 -2.636 773 HD11 ILE 94 HD11 ILE 94 1.648 -0.020 0.248 774 HD12 ILE 94 HD12 ILE 94 3.326 -0.031 -0.335 775 HD13 ILE 94 HD13 ILE 94 2.971 0.347 1.357 776 H ARG 95 H ARG 95 2.928 4.737 -3.098 777 HA ARG 95 HA ARG 95 5.806 5.296 -2.528 778 HB2 ARG 95 HB2 ARG 95 4.710 5.968 -4.744 779 HB3 ARG 95 HB3 ARG 95 3.871 7.228 -3.834 780 HG2 ARG 95 HG2 ARG 95 6.101 8.072 -3.037 781 HG3 ARG 95 HG3 ARG 95 6.886 6.813 -4.001 782 HD2 ARG 95 HD2 ARG 95 7.034 8.720 -5.339 783 HD3 ARG 95 HD3 ARG 95 5.694 7.804 -6.044 784 HE ARG 95 HE ARG 95 4.530 9.585 -4.198 785 HH11 ARG 95 HH11 ARG 95 3.915 11.718 -4.602 786 HH12 ARG 95 HH12 ARG 95 4.286 12.417 -6.150 787 HH21 ARG 95 HH21 ARG 95 6.300 9.862 -7.206 788 HH22 ARG 95 HH22 ARG 95 5.668 11.448 -7.542 789 H ILE 96 H ILE 96 5.857 5.348 -0.324 790 HA ILE 96 HA ILE 96 3.903 6.925 1.163 791 HB ILE 96 HB ILE 96 5.054 6.414 3.167 792 HG12 ILE 96 HG12 ILE 96 6.885 4.446 2.853 793 HG13 ILE 96 HG13 ILE 96 7.250 5.350 1.396 794 HG21 ILE 96 HG21 ILE 96 4.605 3.987 1.418 795 HG22 ILE 96 HG22 ILE 96 4.663 3.988 3.188 796 HG23 ILE 96 HG23 ILE 96 3.390 4.874 2.376 797 HD11 ILE 96 HD11 ILE 96 7.654 7.382 2.824 798 HD12 ILE 96 HD12 ILE 96 7.265 6.401 4.261 799 HD13 ILE 96 HD13 ILE 96 8.683 6.010 3.273 800 H GLN 97 H GLN 97 4.108 8.879 2.104 801 HA GLN 97 HA GLN 97 6.331 10.660 1.222 802 HB2 GLN 97 HB2 GLN 97 3.405 10.885 0.461 803 HB3 GLN 97 HB3 GLN 97 4.513 12.255 0.394 804 HG2 GLN 97 HG2 GLN 97 5.780 11.366 -1.352 805 HG3 GLN 97 HG3 GLN 97 5.230 9.716 -1.089 806 HE21 GLN 97 HE21 GLN 97 2.300 10.025 -3.053 807 HE22 GLN 97 HE22 GLN 97 3.222 9.017 -1.942 808 H ASP 98 H ASP 98 6.611 12.439 2.371 809 HA ASP 98 HA ASP 98 5.370 12.513 5.055 810 HB2 ASP 98 HB2 ASP 98 7.866 12.502 4.592 811 HB3 ASP 98 HB3 ASP 98 7.669 14.137 3.961 812 H GLY 99 H GLY 99 4.454 13.853 2.234 813 HA2 GLY 99 HA2 GLY 99 2.768 15.397 1.813 814 HA3 GLY 99 HA3 GLY 99 2.836 15.945 3.489 815 H THR 100 H THR 100 5.878 15.957 1.945 816 HA THR 100 HA THR 100 5.752 18.860 1.250 817 HB THR 100 HB THR 100 6.393 18.517 3.610 818 HG1 THR 100 HG1 THR 100 8.378 19.563 1.900 819 HG21 THR 100 HG21 THR 100 8.933 17.231 2.530 820 HG22 THR 100 HG22 THR 100 8.577 17.652 4.217 821 HG23 THR 100 HG23 THR 100 7.637 16.390 3.411 822 H GLY 101 H GLY 101 6.144 16.204 -0.322 823 HA2 GLY 101 HA2 GLY 101 7.128 15.927 -2.432 824 HA3 GLY 101 HA3 GLY 101 8.280 17.216 -2.100 825 H ARG 102 H ARG 102 8.421 15.275 0.561 826 HA ARG 102 HA ARG 102 10.722 13.609 -0.189 827 HB2 ARG 102 HB2 ARG 102 8.931 13.753 2.272 828 HB3 ARG 102 HB3 ARG 102 10.291 12.636 2.121 829 HG2 ARG 102 HG2 ARG 102 11.864 14.420 1.973 830 HG3 ARG 102 HG3 ARG 102 10.572 15.641 1.886 831 HD2 ARG 102 HD2 ARG 102 9.810 15.017 4.149 832 HD3 ARG 102 HD3 ARG 102 11.123 13.834 4.282 833 HE ARG 102 HE ARG 102 12.566 16.022 3.787 834 HH11 ARG 102 HH11 ARG 102 13.301 17.606 5.125 835 HH12 ARG 102 HH12 ARG 102 12.401 18.043 6.546 836 HH21 ARG 102 HH21 ARG 102 9.836 15.806 6.065 837 HH22 ARG 102 HH22 ARG 102 10.527 17.058 7.056 838 H SER 103 H SER 103 10.551 11.659 -0.986 839 HA SER 103 HA SER 103 8.170 10.046 -0.435 840 HB2 SER 103 HB2 SER 103 7.835 9.437 -2.810 841 HB3 SER 103 HB3 SER 103 7.634 11.177 -2.550 842 HG SER 103 HG SER 103 8.911 10.803 -4.385 843 H ALA 104 H ALA 104 8.320 7.816 -0.642 844 HA ALA 104 HA ALA 104 10.717 6.577 -1.827 845 HB1 ALA 104 HB1 ALA 104 11.333 6.816 0.564 846 HB2 ALA 104 HB2 ALA 104 9.825 6.003 1.037 847 HB3 ALA 104 HB3 ALA 104 11.073 5.113 0.140 848 H PHE 105 H PHE 105 10.295 4.646 -2.801 849 HA PHE 105 HA PHE 105 7.511 3.623 -2.745 850 HB2 PHE 105 HB2 PHE 105 9.892 3.006 -4.503 851 HB3 PHE 105 HB3 PHE 105 8.436 2.027 -4.478 852 HD1 PHE 105 HD1 PHE 105 9.925 5.047 -5.831 853 HD2 PHE 105 HD2 PHE 105 6.184 3.091 -4.983 854 HE1 PHE 105 HE1 PHE 105 8.790 6.465 -7.530 855 HE2 PHE 105 HE2 PHE 105 5.055 4.467 -6.715 856 HZ PHE 105 HZ PHE 105 6.361 6.159 -7.991 857 H ILE 106 H ILE 106 6.919 2.096 -1.458 858 HA ILE 106 HA ILE 106 8.891 0.074 -0.471 859 HB ILE 106 HB ILE 106 7.879 -0.068 1.629 860 HG12 ILE 106 HG12 ILE 106 5.778 1.971 0.795 861 HG13 ILE 106 HG13 ILE 106 5.500 0.243 1.030 862 HG21 ILE 106 HG21 ILE 106 8.082 2.916 1.091 863 HG22 ILE 106 HG22 ILE 106 8.479 2.051 2.595 864 HG23 ILE 106 HG23 ILE 106 9.486 1.841 1.161 865 HD11 ILE 106 HD11 ILE 106 6.279 2.192 3.225 866 HD12 ILE 106 HD12 ILE 106 4.711 1.420 2.971 867 HD13 ILE 106 HD13 ILE 106 6.117 0.437 3.417 868 H GLY 107 H GLY 107 8.248 -2.066 -0.385 869 HA2 GLY 107 HA2 GLY 107 5.817 -2.787 -1.948 870 HA3 GLY 107 HA3 GLY 107 7.193 -3.834 -1.609 871 H ILE 108 H ILE 108 4.220 -4.025 -1.024 872 HA ILE 108 HA ILE 108 4.578 -5.003 1.732 873 HB ILE 108 HB ILE 108 2.233 -4.525 2.283 874 HG12 ILE 108 HG12 ILE 108 2.232 -2.599 -0.078 875 HG13 ILE 108 HG13 ILE 108 1.359 -4.131 -0.022 876 HG21 ILE 108 HG21 ILE 108 4.123 -3.227 3.127 877 HG22 ILE 108 HG22 ILE 108 3.946 -2.065 1.790 878 HG23 ILE 108 HG23 ILE 108 2.661 -2.250 3.005 879 HD11 ILE 108 HD11 ILE 108 0.080 -3.310 1.978 880 HD12 ILE 108 HD12 ILE 108 0.844 -1.722 1.777 881 HD13 ILE 108 HD13 ILE 108 -0.197 -2.367 0.501 882 H GLY 109 H GLY 109 3.749 -6.919 2.231 883 HA2 GLY 109 HA2 GLY 109 2.333 -8.470 0.084 884 HA3 GLY 109 HA3 GLY 109 3.524 -9.181 1.156 885 H PHE 110 H PHE 110 0.683 -9.755 0.608 886 HA PHE 110 HA PHE 110 -0.619 -9.382 3.273 887 HB2 PHE 110 HB2 PHE 110 -1.643 -9.840 0.460 888 HB3 PHE 110 HB3 PHE 110 -2.664 -10.093 1.860 889 HD1 PHE 110 HD1 PHE 110 -4.009 -8.341 2.589 890 HD2 PHE 110 HD2 PHE 110 -0.386 -7.422 0.426 891 HE1 PHE 110 HE1 PHE 110 -4.573 -5.931 2.647 892 HE2 PHE 110 HE2 PHE 110 -0.901 -5.013 0.602 893 HZ PHE 110 HZ PHE 110 -3.001 -4.260 1.669 894 H THR 111 H THR 111 -1.960 -11.153 4.069 895 HA THR 111 HA THR 111 -0.469 -13.633 4.160 896 HB THR 111 HB THR 111 -1.617 -12.630 6.091 897 HG1 THR 111 HG1 THR 111 -2.349 -14.574 6.892 898 HG21 THR 111 HG21 THR 111 -3.759 -11.915 5.021 899 HG22 THR 111 HG22 THR 111 -4.222 -13.624 4.859 900 HG23 THR 111 HG23 THR 111 -4.000 -12.904 6.464 901 H ASP 112 H ASP 112 -3.283 -12.582 2.321 902 HA ASP 112 HA ASP 112 -3.255 -15.049 0.770 903 HB2 ASP 112 HB2 ASP 112 -4.717 -15.573 2.766 904 HB3 ASP 112 HB3 ASP 112 -5.774 -14.244 2.288 905 H ARG 113 H ARG 113 -4.464 -14.895 -1.199 906 HA ARG 113 HA ARG 113 -4.485 -12.317 -2.449 907 HB2 ARG 113 HB2 ARG 113 -4.132 -14.548 -3.540 908 HB3 ARG 113 HB3 ARG 113 -5.861 -14.887 -3.351 909 HG2 ARG 113 HG2 ARG 113 -6.422 -12.965 -4.781 910 HG3 ARG 113 HG3 ARG 113 -4.718 -12.478 -4.819 911 HD2 ARG 113 HD2 ARG 113 -4.172 -14.690 -5.908 912 HD3 ARG 113 HD3 ARG 113 -5.897 -15.036 -6.000 913 HE ARG 113 HE ARG 113 -4.370 -12.940 -7.500 914 HH11 ARG 113 HH11 ARG 113 -5.136 -12.118 -9.275 915 HH12 ARG 113 HH12 ARG 113 -6.717 -12.554 -9.890 916 HH21 ARG 113 HH21 ARG 113 -7.473 -14.562 -7.184 917 HH22 ARG 113 HH22 ARG 113 -8.042 -13.890 -8.688 918 H GLY 114 H GLY 114 -7.119 -14.121 -0.858 919 HA2 GLY 114 HA2 GLY 114 -9.274 -12.421 -1.768 920 HA3 GLY 114 HA3 GLY 114 -9.276 -13.490 -0.358 921 H ASP 115 H ASP 115 -6.911 -12.125 0.856 922 HA ASP 115 HA ASP 115 -8.322 -9.852 2.129 923 HB2 ASP 115 HB2 ASP 115 -5.712 -11.295 2.709 924 HB3 ASP 115 HB3 ASP 115 -6.173 -9.798 3.515 925 H ALA 116 H ALA 116 -5.541 -10.393 -0.036 926 HA ALA 116 HA ALA 116 -4.771 -7.632 -0.281 927 HB1 ALA 116 HB1 ALA 116 -3.642 -8.458 -2.305 928 HB2 ALA 116 HB2 ALA 116 -3.396 -9.559 -0.931 929 HB3 ALA 116 HB3 ALA 116 -4.549 -9.972 -2.220 930 H PHE 117 H PHE 117 -7.231 -9.603 -2.017 931 HA PHE 117 HA PHE 117 -7.978 -7.593 -3.884 932 HB2 PHE 117 HB2 PHE 117 -9.203 -10.083 -2.835 933 HB3 PHE 117 HB3 PHE 117 -10.340 -8.880 -3.408 934 HD1 PHE 117 HD1 PHE 117 -11.077 -9.299 -5.573 935 HD2 PHE 117 HD2 PHE 117 -6.932 -10.025 -4.620 936 HE1 PHE 117 HE1 PHE 117 -10.633 -9.901 -7.938 937 HE2 PHE 117 HE2 PHE 117 -6.492 -10.611 -6.986 938 HZ PHE 117 HZ PHE 117 -8.341 -10.551 -8.652 939 H ASP 118 H ASP 118 -8.915 -7.860 -0.436 940 HA ASP 118 HA ASP 118 -10.880 -5.750 -0.581 941 HB2 ASP 118 HB2 ASP 118 -9.229 -6.786 1.755 942 HB3 ASP 118 HB3 ASP 118 -10.452 -5.540 1.899 943 H PHE 119 H PHE 119 -7.329 -5.628 -0.281 944 HA PHE 119 HA PHE 119 -7.117 -2.819 0.311 945 HB2 PHE 119 HB2 PHE 119 -5.251 -4.230 0.670 946 HB3 PHE 119 HB3 PHE 119 -5.233 -4.803 -0.979 947 HD1 PHE 119 HD1 PHE 119 -4.118 -2.156 1.250 948 HD2 PHE 119 HD2 PHE 119 -4.437 -3.398 -2.858 949 HE1 PHE 119 HE1 PHE 119 -2.529 -0.397 0.601 950 HE2 PHE 119 HE2 PHE 119 -2.820 -1.641 -3.512 951 HZ PHE 119 HZ PHE 119 -1.853 -0.127 -1.785 952 H ASN 120 H ASN 120 -6.915 -4.504 -2.895 953 HA ASN 120 HA ASN 120 -6.909 -1.925 -4.215 954 HB2 ASN 120 HB2 ASN 120 -6.824 -3.153 -6.301 955 HB3 ASN 120 HB3 ASN 120 -5.661 -3.780 -5.144 956 HD21 ASN 120 HD21 ASN 120 -8.742 -6.206 -6.356 957 HD22 ASN 120 HD22 ASN 120 -8.972 -4.474 -6.488 958 H VAL 121 H VAL 121 -9.578 -4.117 -3.431 959 HA VAL 121 HA VAL 121 -11.463 -2.752 -5.186 960 HB VAL 121 HB VAL 121 -11.835 -4.662 -2.871 961 HG11 VAL 121 HG11 VAL 121 -13.851 -3.268 -2.896 962 HG12 VAL 121 HG12 VAL 121 -13.980 -3.433 -4.663 963 HG13 VAL 121 HG13 VAL 121 -14.219 -4.840 -3.603 964 HG21 VAL 121 HG21 VAL 121 -12.564 -6.198 -4.663 965 HG22 VAL 121 HG22 VAL 121 -12.337 -4.922 -5.880 966 HG23 VAL 121 HG23 VAL 121 -10.944 -5.599 -5.020 967 H SER 122 H SER 122 -10.644 -2.430 -1.674 968 HA SER 122 HA SER 122 -12.660 -0.460 -1.168 969 HB2 SER 122 HB2 SER 122 -10.019 -0.842 0.289 970 HB3 SER 122 HB3 SER 122 -11.443 0.037 0.876 971 HG SER 122 HG SER 122 -11.061 -2.713 0.476 972 H LEU 123 H LEU 123 -9.416 -0.126 -2.529 973 HA LEU 123 HA LEU 123 -9.447 2.797 -2.490 974 HB2 LEU 123 HB2 LEU 123 -7.770 0.725 -3.953 975 HB3 LEU 123 HB3 LEU 123 -7.566 2.457 -4.196 976 HG LEU 123 HG LEU 123 -7.348 1.163 -1.447 977 HD11 LEU 123 HD11 LEU 123 -5.087 1.917 -3.333 978 HD12 LEU 123 HD12 LEU 123 -4.940 1.234 -1.698 979 HD13 LEU 123 HD13 LEU 123 -5.624 0.253 -2.998 980 HD21 LEU 123 HD21 LEU 123 -7.756 3.595 -1.380 981 HD22 LEU 123 HD22 LEU 123 -6.091 3.243 -0.919 982 HD23 LEU 123 HD23 LEU 123 -6.438 3.865 -2.543 983 H GLN 124 H GLN 124 -9.914 0.406 -5.201 984 HA GLN 124 HA GLN 124 -10.547 2.462 -7.031 985 HB2 GLN 124 HB2 GLN 124 -10.954 0.812 -8.606 986 HB3 GLN 124 HB3 GLN 124 -9.809 0.074 -7.484 987 HG2 GLN 124 HG2 GLN 124 -11.795 -1.035 -6.361 988 HG3 GLN 124 HG3 GLN 124 -12.784 -0.483 -7.717 989 HE21 GLN 124 HE21 GLN 124 -9.857 -3.310 -8.464 990 HE22 GLN 124 HE22 GLN 124 -9.673 -2.194 -7.089 991 H ASP 125 H ASP 125 -12.743 0.747 -4.824 992 HA ASP 125 HA ASP 125 -15.125 1.811 -6.112 993 HB2 ASP 125 HB2 ASP 125 -15.023 -0.427 -5.008 994 HB3 ASP 125 HB3 ASP 125 -14.811 0.379 -3.449 995 H HIS 126 H HIS 126 -12.818 3.209 -4.066 996 HA HIS 126 HA HIS 126 -14.771 5.251 -3.168 997 HB2 HIS 126 HB2 HIS 126 -12.953 4.285 -1.601 998 HB3 HIS 126 HB3 HIS 126 -11.827 5.305 -2.502 999 HD2 HIS 126 HD2 HIS 126 -15.182 5.600 -0.525 1000 HE1 HIS 126 HE1 HIS 126 -13.193 9.346 -0.116 1001 HE2 HIS 126 HE2 HIS 126 -15.235 7.993 0.573 1002 H PHE 127 H PHE 127 -12.562 4.648 -5.719 1003 HA PHE 127 HA PHE 127 -12.580 7.512 -6.547 1004 HB2 PHE 127 HB2 PHE 127 -10.780 5.175 -7.213 1005 HB3 PHE 127 HB3 PHE 127 -10.767 6.659 -8.148 1006 HD1 PHE 127 HD1 PHE 127 -9.238 5.060 -5.419 1007 HD2 PHE 127 HD2 PHE 127 -10.627 8.920 -6.730 1008 HE1 PHE 127 HE1 PHE 127 -7.584 6.149 -3.943 1009 HE2 PHE 127 HE2 PHE 127 -8.980 10.017 -5.236 1010 HZ PHE 127 HZ PHE 127 -7.451 8.637 -3.846 1011 H LYS 128 H LYS 128 -14.292 4.659 -7.459 1012 HA LYS 128 HA LYS 128 -14.335 4.889 -10.197 1013 HB2 LYS 128 HB2 LYS 128 -16.197 3.560 -10.331 1014 HB3 LYS 128 HB3 LYS 128 -15.376 3.054 -8.870 1015 HG2 LYS 128 HG2 LYS 128 -17.833 4.891 -8.944 1016 HG3 LYS 128 HG3 LYS 128 -17.876 3.139 -8.748 1017 HD2 LYS 128 HD2 LYS 128 -16.505 3.351 -6.687 1018 HD3 LYS 128 HD3 LYS 128 -16.546 5.109 -6.848 1019 HE2 LYS 128 HE2 LYS 128 -18.199 4.582 -5.274 1020 HE3 LYS 128 HE3 LYS 128 -19.054 4.999 -6.769 1021 HZ1 LYS 128 HZ1 LYS 128 -19.922 2.964 -5.660 1022 HZ2 LYS 128 HZ2 LYS 128 -19.378 2.617 -7.161 1023 HZ3 LYS 128 HZ3 LYS 128 -18.479 2.214 -5.853 1024 H TRP 129 H TRP 129 -15.887 7.164 -8.138 1025 HA TRP 129 HA TRP 129 -17.467 8.409 -10.306 1026 HB2 TRP 129 HB2 TRP 129 -18.251 9.897 -8.590 1027 HB3 TRP 129 HB3 TRP 129 -18.420 8.225 -8.072 1028 HD1 TRP 129 HD1 TRP 129 -16.497 7.354 -6.260 1029 HE1 TRP 129 HE1 TRP 129 -15.137 8.578 -4.500 1030 HE3 TRP 129 HE3 TRP 129 -17.432 12.185 -7.720 1031 HZ2 TRP 129 HZ2 TRP 129 -14.898 11.303 -3.520 1032 HZ3 TRP 129 HZ3 TRP 129 -16.695 14.075 -6.291 1033 HH2 TRP 129 HH2 TRP 129 -15.453 13.650 -4.183 1034 H VAL 130 H VAL 130 -14.307 8.749 -8.944 1035 HA VAL 130 HA VAL 130 -13.859 11.486 -10.001 1036 HB VAL 130 HB VAL 130 -11.883 9.579 -8.687 1037 HG11 VAL 130 HG11 VAL 130 -11.773 12.587 -9.181 1038 HG12 VAL 130 HG12 VAL 130 -10.567 11.635 -8.286 1039 HG13 VAL 130 HG13 VAL 130 -10.797 11.355 -10.012 1040 HG21 VAL 130 HG21 VAL 130 -13.614 10.080 -7.048 1041 HG22 VAL 130 HG22 VAL 130 -12.171 11.012 -6.656 1042 HG23 VAL 130 HG23 VAL 130 -13.551 11.808 -7.448 1043 H LYS 131 H LYS 131 -12.799 8.128 -10.516 1044 HA LYS 131 HA LYS 131 -11.951 8.752 -13.321 1045 HB2 LYS 131 HB2 LYS 131 -10.188 7.798 -11.808 1046 HB3 LYS 131 HB3 LYS 131 -11.205 6.376 -11.582 1047 HG2 LYS 131 HG2 LYS 131 -11.167 6.348 -14.287 1048 HG3 LYS 131 HG3 LYS 131 -9.769 7.375 -14.070 1049 HD2 LYS 131 HD2 LYS 131 -9.189 5.011 -14.406 1050 HD3 LYS 131 HD3 LYS 131 -8.594 5.620 -12.864 1051 HE2 LYS 131 HE2 LYS 131 -9.501 3.304 -12.755 1052 HE3 LYS 131 HE3 LYS 131 -10.263 4.415 -11.625 1053 HZ1 LYS 131 HZ1 LYS 131 -11.855 2.957 -12.843 1054 HZ2 LYS 131 HZ2 LYS 131 -12.187 4.544 -13.059 1055 HZ3 LYS 131 HZ3 LYS 131 -11.480 3.700 -14.256 1056 H GLN 132 H GLN 132 -14.250 8.864 -13.739 1057 HA GLN 132 HA GLN 132 -15.939 6.541 -13.768 1058 HB2 GLN 132 HB2 GLN 132 -16.097 9.107 -15.378 1059 HB3 GLN 132 HB3 GLN 132 -17.431 7.972 -15.103 1060 HG2 GLN 132 HG2 GLN 132 -17.343 8.447 -12.667 1061 HG3 GLN 132 HG3 GLN 132 -16.042 9.610 -12.941 1062 HE21 GLN 132 HE21 GLN 132 -18.767 11.914 -12.786 1063 HE22 GLN 132 HE22 GLN 132 -17.505 11.129 -11.830 1064 H GLU 133 H GLU 133 -13.352 6.244 -15.161 1065 HA GLU 133 HA GLU 133 -14.260 5.265 -17.834 1066 HB2 GLU 133 HB2 GLU 133 -11.489 6.259 -17.061 1067 HB3 GLU 133 HB3 GLU 133 -11.949 5.571 -18.622 1068 HG2 GLU 133 HG2 GLU 133 -13.626 7.435 -18.891 1069 HG3 GLU 133 HG3 GLU 133 -13.002 8.160 -17.406 Start of MODEL 24 1 H1 GLY -4 H1 GLY -4 -15.644 16.784 29.580 2 H2 GLY -4 H2 GLY -4 -15.176 16.768 31.151 3 H3 GLY -4 H3 GLY -4 -14.322 15.929 30.032 4 HA2 GLY -4 HA2 GLY -4 -14.574 18.867 30.159 5 HA3 GLY -4 HA3 GLY -4 -13.139 17.935 30.624 6 H SER -3 H SER -3 -11.819 18.950 29.106 7 HA SER -3 HA SER -3 -10.845 19.466 27.118 8 HB2 SER -3 HB2 SER -3 -11.652 16.609 26.519 9 HB3 SER -3 HB3 SER -3 -10.354 17.526 25.728 10 HG SER -3 HG SER -3 -9.572 16.205 27.445 11 HA PRO -2 HA PRO -2 -14.758 20.280 24.648 12 HB2 PRO -2 HB2 PRO -2 -14.969 22.982 24.891 13 HB3 PRO -2 HB3 PRO -2 -15.510 21.863 26.179 14 HG2 PRO -2 HG2 PRO -2 -12.829 23.293 25.975 15 HG3 PRO -2 HG3 PRO -2 -13.968 23.285 27.363 16 HD2 PRO -2 HD2 PRO -2 -11.868 21.564 27.244 17 HD3 PRO -2 HD3 PRO -2 -13.454 21.047 27.895 18 H ASN -1 H ASN -1 -11.484 20.906 24.311 19 HA ASN -1 HA ASN -1 -11.221 22.754 22.223 20 HB2 ASN -1 HB2 ASN -1 -9.548 20.262 22.801 21 HB3 ASN -1 HB3 ASN -1 -9.022 21.670 21.882 22 HD21 ASN -1 HD21 ASN -1 -8.355 23.627 24.788 23 HD22 ASN -1 HD22 ASN -1 -8.527 23.651 23.039 24 H SER 0 H SER 0 -12.422 19.465 21.981 25 HA SER 0 HA SER 0 -12.031 19.001 19.180 26 HB2 SER 0 HB2 SER 0 -13.836 17.329 19.485 27 HB3 SER 0 HB3 SER 0 -12.565 17.207 20.714 28 HG SER 0 HG SER 0 -14.675 17.112 21.633 29 H MET 1 H MET 1 -14.141 21.232 20.776 30 HA MET 1 HA MET 1 -16.008 21.473 18.507 31 HB2 MET 1 HB2 MET 1 -15.802 23.095 21.070 32 HB3 MET 1 HB3 MET 1 -17.109 23.158 19.885 33 HG2 MET 1 HG2 MET 1 -17.622 20.762 20.330 34 HG3 MET 1 HG3 MET 1 -16.346 20.727 21.544 35 HE1 MET 1 HE1 MET 1 -19.233 23.443 20.776 36 HE2 MET 1 HE2 MET 1 -19.954 21.822 20.629 37 HE3 MET 1 HE3 MET 1 -20.422 22.888 21.971 38 H ALA 2 H ALA 2 -12.918 22.359 18.680 39 HA ALA 2 HA ALA 2 -13.259 24.730 16.926 40 HB1 ALA 2 HB1 ALA 2 -11.422 24.637 19.365 41 HB2 ALA 2 HB2 ALA 2 -11.474 25.931 18.147 42 HB3 ALA 2 HB3 ALA 2 -12.881 25.637 19.188 43 H THR 3 H THR 3 -10.867 22.438 18.352 44 HA THR 3 HA THR 3 -9.542 22.068 15.715 45 HB THR 3 HB THR 3 -9.016 20.635 18.335 46 HG1 THR 3 HG1 THR 3 -7.239 22.023 18.462 47 HG21 THR 3 HG21 THR 3 -8.247 19.424 16.303 48 HG22 THR 3 HG22 THR 3 -7.424 20.887 15.735 49 HG23 THR 3 HG23 THR 3 -6.865 20.058 17.211 50 H GLU 4 H GLU 4 -11.554 21.525 14.788 51 HA GLU 4 HA GLU 4 -13.014 19.194 15.854 52 HB2 GLU 4 HB2 GLU 4 -14.958 20.208 14.888 53 HB3 GLU 4 HB3 GLU 4 -14.053 21.381 15.850 54 HG2 GLU 4 HG2 GLU 4 -13.125 22.415 13.860 55 HG3 GLU 4 HG3 GLU 4 -13.862 21.198 12.814 56 H LEU 5 H LEU 5 -10.724 18.852 13.940 57 HA LEU 5 HA LEU 5 -11.657 17.995 11.390 58 HB2 LEU 5 HB2 LEU 5 -9.233 17.282 13.081 59 HB3 LEU 5 HB3 LEU 5 -9.588 16.416 11.601 60 HG LEU 5 HG LEU 5 -9.590 18.614 10.350 61 HD11 LEU 5 HD11 LEU 5 -9.823 20.213 12.193 62 HD12 LEU 5 HD12 LEU 5 -8.320 19.613 12.940 63 HD13 LEU 5 HD13 LEU 5 -8.278 20.463 11.380 64 HD21 LEU 5 HD21 LEU 5 -7.728 17.000 10.287 65 HD22 LEU 5 HD22 LEU 5 -7.129 18.664 10.234 66 HD23 LEU 5 HD23 LEU 5 -7.029 17.734 11.748 67 H GLU 6 H GLU 6 -13.014 16.451 10.878 68 HA GLU 6 HA GLU 6 -12.929 13.865 12.347 69 HB2 GLU 6 HB2 GLU 6 -15.125 15.156 12.422 70 HB3 GLU 6 HB3 GLU 6 -15.267 14.875 10.685 71 HG2 GLU 6 HG2 GLU 6 -15.213 12.399 11.124 72 HG3 GLU 6 HG3 GLU 6 -15.037 12.725 12.847 73 H TYR 7 H TYR 7 -10.907 14.055 10.978 74 HA TYR 7 HA TYR 7 -11.366 13.691 8.132 75 HB2 TYR 7 HB2 TYR 7 -10.688 15.771 9.431 76 HB3 TYR 7 HB3 TYR 7 -9.106 15.002 9.589 77 HD1 TYR 7 HD1 TYR 7 -10.266 17.571 8.283 78 HD2 TYR 7 HD2 TYR 7 -9.053 13.764 6.760 79 HE1 TYR 7 HE1 TYR 7 -9.536 18.696 6.126 80 HE2 TYR 7 HE2 TYR 7 -8.224 14.855 4.645 81 HH TYR 7 HH TYR 7 -8.564 18.385 4.071 82 H GLU 8 H GLU 8 -11.356 11.540 8.805 83 HA GLU 8 HA GLU 8 -9.379 10.169 7.423 84 HB2 GLU 8 HB2 GLU 8 -8.817 10.226 10.327 85 HB3 GLU 8 HB3 GLU 8 -8.956 8.574 9.719 86 HG2 GLU 8 HG2 GLU 8 -7.269 8.964 8.020 87 HG3 GLU 8 HG3 GLU 8 -7.141 10.654 8.460 88 H SER 9 H SER 9 -11.492 9.923 6.475 89 HA SER 9 HA SER 9 -13.455 8.121 7.742 90 HB2 SER 9 HB2 SER 9 -13.193 9.501 5.109 91 HB3 SER 9 HB3 SER 9 -14.124 7.995 5.131 92 HG SER 9 HG SER 9 -15.463 8.848 6.704 93 H VAL 10 H VAL 10 -12.904 6.087 8.167 94 HA VAL 10 HA VAL 10 -10.760 4.684 6.833 95 HB VAL 10 HB VAL 10 -12.808 3.633 8.827 96 HG11 VAL 10 HG11 VAL 10 -10.051 2.579 8.036 97 HG12 VAL 10 HG12 VAL 10 -11.012 2.006 9.419 98 HG13 VAL 10 HG13 VAL 10 -11.618 1.765 7.789 99 HG21 VAL 10 HG21 VAL 10 -11.580 5.556 9.783 100 HG22 VAL 10 HG22 VAL 10 -11.067 4.054 10.538 101 HG23 VAL 10 HG23 VAL 10 -10.037 4.823 9.308 102 H LEU 11 H LEU 11 -10.779 2.786 5.648 103 HA LEU 11 HA LEU 11 -13.273 2.165 4.098 104 HB2 LEU 11 HB2 LEU 11 -10.481 2.746 3.019 105 HB3 LEU 11 HB3 LEU 11 -11.820 2.130 2.058 106 HG LEU 11 HG LEU 11 -11.803 4.844 3.453 107 HD11 LEU 11 HD11 LEU 11 -11.349 4.079 0.544 108 HD12 LEU 11 HD12 LEU 11 -11.578 5.730 1.148 109 HD13 LEU 11 HD13 LEU 11 -10.165 4.802 1.659 110 HD21 LEU 11 HD21 LEU 11 -13.726 3.653 1.403 111 HD22 LEU 11 HD22 LEU 11 -14.100 3.977 3.112 112 HD23 LEU 11 HD23 LEU 11 -13.759 5.318 2.020 113 H CYS 12 H CYS 12 -9.985 1.110 5.032 114 HA CYS 12 HA CYS 12 -10.966 -1.647 5.336 115 HB2 CYS 12 HB2 CYS 12 -10.080 -1.449 2.969 116 HB3 CYS 12 HB3 CYS 12 -8.489 -1.076 3.667 117 HG CYS 12 HG CYS 12 -8.746 -3.599 2.770 118 H VAL 13 H VAL 13 -9.974 -2.706 6.926 119 HA VAL 13 HA VAL 13 -7.379 -1.769 8.006 120 HB VAL 13 HB VAL 13 -9.789 -2.357 9.770 121 HG11 VAL 13 HG11 VAL 13 -6.910 -1.676 10.529 122 HG12 VAL 13 HG12 VAL 13 -8.279 -1.783 11.654 123 HG13 VAL 13 HG13 VAL 13 -7.728 -3.231 10.814 124 HG21 VAL 13 HG21 VAL 13 -9.855 -0.070 8.843 125 HG22 VAL 13 HG22 VAL 13 -9.469 -0.028 10.565 126 HG23 VAL 13 HG23 VAL 13 -8.180 0.202 9.361 127 H LYS 14 H LYS 14 -6.022 -3.388 8.208 128 HA LYS 14 HA LYS 14 -6.985 -6.158 8.683 129 HB2 LYS 14 HB2 LYS 14 -4.825 -5.448 6.656 130 HB3 LYS 14 HB3 LYS 14 -5.216 -7.069 7.181 131 HG2 LYS 14 HG2 LYS 14 -7.198 -5.235 5.760 132 HG3 LYS 14 HG3 LYS 14 -6.159 -6.411 4.956 133 HD2 LYS 14 HD2 LYS 14 -7.183 -8.248 6.248 134 HD3 LYS 14 HD3 LYS 14 -8.269 -7.092 7.053 135 HE2 LYS 14 HE2 LYS 14 -9.274 -6.467 4.924 136 HE3 LYS 14 HE3 LYS 14 -8.106 -7.461 4.039 137 HZ1 LYS 14 HZ1 LYS 14 -10.215 -8.620 4.301 138 HZ2 LYS 14 HZ2 LYS 14 -9.021 -9.425 5.097 139 HZ3 LYS 14 HZ3 LYS 14 -10.121 -8.535 5.939 140 HA PRO 15 HA PRO 15 -4.059 -5.678 11.937 141 HB2 PRO 15 HB2 PRO 15 -3.888 -8.214 12.925 142 HB3 PRO 15 HB3 PRO 15 -5.369 -7.208 13.070 143 HG2 PRO 15 HG2 PRO 15 -4.743 -9.330 10.985 144 HG3 PRO 15 HG3 PRO 15 -6.237 -9.157 11.967 145 HD2 PRO 15 HD2 PRO 15 -6.077 -8.207 9.432 146 HD3 PRO 15 HD3 PRO 15 -6.960 -7.308 10.705 147 H ASP 16 H ASP 16 -3.256 -7.770 9.261 148 HA ASP 16 HA ASP 16 -0.396 -7.901 10.117 149 HB2 ASP 16 HB2 ASP 16 -1.572 -10.008 10.618 150 HB3 ASP 16 HB3 ASP 16 -2.083 -10.129 8.932 151 H VAL 17 H VAL 17 0.645 -6.677 8.792 152 HA VAL 17 HA VAL 17 0.800 -7.428 5.958 153 HB VAL 17 HB VAL 17 -0.871 -5.600 6.012 154 HG11 VAL 17 HG11 VAL 17 1.406 -3.797 6.935 155 HG12 VAL 17 HG12 VAL 17 -0.205 -3.280 6.406 156 HG13 VAL 17 HG13 VAL 17 -0.032 -4.238 7.879 157 HG21 VAL 17 HG21 VAL 17 0.062 -4.294 4.203 158 HG22 VAL 17 HG22 VAL 17 1.709 -4.803 4.619 159 HG23 VAL 17 HG23 VAL 17 0.523 -5.989 4.018 160 H SER 18 H SER 18 2.808 -7.103 5.070 161 HA SER 18 HA SER 18 5.003 -6.333 6.977 162 HB2 SER 18 HB2 SER 18 4.983 -8.531 4.884 163 HB3 SER 18 HB3 SER 18 6.333 -8.108 5.957 164 HG SER 18 HG SER 18 5.043 -9.904 6.708 165 H VAL 19 H VAL 19 6.608 -5.036 6.254 166 HA VAL 19 HA VAL 19 6.422 -3.961 3.479 167 HB VAL 19 HB VAL 19 7.655 -2.804 5.987 168 HG11 VAL 19 HG11 VAL 19 8.072 -0.759 4.581 169 HG12 VAL 19 HG12 VAL 19 9.105 -2.114 4.148 170 HG13 VAL 19 HG13 VAL 19 7.704 -1.720 3.128 171 HG21 VAL 19 HG21 VAL 19 5.104 -2.666 5.605 172 HG22 VAL 19 HG22 VAL 19 5.967 -1.142 5.836 173 HG23 VAL 19 HG23 VAL 19 5.484 -1.638 4.209 174 H TYR 20 H TYR 20 7.898 -4.220 2.039 175 HA TYR 20 HA TYR 20 10.685 -4.877 2.822 176 HB2 TYR 20 HB2 TYR 20 10.028 -6.168 0.309 177 HB3 TYR 20 HB3 TYR 20 10.819 -6.801 1.732 178 HD1 TYR 20 HD1 TYR 20 9.526 -8.000 3.479 179 HD2 TYR 20 HD2 TYR 20 7.654 -6.483 -0.088 180 HE1 TYR 20 HE1 TYR 20 7.549 -9.451 3.910 181 HE2 TYR 20 HE2 TYR 20 5.663 -7.932 0.346 182 HH TYR 20 HH TYR 20 5.529 -10.178 3.141 183 H ARG 21 H ARG 21 11.915 -3.304 2.116 184 HA ARG 21 HA ARG 21 11.110 -1.371 0.106 185 HB2 ARG 21 HB2 ARG 21 13.902 -1.897 1.208 186 HB3 ARG 21 HB3 ARG 21 13.377 -0.483 0.280 187 HG2 ARG 21 HG2 ARG 21 11.671 -0.013 2.120 188 HG3 ARG 21 HG3 ARG 21 12.437 -1.309 3.059 189 HD2 ARG 21 HD2 ARG 21 14.644 -0.049 2.758 190 HD3 ARG 21 HD3 ARG 21 13.676 1.297 2.116 191 HE ARG 21 HE ARG 21 12.752 0.270 4.717 192 HH11 ARG 21 HH11 ARG 21 12.995 1.221 6.496 193 HH12 ARG 21 HH12 ARG 21 13.959 2.689 6.684 194 HH21 ARG 21 HH21 ARG 21 14.996 2.618 3.370 195 HH22 ARG 21 HH22 ARG 21 15.112 3.453 4.897 196 H ILE 22 H ILE 22 11.377 -1.345 -2.015 197 HA ILE 22 HA ILE 22 11.982 -3.940 -3.193 198 HB ILE 22 HB ILE 22 10.852 -3.139 -5.190 199 HG12 ILE 22 HG12 ILE 22 10.494 -0.478 -3.742 200 HG13 ILE 22 HG13 ILE 22 11.503 -0.762 -5.164 201 HG21 ILE 22 HG21 ILE 22 9.228 -2.473 -2.712 202 HG22 ILE 22 HG22 ILE 22 8.647 -3.126 -4.258 203 HG23 ILE 22 HG23 ILE 22 9.650 -4.123 -3.204 204 HD11 ILE 22 HD11 ILE 22 9.461 0.200 -5.946 205 HD12 ILE 22 HD12 ILE 22 9.414 -1.523 -6.396 206 HD13 ILE 22 HD13 ILE 22 8.484 -0.933 -5.003 207 HA PRO 23 HA PRO 23 15.693 -2.751 -5.546 208 HB2 PRO 23 HB2 PRO 23 15.528 -4.509 -7.631 209 HB3 PRO 23 HB3 PRO 23 15.927 -5.049 -5.972 210 HG2 PRO 23 HG2 PRO 23 13.201 -5.040 -7.325 211 HG3 PRO 23 HG3 PRO 23 14.026 -6.413 -6.518 212 HD2 PRO 23 HD2 PRO 23 12.213 -4.883 -5.214 213 HD3 PRO 23 HD3 PRO 23 13.669 -5.481 -4.368 214 HA PRO 24 HA PRO 24 14.090 -0.142 -8.932 215 HB2 PRO 24 HB2 PRO 24 15.846 -0.615 -11.014 216 HB3 PRO 24 HB3 PRO 24 16.203 0.442 -9.614 217 HG2 PRO 24 HG2 PRO 24 16.957 -2.477 -9.980 218 HG3 PRO 24 HG3 PRO 24 18.014 -1.115 -9.480 219 HD2 PRO 24 HD2 PRO 24 16.947 -2.751 -7.637 220 HD3 PRO 24 HD3 PRO 24 16.986 -0.993 -7.336 221 H ARG 25 H ARG 25 12.888 -0.321 -10.843 222 HA ARG 25 HA ARG 25 11.288 -2.656 -11.050 223 HB2 ARG 25 HB2 ARG 25 10.697 -0.234 -11.532 224 HB3 ARG 25 HB3 ARG 25 11.540 -0.397 -13.081 225 HG2 ARG 25 HG2 ARG 25 9.901 -2.214 -13.697 226 HG3 ARG 25 HG3 ARG 25 9.071 -1.924 -12.157 227 HD2 ARG 25 HD2 ARG 25 9.486 0.108 -14.383 228 HD3 ARG 25 HD3 ARG 25 8.024 -0.840 -14.144 229 HE ARG 25 HE ARG 25 9.092 1.263 -12.279 230 HH11 ARG 25 HH11 ARG 25 7.748 2.041 -10.696 231 HH12 ARG 25 HH12 ARG 25 6.049 1.664 -10.739 232 HH21 ARG 25 HH21 ARG 25 6.214 -0.425 -13.416 233 HH22 ARG 25 HH22 ARG 25 5.232 0.312 -12.157 234 H ALA 26 H ALA 26 10.861 -4.061 -12.767 235 HA ALA 26 HA ALA 26 12.979 -5.153 -14.376 236 HB1 ALA 26 HB1 ALA 26 10.899 -6.340 -13.664 237 HB2 ALA 26 HB2 ALA 26 9.957 -5.227 -14.685 238 HB3 ALA 26 HB3 ALA 26 11.099 -6.367 -15.427 239 H SER 27 H SER 27 12.154 -5.373 -16.874 240 HA SER 27 HA SER 27 13.116 -2.908 -18.010 241 HB2 SER 27 HB2 SER 27 13.113 -4.316 -20.143 242 HB3 SER 27 HB3 SER 27 14.134 -4.833 -18.798 243 HG SER 27 HG SER 27 13.122 -6.628 -19.499 244 H ASN 28 H ASN 28 11.268 -1.673 -17.343 245 HA ASN 28 HA ASN 28 9.425 -0.447 -17.645 246 HB2 ASN 28 HB2 ASN 28 9.224 -1.377 -20.522 247 HB3 ASN 28 HB3 ASN 28 8.555 0.080 -19.809 248 HD21 ASN 28 HD21 ASN 28 12.472 -0.008 -20.970 249 HD22 ASN 28 HD22 ASN 28 11.507 -1.484 -20.920 250 H ARG 29 H ARG 29 9.322 -3.470 -17.054 251 HA ARG 29 HA ARG 29 6.551 -4.176 -17.796 252 HB2 ARG 29 HB2 ARG 29 8.356 -5.861 -16.073 253 HB3 ARG 29 HB3 ARG 29 6.952 -6.323 -17.021 254 HG2 ARG 29 HG2 ARG 29 8.266 -5.752 -19.119 255 HG3 ARG 29 HG3 ARG 29 9.682 -5.474 -18.070 256 HD2 ARG 29 HD2 ARG 29 9.325 -7.770 -17.111 257 HD3 ARG 29 HD3 ARG 29 8.087 -8.019 -18.361 258 HE ARG 29 HE ARG 29 10.771 -7.146 -19.288 259 HH11 ARG 29 HH11 ARG 29 11.845 -8.413 -20.748 260 HH12 ARG 29 HH12 ARG 29 11.411 -10.086 -20.950 261 HH21 ARG 29 HH21 ARG 29 8.787 -9.989 -18.742 262 HH22 ARG 29 HH22 ARG 29 9.707 -10.956 -19.863 263 H GLY 30 H GLY 30 8.392 -3.916 -14.678 264 HA2 GLY 30 HA2 GLY 30 6.787 -2.642 -12.945 265 HA3 GLY 30 HA3 GLY 30 5.852 -4.112 -13.256 266 H TYR 31 H TYR 31 6.027 -4.700 -11.203 267 HA TYR 31 HA TYR 31 8.592 -5.822 -10.175 268 HB2 TYR 31 HB2 TYR 31 6.055 -5.030 -8.702 269 HB3 TYR 31 HB3 TYR 31 7.626 -5.417 -8.006 270 HD1 TYR 31 HD1 TYR 31 9.553 -3.843 -9.491 271 HD2 TYR 31 HD2 TYR 31 5.497 -2.747 -8.456 272 HE1 TYR 31 HE1 TYR 31 10.234 -1.468 -9.313 273 HE2 TYR 31 HE2 TYR 31 6.173 -0.379 -8.362 274 HH TYR 31 HH TYR 31 9.570 0.680 -8.906 275 H ARG 32 H ARG 32 8.382 -7.837 -8.927 276 HA ARG 32 HA ARG 32 6.154 -9.622 -9.840 277 HB2 ARG 32 HB2 ARG 32 7.811 -11.366 -10.435 278 HB3 ARG 32 HB3 ARG 32 7.752 -10.001 -11.522 279 HG2 ARG 32 HG2 ARG 32 9.850 -10.164 -9.331 280 HG3 ARG 32 HG3 ARG 32 10.044 -11.018 -10.865 281 HD2 ARG 32 HD2 ARG 32 9.752 -8.845 -12.092 282 HD3 ARG 32 HD3 ARG 32 9.726 -8.013 -10.545 283 HE ARG 32 HE ARG 32 12.017 -8.309 -10.254 284 HH11 ARG 32 HH11 ARG 32 13.980 -8.539 -10.864 285 HH12 ARG 32 HH12 ARG 32 14.416 -9.331 -12.378 286 HH21 ARG 32 HH21 ARG 32 11.126 -10.060 -13.174 287 HH22 ARG 32 HH22 ARG 32 12.793 -10.190 -13.666 288 H ALA 33 H ALA 33 6.871 -8.505 -7.226 289 HA ALA 33 HA ALA 33 7.035 -8.995 -5.046 290 HB1 ALA 33 HB1 ALA 33 5.624 -10.845 -4.313 291 HB2 ALA 33 HB2 ALA 33 4.885 -9.935 -5.648 292 HB3 ALA 33 HB3 ALA 33 5.610 -11.510 -5.970 293 H SER 34 H SER 34 8.027 -12.023 -6.707 294 HA SER 34 HA SER 34 9.580 -13.035 -4.563 295 HB2 SER 34 HB2 SER 34 9.753 -13.646 -7.533 296 HB3 SER 34 HB3 SER 34 10.455 -14.631 -6.234 297 HG SER 34 HG SER 34 8.390 -15.404 -6.899 298 H ASP 35 H ASP 35 10.370 -10.523 -6.725 299 HA ASP 35 HA ASP 35 13.290 -10.777 -6.451 300 HB2 ASP 35 HB2 ASP 35 11.975 -9.978 -8.494 301 HB3 ASP 35 HB3 ASP 35 11.666 -8.482 -7.619 302 H TRP 36 H TRP 36 10.786 -9.645 -4.433 303 HA TRP 36 HA TRP 36 12.356 -7.514 -3.130 304 HB2 TRP 36 HB2 TRP 36 9.606 -8.574 -2.445 305 HB3 TRP 36 HB3 TRP 36 10.333 -7.076 -1.919 306 HD1 TRP 36 HD1 TRP 36 11.039 -6.715 -5.377 307 HE1 TRP 36 HE1 TRP 36 9.171 -5.451 -6.636 308 HE3 TRP 36 HE3 TRP 36 7.195 -7.410 -2.071 309 HZ2 TRP 36 HZ2 TRP 36 6.483 -4.626 -6.140 310 HZ3 TRP 36 HZ3 TRP 36 4.976 -6.353 -2.490 311 HH2 TRP 36 HH2 TRP 36 4.623 -4.976 -4.517 312 H LYS 37 H LYS 37 12.292 -7.584 -0.737 313 HA LYS 37 HA LYS 37 13.426 -10.073 0.328 314 HB2 LYS 37 HB2 LYS 37 13.122 -7.244 1.379 315 HB3 LYS 37 HB3 LYS 37 13.743 -8.534 2.397 316 HG2 LYS 37 HG2 LYS 37 14.957 -8.193 -0.331 317 HG3 LYS 37 HG3 LYS 37 15.350 -6.996 0.899 318 HD2 LYS 37 HD2 LYS 37 15.696 -9.997 1.283 319 HD3 LYS 37 HD3 LYS 37 16.966 -8.964 0.646 320 HE2 LYS 37 HE2 LYS 37 15.660 -8.542 3.374 321 HE3 LYS 37 HE3 LYS 37 17.125 -9.496 3.115 322 HZ1 LYS 37 HZ1 LYS 37 17.682 -7.237 3.748 323 HZ2 LYS 37 HZ2 LYS 37 18.201 -7.502 2.227 324 HZ3 LYS 37 HZ3 LYS 37 16.861 -6.603 2.491 325 H LEU 38 H LEU 38 11.029 -10.819 -0.296 326 HA LEU 38 HA LEU 38 8.815 -10.392 1.350 327 HB2 LEU 38 HB2 LEU 38 9.681 -12.986 0.012 328 HB3 LEU 38 HB3 LEU 38 8.057 -12.632 0.597 329 HG LEU 38 HG LEU 38 9.495 -11.304 -1.717 330 HD11 LEU 38 HD11 LEU 38 6.965 -13.009 -1.514 331 HD12 LEU 38 HD12 LEU 38 7.604 -12.305 -3.004 332 HD13 LEU 38 HD13 LEU 38 8.537 -13.543 -2.151 333 HD21 LEU 38 HD21 LEU 38 8.204 -9.549 -0.677 334 HD22 LEU 38 HD22 LEU 38 7.296 -10.101 -2.087 335 HD23 LEU 38 HD23 LEU 38 6.810 -10.623 -0.459 336 H ASP 39 H ASP 39 11.549 -12.499 2.028 337 HA ASP 39 HA ASP 39 10.174 -13.834 4.291 338 HB2 ASP 39 HB2 ASP 39 11.613 -15.050 2.653 339 HB3 ASP 39 HB3 ASP 39 13.003 -14.125 3.216 340 H GLN 40 H GLN 40 11.771 -10.924 3.898 341 HA GLN 40 HA GLN 40 13.054 -10.864 6.615 342 HB2 GLN 40 HB2 GLN 40 14.230 -10.261 3.872 343 HB3 GLN 40 HB3 GLN 40 15.019 -9.794 5.390 344 HG2 GLN 40 HG2 GLN 40 15.417 -11.997 6.033 345 HG3 GLN 40 HG3 GLN 40 14.254 -12.664 4.892 346 HE21 GLN 40 HE21 GLN 40 16.424 -12.596 2.061 347 HE22 GLN 40 HE22 GLN 40 14.737 -12.621 2.549 348 HA PRO 41 HA PRO 41 10.626 -7.258 5.291 349 HB2 PRO 41 HB2 PRO 41 9.392 -7.226 8.053 350 HB3 PRO 41 HB3 PRO 41 8.577 -7.000 6.486 351 HG2 PRO 41 HG2 PRO 41 8.408 -9.381 7.793 352 HG3 PRO 41 HG3 PRO 41 8.660 -9.351 6.018 353 HD2 PRO 41 HD2 PRO 41 10.748 -9.699 8.193 354 HD3 PRO 41 HD3 PRO 41 10.480 -10.679 6.728 355 H ASP 42 H ASP 42 10.867 -5.027 5.638 356 HA ASP 42 HA ASP 42 13.039 -4.107 7.404 357 HB2 ASP 42 HB2 ASP 42 12.636 -3.174 5.127 358 HB3 ASP 42 HB3 ASP 42 11.059 -2.585 5.659 359 H TRP 43 H TRP 43 9.536 -4.250 7.402 360 HA TRP 43 HA TRP 43 9.328 -3.730 10.258 361 HB2 TRP 43 HB2 TRP 43 9.356 -1.432 9.485 362 HB3 TRP 43 HB3 TRP 43 8.229 -1.793 8.191 363 HD1 TRP 43 HD1 TRP 43 8.344 -0.875 11.853 364 HE1 TRP 43 HE1 TRP 43 5.970 -0.296 12.649 365 HE3 TRP 43 HE3 TRP 43 5.718 -2.644 7.850 366 HZ2 TRP 43 HZ2 TRP 43 3.285 -0.407 11.573 367 HZ3 TRP 43 HZ3 TRP 43 3.256 -2.278 7.699 368 HH2 TRP 43 HH2 TRP 43 2.025 -1.210 9.573 369 H THR 44 H THR 44 7.234 -4.335 11.075 370 HA THR 44 HA THR 44 5.230 -5.400 9.168 371 HB THR 44 HB THR 44 4.743 -7.306 10.686 372 HG1 THR 44 HG1 THR 44 6.399 -7.950 12.109 373 HG21 THR 44 HG21 THR 44 6.102 -7.573 8.620 374 HG22 THR 44 HG22 THR 44 7.578 -7.421 9.601 375 HG23 THR 44 HG23 THR 44 6.453 -8.777 9.867 376 H GLY 45 H GLY 45 3.115 -5.232 9.791 377 HA2 GLY 45 HA2 GLY 45 2.142 -4.814 12.377 378 HA3 GLY 45 HA3 GLY 45 2.463 -3.201 11.731 379 H ARG 46 H ARG 46 0.503 -2.445 11.464 380 HA ARG 46 HA ARG 46 -1.719 -4.110 10.384 381 HB2 ARG 46 HB2 ARG 46 -1.741 -1.548 12.032 382 HB3 ARG 46 HB3 ARG 46 -3.150 -2.503 11.572 383 HG2 ARG 46 HG2 ARG 46 -2.392 -4.377 12.956 384 HG3 ARG 46 HG3 ARG 46 -0.894 -3.527 13.383 385 HD2 ARG 46 HD2 ARG 46 -2.080 -1.816 14.571 386 HD3 ARG 46 HD3 ARG 46 -3.636 -2.335 13.925 387 HE ARG 46 HE ARG 46 -3.342 -4.475 15.211 388 HH11 ARG 46 HH11 ARG 46 -3.773 -4.949 17.322 389 HH12 ARG 46 HH12 ARG 46 -3.186 -3.911 18.583 390 HH21 ARG 46 HH21 ARG 46 -1.626 -1.694 16.500 391 HH22 ARG 46 HH22 ARG 46 -2.160 -2.036 18.131 392 H LEU 47 H LEU 47 -2.978 -3.451 8.764 393 HA LEU 47 HA LEU 47 -2.181 -1.179 7.027 394 HB2 LEU 47 HB2 LEU 47 -2.754 -3.351 5.957 395 HB3 LEU 47 HB3 LEU 47 -4.289 -3.351 6.819 396 HG LEU 47 HG LEU 47 -4.929 -1.229 5.544 397 HD11 LEU 47 HD11 LEU 47 -2.636 -0.582 4.821 398 HD12 LEU 47 HD12 LEU 47 -2.557 -2.047 3.818 399 HD13 LEU 47 HD13 LEU 47 -3.747 -0.771 3.464 400 HD21 LEU 47 HD21 LEU 47 -5.874 -3.374 5.011 401 HD22 LEU 47 HD22 LEU 47 -5.579 -2.448 3.542 402 HD23 LEU 47 HD23 LEU 47 -4.482 -3.776 3.991 403 H ARG 48 H ARG 48 -3.271 0.709 7.010 404 HA ARG 48 HA ARG 48 -6.188 0.599 7.533 405 HB2 ARG 48 HB2 ARG 48 -5.095 1.769 9.463 406 HB3 ARG 48 HB3 ARG 48 -4.446 2.968 8.338 407 HG2 ARG 48 HG2 ARG 48 -6.792 3.541 7.642 408 HG3 ARG 48 HG3 ARG 48 -7.405 2.388 8.831 409 HD2 ARG 48 HD2 ARG 48 -5.807 4.925 9.355 410 HD3 ARG 48 HD3 ARG 48 -7.510 4.673 9.721 411 HE ARG 48 HE ARG 48 -5.192 3.855 11.284 412 HH11 ARG 48 HH11 ARG 48 -5.327 2.680 13.083 413 HH12 ARG 48 HH12 ARG 48 -6.875 2.088 13.658 414 HH21 ARG 48 HH21 ARG 48 -8.613 3.153 10.882 415 HH22 ARG 48 HH22 ARG 48 -8.696 2.318 12.409 416 H ILE 49 H ILE 49 -7.291 1.251 5.846 417 HA ILE 49 HA ILE 49 -6.060 3.165 3.910 418 HB ILE 49 HB ILE 49 -8.363 1.305 3.267 419 HG12 ILE 49 HG12 ILE 49 -5.402 1.068 2.556 420 HG13 ILE 49 HG13 ILE 49 -6.347 -0.047 3.542 421 HG21 ILE 49 HG21 ILE 49 -6.647 3.143 1.525 422 HG22 ILE 49 HG22 ILE 49 -8.021 2.154 0.975 423 HG23 ILE 49 HG23 ILE 49 -8.302 3.498 2.061 424 HD11 ILE 49 HD11 ILE 49 -6.167 -1.078 1.448 425 HD12 ILE 49 HD12 ILE 49 -7.820 -0.455 1.494 426 HD13 ILE 49 HD13 ILE 49 -6.563 0.395 0.556 427 H THR 50 H THR 50 -6.976 5.026 3.762 428 HA THR 50 HA THR 50 -9.482 5.716 5.191 429 HB THR 50 HB THR 50 -7.707 7.734 5.931 430 HG1 THR 50 HG1 THR 50 -5.985 6.124 5.295 431 HG21 THR 50 HG21 THR 50 -8.474 5.205 7.430 432 HG22 THR 50 HG22 THR 50 -7.787 6.656 8.184 433 HG23 THR 50 HG23 THR 50 -9.382 6.738 7.406 434 H SER 51 H SER 51 -10.204 7.996 4.680 435 HA SER 51 HA SER 51 -8.883 9.386 2.434 436 HB2 SER 51 HB2 SER 51 -10.267 7.674 1.308 437 HB3 SER 51 HB3 SER 51 -11.687 8.221 2.215 438 HG SER 51 HG SER 51 -10.140 9.887 0.481 439 H LYS 52 H LYS 52 -9.572 11.428 2.087 440 HA LYS 52 HA LYS 52 -12.139 12.292 2.839 441 HB2 LYS 52 HB2 LYS 52 -9.875 13.258 4.560 442 HB3 LYS 52 HB3 LYS 52 -11.042 14.480 4.043 443 HG2 LYS 52 HG2 LYS 52 -11.355 12.252 5.977 444 HG3 LYS 52 HG3 LYS 52 -11.757 13.958 6.075 445 HD2 LYS 52 HD2 LYS 52 -13.716 13.606 4.581 446 HD3 LYS 52 HD3 LYS 52 -13.362 11.848 4.577 447 HE2 LYS 52 HE2 LYS 52 -13.380 11.843 7.039 448 HE3 LYS 52 HE3 LYS 52 -13.777 13.569 7.044 449 HZ1 LYS 52 HZ1 LYS 52 -15.468 11.342 6.076 450 HZ2 LYS 52 HZ2 LYS 52 -15.786 12.329 7.329 451 HZ3 LYS 52 HZ3 LYS 52 -15.861 12.926 5.805 452 H GLY 53 H GLY 53 -12.812 13.575 1.348 453 HA2 GLY 53 HA2 GLY 53 -12.968 15.342 -0.143 454 HA3 GLY 53 HA3 GLY 53 -11.419 15.922 0.467 455 H LYS 54 H LYS 54 -12.360 13.002 -1.363 456 HA LYS 54 HA LYS 54 -11.606 11.990 -3.244 457 HB2 LYS 54 HB2 LYS 54 -11.052 14.779 -4.298 458 HB3 LYS 54 HB3 LYS 54 -11.131 13.297 -5.254 459 HG2 LYS 54 HG2 LYS 54 -13.483 12.958 -4.574 460 HG3 LYS 54 HG3 LYS 54 -13.459 14.486 -3.682 461 HD2 LYS 54 HD2 LYS 54 -13.011 14.177 -6.682 462 HD3 LYS 54 HD3 LYS 54 -14.515 14.691 -5.906 463 HE2 LYS 54 HE2 LYS 54 -13.333 16.655 -4.923 464 HE3 LYS 54 HE3 LYS 54 -11.850 16.169 -5.754 465 HZ1 LYS 54 HZ1 LYS 54 -13.020 16.458 -7.875 466 HZ2 LYS 54 HZ2 LYS 54 -14.392 16.911 -7.105 467 HZ3 LYS 54 HZ3 LYS 54 -13.060 17.847 -7.021 468 H THR 55 H THR 55 -9.774 12.594 -1.045 469 HA THR 55 HA THR 55 -7.300 11.667 -2.417 470 HB THR 55 HB THR 55 -7.377 13.373 0.106 471 HG1 THR 55 HG1 THR 55 -7.831 14.635 -1.690 472 HG21 THR 55 HG21 THR 55 -5.098 12.364 -1.643 473 HG22 THR 55 HG22 THR 55 -4.935 13.495 -0.276 474 HG23 THR 55 HG23 THR 55 -5.472 11.833 0.015 475 H ALA 56 H ALA 56 -6.737 9.687 -1.747 476 HA ALA 56 HA ALA 56 -7.870 8.599 0.788 477 HB1 ALA 56 HB1 ALA 56 -6.761 7.033 -1.549 478 HB2 ALA 56 HB2 ALA 56 -7.489 6.382 -0.074 479 HB3 ALA 56 HB3 ALA 56 -8.491 7.299 -1.210 480 H TYR 57 H TYR 57 -6.461 7.253 2.020 481 HA TYR 57 HA TYR 57 -3.566 7.958 1.994 482 HB2 TYR 57 HB2 TYR 57 -5.403 8.112 4.422 483 HB3 TYR 57 HB3 TYR 57 -3.698 8.519 4.349 484 HD1 TYR 57 HD1 TYR 57 -3.015 10.516 2.834 485 HD2 TYR 57 HD2 TYR 57 -7.071 9.803 4.156 486 HE1 TYR 57 HE1 TYR 57 -3.593 12.896 2.386 487 HE2 TYR 57 HE2 TYR 57 -7.634 12.175 3.702 488 HH TYR 57 HH TYR 57 -5.220 14.509 2.458 489 H ILE 58 H ILE 58 -2.640 5.943 1.777 490 HA ILE 58 HA ILE 58 -3.680 3.655 3.410 491 HB ILE 58 HB ILE 58 -1.366 3.757 1.439 492 HG12 ILE 58 HG12 ILE 58 -2.842 1.892 0.348 493 HG13 ILE 58 HG13 ILE 58 -4.175 2.610 1.248 494 HG21 ILE 58 HG21 ILE 58 -1.217 1.315 1.825 495 HG22 ILE 58 HG22 ILE 58 -0.890 2.201 3.300 496 HG23 ILE 58 HG23 ILE 58 -2.477 1.434 3.077 497 HD11 ILE 58 HD11 ILE 58 -3.883 4.712 0.008 498 HD12 ILE 58 HD12 ILE 58 -2.374 4.095 -0.722 499 HD13 ILE 58 HD13 ILE 58 -3.931 3.358 -1.134 500 H LYS 59 H LYS 59 -3.255 3.939 5.495 501 HA LYS 59 HA LYS 59 -0.552 4.953 6.314 502 HB2 LYS 59 HB2 LYS 59 -3.106 4.932 7.962 503 HB3 LYS 59 HB3 LYS 59 -1.534 5.601 8.408 504 HG2 LYS 59 HG2 LYS 59 -1.832 7.005 6.174 505 HG3 LYS 59 HG3 LYS 59 -3.537 6.613 6.374 506 HD2 LYS 59 HD2 LYS 59 -3.493 7.658 8.638 507 HD3 LYS 59 HD3 LYS 59 -1.766 8.034 8.415 508 HE2 LYS 59 HE2 LYS 59 -2.342 9.379 6.387 509 HE3 LYS 59 HE3 LYS 59 -4.058 9.051 6.678 510 HZ1 LYS 59 HZ1 LYS 59 -3.399 11.198 7.604 511 HZ2 LYS 59 HZ2 LYS 59 -3.867 10.196 8.810 512 HZ3 LYS 59 HZ3 LYS 59 -2.274 10.500 8.565 513 H LEU 60 H LEU 60 0.808 3.710 7.335 514 HA LEU 60 HA LEU 60 -0.005 0.941 8.134 515 HB2 LEU 60 HB2 LEU 60 2.451 2.186 6.960 516 HB3 LEU 60 HB3 LEU 60 2.700 0.923 8.153 517 HG LEU 60 HG LEU 60 1.447 -0.693 6.899 518 HD11 LEU 60 HD11 LEU 60 0.901 1.520 4.872 519 HD12 LEU 60 HD12 LEU 60 0.620 -0.212 4.586 520 HD13 LEU 60 HD13 LEU 60 -0.309 0.629 5.826 521 HD21 LEU 60 HD21 LEU 60 3.836 -0.256 6.335 522 HD22 LEU 60 HD22 LEU 60 2.918 -0.896 4.967 523 HD23 LEU 60 HD23 LEU 60 3.318 0.836 5.036 524 H GLU 61 H GLU 61 0.042 0.293 10.188 525 HA GLU 61 HA GLU 61 1.035 2.221 12.254 526 HB2 GLU 61 HB2 GLU 61 -1.669 0.883 12.018 527 HB3 GLU 61 HB3 GLU 61 -1.072 1.626 13.510 528 HG2 GLU 61 HG2 GLU 61 -0.832 3.798 12.387 529 HG3 GLU 61 HG3 GLU 61 -1.359 3.091 10.856 530 H ASP 62 H ASP 62 1.736 1.421 14.262 531 HA ASP 62 HA ASP 62 2.952 -1.134 14.252 532 HB2 ASP 62 HB2 ASP 62 3.708 0.786 15.577 533 HB3 ASP 62 HB3 ASP 62 2.274 0.580 16.622 534 H LYS 63 H LYS 63 2.573 -3.003 15.139 535 HA LYS 63 HA LYS 63 -0.146 -3.806 15.596 536 HB2 LYS 63 HB2 LYS 63 1.123 -6.150 15.875 537 HB3 LYS 63 HB3 LYS 63 0.829 -5.397 14.323 538 HG2 LYS 63 HG2 LYS 63 3.088 -6.277 14.433 539 HG3 LYS 63 HG3 LYS 63 3.083 -4.536 14.209 540 HD2 LYS 63 HD2 LYS 63 3.585 -4.262 16.686 541 HD3 LYS 63 HD3 LYS 63 3.697 -6.020 16.785 542 HE2 LYS 63 HE2 LYS 63 5.904 -5.090 16.591 543 HE3 LYS 63 HE3 LYS 63 5.533 -5.983 15.103 544 HZ1 LYS 63 HZ1 LYS 63 5.213 -3.907 13.965 545 HZ2 LYS 63 HZ2 LYS 63 5.320 -3.031 15.378 546 HZ3 LYS 63 HZ3 LYS 63 6.625 -3.799 14.764 547 H VAL 64 H VAL 64 1.924 -2.564 17.839 548 HA VAL 64 HA VAL 64 0.322 -3.872 20.004 549 HB VAL 64 HB VAL 64 3.052 -2.563 20.295 550 HG11 VAL 64 HG11 VAL 64 3.003 -3.582 22.557 551 HG12 VAL 64 HG12 VAL 64 1.703 -2.409 22.348 552 HG13 VAL 64 HG13 VAL 64 1.345 -4.150 22.264 553 HG21 VAL 64 HG21 VAL 64 3.325 -4.688 19.104 554 HG22 VAL 64 HG22 VAL 64 3.873 -4.872 20.769 555 HG23 VAL 64 HG23 VAL 64 2.287 -5.519 20.287 556 H SER 65 H SER 65 1.822 -0.771 18.981 557 HA SER 65 HA SER 65 -0.042 0.633 20.857 558 HB2 SER 65 HB2 SER 65 2.723 1.305 19.842 559 HB3 SER 65 HB3 SER 65 1.725 2.424 20.793 560 HG SER 65 HG SER 65 3.144 1.170 22.109 561 H GLY 66 H GLY 66 0.217 0.192 17.526 562 HA2 GLY 66 HA2 GLY 66 -1.063 1.128 15.839 563 HA3 GLY 66 HA3 GLY 66 -1.825 2.196 17.020 564 H GLU 67 H GLU 67 1.608 2.322 16.928 565 HA GLU 67 HA GLU 67 1.765 5.085 16.359 566 HB2 GLU 67 HB2 GLU 67 3.953 2.984 16.139 567 HB3 GLU 67 HB3 GLU 67 4.176 4.733 16.351 568 HG2 GLU 67 HG2 GLU 67 2.868 4.442 18.556 569 HG3 GLU 67 HG3 GLU 67 3.045 2.700 18.281 570 H LEU 68 H LEU 68 2.043 6.225 14.457 571 HA LEU 68 HA LEU 68 1.642 4.906 11.941 572 HB2 LEU 68 HB2 LEU 68 0.856 7.201 12.469 573 HB3 LEU 68 HB3 LEU 68 2.530 7.752 12.546 574 HG LEU 68 HG LEU 68 2.802 7.117 10.113 575 HD11 LEU 68 HD11 LEU 68 -0.219 6.708 10.269 576 HD12 LEU 68 HD12 LEU 68 0.737 6.803 8.773 577 HD13 LEU 68 HD13 LEU 68 0.988 5.465 9.884 578 HD21 LEU 68 HD21 LEU 68 2.288 9.431 10.794 579 HD22 LEU 68 HD22 LEU 68 1.530 9.030 9.245 580 HD23 LEU 68 HD23 LEU 68 0.548 9.072 10.729 581 H PHE 69 H PHE 69 3.081 3.726 10.894 582 HA PHE 69 HA PHE 69 5.995 4.109 11.104 583 HB2 PHE 69 HB2 PHE 69 5.211 1.863 11.023 584 HB3 PHE 69 HB3 PHE 69 4.179 2.175 9.636 585 HD1 PHE 69 HD1 PHE 69 7.820 2.280 10.610 586 HD2 PHE 69 HD2 PHE 69 4.930 1.577 7.481 587 HE1 PHE 69 HE1 PHE 69 9.649 1.623 9.061 588 HE2 PHE 69 HE2 PHE 69 6.767 0.992 5.925 589 HZ PHE 69 HZ PHE 69 9.125 0.984 6.716 590 H ALA 70 H ALA 70 3.537 4.287 8.496 591 HA ALA 70 HA ALA 70 4.906 6.499 7.163 592 HB1 ALA 70 HB1 ALA 70 5.290 5.254 5.077 593 HB2 ALA 70 HB2 ALA 70 6.192 4.492 6.389 594 HB3 ALA 70 HB3 ALA 70 4.677 3.760 5.816 595 H GLN 71 H GLN 71 3.630 7.363 5.359 596 HA GLN 71 HA GLN 71 0.955 6.191 4.969 597 HB2 GLN 71 HB2 GLN 71 -0.244 8.211 5.285 598 HB3 GLN 71 HB3 GLN 71 0.690 7.877 6.728 599 HG2 GLN 71 HG2 GLN 71 1.100 10.114 6.570 600 HG3 GLN 71 HG3 GLN 71 2.455 9.548 5.610 601 HE21 GLN 71 HE21 GLN 71 1.314 11.889 3.177 602 HE22 GLN 71 HE22 GLN 71 2.668 11.252 4.116 603 H ALA 72 H ALA 72 0.220 6.228 2.938 604 HA ALA 72 HA ALA 72 1.725 7.787 0.871 605 HB1 ALA 72 HB1 ALA 72 1.086 5.981 -0.683 606 HB2 ALA 72 HB2 ALA 72 2.137 5.437 0.632 607 HB3 ALA 72 HB3 ALA 72 0.401 5.069 0.680 608 HA PRO 73 HA PRO 73 -2.456 9.548 0.415 609 HB2 PRO 73 HB2 PRO 73 -1.787 11.968 -0.598 610 HB3 PRO 73 HB3 PRO 73 -1.571 11.566 1.134 611 HG2 PRO 73 HG2 PRO 73 0.510 11.501 -1.065 612 HG3 PRO 73 HG3 PRO 73 0.651 12.217 0.570 613 HD2 PRO 73 HD2 PRO 73 1.573 9.697 -0.072 614 HD3 PRO 73 HD3 PRO 73 0.980 10.115 1.559 615 H VAL 74 H VAL 74 -3.785 9.493 -1.333 616 HA VAL 74 HA VAL 74 -2.676 9.009 -4.076 617 HB VAL 74 HB VAL 74 -5.020 7.505 -2.864 618 HG11 VAL 74 HG11 VAL 74 -4.552 5.889 -4.682 619 HG12 VAL 74 HG12 VAL 74 -4.920 7.498 -5.298 620 HG13 VAL 74 HG13 VAL 74 -3.234 6.927 -5.262 621 HG21 VAL 74 HG21 VAL 74 -3.169 6.830 -1.464 622 HG22 VAL 74 HG22 VAL 74 -3.572 5.535 -2.586 623 HG23 VAL 74 HG23 VAL 74 -2.141 6.542 -2.883 624 H GLU 75 H GLU 75 -3.691 10.271 -5.620 625 HA GLU 75 HA GLU 75 -6.170 11.749 -4.850 626 HB2 GLU 75 HB2 GLU 75 -4.243 12.071 -7.176 627 HB3 GLU 75 HB3 GLU 75 -5.685 13.058 -6.908 628 HG2 GLU 75 HG2 GLU 75 -4.790 13.762 -4.691 629 HG3 GLU 75 HG3 GLU 75 -3.315 12.844 -5.002 630 H GLN 76 H GLN 76 -5.262 9.088 -6.841 631 HA GLN 76 HA GLN 76 -7.979 8.410 -7.454 632 HB2 GLN 76 HB2 GLN 76 -7.952 8.458 -9.824 633 HB3 GLN 76 HB3 GLN 76 -7.544 10.072 -9.293 634 HG2 GLN 76 HG2 GLN 76 -5.607 7.993 -10.413 635 HG3 GLN 76 HG3 GLN 76 -6.266 9.374 -11.264 636 HE21 GLN 76 HE21 GLN 76 -3.082 9.932 -8.764 637 HE22 GLN 76 HE22 GLN 76 -3.991 8.408 -8.701 638 H TYR 77 H TYR 77 -8.162 6.200 -8.092 639 HA TYR 77 HA TYR 77 -5.631 4.655 -8.264 640 HB2 TYR 77 HB2 TYR 77 -6.608 4.456 -6.019 641 HB3 TYR 77 HB3 TYR 77 -8.109 3.857 -6.748 642 HD1 TYR 77 HD1 TYR 77 -8.372 1.573 -7.272 643 HD2 TYR 77 HD2 TYR 77 -4.456 3.163 -6.495 644 HE1 TYR 77 HE1 TYR 77 -7.428 -0.728 -7.419 645 HE2 TYR 77 HE2 TYR 77 -3.486 0.872 -6.776 646 HH TYR 77 HH TYR 77 -5.500 -1.984 -7.510 647 HA PRO 78 HA PRO 78 -4.730 2.875 -9.282 648 HB2 PRO 78 HB2 PRO 78 -3.795 2.351 -11.799 649 HB3 PRO 78 HB3 PRO 78 -4.663 1.161 -10.784 650 HG2 PRO 78 HG2 PRO 78 -5.817 2.944 -12.953 651 HG3 PRO 78 HG3 PRO 78 -6.029 1.174 -12.750 652 HD2 PRO 78 HD2 PRO 78 -7.906 2.895 -11.837 653 HD3 PRO 78 HD3 PRO 78 -7.449 1.467 -10.870 654 H GLY 79 H GLY 79 -2.875 4.069 -9.441 655 HA2 GLY 79 HA2 GLY 79 -2.449 6.349 -11.180 656 HA3 GLY 79 HA3 GLY 79 -3.000 6.820 -9.573 657 H ILE 80 H ILE 80 -0.887 7.920 -9.483 658 HA ILE 80 HA ILE 80 1.568 6.546 -9.794 659 HB ILE 80 HB ILE 80 1.305 8.918 -10.142 660 HG12 ILE 80 HG12 ILE 80 3.283 9.832 -9.012 661 HG13 ILE 80 HG13 ILE 80 3.306 8.477 -7.883 662 HG21 ILE 80 HG21 ILE 80 1.031 9.293 -7.124 663 HG22 ILE 80 HG22 ILE 80 1.101 10.563 -8.353 664 HG23 ILE 80 HG23 ILE 80 -0.288 9.481 -8.303 665 HD11 ILE 80 HD11 ILE 80 4.975 8.262 -9.698 666 HD12 ILE 80 HD12 ILE 80 3.819 6.924 -9.726 667 HD13 ILE 80 HD13 ILE 80 3.670 8.254 -10.904 668 H ALA 81 H ALA 81 -0.288 7.051 -6.821 669 HA ALA 81 HA ALA 81 2.020 6.338 -5.126 670 HB1 ALA 81 HB1 ALA 81 -0.774 7.321 -4.492 671 HB2 ALA 81 HB2 ALA 81 0.543 7.112 -3.315 672 HB3 ALA 81 HB3 ALA 81 0.694 8.308 -4.612 673 H VAL 82 H VAL 82 0.114 4.325 -6.735 674 HA VAL 82 HA VAL 82 0.438 2.180 -4.763 675 HB VAL 82 HB VAL 82 -2.300 2.649 -5.919 676 HG11 VAL 82 HG11 VAL 82 -1.752 0.276 -5.348 677 HG12 VAL 82 HG12 VAL 82 -1.346 0.770 -3.701 678 HG13 VAL 82 HG13 VAL 82 -3.009 0.913 -4.287 679 HG21 VAL 82 HG21 VAL 82 -3.166 3.198 -3.696 680 HG22 VAL 82 HG22 VAL 82 -1.508 3.301 -3.075 681 HG23 VAL 82 HG23 VAL 82 -2.080 4.427 -4.327 682 H GLU 83 H GLU 83 1.059 0.383 -5.810 683 HA GLU 83 HA GLU 83 0.203 -0.160 -8.616 684 HB2 GLU 83 HB2 GLU 83 3.066 0.117 -7.632 685 HB3 GLU 83 HB3 GLU 83 2.664 -0.959 -8.972 686 HG2 GLU 83 HG2 GLU 83 1.515 0.945 -10.107 687 HG3 GLU 83 HG3 GLU 83 2.183 2.027 -8.863 688 H THR 84 H THR 84 0.521 -2.295 -9.340 689 HA THR 84 HA THR 84 0.438 -4.411 -7.224 690 HB THR 84 HB THR 84 -0.694 -5.756 -8.966 691 HG1 THR 84 HG1 THR 84 -0.027 -4.835 -10.863 692 HG21 THR 84 HG21 THR 84 -2.048 -4.419 -7.395 693 HG22 THR 84 HG22 THR 84 -2.026 -3.043 -8.521 694 HG23 THR 84 HG23 THR 84 -2.835 -4.562 -8.973 695 H VAL 85 H VAL 85 1.528 -6.397 -7.625 696 HA VAL 85 HA VAL 85 3.954 -6.291 -9.317 697 HB VAL 85 HB VAL 85 4.481 -8.434 -8.371 698 HG11 VAL 85 HG11 VAL 85 4.976 -6.362 -7.096 699 HG12 VAL 85 HG12 VAL 85 3.481 -6.584 -6.171 700 HG13 VAL 85 HG13 VAL 85 4.780 -7.774 -6.053 701 HG21 VAL 85 HG21 VAL 85 3.071 -9.575 -6.763 702 HG22 VAL 85 HG22 VAL 85 1.829 -8.317 -6.879 703 HG23 VAL 85 HG23 VAL 85 2.164 -9.385 -8.251 704 H THR 86 H THR 86 4.302 -8.401 -10.585 705 HA THR 86 HA THR 86 1.996 -8.948 -12.375 706 HB THR 86 HB THR 86 3.724 -9.620 -13.982 707 HG1 THR 86 HG1 THR 86 5.647 -8.659 -12.169 708 HG21 THR 86 HG21 THR 86 4.802 -7.414 -14.261 709 HG22 THR 86 HG22 THR 86 3.081 -7.239 -13.825 710 HG23 THR 86 HG23 THR 86 4.334 -6.965 -12.606 711 H ASP 87 H ASP 87 4.038 -10.657 -10.100 712 HA ASP 87 HA ASP 87 3.427 -13.286 -11.265 713 HB2 ASP 87 HB2 ASP 87 5.659 -12.690 -10.332 714 HB3 ASP 87 HB3 ASP 87 4.918 -12.606 -8.726 715 H SER 88 H SER 88 2.628 -11.580 -8.196 716 HA SER 88 HA SER 88 0.233 -13.351 -7.953 717 HB2 SER 88 HB2 SER 88 1.995 -14.521 -6.716 718 HB3 SER 88 HB3 SER 88 2.201 -13.099 -5.674 719 HG SER 88 HG SER 88 0.752 -14.682 -4.792 720 H SER 89 H SER 89 -1.537 -12.291 -7.526 721 HA SER 89 HA SER 89 -1.576 -9.539 -7.027 722 HB2 SER 89 HB2 SER 89 -3.920 -11.424 -6.698 723 HB3 SER 89 HB3 SER 89 -3.956 -9.710 -7.152 724 HG SER 89 HG SER 89 -4.163 -11.045 -8.991 725 H ARG 90 H ARG 90 -0.584 -11.353 -4.613 726 HA ARG 90 HA ARG 90 -2.168 -10.012 -2.497 727 HB2 ARG 90 HB2 ARG 90 -1.637 -11.581 -0.949 728 HB3 ARG 90 HB3 ARG 90 -2.048 -12.469 -2.414 729 HG2 ARG 90 HG2 ARG 90 0.389 -12.762 -2.891 730 HG3 ARG 90 HG3 ARG 90 0.753 -11.934 -1.357 731 HD2 ARG 90 HD2 ARG 90 -0.579 -13.696 -0.155 732 HD3 ARG 90 HD3 ARG 90 -0.742 -14.555 -1.703 733 HE ARG 90 HE ARG 90 2.017 -13.876 -0.969 734 HH11 ARG 90 HH11 ARG 90 3.466 -15.404 -0.592 735 HH12 ARG 90 HH12 ARG 90 2.983 -17.040 -0.204 736 HH21 ARG 90 HH21 ARG 90 -0.389 -16.380 -0.458 737 HH22 ARG 90 HH22 ARG 90 0.829 -17.582 -0.137 738 H TYR 91 H TYR 91 0.118 -8.894 -4.260 739 HA TYR 91 HA TYR 91 1.679 -7.655 -2.059 740 HB2 TYR 91 HB2 TYR 91 2.748 -8.827 -4.643 741 HB3 TYR 91 HB3 TYR 91 3.688 -7.931 -3.473 742 HD1 TYR 91 HD1 TYR 91 4.058 -8.873 -1.178 743 HD2 TYR 91 HD2 TYR 91 2.364 -11.210 -4.378 744 HE1 TYR 91 HE1 TYR 91 4.559 -10.964 0.086 745 HE2 TYR 91 HE2 TYR 91 2.980 -13.299 -3.174 746 HH TYR 91 HH TYR 91 4.513 -13.242 0.065 747 H PHE 92 H PHE 92 2.185 -5.515 -2.340 748 HA PHE 92 HA PHE 92 1.498 -4.142 -4.890 749 HB2 PHE 92 HB2 PHE 92 0.548 -3.237 -2.144 750 HB3 PHE 92 HB3 PHE 92 0.259 -2.415 -3.662 751 HD1 PHE 92 HD1 PHE 92 -1.339 -3.343 -5.332 752 HD2 PHE 92 HD2 PHE 92 -0.720 -5.162 -1.483 753 HE1 PHE 92 HE1 PHE 92 -3.401 -4.723 -5.643 754 HE2 PHE 92 HE2 PHE 92 -2.796 -6.469 -1.753 755 HZ PHE 92 HZ PHE 92 -4.118 -6.299 -3.875 756 H VAL 93 H VAL 93 2.290 -1.930 -4.947 757 HA VAL 93 HA VAL 93 4.453 -1.276 -2.992 758 HB VAL 93 HB VAL 93 4.417 -0.533 -5.937 759 HG11 VAL 93 HG11 VAL 93 5.419 1.240 -4.489 760 HG12 VAL 93 HG12 VAL 93 6.558 0.041 -3.850 761 HG13 VAL 93 HG13 VAL 93 6.583 0.484 -5.572 762 HG21 VAL 93 HG21 VAL 93 6.551 -1.881 -5.975 763 HG22 VAL 93 HG22 VAL 93 6.165 -2.444 -4.341 764 HG23 VAL 93 HG23 VAL 93 5.087 -2.830 -5.705 765 H ILE 94 H ILE 94 4.309 0.807 -2.097 766 HA ILE 94 HA ILE 94 2.350 2.635 -3.350 767 HB ILE 94 HB ILE 94 1.494 3.444 -1.298 768 HG12 ILE 94 HG12 ILE 94 3.354 2.575 0.238 769 HG13 ILE 94 HG13 ILE 94 1.709 2.534 0.838 770 HG21 ILE 94 HG21 ILE 94 0.875 0.509 -1.734 771 HG22 ILE 94 HG22 ILE 94 -0.134 1.673 -0.840 772 HG23 ILE 94 HG23 ILE 94 0.189 1.910 -2.562 773 HD11 ILE 94 HD11 ILE 94 2.961 0.532 1.481 774 HD12 ILE 94 HD12 ILE 94 1.580 0.109 0.467 775 HD13 ILE 94 HD13 ILE 94 3.216 0.100 -0.217 776 H ARG 95 H ARG 95 2.668 4.797 -3.117 777 HA ARG 95 HA ARG 95 5.516 5.517 -2.617 778 HB2 ARG 95 HB2 ARG 95 4.331 6.117 -4.785 779 HB3 ARG 95 HB3 ARG 95 3.443 7.339 -3.859 780 HG2 ARG 95 HG2 ARG 95 5.619 8.321 -3.123 781 HG3 ARG 95 HG3 ARG 95 6.477 7.113 -4.100 782 HD2 ARG 95 HD2 ARG 95 5.305 7.998 -6.128 783 HD3 ARG 95 HD3 ARG 95 4.573 9.264 -5.123 784 HE ARG 95 HE ARG 95 7.274 9.526 -4.593 785 HH11 ARG 95 HH11 ARG 95 8.692 10.771 -5.544 786 HH12 ARG 95 HH12 ARG 95 8.511 11.275 -7.211 787 HH21 ARG 95 HH21 ARG 95 5.502 9.640 -7.618 788 HH22 ARG 95 HH22 ARG 95 6.718 10.637 -8.368 789 H ILE 96 H ILE 96 5.506 5.412 -0.383 790 HA ILE 96 HA ILE 96 3.743 7.093 1.202 791 HB ILE 96 HB ILE 96 4.979 6.526 3.134 792 HG12 ILE 96 HG12 ILE 96 6.799 4.551 2.654 793 HG13 ILE 96 HG13 ILE 96 7.096 5.540 1.239 794 HG21 ILE 96 HG21 ILE 96 4.431 4.127 1.384 795 HG22 ILE 96 HG22 ILE 96 4.607 4.092 3.143 796 HG23 ILE 96 HG23 ILE 96 3.280 4.993 2.437 797 HD11 ILE 96 HD11 ILE 96 8.597 6.118 3.091 798 HD12 ILE 96 HD12 ILE 96 7.530 7.496 2.761 799 HD13 ILE 96 HD13 ILE 96 7.216 6.431 4.155 800 H GLN 97 H GLN 97 4.125 8.996 2.240 801 HA GLN 97 HA GLN 97 6.348 10.719 1.224 802 HB2 GLN 97 HB2 GLN 97 3.360 11.067 0.831 803 HB3 GLN 97 HB3 GLN 97 4.463 12.446 0.798 804 HG2 GLN 97 HG2 GLN 97 5.554 11.762 -1.124 805 HG3 GLN 97 HG3 GLN 97 5.071 10.075 -0.974 806 HE21 GLN 97 HE21 GLN 97 2.161 10.450 -2.903 807 HE22 GLN 97 HE22 GLN 97 3.188 9.363 -1.968 808 H ASP 98 H ASP 98 6.745 12.562 2.369 809 HA ASP 98 HA ASP 98 5.842 12.530 5.208 810 HB2 ASP 98 HB2 ASP 98 8.287 12.519 4.484 811 HB3 ASP 98 HB3 ASP 98 8.028 14.182 3.952 812 H GLY 99 H GLY 99 4.694 13.954 2.502 813 HA2 GLY 99 HA2 GLY 99 2.994 15.523 2.274 814 HA3 GLY 99 HA3 GLY 99 3.201 16.008 3.957 815 H THR 100 H THR 100 6.115 16.063 2.201 816 HA THR 100 HA THR 100 5.961 18.990 1.619 817 HB THR 100 HB THR 100 6.791 18.452 3.921 818 HG1 THR 100 HG1 THR 100 7.358 20.388 3.032 819 HG21 THR 100 HG21 THR 100 9.294 17.435 2.530 820 HG22 THR 100 HG22 THR 100 9.008 17.600 4.272 821 HG23 THR 100 HG23 THR 100 8.095 16.401 3.344 822 H GLY 101 H GLY 101 6.243 16.330 -0.021 823 HA2 GLY 101 HA2 GLY 101 7.014 16.125 -2.232 824 HA3 GLY 101 HA3 GLY 101 8.220 17.379 -1.966 825 H ARG 102 H ARG 102 8.590 15.402 0.634 826 HA ARG 102 HA ARG 102 10.747 13.689 -0.391 827 HB2 ARG 102 HB2 ARG 102 9.268 13.772 2.270 828 HB3 ARG 102 HB3 ARG 102 10.647 12.729 1.929 829 HG2 ARG 102 HG2 ARG 102 12.113 14.602 1.675 830 HG3 ARG 102 HG3 ARG 102 10.758 15.752 1.777 831 HD2 ARG 102 HD2 ARG 102 10.271 14.992 4.074 832 HD3 ARG 102 HD3 ARG 102 11.660 13.894 4.019 833 HE ARG 102 HE ARG 102 12.929 16.164 3.495 834 HH11 ARG 102 HH11 ARG 102 13.697 17.748 4.817 835 HH12 ARG 102 HH12 ARG 102 12.888 18.112 6.311 836 HH21 ARG 102 HH21 ARG 102 10.386 15.784 5.960 837 HH22 ARG 102 HH22 ARG 102 11.104 17.034 6.935 838 H SER 103 H SER 103 10.459 11.711 -1.087 839 HA SER 103 HA SER 103 8.189 10.147 -0.169 840 HB2 SER 103 HB2 SER 103 7.286 9.550 -2.329 841 HB3 SER 103 HB3 SER 103 7.327 11.314 -2.216 842 HG SER 103 HG SER 103 9.359 11.208 -3.369 843 H ALA 104 H ALA 104 8.194 7.895 -0.643 844 HA ALA 104 HA ALA 104 10.513 6.714 -2.022 845 HB1 ALA 104 HB1 ALA 104 9.737 5.951 0.831 846 HB2 ALA 104 HB2 ALA 104 10.935 5.117 -0.180 847 HB3 ALA 104 HB3 ALA 104 11.231 6.784 0.349 848 H PHE 105 H PHE 105 10.045 4.726 -2.964 849 HA PHE 105 HA PHE 105 7.214 3.782 -2.878 850 HB2 PHE 105 HB2 PHE 105 9.522 3.235 -4.759 851 HB3 PHE 105 HB3 PHE 105 8.084 2.242 -4.715 852 HD1 PHE 105 HD1 PHE 105 9.471 5.425 -5.867 853 HD2 PHE 105 HD2 PHE 105 5.831 3.194 -5.282 854 HE1 PHE 105 HE1 PHE 105 8.296 6.894 -7.492 855 HE2 PHE 105 HE2 PHE 105 4.668 4.627 -6.923 856 HZ PHE 105 HZ PHE 105 5.905 6.478 -8.047 857 H ILE 106 H ILE 106 6.744 2.312 -1.396 858 HA ILE 106 HA ILE 106 8.827 0.317 -0.574 859 HB ILE 106 HB ILE 106 7.906 0.146 1.585 860 HG12 ILE 106 HG12 ILE 106 5.855 2.299 0.919 861 HG13 ILE 106 HG13 ILE 106 5.495 0.578 1.059 862 HG21 ILE 106 HG21 ILE 106 8.235 3.106 0.964 863 HG22 ILE 106 HG22 ILE 106 8.603 2.280 2.495 864 HG23 ILE 106 HG23 ILE 106 9.578 1.945 1.060 865 HD11 ILE 106 HD11 ILE 106 6.472 2.331 3.333 866 HD12 ILE 106 HD12 ILE 106 4.858 1.639 3.107 867 HD13 ILE 106 HD13 ILE 106 6.238 0.571 3.413 868 H GLY 107 H GLY 107 8.267 -1.846 -0.393 869 HA2 GLY 107 HA2 GLY 107 5.858 -2.670 -1.920 870 HA3 GLY 107 HA3 GLY 107 7.237 -3.679 -1.497 871 H ILE 108 H ILE 108 4.225 -3.826 -0.971 872 HA ILE 108 HA ILE 108 4.542 -4.782 1.794 873 HB ILE 108 HB ILE 108 2.218 -4.316 2.341 874 HG12 ILE 108 HG12 ILE 108 2.100 -2.483 -0.085 875 HG13 ILE 108 HG13 ILE 108 1.327 -4.068 0.007 876 HG21 ILE 108 HG21 ILE 108 2.564 -1.975 2.937 877 HG22 ILE 108 HG22 ILE 108 4.046 -2.915 3.113 878 HG23 ILE 108 HG23 ILE 108 3.849 -1.830 1.719 879 HD11 ILE 108 HD11 ILE 108 0.649 -1.691 1.796 880 HD12 ILE 108 HD12 ILE 108 -0.318 -2.351 0.472 881 HD13 ILE 108 HD13 ILE 108 -0.049 -3.317 1.932 882 H GLY 109 H GLY 109 3.522 -6.670 2.331 883 HA2 GLY 109 HA2 GLY 109 2.073 -8.135 0.159 884 HA3 GLY 109 HA3 GLY 109 3.380 -8.904 1.045 885 H PHE 110 H PHE 110 0.542 -9.530 0.728 886 HA PHE 110 HA PHE 110 -0.393 -9.561 3.567 887 HB2 PHE 110 HB2 PHE 110 -1.857 -9.968 0.936 888 HB3 PHE 110 HB3 PHE 110 -2.574 -10.238 2.515 889 HD1 PHE 110 HD1 PHE 110 -1.279 -7.631 0.203 890 HD2 PHE 110 HD2 PHE 110 -3.145 -8.410 4.013 891 HE1 PHE 110 HE1 PHE 110 -1.862 -5.221 0.422 892 HE2 PHE 110 HE2 PHE 110 -3.706 -6.003 4.225 893 HZ PHE 110 HZ PHE 110 -3.086 -4.415 2.390 894 H THR 111 H THR 111 -1.271 -11.533 4.404 895 HA THR 111 HA THR 111 0.360 -13.860 3.804 896 HB THR 111 HB THR 111 -0.412 -13.118 6.062 897 HG1 THR 111 HG1 THR 111 -0.979 -15.777 5.264 898 HG21 THR 111 HG21 THR 111 -3.051 -14.467 5.357 899 HG22 THR 111 HG22 THR 111 -2.548 -13.842 6.940 900 HG23 THR 111 HG23 THR 111 -2.818 -12.721 5.599 901 H ASP 112 H ASP 112 -2.609 -12.711 2.535 902 HA ASP 112 HA ASP 112 -3.021 -15.142 1.000 903 HB2 ASP 112 HB2 ASP 112 -4.248 -15.544 3.196 904 HB3 ASP 112 HB3 ASP 112 -5.280 -14.172 2.800 905 H ARG 113 H ARG 113 -4.239 -14.798 -0.862 906 HA ARG 113 HA ARG 113 -4.235 -12.125 -1.916 907 HB2 ARG 113 HB2 ARG 113 -3.872 -14.267 -3.165 908 HB3 ARG 113 HB3 ARG 113 -5.595 -14.632 -2.992 909 HG2 ARG 113 HG2 ARG 113 -6.187 -12.627 -4.268 910 HG3 ARG 113 HG3 ARG 113 -4.491 -12.123 -4.356 911 HD2 ARG 113 HD2 ARG 113 -5.575 -14.746 -5.458 912 HD3 ARG 113 HD3 ARG 113 -5.426 -13.264 -6.419 913 HE ARG 113 HE ARG 113 -2.896 -13.890 -5.188 914 HH11 ARG 113 HH11 ARG 113 -1.190 -14.739 -6.365 915 HH12 ARG 113 HH12 ARG 113 -1.523 -15.530 -7.879 916 HH21 ARG 113 HH21 ARG 113 -4.905 -15.032 -7.818 917 HH22 ARG 113 HH22 ARG 113 -3.546 -15.664 -8.702 918 H GLY 114 H GLY 114 -6.787 -13.969 -0.328 919 HA2 GLY 114 HA2 GLY 114 -9.034 -12.350 -1.044 920 HA3 GLY 114 HA3 GLY 114 -8.857 -13.314 0.423 921 H ASP 115 H ASP 115 -6.456 -11.783 1.370 922 HA ASP 115 HA ASP 115 -7.902 -9.505 2.594 923 HB2 ASP 115 HB2 ASP 115 -5.108 -10.622 3.023 924 HB3 ASP 115 HB3 ASP 115 -5.764 -9.220 3.869 925 H ALA 116 H ALA 116 -5.254 -10.020 0.286 926 HA ALA 116 HA ALA 116 -4.693 -7.250 -0.261 927 HB1 ALA 116 HB1 ALA 116 -3.176 -9.022 -0.844 928 HB2 ALA 116 HB2 ALA 116 -4.412 -9.840 -1.833 929 HB3 ALA 116 HB3 ALA 116 -3.756 -8.300 -2.365 930 H PHE 117 H PHE 117 -7.131 -9.524 -1.556 931 HA PHE 117 HA PHE 117 -8.307 -7.799 -3.489 932 HB2 PHE 117 HB2 PHE 117 -9.086 -10.243 -2.094 933 HB3 PHE 117 HB3 PHE 117 -10.445 -9.164 -2.337 934 HD1 PHE 117 HD1 PHE 117 -11.599 -9.244 -4.384 935 HD2 PHE 117 HD2 PHE 117 -7.484 -10.527 -4.238 936 HE1 PHE 117 HE1 PHE 117 -11.728 -9.937 -6.764 937 HE2 PHE 117 HE2 PHE 117 -7.618 -11.224 -6.620 938 HZ PHE 117 HZ PHE 117 -9.741 -10.928 -7.885 939 H ASP 118 H ASP 118 -9.074 -8.020 0.041 940 HA ASP 118 HA ASP 118 -10.906 -5.809 -0.036 941 HB2 ASP 118 HB2 ASP 118 -9.268 -6.978 2.240 942 HB3 ASP 118 HB3 ASP 118 -10.460 -5.703 2.453 943 H PHE 119 H PHE 119 -7.338 -5.802 0.237 944 HA PHE 119 HA PHE 119 -7.077 -3.007 0.839 945 HB2 PHE 119 HB2 PHE 119 -5.198 -4.463 1.089 946 HB3 PHE 119 HB3 PHE 119 -5.249 -4.963 -0.586 947 HD1 PHE 119 HD1 PHE 119 -4.423 -3.514 -2.407 948 HD2 PHE 119 HD2 PHE 119 -4.175 -2.312 1.712 949 HE1 PHE 119 HE1 PHE 119 -2.892 -1.674 -3.042 950 HE2 PHE 119 HE2 PHE 119 -2.651 -0.460 1.081 951 HZ PHE 119 HZ PHE 119 -2.006 -0.134 -1.300 952 H ASN 120 H ASN 120 -6.813 -4.603 -2.391 953 HA ASN 120 HA ASN 120 -6.811 -1.996 -3.636 954 HB2 ASN 120 HB2 ASN 120 -6.391 -2.999 -5.649 955 HB3 ASN 120 HB3 ASN 120 -5.560 -4.016 -4.475 956 HD21 ASN 120 HD21 ASN 120 -7.613 -6.845 -5.296 957 HD22 ASN 120 HD22 ASN 120 -6.674 -6.167 -3.968 958 H VAL 121 H VAL 121 -9.470 -4.257 -3.096 959 HA VAL 121 HA VAL 121 -11.243 -2.953 -4.968 960 HB VAL 121 HB VAL 121 -11.746 -4.803 -2.633 961 HG11 VAL 121 HG11 VAL 121 -14.048 -5.106 -3.546 962 HG12 VAL 121 HG12 VAL 121 -13.797 -3.497 -2.875 963 HG13 VAL 121 HG13 VAL 121 -13.776 -3.729 -4.640 964 HG21 VAL 121 HG21 VAL 121 -12.233 -6.442 -4.400 965 HG22 VAL 121 HG22 VAL 121 -11.990 -5.205 -5.656 966 HG23 VAL 121 HG23 VAL 121 -10.626 -5.763 -4.673 967 H SER 122 H SER 122 -10.562 -2.474 -1.484 968 HA SER 122 HA SER 122 -12.581 -0.478 -1.057 969 HB2 SER 122 HB2 SER 122 -9.950 -0.883 0.413 970 HB3 SER 122 HB3 SER 122 -11.326 0.089 0.967 971 HG SER 122 HG SER 122 -11.006 -2.671 0.820 972 H LEU 123 H LEU 123 -9.570 -0.257 -2.752 973 HA LEU 123 HA LEU 123 -9.571 2.708 -2.730 974 HB2 LEU 123 HB2 LEU 123 -7.850 0.674 -4.188 975 HB3 LEU 123 HB3 LEU 123 -7.688 2.420 -4.345 976 HG LEU 123 HG LEU 123 -7.352 0.942 -1.700 977 HD11 LEU 123 HD11 LEU 123 -5.632 0.261 -3.325 978 HD12 LEU 123 HD12 LEU 123 -5.259 1.966 -3.655 979 HD13 LEU 123 HD13 LEU 123 -4.942 1.268 -2.047 980 HD21 LEU 123 HD21 LEU 123 -7.930 3.337 -1.431 981 HD22 LEU 123 HD22 LEU 123 -6.258 3.023 -0.976 982 HD23 LEU 123 HD23 LEU 123 -6.614 3.780 -2.543 983 H GLN 124 H GLN 124 -10.002 0.129 -5.248 984 HA GLN 124 HA GLN 124 -10.713 2.056 -7.214 985 HB2 GLN 124 HB2 GLN 124 -11.054 0.267 -8.688 986 HB3 GLN 124 HB3 GLN 124 -9.802 -0.261 -7.567 987 HG2 GLN 124 HG2 GLN 124 -11.765 -1.392 -6.268 988 HG3 GLN 124 HG3 GLN 124 -12.683 -1.180 -7.758 989 HE21 GLN 124 HE21 GLN 124 -9.469 -3.806 -7.624 990 HE22 GLN 124 HE22 GLN 124 -9.545 -2.444 -6.526 991 H ASP 125 H ASP 125 -12.855 0.283 -4.977 992 HA ASP 125 HA ASP 125 -15.235 1.346 -6.328 993 HB2 ASP 125 HB2 ASP 125 -15.159 -0.976 -5.425 994 HB3 ASP 125 HB3 ASP 125 -14.976 -0.319 -3.797 995 H HIS 126 H HIS 126 -13.020 2.698 -4.265 996 HA HIS 126 HA HIS 126 -15.040 4.625 -3.196 997 HB2 HIS 126 HB2 HIS 126 -13.425 3.706 -1.556 998 HB3 HIS 126 HB3 HIS 126 -12.084 4.298 -2.540 999 HD2 HIS 126 HD2 HIS 126 -11.272 6.719 -2.062 1000 HE1 HIS 126 HE1 HIS 126 -14.470 8.048 0.426 1001 HE2 HIS 126 HE2 HIS 126 -12.162 8.618 -0.462 1002 H PHE 127 H PHE 127 -12.335 4.326 -5.444 1003 HA PHE 127 HA PHE 127 -12.584 7.166 -6.177 1004 HB2 PHE 127 HB2 PHE 127 -10.640 4.945 -6.856 1005 HB3 PHE 127 HB3 PHE 127 -10.629 6.459 -7.730 1006 HD1 PHE 127 HD1 PHE 127 -10.785 8.657 -6.095 1007 HD2 PHE 127 HD2 PHE 127 -9.064 4.837 -5.090 1008 HE1 PHE 127 HE1 PHE 127 -9.145 9.782 -4.617 1009 HE2 PHE 127 HE2 PHE 127 -7.380 5.956 -3.677 1010 HZ PHE 127 HZ PHE 127 -7.428 8.445 -3.433 1011 H LYS 128 H LYS 128 -14.159 4.378 -7.416 1012 HA LYS 128 HA LYS 128 -13.942 4.683 -10.108 1013 HB2 LYS 128 HB2 LYS 128 -15.936 3.564 -10.497 1014 HB3 LYS 128 HB3 LYS 128 -15.229 2.869 -9.060 1015 HG2 LYS 128 HG2 LYS 128 -17.434 4.978 -8.845 1016 HG3 LYS 128 HG3 LYS 128 -17.804 3.311 -9.247 1017 HD2 LYS 128 HD2 LYS 128 -16.834 2.485 -7.226 1018 HD3 LYS 128 HD3 LYS 128 -16.282 4.105 -6.733 1019 HE2 LYS 128 HE2 LYS 128 -18.470 4.876 -6.358 1020 HE3 LYS 128 HE3 LYS 128 -19.199 3.602 -7.360 1021 HZ1 LYS 128 HZ1 LYS 128 -19.527 3.109 -5.006 1022 HZ2 LYS 128 HZ2 LYS 128 -18.512 1.978 -5.655 1023 HZ3 LYS 128 HZ3 LYS 128 -17.900 3.148 -4.734 1024 H TRP 129 H TRP 129 -15.828 6.865 -8.147 1025 HA TRP 129 HA TRP 129 -17.047 8.240 -10.442 1026 HB2 TRP 129 HB2 TRP 129 -18.091 9.630 -8.776 1027 HB3 TRP 129 HB3 TRP 129 -18.278 7.935 -8.347 1028 HD1 TRP 129 HD1 TRP 129 -16.515 7.043 -6.351 1029 HE1 TRP 129 HE1 TRP 129 -15.472 8.240 -4.374 1030 HE3 TRP 129 HE3 TRP 129 -17.563 11.885 -7.695 1031 HZ2 TRP 129 HZ2 TRP 129 -15.420 10.933 -3.296 1032 HZ3 TRP 129 HZ3 TRP 129 -17.073 13.742 -6.120 1033 HH2 TRP 129 HH2 TRP 129 -16.020 13.281 -3.917 1034 H VAL 130 H VAL 130 -14.187 8.667 -8.470 1035 HA VAL 130 HA VAL 130 -13.657 11.437 -9.325 1036 HB VAL 130 HB VAL 130 -11.801 9.463 -7.947 1037 HG11 VAL 130 HG11 VAL 130 -11.727 12.506 -8.140 1038 HG12 VAL 130 HG12 VAL 130 -10.627 11.504 -7.168 1039 HG13 VAL 130 HG13 VAL 130 -10.600 11.375 -8.924 1040 HG21 VAL 130 HG21 VAL 130 -13.725 9.754 -6.496 1041 HG22 VAL 130 HG22 VAL 130 -12.392 10.699 -5.841 1042 HG23 VAL 130 HG23 VAL 130 -13.697 11.515 -6.731 1043 H LYS 131 H LYS 131 -12.624 8.139 -10.133 1044 HA LYS 131 HA LYS 131 -10.844 9.122 -12.298 1045 HB2 LYS 131 HB2 LYS 131 -10.008 7.550 -10.436 1046 HB3 LYS 131 HB3 LYS 131 -10.979 6.296 -11.219 1047 HG2 LYS 131 HG2 LYS 131 -9.757 7.039 -13.420 1048 HG3 LYS 131 HG3 LYS 131 -8.649 7.911 -12.358 1049 HD2 LYS 131 HD2 LYS 131 -7.873 5.861 -11.359 1050 HD3 LYS 131 HD3 LYS 131 -9.247 4.950 -12.023 1051 HE2 LYS 131 HE2 LYS 131 -7.475 4.370 -13.443 1052 HE3 LYS 131 HE3 LYS 131 -8.445 5.560 -14.334 1053 HZ1 LYS 131 HZ1 LYS 131 -6.838 7.232 -13.866 1054 HZ2 LYS 131 HZ2 LYS 131 -5.973 6.246 -12.824 1055 HZ3 LYS 131 HZ3 LYS 131 -6.006 5.959 -14.438 1056 H GLN 132 H GLN 132 -13.174 9.636 -13.050 1057 HA GLN 132 HA GLN 132 -14.282 7.528 -14.795 1058 HB2 GLN 132 HB2 GLN 132 -14.948 10.460 -14.424 1059 HB3 GLN 132 HB3 GLN 132 -15.634 9.461 -15.709 1060 HG2 GLN 132 HG2 GLN 132 -15.889 8.751 -12.756 1061 HG3 GLN 132 HG3 GLN 132 -17.073 9.722 -13.625 1062 HE21 GLN 132 HE21 GLN 132 -17.229 5.703 -14.037 1063 HE22 GLN 132 HE22 GLN 132 -16.155 6.480 -12.872 1064 H GLU 133 H GLU 133 -12.592 6.965 -16.000 1065 HA GLU 133 HA GLU 133 -11.521 8.820 -18.088 1066 HB2 GLU 133 HB2 GLU 133 -9.836 6.959 -16.360 1067 HB3 GLU 133 HB3 GLU 133 -9.285 7.803 -17.809 1068 HG2 GLU 133 HG2 GLU 133 -9.912 9.991 -16.660 1069 HG3 GLU 133 HG3 GLU 133 -10.144 9.062 -15.175 Start of MODEL 25 1 H1 GLY -4 H1 GLY -4 -13.442 32.273 18.611 2 H2 GLY -4 H2 GLY -4 -13.035 33.852 18.753 3 H3 GLY -4 H3 GLY -4 -13.724 33.067 20.017 4 HA2 GLY -4 HA2 GLY -4 -11.377 33.340 20.430 5 HA3 GLY -4 HA3 GLY -4 -11.809 31.629 20.251 6 H SER -3 H SER -3 -9.684 31.104 19.646 7 HA SER -3 HA SER -3 -7.850 30.813 18.334 8 HB2 SER -3 HB2 SER -3 -9.991 30.693 16.195 9 HB3 SER -3 HB3 SER -3 -8.362 29.993 16.095 10 HG SER -3 HG SER -3 -9.941 28.457 16.775 11 HA PRO -2 HA PRO -2 -7.451 35.168 16.657 12 HB2 PRO -2 HB2 PRO -2 -5.601 36.194 18.372 13 HB3 PRO -2 HB3 PRO -2 -7.344 36.112 18.773 14 HG2 PRO -2 HG2 PRO -2 -5.167 34.141 19.559 15 HG3 PRO -2 HG3 PRO -2 -6.372 34.934 20.624 16 HD2 PRO -2 HD2 PRO -2 -6.776 32.434 19.628 17 HD3 PRO -2 HD3 PRO -2 -8.125 33.597 19.799 18 H ASN -1 H ASN -1 -5.238 32.562 17.324 19 HA ASN -1 HA ASN -1 -3.153 33.640 15.480 20 HB2 ASN -1 HB2 ASN -1 -3.069 31.322 17.455 21 HB3 ASN -1 HB3 ASN -1 -1.740 31.827 16.416 22 HD21 ASN -1 HD21 ASN -1 -2.066 33.624 19.938 23 HD22 ASN -1 HD22 ASN -1 -2.858 32.109 19.537 24 H SER 0 H SER 0 -2.325 32.337 13.788 25 HA SER 0 HA SER 0 -4.324 30.989 12.252 26 HB2 SER 0 HB2 SER 0 -1.317 31.090 11.814 27 HB3 SER 0 HB3 SER 0 -2.554 30.710 10.599 28 HG SER 0 HG SER 0 -1.886 32.908 10.495 29 H MET 1 H MET 1 -2.138 29.695 14.596 30 HA MET 1 HA MET 1 -1.957 27.015 13.430 31 HB2 MET 1 HB2 MET 1 -1.001 28.054 16.128 32 HB3 MET 1 HB3 MET 1 -0.648 26.484 15.414 33 HG2 MET 1 HG2 MET 1 1.275 27.721 14.986 34 HG3 MET 1 HG3 MET 1 0.414 27.707 13.457 35 HE1 MET 1 HE1 MET 1 0.086 29.995 16.768 36 HE2 MET 1 HE2 MET 1 1.819 29.774 16.433 37 HE3 MET 1 HE3 MET 1 1.070 31.373 16.236 38 H ALA 2 H ALA 2 -3.280 25.375 13.772 39 HA ALA 2 HA ALA 2 -4.595 24.889 16.299 40 HB1 ALA 2 HB1 ALA 2 -6.867 24.672 15.301 41 HB2 ALA 2 HB2 ALA 2 -6.298 26.351 15.237 42 HB3 ALA 2 HB3 ALA 2 -6.262 25.345 13.771 43 H THR 3 H THR 3 -4.742 22.672 16.552 44 HA THR 3 HA THR 3 -3.473 21.078 14.443 45 HB THR 3 HB THR 3 -4.328 19.924 17.094 46 HG1 THR 3 HG1 THR 3 -2.316 20.576 17.867 47 HG21 THR 3 HG21 THR 3 -3.456 18.492 15.222 48 HG22 THR 3 HG22 THR 3 -2.010 19.517 15.141 49 HG23 THR 3 HG23 THR 3 -2.328 18.530 16.597 50 H GLU 4 H GLU 4 -5.154 21.372 12.988 51 HA GLU 4 HA GLU 4 -7.822 20.489 13.710 52 HB2 GLU 4 HB2 GLU 4 -8.541 21.940 11.973 53 HB3 GLU 4 HB3 GLU 4 -7.248 22.730 12.894 54 HG2 GLU 4 HG2 GLU 4 -5.623 22.258 11.126 55 HG3 GLU 4 HG3 GLU 4 -6.818 21.338 10.212 56 H LEU 5 H LEU 5 -5.664 18.553 12.709 57 HA LEU 5 HA LEU 5 -6.887 17.314 10.372 58 HB2 LEU 5 HB2 LEU 5 -4.330 17.503 11.243 59 HB3 LEU 5 HB3 LEU 5 -4.701 15.905 11.871 60 HG LEU 5 HG LEU 5 -5.070 16.859 9.000 61 HD11 LEU 5 HD11 LEU 5 -2.697 16.745 9.656 62 HD12 LEU 5 HD12 LEU 5 -2.915 15.066 10.200 63 HD13 LEU 5 HD13 LEU 5 -3.086 15.483 8.479 64 HD21 LEU 5 HD21 LEU 5 -6.581 14.964 9.459 65 HD22 LEU 5 HD22 LEU 5 -5.270 14.458 8.396 66 HD23 LEU 5 HD23 LEU 5 -5.229 14.024 10.121 67 H GLU 6 H GLU 6 -8.782 17.462 12.200 68 HA GLU 6 HA GLU 6 -9.098 14.871 13.617 69 HB2 GLU 6 HB2 GLU 6 -9.446 17.129 14.728 70 HB3 GLU 6 HB3 GLU 6 -10.915 17.300 13.765 71 HG2 GLU 6 HG2 GLU 6 -11.778 15.168 14.804 72 HG3 GLU 6 HG3 GLU 6 -10.281 15.031 15.717 73 H TYR 7 H TYR 7 -9.055 14.242 11.090 74 HA TYR 7 HA TYR 7 -11.813 13.540 10.354 75 HB2 TYR 7 HB2 TYR 7 -11.739 14.461 8.170 76 HB3 TYR 7 HB3 TYR 7 -11.388 15.757 9.278 77 HD1 TYR 7 HD1 TYR 7 -9.848 13.394 6.795 78 HD2 TYR 7 HD2 TYR 7 -9.333 17.019 9.097 79 HE1 TYR 7 HE1 TYR 7 -7.946 14.009 5.370 80 HE2 TYR 7 HE2 TYR 7 -7.360 17.607 7.686 81 HH TYR 7 HH TYR 7 -6.285 15.543 4.958 82 H GLU 8 H GLU 8 -11.953 11.603 9.312 83 HA GLU 8 HA GLU 8 -10.179 10.644 7.373 84 HB2 GLU 8 HB2 GLU 8 -9.417 9.913 10.150 85 HB3 GLU 8 HB3 GLU 8 -9.919 8.471 9.275 86 HG2 GLU 8 HG2 GLU 8 -8.274 8.838 7.545 87 HG3 GLU 8 HG3 GLU 8 -7.840 10.407 8.200 88 H SER 9 H SER 9 -11.602 9.575 6.099 89 HA SER 9 HA SER 9 -13.843 8.036 7.334 90 HB2 SER 9 HB2 SER 9 -13.215 8.912 4.505 91 HB3 SER 9 HB3 SER 9 -14.432 7.672 4.857 92 HG SER 9 HG SER 9 -15.667 9.126 5.913 93 H VAL 10 H VAL 10 -13.056 6.103 8.049 94 HA VAL 10 HA VAL 10 -10.879 4.642 6.730 95 HB VAL 10 HB VAL 10 -12.812 3.702 8.891 96 HG11 VAL 10 HG11 VAL 10 -11.655 1.798 7.875 97 HG12 VAL 10 HG12 VAL 10 -10.086 2.634 8.020 98 HG13 VAL 10 HG13 VAL 10 -10.977 2.114 9.467 99 HG21 VAL 10 HG21 VAL 10 -11.542 5.697 9.665 100 HG22 VAL 10 HG22 VAL 10 -11.031 4.233 10.502 101 HG23 VAL 10 HG23 VAL 10 -10.022 4.899 9.207 102 H LEU 11 H LEU 11 -10.926 2.768 5.585 103 HA LEU 11 HA LEU 11 -13.502 2.129 4.180 104 HB2 LEU 11 HB2 LEU 11 -10.773 2.632 2.933 105 HB3 LEU 11 HB3 LEU 11 -12.239 2.163 2.075 106 HG LEU 11 HG LEU 11 -11.892 4.812 3.521 107 HD11 LEU 11 HD11 LEU 11 -11.651 4.052 0.591 108 HD12 LEU 11 HD12 LEU 11 -11.765 5.717 1.193 109 HD13 LEU 11 HD13 LEU 11 -10.378 4.709 1.641 110 HD21 LEU 11 HD21 LEU 11 -14.266 4.125 3.315 111 HD22 LEU 11 HD22 LEU 11 -13.897 5.475 2.239 112 HD23 LEU 11 HD23 LEU 11 -14.030 3.832 1.577 113 H CYS 12 H CYS 12 -10.204 1.057 5.036 114 HA CYS 12 HA CYS 12 -11.190 -1.665 5.465 115 HB2 CYS 12 HB2 CYS 12 -10.525 -1.672 3.052 116 HB3 CYS 12 HB3 CYS 12 -8.894 -1.159 3.529 117 HG CYS 12 HG CYS 12 -8.882 -3.700 2.898 118 H VAL 13 H VAL 13 -10.064 -2.674 7.036 119 HA VAL 13 HA VAL 13 -7.375 -1.699 7.806 120 HB VAL 13 HB VAL 13 -9.610 -2.150 9.817 121 HG11 VAL 13 HG11 VAL 13 -7.494 -3.064 10.715 122 HG12 VAL 13 HG12 VAL 13 -6.658 -1.545 10.310 123 HG13 VAL 13 HG13 VAL 13 -7.934 -1.569 11.541 124 HG21 VAL 13 HG21 VAL 13 -9.131 0.201 10.476 125 HG22 VAL 13 HG22 VAL 13 -7.942 0.323 9.164 126 HG23 VAL 13 HG23 VAL 13 -9.662 0.103 8.794 127 H LYS 14 H LYS 14 -5.991 -3.308 7.899 128 HA LYS 14 HA LYS 14 -6.954 -6.087 8.410 129 HB2 LYS 14 HB2 LYS 14 -4.735 -5.400 6.475 130 HB3 LYS 14 HB3 LYS 14 -5.239 -7.007 6.937 131 HG2 LYS 14 HG2 LYS 14 -7.043 -5.006 5.502 132 HG3 LYS 14 HG3 LYS 14 -6.088 -6.264 4.717 133 HD2 LYS 14 HD2 LYS 14 -7.316 -8.000 6.002 134 HD3 LYS 14 HD3 LYS 14 -8.343 -6.733 6.711 135 HE2 LYS 14 HE2 LYS 14 -9.162 -6.107 4.498 136 HE3 LYS 14 HE3 LYS 14 -8.071 -7.273 3.734 137 HZ1 LYS 14 HZ1 LYS 14 -10.277 -7.980 5.596 138 HZ2 LYS 14 HZ2 LYS 14 -10.294 -8.203 3.969 139 HZ3 LYS 14 HZ3 LYS 14 -9.240 -9.051 4.903 140 HA PRO 15 HA PRO 15 -4.303 -5.620 11.861 141 HB2 PRO 15 HB2 PRO 15 -4.166 -8.622 12.009 142 HB3 PRO 15 HB3 PRO 15 -4.635 -7.450 13.278 143 HG2 PRO 15 HG2 PRO 15 -6.515 -8.900 11.972 144 HG3 PRO 15 HG3 PRO 15 -6.795 -7.156 12.305 145 HD2 PRO 15 HD2 PRO 15 -5.837 -8.452 9.739 146 HD3 PRO 15 HD3 PRO 15 -7.110 -7.224 10.002 147 H ASP 16 H ASP 16 -3.136 -7.895 9.397 148 HA ASP 16 HA ASP 16 -0.336 -7.261 10.200 149 HB2 ASP 16 HB2 ASP 16 -1.081 -9.434 11.174 150 HB3 ASP 16 HB3 ASP 16 -1.265 -10.045 9.524 151 H VAL 17 H VAL 17 0.748 -6.468 8.663 152 HA VAL 17 HA VAL 17 0.802 -7.561 5.936 153 HB VAL 17 HB VAL 17 -0.926 -5.709 6.033 154 HG11 VAL 17 HG11 VAL 17 1.484 -3.853 6.257 155 HG12 VAL 17 HG12 VAL 17 -0.200 -3.381 5.984 156 HG13 VAL 17 HG13 VAL 17 0.265 -4.119 7.521 157 HG21 VAL 17 HG21 VAL 17 -0.231 -4.679 3.923 158 HG22 VAL 17 HG22 VAL 17 1.415 -5.310 4.143 159 HG23 VAL 17 HG23 VAL 17 0.041 -6.422 3.924 160 H SER 18 H SER 18 2.770 -7.136 4.880 161 HA SER 18 HA SER 18 4.991 -6.318 6.734 162 HB2 SER 18 HB2 SER 18 4.914 -8.548 4.682 163 HB3 SER 18 HB3 SER 18 6.282 -8.136 5.739 164 HG SER 18 HG SER 18 4.948 -9.888 6.524 165 H VAL 19 H VAL 19 6.508 -4.947 6.044 166 HA VAL 19 HA VAL 19 6.375 -3.892 3.272 167 HB VAL 19 HB VAL 19 7.559 -2.743 5.799 168 HG11 VAL 19 HG11 VAL 19 7.683 -1.651 2.944 169 HG12 VAL 19 HG12 VAL 19 7.983 -0.679 4.405 170 HG13 VAL 19 HG13 VAL 19 9.054 -2.018 4.016 171 HG21 VAL 19 HG21 VAL 19 5.024 -2.616 5.362 172 HG22 VAL 19 HG22 VAL 19 5.872 -1.083 5.595 173 HG23 VAL 19 HG23 VAL 19 5.426 -1.601 3.961 174 H TYR 20 H TYR 20 7.832 -3.998 1.855 175 HA TYR 20 HA TYR 20 10.614 -4.757 2.583 176 HB2 TYR 20 HB2 TYR 20 9.539 -5.596 -0.073 177 HB3 TYR 20 HB3 TYR 20 10.833 -6.281 0.908 178 HD1 TYR 20 HD1 TYR 20 7.262 -6.322 0.119 179 HD2 TYR 20 HD2 TYR 20 10.275 -7.813 2.804 180 HE1 TYR 20 HE1 TYR 20 5.689 -8.075 0.895 181 HE2 TYR 20 HE2 TYR 20 8.689 -9.553 3.623 182 HH TYR 20 HH TYR 20 5.362 -9.861 2.357 183 H ARG 21 H ARG 21 11.959 -3.222 2.020 184 HA ARG 21 HA ARG 21 11.343 -1.032 0.179 185 HB2 ARG 21 HB2 ARG 21 14.100 -1.950 1.088 186 HB3 ARG 21 HB3 ARG 21 13.669 -0.382 0.410 187 HG2 ARG 21 HG2 ARG 21 12.834 -1.491 3.121 188 HG3 ARG 21 HG3 ARG 21 14.024 -0.233 2.818 189 HD2 ARG 21 HD2 ARG 21 12.288 1.279 1.984 190 HD3 ARG 21 HD3 ARG 21 11.049 0.019 2.188 191 HE ARG 21 HE ARG 21 12.010 0.071 4.687 192 HH11 ARG 21 HH11 ARG 21 11.691 1.180 6.330 193 HH12 ARG 21 HH12 ARG 21 11.173 2.869 6.278 194 HH21 ARG 21 HH21 ARG 21 11.155 2.916 2.804 195 HH22 ARG 21 HH22 ARG 21 10.873 3.838 4.257 196 H ILE 22 H ILE 22 11.593 -0.918 -1.958 197 HA ILE 22 HA ILE 22 12.531 -3.356 -3.392 198 HB ILE 22 HB ILE 22 11.049 -2.728 -5.211 199 HG12 ILE 22 HG12 ILE 22 10.121 -0.427 -3.441 200 HG13 ILE 22 HG13 ILE 22 11.012 -0.291 -4.962 201 HG21 ILE 22 HG21 ILE 22 9.501 -2.817 -2.598 202 HG22 ILE 22 HG22 ILE 22 8.997 -3.420 -4.191 203 HG23 ILE 22 HG23 ILE 22 10.314 -4.217 -3.328 204 HD11 ILE 22 HD11 ILE 22 8.754 0.151 -5.495 205 HD12 ILE 22 HD12 ILE 22 9.069 -1.493 -6.088 206 HD13 ILE 22 HD13 ILE 22 8.173 -1.243 -4.570 207 HA PRO 23 HA PRO 23 15.493 -0.820 -5.684 208 HB2 PRO 23 HB2 PRO 23 15.845 -2.314 -7.939 209 HB3 PRO 23 HB3 PRO 23 16.480 -2.825 -6.345 210 HG2 PRO 23 HG2 PRO 23 13.888 -3.688 -7.679 211 HG3 PRO 23 HG3 PRO 23 15.153 -4.727 -6.947 212 HD2 PRO 23 HD2 PRO 23 12.909 -3.992 -5.589 213 HD3 PRO 23 HD3 PRO 23 14.483 -4.162 -4.761 214 HA PRO 24 HA PRO 24 12.857 1.455 -8.596 215 HB2 PRO 24 HB2 PRO 24 14.667 2.488 -10.375 216 HB3 PRO 24 HB3 PRO 24 14.485 3.096 -8.701 217 HG2 PRO 24 HG2 PRO 24 16.514 1.090 -9.741 218 HG3 PRO 24 HG3 PRO 24 16.811 2.536 -8.725 219 HD2 PRO 24 HD2 PRO 24 16.580 0.055 -7.643 220 HD3 PRO 24 HD3 PRO 24 15.911 1.485 -6.805 221 H ARG 25 H ARG 25 11.807 1.033 -10.553 222 HA ARG 25 HA ARG 25 12.144 -1.646 -11.517 223 HB2 ARG 25 HB2 ARG 25 9.952 -0.547 -11.234 224 HB3 ARG 25 HB3 ARG 25 10.303 0.523 -12.596 225 HG2 ARG 25 HG2 ARG 25 10.209 -1.264 -14.163 226 HG3 ARG 25 HG3 ARG 25 10.384 -2.497 -12.906 227 HD2 ARG 25 HD2 ARG 25 8.156 -2.426 -13.881 228 HD3 ARG 25 HD3 ARG 25 8.164 -2.177 -12.135 229 HE ARG 25 HE ARG 25 7.813 0.003 -14.193 230 HH11 ARG 25 HH11 ARG 25 6.280 1.594 -13.723 231 HH12 ARG 25 HH12 ARG 25 5.398 1.490 -12.206 232 HH21 ARG 25 HH21 ARG 25 7.030 -1.199 -10.982 233 HH22 ARG 25 HH22 ARG 25 5.910 0.107 -10.684 234 H ALA 26 H ALA 26 12.511 -2.462 -13.435 235 HA ALA 26 HA ALA 26 14.299 -1.357 -15.421 236 HB1 ALA 26 HB1 ALA 26 12.463 -3.789 -15.340 237 HB2 ALA 26 HB2 ALA 26 13.880 -3.591 -16.412 238 HB3 ALA 26 HB3 ALA 26 14.108 -3.754 -14.666 239 H SER 27 H SER 27 12.482 -2.767 -17.477 240 HA SER 27 HA SER 27 10.337 -0.770 -17.996 241 HB2 SER 27 HB2 SER 27 11.069 -0.453 -20.309 242 HB3 SER 27 HB3 SER 27 12.324 0.074 -19.175 243 HG SER 27 HG SER 27 13.337 -1.153 -20.717 244 H ASN 28 H ASN 28 11.885 -3.824 -18.893 245 HA ASN 28 HA ASN 28 9.256 -4.999 -19.697 246 HB2 ASN 28 HB2 ASN 28 12.034 -5.336 -20.915 247 HB3 ASN 28 HB3 ASN 28 10.663 -6.373 -21.296 248 HD21 ASN 28 HD21 ASN 28 10.728 -2.606 -22.875 249 HD22 ASN 28 HD22 ASN 28 11.783 -2.960 -21.512 250 H ARG 29 H ARG 29 10.052 -5.047 -17.039 251 HA ARG 29 HA ARG 29 10.409 -7.982 -16.599 252 HB2 ARG 29 HB2 ARG 29 11.834 -5.820 -14.978 253 HB3 ARG 29 HB3 ARG 29 11.769 -7.513 -14.544 254 HG2 ARG 29 HG2 ARG 29 13.066 -6.451 -17.095 255 HG3 ARG 29 HG3 ARG 29 13.916 -6.889 -15.604 256 HD2 ARG 29 HD2 ARG 29 13.017 -9.173 -15.736 257 HD3 ARG 29 HD3 ARG 29 12.169 -8.789 -17.223 258 HE ARG 29 HE ARG 29 15.080 -9.196 -16.882 259 HH11 ARG 29 HH11 ARG 29 16.325 -9.518 -18.679 260 HH12 ARG 29 HH12 ARG 29 15.675 -9.211 -20.262 261 HH21 ARG 29 HH21 ARG 29 12.572 -8.223 -19.167 262 HH22 ARG 29 HH22 ARG 29 13.617 -8.521 -20.533 263 H GLY 30 H GLY 30 9.680 -5.037 -14.655 264 HA2 GLY 30 HA2 GLY 30 7.724 -4.610 -13.468 265 HA3 GLY 30 HA3 GLY 30 7.070 -6.173 -13.976 266 H TYR 31 H TYR 31 7.079 -4.970 -11.299 267 HA TYR 31 HA TYR 31 8.855 -6.471 -9.585 268 HB2 TYR 31 HB2 TYR 31 6.099 -5.366 -8.954 269 HB3 TYR 31 HB3 TYR 31 7.388 -5.747 -7.823 270 HD1 TYR 31 HD1 TYR 31 5.699 -3.154 -8.249 271 HD2 TYR 31 HD2 TYR 31 9.669 -4.316 -9.527 272 HE1 TYR 31 HE1 TYR 31 6.400 -0.797 -8.201 273 HE2 TYR 31 HE2 TYR 31 10.397 -1.951 -9.357 274 HH TYR 31 HH TYR 31 8.138 0.695 -8.490 275 H ARG 32 H ARG 32 8.577 -8.530 -8.822 276 HA ARG 32 HA ARG 32 6.095 -10.036 -9.605 277 HB2 ARG 32 HB2 ARG 32 7.432 -12.019 -10.111 278 HB3 ARG 32 HB3 ARG 32 7.645 -10.699 -11.223 279 HG2 ARG 32 HG2 ARG 32 9.613 -11.201 -8.963 280 HG3 ARG 32 HG3 ARG 32 9.676 -12.128 -10.456 281 HD2 ARG 32 HD2 ARG 32 9.921 -9.120 -10.215 282 HD3 ARG 32 HD3 ARG 32 11.250 -10.236 -10.526 283 HE ARG 32 HE ARG 32 9.450 -9.054 -12.408 284 HH11 ARG 32 HH11 ARG 32 9.287 -9.633 -14.521 285 HH12 ARG 32 HH12 ARG 32 10.078 -11.079 -15.098 286 HH21 ARG 32 HH21 ARG 32 11.290 -12.019 -12.029 287 HH22 ARG 32 HH22 ARG 32 11.191 -12.397 -13.725 288 H ALA 33 H ALA 33 6.880 -8.857 -7.049 289 HA ALA 33 HA ALA 33 6.938 -9.210 -4.837 290 HB1 ALA 33 HB1 ALA 33 5.469 -10.895 -3.966 291 HB2 ALA 33 HB2 ALA 33 4.771 -10.238 -5.473 292 HB3 ALA 33 HB3 ALA 33 5.537 -11.825 -5.481 293 H SER 34 H SER 34 8.007 -12.258 -6.418 294 HA SER 34 HA SER 34 9.617 -13.234 -4.297 295 HB2 SER 34 HB2 SER 34 10.481 -14.764 -5.997 296 HB3 SER 34 HB3 SER 34 8.717 -14.587 -6.118 297 HG SER 34 HG SER 34 9.758 -14.471 -8.169 298 H ASP 35 H ASP 35 10.293 -10.700 -6.533 299 HA ASP 35 HA ASP 35 13.196 -10.726 -6.326 300 HB2 ASP 35 HB2 ASP 35 11.908 -9.710 -8.194 301 HB3 ASP 35 HB3 ASP 35 11.234 -8.522 -7.080 302 H TRP 36 H TRP 36 10.655 -9.754 -4.143 303 HA TRP 36 HA TRP 36 12.247 -7.721 -2.749 304 HB2 TRP 36 HB2 TRP 36 9.488 -8.765 -2.092 305 HB3 TRP 36 HB3 TRP 36 10.227 -7.270 -1.568 306 HD1 TRP 36 HD1 TRP 36 11.015 -6.828 -4.970 307 HE1 TRP 36 HE1 TRP 36 9.146 -5.675 -6.327 308 HE3 TRP 36 HE3 TRP 36 7.066 -7.609 -1.797 309 HZ2 TRP 36 HZ2 TRP 36 6.432 -4.932 -5.951 310 HZ3 TRP 36 HZ3 TRP 36 4.842 -6.580 -2.299 311 HH2 TRP 36 HH2 TRP 36 4.529 -5.246 -4.344 312 H LYS 37 H LYS 37 12.003 -7.829 -0.308 313 HA LYS 37 HA LYS 37 13.472 -10.173 0.623 314 HB2 LYS 37 HB2 LYS 37 12.665 -7.596 2.022 315 HB3 LYS 37 HB3 LYS 37 13.643 -8.871 2.741 316 HG2 LYS 37 HG2 LYS 37 15.243 -8.611 0.760 317 HG3 LYS 37 HG3 LYS 37 14.399 -7.081 0.433 318 HD2 LYS 37 HD2 LYS 37 15.975 -7.918 2.889 319 HD3 LYS 37 HD3 LYS 37 16.346 -6.604 1.764 320 HE2 LYS 37 HE2 LYS 37 14.324 -5.379 2.543 321 HE3 LYS 37 HE3 LYS 37 13.942 -6.716 3.642 322 HZ1 LYS 37 HZ1 LYS 37 16.411 -5.065 3.803 323 HZ2 LYS 37 HZ2 LYS 37 15.125 -4.925 4.800 324 HZ3 LYS 37 HZ3 LYS 37 16.018 -6.287 4.817 325 H LEU 38 H LEU 38 11.242 -11.327 0.050 326 HA LEU 38 HA LEU 38 9.068 -11.234 1.827 327 HB2 LEU 38 HB2 LEU 38 10.044 -13.611 0.204 328 HB3 LEU 38 HB3 LEU 38 8.427 -13.414 0.878 329 HG LEU 38 HG LEU 38 9.696 -11.704 -1.292 330 HD11 LEU 38 HD11 LEU 38 7.343 -13.663 -1.273 331 HD12 LEU 38 HD12 LEU 38 7.867 -12.714 -2.670 332 HD13 LEU 38 HD13 LEU 38 8.939 -13.958 -2.002 333 HD21 LEU 38 HD21 LEU 38 8.275 -10.226 -0.034 334 HD22 LEU 38 HD22 LEU 38 7.387 -10.694 -1.484 335 HD23 LEU 38 HD23 LEU 38 7.002 -11.463 0.076 336 H ASP 39 H ASP 39 12.103 -12.707 2.557 337 HA ASP 39 HA ASP 39 10.895 -14.187 4.861 338 HB2 ASP 39 HB2 ASP 39 12.191 -15.490 3.155 339 HB3 ASP 39 HB3 ASP 39 13.628 -14.587 3.616 340 H GLN 40 H GLN 40 12.251 -11.251 4.222 341 HA GLN 40 HA GLN 40 12.883 -10.774 7.032 342 HB2 GLN 40 HB2 GLN 40 15.086 -9.692 6.541 343 HB3 GLN 40 HB3 GLN 40 15.054 -11.437 6.599 344 HG2 GLN 40 HG2 GLN 40 15.056 -9.863 4.003 345 HG3 GLN 40 HG3 GLN 40 16.514 -10.357 4.829 346 HE21 GLN 40 HE21 GLN 40 15.257 -12.931 2.218 347 HE22 GLN 40 HE22 GLN 40 15.123 -11.181 2.137 348 HA PRO 41 HA PRO 41 10.696 -7.255 4.845 349 HB2 PRO 41 HB2 PRO 41 8.894 -6.797 6.929 350 HB3 PRO 41 HB3 PRO 41 8.588 -7.841 5.520 351 HG2 PRO 41 HG2 PRO 41 9.588 -8.656 8.261 352 HG3 PRO 41 HG3 PRO 41 8.299 -9.422 7.276 353 HD2 PRO 41 HD2 PRO 41 10.782 -10.454 7.344 354 HD3 PRO 41 HD3 PRO 41 9.888 -10.393 5.798 355 H ASP 42 H ASP 42 10.953 -5.113 5.288 356 HA ASP 42 HA ASP 42 13.061 -4.327 7.173 357 HB2 ASP 42 HB2 ASP 42 12.776 -3.308 4.923 358 HB3 ASP 42 HB3 ASP 42 11.193 -2.693 5.402 359 H TRP 43 H TRP 43 9.552 -4.296 7.051 360 HA TRP 43 HA TRP 43 9.348 -3.842 9.949 361 HB2 TRP 43 HB2 TRP 43 9.429 -1.539 9.197 362 HB3 TRP 43 HB3 TRP 43 8.289 -1.858 7.905 363 HD1 TRP 43 HD1 TRP 43 8.446 -0.979 11.570 364 HE1 TRP 43 HE1 TRP 43 6.099 -0.335 12.388 365 HE3 TRP 43 HE3 TRP 43 5.726 -2.665 7.589 366 HZ2 TRP 43 HZ2 TRP 43 3.416 -0.270 11.291 367 HZ3 TRP 43 HZ3 TRP 43 3.270 -2.195 7.459 368 HH2 TRP 43 HH2 TRP 43 2.114 -1.032 9.308 369 H THR 44 H THR 44 7.259 -4.484 10.790 370 HA THR 44 HA THR 44 5.190 -5.218 8.830 371 HB THR 44 HB THR 44 4.546 -7.231 9.859 372 HG1 THR 44 HG1 THR 44 6.799 -7.026 11.562 373 HG21 THR 44 HG21 THR 44 7.530 -7.483 9.424 374 HG22 THR 44 HG22 THR 44 6.274 -8.742 9.258 375 HG23 THR 44 HG23 THR 44 6.306 -7.370 8.141 376 H GLY 45 H GLY 45 3.089 -5.166 9.577 377 HA2 GLY 45 HA2 GLY 45 2.236 -4.447 12.204 378 HA3 GLY 45 HA3 GLY 45 2.575 -2.965 11.327 379 H ARG 46 H ARG 46 0.478 -2.277 11.280 380 HA ARG 46 HA ARG 46 -1.690 -3.985 10.172 381 HB2 ARG 46 HB2 ARG 46 -1.963 -1.230 11.407 382 HB3 ARG 46 HB3 ARG 46 -3.218 -2.445 11.149 383 HG2 ARG 46 HG2 ARG 46 -1.980 -3.909 12.841 384 HG3 ARG 46 HG3 ARG 46 -0.957 -2.518 13.195 385 HD2 ARG 46 HD2 ARG 46 -3.983 -2.689 13.521 386 HD3 ARG 46 HD3 ARG 46 -2.786 -2.718 14.812 387 HE ARG 46 HE ARG 46 -3.049 -0.331 13.009 388 HH11 ARG 46 HH11 ARG 46 -3.457 1.649 13.903 389 HH12 ARG 46 HH12 ARG 46 -3.599 1.789 15.635 390 HH21 ARG 46 HH21 ARG 46 -3.240 -1.551 16.290 391 HH22 ARG 46 HH22 ARG 46 -3.527 0.033 16.947 392 H LEU 47 H LEU 47 -2.978 -3.358 8.538 393 HA LEU 47 HA LEU 47 -2.153 -1.117 6.740 394 HB2 LEU 47 HB2 LEU 47 -2.625 -3.390 5.743 395 HB3 LEU 47 HB3 LEU 47 -4.226 -3.317 6.473 396 HG LEU 47 HG LEU 47 -4.652 -1.198 5.069 397 HD11 LEU 47 HD11 LEU 47 -2.226 -2.276 3.567 398 HD12 LEU 47 HD12 LEU 47 -3.315 -0.981 3.023 399 HD13 LEU 47 HD13 LEU 47 -2.292 -0.730 4.442 400 HD21 LEU 47 HD21 LEU 47 -5.185 -2.572 3.075 401 HD22 LEU 47 HD22 LEU 47 -4.226 -3.899 3.775 402 HD23 LEU 47 HD23 LEU 47 -5.693 -3.315 4.588 403 H ARG 48 H ARG 48 -3.281 0.770 6.853 404 HA ARG 48 HA ARG 48 -6.201 0.640 7.472 405 HB2 ARG 48 HB2 ARG 48 -4.980 1.768 9.368 406 HB3 ARG 48 HB3 ARG 48 -4.335 2.939 8.217 407 HG2 ARG 48 HG2 ARG 48 -6.782 3.476 7.598 408 HG3 ARG 48 HG3 ARG 48 -7.251 2.521 9.002 409 HD2 ARG 48 HD2 ARG 48 -5.543 5.045 8.983 410 HD3 ARG 48 HD3 ARG 48 -7.240 4.897 9.467 411 HE ARG 48 HE ARG 48 -5.201 3.332 10.976 412 HH11 ARG 48 HH11 ARG 48 -5.091 3.575 13.058 413 HH12 ARG 48 HH12 ARG 48 -6.137 4.673 13.937 414 HH21 ARG 48 HH21 ARG 48 -7.226 6.246 11.083 415 HH22 ARG 48 HH22 ARG 48 -7.349 6.130 12.813 416 H ILE 49 H ILE 49 -7.258 1.028 5.674 417 HA ILE 49 HA ILE 49 -6.184 3.000 3.705 418 HB ILE 49 HB ILE 49 -8.400 1.005 3.194 419 HG12 ILE 49 HG12 ILE 49 -5.456 0.952 2.362 420 HG13 ILE 49 HG13 ILE 49 -6.257 -0.176 3.461 421 HG21 ILE 49 HG21 ILE 49 -8.136 1.796 0.848 422 HG22 ILE 49 HG22 ILE 49 -8.554 3.124 1.918 423 HG23 ILE 49 HG23 ILE 49 -6.865 2.928 1.374 424 HD11 ILE 49 HD11 ILE 49 -6.076 -1.282 1.402 425 HD12 ILE 49 HD12 ILE 49 -7.777 -0.855 1.575 426 HD13 ILE 49 HD13 ILE 49 -6.718 0.078 0.478 427 H THR 50 H THR 50 -7.128 4.809 3.525 428 HA THR 50 HA THR 50 -9.648 5.502 4.911 429 HB THR 50 HB THR 50 -7.928 7.534 5.683 430 HG1 THR 50 HG1 THR 50 -6.151 5.984 5.026 431 HG21 THR 50 HG21 THR 50 -8.637 4.969 7.152 432 HG22 THR 50 HG22 THR 50 -7.952 6.411 7.914 433 HG23 THR 50 HG23 THR 50 -9.545 6.509 7.158 434 H SER 51 H SER 51 -10.304 7.809 4.427 435 HA SER 51 HA SER 51 -8.850 9.197 2.294 436 HB2 SER 51 HB2 SER 51 -10.316 7.511 1.105 437 HB3 SER 51 HB3 SER 51 -11.728 8.289 1.845 438 HG SER 51 HG SER 51 -11.211 9.044 -0.285 439 H LYS 52 H LYS 52 -9.560 11.306 1.892 440 HA LYS 52 HA LYS 52 -12.074 12.064 3.057 441 HB2 LYS 52 HB2 LYS 52 -10.318 12.655 4.783 442 HB3 LYS 52 HB3 LYS 52 -9.741 13.889 3.667 443 HG2 LYS 52 HG2 LYS 52 -11.260 14.736 5.394 444 HG3 LYS 52 HG3 LYS 52 -11.848 15.047 3.759 445 HD2 LYS 52 HD2 LYS 52 -13.671 14.492 5.274 446 HD3 LYS 52 HD3 LYS 52 -13.541 13.242 4.042 447 HE2 LYS 52 HE2 LYS 52 -12.321 11.782 5.641 448 HE3 LYS 52 HE3 LYS 52 -12.383 13.068 6.856 449 HZ1 LYS 52 HZ1 LYS 52 -14.181 11.577 7.300 450 HZ2 LYS 52 HZ2 LYS 52 -14.888 12.902 6.649 451 HZ3 LYS 52 HZ3 LYS 52 -14.667 11.526 5.768 452 H GLY 53 H GLY 53 -13.194 12.837 1.457 453 HA2 GLY 53 HA2 GLY 53 -13.933 14.068 -0.333 454 HA3 GLY 53 HA3 GLY 53 -12.443 15.014 -0.282 455 H LYS 54 H LYS 54 -11.237 14.794 -1.956 456 HA LYS 54 HA LYS 54 -11.316 12.394 -3.730 457 HB2 LYS 54 HB2 LYS 54 -10.562 15.297 -4.074 458 HB3 LYS 54 HB3 LYS 54 -10.253 14.073 -5.335 459 HG2 LYS 54 HG2 LYS 54 -12.692 13.549 -5.388 460 HG3 LYS 54 HG3 LYS 54 -12.978 14.840 -4.208 461 HD2 LYS 54 HD2 LYS 54 -12.001 16.493 -5.804 462 HD3 LYS 54 HD3 LYS 54 -11.795 15.189 -6.998 463 HE2 LYS 54 HE2 LYS 54 -14.243 14.752 -6.926 464 HE3 LYS 54 HE3 LYS 54 -14.439 16.043 -5.735 465 HZ1 LYS 54 HZ1 LYS 54 -13.630 17.624 -7.409 466 HZ2 LYS 54 HZ2 LYS 54 -13.443 16.433 -8.513 467 HZ3 LYS 54 HZ3 LYS 54 -14.934 16.832 -7.985 468 H THR 55 H THR 55 -9.631 12.912 -1.131 469 HA THR 55 HA THR 55 -7.080 11.911 -2.336 470 HB THR 55 HB THR 55 -7.286 13.473 0.245 471 HG1 THR 55 HG1 THR 55 -7.757 14.894 -1.398 472 HG21 THR 55 HG21 THR 55 -4.976 12.699 -1.608 473 HG22 THR 55 HG22 THR 55 -4.824 13.691 -0.136 474 HG23 THR 55 HG23 THR 55 -5.307 11.989 -0.015 475 H ALA 56 H ALA 56 -7.009 9.802 -1.985 476 HA ALA 56 HA ALA 56 -8.033 8.641 0.542 477 HB1 ALA 56 HB1 ALA 56 -6.849 7.215 -1.834 478 HB2 ALA 56 HB2 ALA 56 -7.584 6.478 -0.406 479 HB3 ALA 56 HB3 ALA 56 -8.587 7.441 -1.507 480 H TYR 57 H TYR 57 -6.646 7.282 1.784 481 HA TYR 57 HA TYR 57 -3.755 7.991 1.842 482 HB2 TYR 57 HB2 TYR 57 -5.644 8.073 4.232 483 HB3 TYR 57 HB3 TYR 57 -3.934 8.458 4.223 484 HD1 TYR 57 HD1 TYR 57 -3.217 10.479 2.673 485 HD2 TYR 57 HD2 TYR 57 -7.246 9.825 4.104 486 HE1 TYR 57 HE1 TYR 57 -3.728 12.899 2.380 487 HE2 TYR 57 HE2 TYR 57 -7.754 12.219 3.756 488 HH TYR 57 HH TYR 57 -5.303 14.556 2.595 489 H ILE 58 H ILE 58 -2.793 6.001 1.625 490 HA ILE 58 HA ILE 58 -3.836 3.698 3.247 491 HB ILE 58 HB ILE 58 -1.566 3.725 1.240 492 HG12 ILE 58 HG12 ILE 58 -3.169 1.990 0.099 493 HG13 ILE 58 HG13 ILE 58 -4.446 2.843 0.962 494 HG21 ILE 58 HG21 ILE 58 -2.857 1.434 2.782 495 HG22 ILE 58 HG22 ILE 58 -1.553 1.288 1.578 496 HG23 ILE 58 HG23 ILE 58 -1.241 2.102 3.097 497 HD11 ILE 58 HD11 ILE 58 -3.904 4.904 -0.250 498 HD12 ILE 58 HD12 ILE 58 -2.408 4.176 -0.892 499 HD13 ILE 58 HD13 ILE 58 -3.981 3.583 -1.425 500 H LYS 59 H LYS 59 -3.337 3.966 5.284 501 HA LYS 59 HA LYS 59 -0.630 4.984 6.058 502 HB2 LYS 59 HB2 LYS 59 -3.207 4.916 7.672 503 HB3 LYS 59 HB3 LYS 59 -1.627 5.474 8.242 504 HG2 LYS 59 HG2 LYS 59 -1.657 7.153 6.302 505 HG3 LYS 59 HG3 LYS 59 -3.348 6.702 6.042 506 HD2 LYS 59 HD2 LYS 59 -3.898 7.406 8.351 507 HD3 LYS 59 HD3 LYS 59 -2.192 7.834 8.629 508 HE2 LYS 59 HE2 LYS 59 -2.303 9.487 6.776 509 HE3 LYS 59 HE3 LYS 59 -4.004 9.066 6.506 510 HZ1 LYS 59 HZ1 LYS 59 -2.922 10.240 9.011 511 HZ2 LYS 59 HZ2 LYS 59 -3.819 11.036 7.897 512 HZ3 LYS 59 HZ3 LYS 59 -4.488 9.817 8.766 513 H LEU 60 H LEU 60 0.720 3.796 7.111 514 HA LEU 60 HA LEU 60 0.007 0.994 7.894 515 HB2 LEU 60 HB2 LEU 60 2.412 2.282 6.652 516 HB3 LEU 60 HB3 LEU 60 2.705 1.038 7.857 517 HG LEU 60 HG LEU 60 1.469 -0.617 6.644 518 HD11 LEU 60 HD11 LEU 60 0.628 -0.186 4.321 519 HD12 LEU 60 HD12 LEU 60 -0.314 0.655 5.551 520 HD13 LEU 60 HD13 LEU 60 0.876 1.556 4.581 521 HD21 LEU 60 HD21 LEU 60 2.943 -0.820 4.717 522 HD22 LEU 60 HD22 LEU 60 3.305 0.921 4.756 523 HD23 LEU 60 HD23 LEU 60 3.843 -0.138 6.076 524 H GLU 61 H GLU 61 0.102 0.426 9.964 525 HA GLU 61 HA GLU 61 1.226 2.366 11.960 526 HB2 GLU 61 HB2 GLU 61 -1.519 1.063 11.997 527 HB3 GLU 61 HB3 GLU 61 -0.799 1.987 13.327 528 HG2 GLU 61 HG2 GLU 61 -0.633 3.965 11.778 529 HG3 GLU 61 HG3 GLU 61 -1.542 3.046 10.567 530 H ASP 62 H ASP 62 1.979 1.503 13.935 531 HA ASP 62 HA ASP 62 2.953 -1.202 13.791 532 HB2 ASP 62 HB2 ASP 62 3.997 0.812 14.945 533 HB3 ASP 62 HB3 ASP 62 2.767 0.596 16.212 534 H LYS 63 H LYS 63 2.179 -3.039 14.584 535 HA LYS 63 HA LYS 63 -0.573 -3.130 15.486 536 HB2 LYS 63 HB2 LYS 63 -0.236 -5.642 15.298 537 HB3 LYS 63 HB3 LYS 63 0.136 -4.740 13.828 538 HG2 LYS 63 HG2 LYS 63 2.539 -4.801 14.345 539 HG3 LYS 63 HG3 LYS 63 2.227 -5.674 15.847 540 HD2 LYS 63 HD2 LYS 63 1.655 -7.646 14.736 541 HD3 LYS 63 HD3 LYS 63 1.252 -6.806 13.213 542 HE2 LYS 63 HE2 LYS 63 3.634 -6.183 12.923 543 HE3 LYS 63 HE3 LYS 63 4.058 -7.065 14.389 544 HZ1 LYS 63 HZ1 LYS 63 3.431 -9.113 13.327 545 HZ2 LYS 63 HZ2 LYS 63 2.772 -8.367 12.030 546 HZ3 LYS 63 HZ3 LYS 63 4.398 -8.299 12.274 547 H VAL 64 H VAL 64 2.085 -2.615 17.284 548 HA VAL 64 HA VAL 64 0.772 -3.736 19.730 549 HB VAL 64 HB VAL 64 3.691 -3.487 18.961 550 HG11 VAL 64 HG11 VAL 64 3.570 -2.766 21.306 551 HG12 VAL 64 HG12 VAL 64 2.549 -4.169 21.711 552 HG13 VAL 64 HG13 VAL 64 4.245 -4.393 21.228 553 HG21 VAL 64 HG21 VAL 64 2.592 -5.539 18.191 554 HG22 VAL 64 HG22 VAL 64 3.746 -5.910 19.470 555 HG23 VAL 64 HG23 VAL 64 2.007 -5.871 19.836 556 H SER 65 H SER 65 2.732 -1.017 18.422 557 HA SER 65 HA SER 65 2.116 0.572 20.845 558 HB2 SER 65 HB2 SER 65 3.797 1.194 18.397 559 HB3 SER 65 HB3 SER 65 3.615 2.254 19.806 560 HG SER 65 HG SER 65 5.488 0.949 19.952 561 H GLY 66 H GLY 66 0.889 0.279 17.601 562 HA2 GLY 66 HA2 GLY 66 -0.957 1.260 16.611 563 HA3 GLY 66 HA3 GLY 66 -1.231 2.229 18.063 564 H GLU 67 H GLU 67 1.959 2.505 16.852 565 HA GLU 67 HA GLU 67 1.489 5.313 16.220 566 HB2 GLU 67 HB2 GLU 67 3.807 5.607 16.524 567 HB3 GLU 67 HB3 GLU 67 3.215 4.531 17.800 568 HG2 GLU 67 HG2 GLU 67 4.137 2.579 16.615 569 HG3 GLU 67 HG3 GLU 67 4.718 3.617 15.310 570 H LEU 68 H LEU 68 2.191 6.401 14.323 571 HA LEU 68 HA LEU 68 1.673 4.921 11.898 572 HB2 LEU 68 HB2 LEU 68 0.978 7.294 12.345 573 HB3 LEU 68 HB3 LEU 68 2.673 7.767 12.272 574 HG LEU 68 HG LEU 68 2.715 6.870 9.870 575 HD11 LEU 68 HD11 LEU 68 0.545 6.694 8.715 576 HD12 LEU 68 HD12 LEU 68 0.665 5.460 9.969 577 HD13 LEU 68 HD13 LEU 68 -0.315 6.908 10.257 578 HD21 LEU 68 HD21 LEU 68 1.575 8.864 8.958 579 HD22 LEU 68 HD22 LEU 68 0.792 9.140 10.529 580 HD23 LEU 68 HD23 LEU 68 2.558 9.270 10.374 581 H PHE 69 H PHE 69 3.047 3.826 10.667 582 HA PHE 69 HA PHE 69 5.993 4.151 10.880 583 HB2 PHE 69 HB2 PHE 69 5.253 1.897 10.877 584 HB3 PHE 69 HB3 PHE 69 4.158 2.156 9.528 585 HD1 PHE 69 HD1 PHE 69 7.818 2.171 10.390 586 HD2 PHE 69 HD2 PHE 69 4.846 1.704 7.298 587 HE1 PHE 69 HE1 PHE 69 9.583 1.470 8.788 588 HE2 PHE 69 HE2 PHE 69 6.615 1.076 5.693 589 HZ PHE 69 HZ PHE 69 8.978 0.919 6.433 590 H ALA 70 H ALA 70 3.470 4.221 8.316 591 HA ALA 70 HA ALA 70 4.839 6.389 6.898 592 HB1 ALA 70 HB1 ALA 70 4.496 3.645 5.595 593 HB2 ALA 70 HB2 ALA 70 5.158 5.112 4.842 594 HB3 ALA 70 HB3 ALA 70 6.044 4.325 6.147 595 H GLN 71 H GLN 71 3.591 7.116 4.995 596 HA GLN 71 HA GLN 71 0.762 6.282 4.846 597 HB2 GLN 71 HB2 GLN 71 0.070 8.712 4.981 598 HB3 GLN 71 HB3 GLN 71 0.524 7.947 6.506 599 HG2 GLN 71 HG2 GLN 71 2.524 9.148 6.710 600 HG3 GLN 71 HG3 GLN 71 2.641 9.452 4.990 601 HE21 GLN 71 HE21 GLN 71 1.611 12.728 5.596 602 HE22 GLN 71 HE22 GLN 71 2.859 11.623 4.987 603 H ALA 72 H ALA 72 0.047 6.263 2.815 604 HA ALA 72 HA ALA 72 1.532 7.747 0.680 605 HB1 ALA 72 HB1 ALA 72 1.912 5.417 0.447 606 HB2 ALA 72 HB2 ALA 72 0.191 5.032 0.659 607 HB3 ALA 72 HB3 ALA 72 0.746 5.888 -0.795 608 HA PRO 73 HA PRO 73 -2.628 9.566 0.248 609 HB2 PRO 73 HB2 PRO 73 -1.935 11.969 -0.787 610 HB3 PRO 73 HB3 PRO 73 -1.755 11.593 0.956 611 HG2 PRO 73 HG2 PRO 73 0.361 11.481 -1.204 612 HG3 PRO 73 HG3 PRO 73 0.482 12.231 0.418 613 HD2 PRO 73 HD2 PRO 73 1.417 9.706 -0.156 614 HD3 PRO 73 HD3 PRO 73 0.784 10.149 1.459 615 H VAL 74 H VAL 74 -3.930 9.582 -1.539 616 HA VAL 74 HA VAL 74 -2.768 9.108 -4.262 617 HB VAL 74 HB VAL 74 -5.119 7.587 -3.086 618 HG11 VAL 74 HG11 VAL 74 -5.126 7.682 -5.514 619 HG12 VAL 74 HG12 VAL 74 -3.436 7.119 -5.577 620 HG13 VAL 74 HG13 VAL 74 -4.726 6.049 -4.991 621 HG21 VAL 74 HG21 VAL 74 -3.206 6.844 -1.795 622 HG22 VAL 74 HG22 VAL 74 -3.678 5.597 -2.945 623 HG23 VAL 74 HG23 VAL 74 -2.254 6.605 -3.274 624 H GLU 75 H GLU 75 -3.766 10.347 -5.828 625 HA GLU 75 HA GLU 75 -6.148 11.958 -5.022 626 HB2 GLU 75 HB2 GLU 75 -4.243 12.178 -7.378 627 HB3 GLU 75 HB3 GLU 75 -5.625 13.243 -7.086 628 HG2 GLU 75 HG2 GLU 75 -4.656 13.889 -4.880 629 HG3 GLU 75 HG3 GLU 75 -3.237 12.896 -5.220 630 H GLN 76 H GLN 76 -5.389 9.285 -7.070 631 HA GLN 76 HA GLN 76 -8.131 8.663 -7.528 632 HB2 GLN 76 HB2 GLN 76 -8.302 8.748 -9.887 633 HB3 GLN 76 HB3 GLN 76 -7.839 10.350 -9.369 634 HG2 GLN 76 HG2 GLN 76 -6.032 8.280 -10.688 635 HG3 GLN 76 HG3 GLN 76 -6.724 9.702 -11.440 636 HE21 GLN 76 HE21 GLN 76 -3.320 10.090 -9.219 637 HE22 GLN 76 HE22 GLN 76 -4.264 8.588 -9.137 638 H TYR 77 H TYR 77 -8.382 6.483 -8.253 639 HA TYR 77 HA TYR 77 -5.888 4.876 -8.444 640 HB2 TYR 77 HB2 TYR 77 -7.019 4.626 -6.283 641 HB3 TYR 77 HB3 TYR 77 -8.491 4.118 -7.124 642 HD1 TYR 77 HD1 TYR 77 -8.861 1.826 -7.471 643 HD2 TYR 77 HD2 TYR 77 -4.844 3.258 -6.833 644 HE1 TYR 77 HE1 TYR 77 -8.032 -0.519 -7.463 645 HE2 TYR 77 HE2 TYR 77 -4.010 0.915 -6.919 646 HH TYR 77 HH TYR 77 -6.187 -1.882 -7.394 647 HA PRO 78 HA PRO 78 -4.985 3.129 -9.589 648 HB2 PRO 78 HB2 PRO 78 -4.646 3.219 -12.572 649 HB3 PRO 78 HB3 PRO 78 -4.021 2.025 -11.393 650 HG2 PRO 78 HG2 PRO 78 -6.164 1.413 -12.927 651 HG3 PRO 78 HG3 PRO 78 -6.183 1.006 -11.177 652 HD2 PRO 78 HD2 PRO 78 -7.403 3.432 -12.546 653 HD3 PRO 78 HD3 PRO 78 -8.160 2.305 -11.381 654 H GLY 79 H GLY 79 -3.067 4.315 -9.517 655 HA2 GLY 79 HA2 GLY 79 -2.653 6.801 -11.036 656 HA3 GLY 79 HA3 GLY 79 -2.916 6.988 -9.297 657 H ILE 80 H ILE 80 -0.670 7.942 -9.492 658 HA ILE 80 HA ILE 80 1.553 6.144 -10.027 659 HB ILE 80 HB ILE 80 1.783 8.494 -10.481 660 HG12 ILE 80 HG12 ILE 80 3.643 7.721 -8.189 661 HG13 ILE 80 HG13 ILE 80 3.755 7.063 -9.824 662 HG21 ILE 80 HG21 ILE 80 1.643 9.051 -7.478 663 HG22 ILE 80 HG22 ILE 80 1.871 10.229 -8.780 664 HG23 ILE 80 HG23 ILE 80 0.331 9.398 -8.626 665 HD11 ILE 80 HD11 ILE 80 5.396 8.816 -9.466 666 HD12 ILE 80 HD12 ILE 80 4.223 9.323 -10.705 667 HD13 ILE 80 HD13 ILE 80 4.130 9.981 -9.053 668 H ALA 81 H ALA 81 -0.115 7.107 -7.055 669 HA ALA 81 HA ALA 81 2.072 6.222 -5.344 670 HB1 ALA 81 HB1 ALA 81 -0.692 7.323 -4.742 671 HB2 ALA 81 HB2 ALA 81 0.605 7.081 -3.550 672 HB3 ALA 81 HB3 ALA 81 0.815 8.251 -4.863 673 H VAL 82 H VAL 82 0.164 4.255 -6.967 674 HA VAL 82 HA VAL 82 0.254 2.125 -4.960 675 HB VAL 82 HB VAL 82 -2.370 2.746 -6.324 676 HG11 VAL 82 HG11 VAL 82 -3.235 1.044 -4.656 677 HG12 VAL 82 HG12 VAL 82 -2.043 0.353 -5.759 678 HG13 VAL 82 HG13 VAL 82 -1.569 0.788 -4.110 679 HG21 VAL 82 HG21 VAL 82 -2.138 4.493 -4.681 680 HG22 VAL 82 HG22 VAL 82 -3.338 3.328 -4.145 681 HG23 VAL 82 HG23 VAL 82 -1.719 3.309 -3.419 682 H GLU 83 H GLU 83 0.776 0.249 -5.927 683 HA GLU 83 HA GLU 83 0.272 -0.279 -8.809 684 HB2 GLU 83 HB2 GLU 83 2.880 0.456 -7.570 685 HB3 GLU 83 HB3 GLU 83 2.935 -1.050 -8.493 686 HG2 GLU 83 HG2 GLU 83 2.030 0.023 -10.453 687 HG3 GLU 83 HG3 GLU 83 1.816 1.556 -9.582 688 H THR 84 H THR 84 0.795 -2.500 -9.450 689 HA THR 84 HA THR 84 0.486 -4.569 -7.281 690 HB THR 84 HB THR 84 -0.399 -5.953 -9.201 691 HG1 THR 84 HG1 THR 84 -1.113 -4.835 -11.014 692 HG21 THR 84 HG21 THR 84 -1.958 -3.432 -8.499 693 HG22 THR 84 HG22 THR 84 -2.636 -4.905 -9.232 694 HG23 THR 84 HG23 THR 84 -1.938 -4.974 -7.611 695 H VAL 85 H VAL 85 1.487 -6.663 -7.711 696 HA VAL 85 HA VAL 85 4.037 -6.596 -9.197 697 HB VAL 85 HB VAL 85 4.424 -8.769 -8.203 698 HG11 VAL 85 HG11 VAL 85 4.999 -6.687 -6.974 699 HG12 VAL 85 HG12 VAL 85 3.461 -6.796 -6.094 700 HG13 VAL 85 HG13 VAL 85 4.686 -8.052 -5.894 701 HG21 VAL 85 HG21 VAL 85 2.064 -9.595 -8.127 702 HG22 VAL 85 HG22 VAL 85 2.920 -9.783 -6.605 703 HG23 VAL 85 HG23 VAL 85 1.737 -8.476 -6.793 704 H THR 86 H THR 86 4.398 -8.700 -10.489 705 HA THR 86 HA THR 86 2.174 -9.122 -12.390 706 HB THR 86 HB THR 86 3.869 -10.117 -13.815 707 HG1 THR 86 HG1 THR 86 5.990 -10.248 -13.114 708 HG21 THR 86 HG21 THR 86 3.718 -7.615 -13.726 709 HG22 THR 86 HG22 THR 86 5.001 -7.609 -12.503 710 HG23 THR 86 HG23 THR 86 5.349 -8.199 -14.138 711 H ASP 87 H ASP 87 4.156 -11.004 -10.128 712 HA ASP 87 HA ASP 87 3.067 -13.482 -11.273 713 HB2 ASP 87 HB2 ASP 87 5.488 -13.023 -11.016 714 HB3 ASP 87 HB3 ASP 87 5.280 -13.139 -9.265 715 H SER 88 H SER 88 2.708 -11.882 -8.111 716 HA SER 88 HA SER 88 1.009 -14.204 -7.265 717 HB2 SER 88 HB2 SER 88 3.196 -14.397 -6.194 718 HB3 SER 88 HB3 SER 88 2.984 -12.795 -5.460 719 HG SER 88 HG SER 88 2.298 -14.788 -4.228 720 H SER 89 H SER 89 -0.917 -13.765 -6.590 721 HA SER 89 HA SER 89 -1.954 -11.147 -6.961 722 HB2 SER 89 HB2 SER 89 -4.144 -12.427 -6.527 723 HB3 SER 89 HB3 SER 89 -3.110 -12.938 -7.861 724 HG SER 89 HG SER 89 -3.609 -14.776 -6.828 725 H ARG 90 H ARG 90 -0.328 -11.401 -4.475 726 HA ARG 90 HA ARG 90 -2.213 -10.212 -2.510 727 HB2 ARG 90 HB2 ARG 90 -1.561 -11.665 -0.714 728 HB3 ARG 90 HB3 ARG 90 -2.291 -12.520 -2.049 729 HG2 ARG 90 HG2 ARG 90 0.331 -12.799 -2.752 730 HG3 ARG 90 HG3 ARG 90 0.495 -12.659 -0.994 731 HD2 ARG 90 HD2 ARG 90 0.317 -14.985 -1.555 732 HD3 ARG 90 HD3 ARG 90 -1.219 -14.522 -0.796 733 HE ARG 90 HE ARG 90 -1.510 -14.132 -3.586 734 HH11 ARG 90 HH11 ARG 90 -2.456 -15.521 -4.984 735 HH12 ARG 90 HH12 ARG 90 -2.496 -17.228 -4.621 736 HH21 ARG 90 HH21 ARG 90 -0.943 -16.934 -1.571 737 HH22 ARG 90 HH22 ARG 90 -1.686 -18.013 -2.719 738 H TYR 91 H TYR 91 -0.083 -9.012 -4.173 739 HA TYR 91 HA TYR 91 1.473 -7.715 -2.015 740 HB2 TYR 91 HB2 TYR 91 2.587 -8.969 -4.541 741 HB3 TYR 91 HB3 TYR 91 3.483 -7.884 -3.512 742 HD1 TYR 91 HD1 TYR 91 2.157 -11.283 -3.903 743 HD2 TYR 91 HD2 TYR 91 4.262 -8.595 -1.277 744 HE1 TYR 91 HE1 TYR 91 2.889 -13.216 -2.519 745 HE2 TYR 91 HE2 TYR 91 4.965 -10.531 0.128 746 HH TYR 91 HH TYR 91 4.057 -13.901 -0.665 747 H PHE 92 H PHE 92 1.942 -5.580 -2.374 748 HA PHE 92 HA PHE 92 1.261 -4.309 -4.975 749 HB2 PHE 92 HB2 PHE 92 0.223 -3.362 -2.275 750 HB3 PHE 92 HB3 PHE 92 -0.007 -2.544 -3.805 751 HD1 PHE 92 HD1 PHE 92 -1.461 -3.589 -5.596 752 HD2 PHE 92 HD2 PHE 92 -1.173 -5.177 -1.613 753 HE1 PHE 92 HE1 PHE 92 -3.529 -4.931 -5.974 754 HE2 PHE 92 HE2 PHE 92 -3.268 -6.432 -1.943 755 HZ PHE 92 HZ PHE 92 -4.447 -6.347 -4.147 756 H VAL 93 H VAL 93 2.057 -2.089 -5.089 757 HA VAL 93 HA VAL 93 4.217 -1.384 -3.146 758 HB VAL 93 HB VAL 93 4.160 -0.913 -6.142 759 HG11 VAL 93 HG11 VAL 93 6.286 0.285 -5.899 760 HG12 VAL 93 HG12 VAL 93 4.987 1.146 -5.083 761 HG13 VAL 93 HG13 VAL 93 6.158 0.203 -4.131 762 HG21 VAL 93 HG21 VAL 93 4.989 -3.096 -5.561 763 HG22 VAL 93 HG22 VAL 93 6.383 -2.096 -5.971 764 HG23 VAL 93 HG23 VAL 93 6.027 -2.432 -4.279 765 H ILE 94 H ILE 94 4.171 0.751 -2.364 766 HA ILE 94 HA ILE 94 2.205 2.563 -3.607 767 HB ILE 94 HB ILE 94 1.393 3.427 -1.528 768 HG12 ILE 94 HG12 ILE 94 3.242 2.580 -0.007 769 HG13 ILE 94 HG13 ILE 94 1.602 2.526 0.603 770 HG21 ILE 94 HG21 ILE 94 0.692 0.504 -1.920 771 HG22 ILE 94 HG22 ILE 94 -0.262 1.700 -1.010 772 HG23 ILE 94 HG23 ILE 94 0.004 1.910 -2.744 773 HD11 ILE 94 HD11 ILE 94 1.493 0.094 0.225 774 HD12 ILE 94 HD12 ILE 94 3.146 0.103 -0.421 775 HD13 ILE 94 HD13 ILE 94 2.846 0.543 1.267 776 H ARG 95 H ARG 95 2.586 4.749 -3.384 777 HA ARG 95 HA ARG 95 5.425 5.434 -2.702 778 HB2 ARG 95 HB2 ARG 95 4.363 6.125 -4.948 779 HB3 ARG 95 HB3 ARG 95 3.495 7.347 -4.015 780 HG2 ARG 95 HG2 ARG 95 5.833 8.025 -3.078 781 HG3 ARG 95 HG3 ARG 95 6.503 6.970 -4.316 782 HD2 ARG 95 HD2 ARG 95 6.554 9.174 -5.206 783 HD3 ARG 95 HD3 ARG 95 5.243 8.328 -6.049 784 HE ARG 95 HE ARG 95 4.299 9.761 -3.698 785 HH11 ARG 95 HH11 ARG 95 3.010 11.537 -3.891 786 HH12 ARG 95 HH12 ARG 95 3.025 12.460 -5.371 787 HH21 ARG 95 HH21 ARG 95 5.325 10.470 -6.961 788 HH22 ARG 95 HH22 ARG 95 4.310 11.882 -7.066 789 H ILE 96 H ILE 96 5.646 5.761 -0.610 790 HA ILE 96 HA ILE 96 3.576 7.180 0.946 791 HB ILE 96 HB ILE 96 4.750 6.607 2.932 792 HG12 ILE 96 HG12 ILE 96 6.646 4.720 2.541 793 HG13 ILE 96 HG13 ILE 96 6.963 5.673 1.106 794 HG21 ILE 96 HG21 ILE 96 4.478 4.152 2.849 795 HG22 ILE 96 HG22 ILE 96 3.141 5.040 2.158 796 HG23 ILE 96 HG23 ILE 96 4.334 4.247 1.090 797 HD11 ILE 96 HD11 ILE 96 8.391 6.330 2.988 798 HD12 ILE 96 HD12 ILE 96 7.318 7.679 2.573 799 HD13 ILE 96 HD13 ILE 96 6.969 6.655 3.993 800 H GLN 97 H GLN 97 3.950 9.092 2.161 801 HA GLN 97 HA GLN 97 6.257 10.793 1.309 802 HB2 GLN 97 HB2 GLN 97 3.301 11.511 1.159 803 HB3 GLN 97 HB3 GLN 97 4.538 12.722 1.448 804 HG2 GLN 97 HG2 GLN 97 4.330 12.966 -0.776 805 HG3 GLN 97 HG3 GLN 97 5.682 11.852 -0.708 806 HE21 GLN 97 HE21 GLN 97 3.582 9.092 -1.883 807 HE22 GLN 97 HE22 GLN 97 5.106 9.483 -1.108 808 H ASP 98 H ASP 98 7.128 12.051 2.840 809 HA ASP 98 HA ASP 98 6.266 11.683 5.624 810 HB2 ASP 98 HB2 ASP 98 8.649 11.569 4.747 811 HB3 ASP 98 HB3 ASP 98 8.563 13.320 4.547 812 H GLY 99 H GLY 99 5.081 13.692 3.364 813 HA2 GLY 99 HA2 GLY 99 3.567 15.435 3.571 814 HA3 GLY 99 HA3 GLY 99 3.918 15.544 5.296 815 H THR 100 H THR 100 6.706 15.703 3.341 816 HA THR 100 HA THR 100 6.828 18.685 3.365 817 HB THR 100 HB THR 100 7.654 17.753 5.495 818 HG1 THR 100 HG1 THR 100 9.578 18.985 3.839 819 HG21 THR 100 HG21 THR 100 9.775 16.579 5.634 820 HG22 THR 100 HG22 THR 100 8.626 15.628 4.685 821 HG23 THR 100 HG23 THR 100 9.916 16.534 3.866 822 H GLY 101 H GLY 101 6.744 16.497 1.184 823 HA2 GLY 101 HA2 GLY 101 7.465 16.661 -1.032 824 HA3 GLY 101 HA3 GLY 101 8.791 17.718 -0.556 825 H ARG 102 H ARG 102 8.909 15.082 1.487 826 HA ARG 102 HA ARG 102 10.921 13.542 -0.034 827 HB2 ARG 102 HB2 ARG 102 9.702 13.117 2.723 828 HB3 ARG 102 HB3 ARG 102 10.992 12.142 2.023 829 HG2 ARG 102 HG2 ARG 102 12.504 14.048 2.019 830 HG3 ARG 102 HG3 ARG 102 11.203 15.117 2.574 831 HD2 ARG 102 HD2 ARG 102 12.514 14.610 4.503 832 HD3 ARG 102 HD3 ARG 102 10.981 13.740 4.644 833 HE ARG 102 HE ARG 102 13.294 12.282 3.487 834 HH11 ARG 102 HH11 ARG 102 14.116 10.527 4.533 835 HH12 ARG 102 HH12 ARG 102 13.556 10.113 6.125 836 HH21 ARG 102 HH21 ARG 102 11.276 12.667 6.387 837 HH22 ARG 102 HH22 ARG 102 12.051 11.307 7.149 838 H SER 103 H SER 103 10.543 11.578 -0.774 839 HA SER 103 HA SER 103 8.164 10.121 -0.025 840 HB2 SER 103 HB2 SER 103 7.268 9.665 -2.240 841 HB3 SER 103 HB3 SER 103 7.339 11.419 -1.997 842 HG SER 103 HG SER 103 9.219 11.485 -3.255 843 H ALA 104 H ALA 104 8.067 7.894 -0.672 844 HA ALA 104 HA ALA 104 10.403 6.697 -2.005 845 HB1 ALA 104 HB1 ALA 104 10.741 5.029 -0.215 846 HB2 ALA 104 HB2 ALA 104 11.053 6.668 0.388 847 HB3 ALA 104 HB3 ALA 104 9.528 5.846 0.793 848 H PHE 105 H PHE 105 9.930 4.781 -3.042 849 HA PHE 105 HA PHE 105 7.103 3.826 -3.024 850 HB2 PHE 105 HB2 PHE 105 9.433 3.302 -4.887 851 HB3 PHE 105 HB3 PHE 105 7.976 2.326 -4.871 852 HD1 PHE 105 HD1 PHE 105 9.350 5.641 -5.792 853 HD2 PHE 105 HD2 PHE 105 5.818 3.172 -5.638 854 HE1 PHE 105 HE1 PHE 105 8.216 7.153 -7.395 855 HE2 PHE 105 HE2 PHE 105 4.695 4.668 -7.253 856 HZ PHE 105 HZ PHE 105 5.896 6.661 -8.146 857 H ILE 106 H ILE 106 6.604 2.253 -1.679 858 HA ILE 106 HA ILE 106 8.690 0.272 -0.837 859 HB ILE 106 HB ILE 106 7.769 0.108 1.331 860 HG12 ILE 106 HG12 ILE 106 5.717 2.251 0.626 861 HG13 ILE 106 HG13 ILE 106 5.369 0.532 0.833 862 HG21 ILE 106 HG21 ILE 106 8.488 2.221 2.245 863 HG22 ILE 106 HG22 ILE 106 9.441 1.917 0.783 864 HG23 ILE 106 HG23 ILE 106 8.088 3.071 0.734 865 HD11 ILE 106 HD11 ILE 106 6.127 0.638 3.189 866 HD12 ILE 106 HD12 ILE 106 6.335 2.396 3.026 867 HD13 ILE 106 HD13 ILE 106 4.732 1.672 2.841 868 H GLY 107 H GLY 107 8.087 -1.877 -0.601 869 HA2 GLY 107 HA2 GLY 107 5.644 -2.703 -2.093 870 HA3 GLY 107 HA3 GLY 107 7.029 -3.720 -1.700 871 H ILE 108 H ILE 108 4.047 -3.877 -1.101 872 HA ILE 108 HA ILE 108 4.393 -4.694 1.709 873 HB ILE 108 HB ILE 108 2.046 -4.241 2.206 874 HG12 ILE 108 HG12 ILE 108 1.991 -2.463 -0.267 875 HG13 ILE 108 HG13 ILE 108 1.195 -4.033 -0.149 876 HG21 ILE 108 HG21 ILE 108 2.406 -1.879 2.733 877 HG22 ILE 108 HG22 ILE 108 3.862 -2.841 2.988 878 HG23 ILE 108 HG23 ILE 108 3.732 -1.802 1.552 879 HD11 ILE 108 HD11 ILE 108 -0.449 -2.324 0.266 880 HD12 ILE 108 HD12 ILE 108 -0.162 -3.198 1.782 881 HD13 ILE 108 HD13 ILE 108 0.528 -1.585 1.541 882 H GLY 109 H GLY 109 3.645 -6.620 2.284 883 HA2 GLY 109 HA2 GLY 109 2.286 -8.330 0.222 884 HA3 GLY 109 HA3 GLY 109 3.560 -8.918 1.286 885 H PHE 110 H PHE 110 0.639 -9.538 0.799 886 HA PHE 110 HA PHE 110 -0.538 -9.200 3.506 887 HB2 PHE 110 HB2 PHE 110 -1.679 -9.889 0.780 888 HB3 PHE 110 HB3 PHE 110 -2.595 -10.077 2.259 889 HD1 PHE 110 HD1 PHE 110 -0.531 -7.403 0.516 890 HD2 PHE 110 HD2 PHE 110 -3.994 -8.356 2.909 891 HE1 PHE 110 HE1 PHE 110 -1.170 -5.014 0.558 892 HE2 PHE 110 HE2 PHE 110 -4.696 -5.984 2.822 893 HZ PHE 110 HZ PHE 110 -3.254 -4.303 1.677 894 H THR 111 H THR 111 -1.637 -10.972 4.498 895 HA THR 111 HA THR 111 -0.062 -13.411 4.522 896 HB THR 111 HB THR 111 -1.074 -12.263 6.499 897 HG1 THR 111 HG1 THR 111 -1.502 -14.193 7.539 898 HG21 THR 111 HG21 THR 111 -3.377 -11.876 5.620 899 HG22 THR 111 HG22 THR 111 -3.669 -13.628 5.674 900 HG23 THR 111 HG23 THR 111 -3.355 -12.726 7.170 901 H ASP 112 H ASP 112 -2.874 -12.435 2.748 902 HA ASP 112 HA ASP 112 -3.093 -15.023 1.483 903 HB2 ASP 112 HB2 ASP 112 -4.475 -15.286 3.610 904 HB3 ASP 112 HB3 ASP 112 -5.525 -14.004 3.012 905 H ARG 113 H ARG 113 -4.315 -14.971 -0.425 906 HA ARG 113 HA ARG 113 -4.424 -12.576 -1.963 907 HB2 ARG 113 HB2 ARG 113 -4.389 -15.031 -2.723 908 HB3 ARG 113 HB3 ARG 113 -6.109 -15.095 -2.319 909 HG2 ARG 113 HG2 ARG 113 -6.404 -13.081 -3.919 910 HG3 ARG 113 HG3 ARG 113 -4.702 -13.320 -4.342 911 HD2 ARG 113 HD2 ARG 113 -6.016 -14.444 -6.005 912 HD3 ARG 113 HD3 ARG 113 -5.292 -15.700 -4.974 913 HE ARG 113 HE ARG 113 -7.923 -14.950 -4.033 914 HH11 ARG 113 HH11 ARG 113 -9.652 -16.329 -4.258 915 HH12 ARG 113 HH12 ARG 113 -9.600 -17.600 -5.442 916 HH21 ARG 113 HH21 ARG 113 -6.451 -16.858 -6.577 917 HH22 ARG 113 HH22 ARG 113 -7.838 -17.904 -6.718 918 H GLY 114 H GLY 114 -6.998 -14.177 -0.067 919 HA2 GLY 114 HA2 GLY 114 -9.189 -12.597 -0.959 920 HA3 GLY 114 HA3 GLY 114 -9.082 -13.460 0.580 921 H ASP 115 H ASP 115 -6.711 -11.843 1.478 922 HA ASP 115 HA ASP 115 -8.191 -9.486 2.480 923 HB2 ASP 115 HB2 ASP 115 -5.441 -10.607 3.123 924 HB3 ASP 115 HB3 ASP 115 -6.118 -9.142 3.840 925 H ALA 116 H ALA 116 -5.391 -10.146 0.334 926 HA ALA 116 HA ALA 116 -4.853 -7.398 -0.333 927 HB1 ALA 116 HB1 ALA 116 -4.488 -10.034 -1.814 928 HB2 ALA 116 HB2 ALA 116 -3.875 -8.484 -2.398 929 HB3 ALA 116 HB3 ALA 116 -3.285 -9.136 -0.852 930 H PHE 117 H PHE 117 -7.247 -9.741 -1.560 931 HA PHE 117 HA PHE 117 -8.346 -7.882 -3.480 932 HB2 PHE 117 HB2 PHE 117 -8.920 -10.665 -2.672 933 HB3 PHE 117 HB3 PHE 117 -10.292 -9.753 -3.253 934 HD1 PHE 117 HD1 PHE 117 -6.791 -10.729 -4.174 935 HD2 PHE 117 HD2 PHE 117 -10.570 -9.164 -5.540 936 HE1 PHE 117 HE1 PHE 117 -6.022 -10.927 -6.524 937 HE2 PHE 117 HE2 PHE 117 -9.797 -9.364 -7.895 938 HZ PHE 117 HZ PHE 117 -7.524 -10.249 -8.390 939 H ASP 118 H ASP 118 -8.431 -7.479 -0.253 940 HA ASP 118 HA ASP 118 -10.911 -5.837 -0.565 941 HB2 ASP 118 HB2 ASP 118 -9.349 -6.605 1.936 942 HB3 ASP 118 HB3 ASP 118 -10.515 -5.297 1.899 943 H PHE 119 H PHE 119 -7.368 -5.622 -0.174 944 HA PHE 119 HA PHE 119 -7.137 -2.851 0.304 945 HB2 PHE 119 HB2 PHE 119 -5.262 -4.319 0.497 946 HB3 PHE 119 HB3 PHE 119 -5.362 -4.809 -1.182 947 HD1 PHE 119 HD1 PHE 119 -4.113 -2.228 1.100 948 HD2 PHE 119 HD2 PHE 119 -4.626 -3.346 -3.024 949 HE1 PHE 119 HE1 PHE 119 -2.604 -0.396 0.421 950 HE2 PHE 119 HE2 PHE 119 -3.090 -1.524 -3.705 951 HZ PHE 119 HZ PHE 119 -2.079 -0.034 -1.981 952 H ASN 120 H ASN 120 -7.229 -4.515 -2.847 953 HA ASN 120 HA ASN 120 -7.124 -2.077 -4.391 954 HB2 ASN 120 HB2 ASN 120 -7.522 -3.615 -6.301 955 HB3 ASN 120 HB3 ASN 120 -6.256 -4.216 -5.239 956 HD21 ASN 120 HD21 ASN 120 -8.409 -7.114 -6.055 957 HD22 ASN 120 HD22 ASN 120 -7.360 -6.034 -6.971 958 H VAL 121 H VAL 121 -9.843 -4.082 -3.288 959 HA VAL 121 HA VAL 121 -11.851 -2.675 -4.818 960 HB VAL 121 HB VAL 121 -12.024 -4.559 -2.451 961 HG11 VAL 121 HG11 VAL 121 -14.312 -3.345 -4.071 962 HG12 VAL 121 HG12 VAL 121 -14.463 -4.727 -2.963 963 HG13 VAL 121 HG13 VAL 121 -14.029 -3.142 -2.326 964 HG21 VAL 121 HG21 VAL 121 -12.919 -6.103 -4.155 965 HG22 VAL 121 HG22 VAL 121 -12.752 -4.849 -5.406 966 HG23 VAL 121 HG23 VAL 121 -11.316 -5.539 -4.622 967 H SER 122 H SER 122 -10.633 -2.330 -1.490 968 HA SER 122 HA SER 122 -12.378 -0.354 -0.514 969 HB2 SER 122 HB2 SER 122 -10.676 -1.635 0.775 970 HB3 SER 122 HB3 SER 122 -9.394 -0.698 -0.016 971 HG SER 122 HG SER 122 -11.472 0.249 1.675 972 H LEU 123 H LEU 123 -9.449 0.051 -2.528 973 HA LEU 123 HA LEU 123 -9.611 2.960 -2.569 974 HB2 LEU 123 HB2 LEU 123 -8.031 0.962 -4.229 975 HB3 LEU 123 HB3 LEU 123 -7.845 2.710 -4.342 976 HG LEU 123 HG LEU 123 -7.369 1.126 -1.776 977 HD11 LEU 123 HD11 LEU 123 -4.976 1.450 -2.262 978 HD12 LEU 123 HD12 LEU 123 -5.762 0.486 -3.517 979 HD13 LEU 123 HD13 LEU 123 -5.392 2.196 -3.826 980 HD21 LEU 123 HD21 LEU 123 -6.216 3.156 -1.024 981 HD22 LEU 123 HD22 LEU 123 -6.638 3.988 -2.538 982 HD23 LEU 123 HD23 LEU 123 -7.900 3.515 -1.376 983 H GLN 124 H GLN 124 -10.346 0.458 -5.093 984 HA GLN 124 HA GLN 124 -11.166 2.442 -6.964 985 HB2 GLN 124 HB2 GLN 124 -11.748 0.701 -8.404 986 HB3 GLN 124 HB3 GLN 124 -10.434 0.058 -7.418 987 HG2 GLN 124 HG2 GLN 124 -12.229 -1.000 -5.959 988 HG3 GLN 124 HG3 GLN 124 -13.392 -0.588 -7.218 989 HE21 GLN 124 HE21 GLN 124 -10.564 -3.513 -7.957 990 HE22 GLN 124 HE22 GLN 124 -10.263 -2.299 -6.704 991 H ASP 125 H ASP 125 -13.059 0.841 -4.423 992 HA ASP 125 HA ASP 125 -15.554 2.028 -5.428 993 HB2 ASP 125 HB2 ASP 125 -15.415 -0.323 -4.526 994 HB3 ASP 125 HB3 ASP 125 -15.136 0.377 -2.927 995 H HIS 126 H HIS 126 -13.012 3.356 -3.845 996 HA HIS 126 HA HIS 126 -14.843 5.401 -2.676 997 HB2 HIS 126 HB2 HIS 126 -12.849 4.852 -1.304 998 HB3 HIS 126 HB3 HIS 126 -11.805 5.400 -2.624 999 HD2 HIS 126 HD2 HIS 126 -11.745 8.077 -3.121 1000 HE1 HIS 126 HE1 HIS 126 -14.223 9.326 0.119 1001 HE2 HIS 126 HE2 HIS 126 -12.722 10.134 -1.765 1002 H PHE 127 H PHE 127 -12.377 4.919 -5.240 1003 HA PHE 127 HA PHE 127 -12.804 7.634 -6.205 1004 HB2 PHE 127 HB2 PHE 127 -10.997 5.372 -7.084 1005 HB3 PHE 127 HB3 PHE 127 -11.049 6.930 -7.892 1006 HD1 PHE 127 HD1 PHE 127 -10.928 9.060 -6.216 1007 HD2 PHE 127 HD2 PHE 127 -9.344 5.140 -5.394 1008 HE1 PHE 127 HE1 PHE 127 -9.186 10.063 -4.769 1009 HE2 PHE 127 HE2 PHE 127 -7.583 6.143 -3.976 1010 HZ PHE 127 HZ PHE 127 -7.498 8.613 -3.678 1011 H LYS 128 H LYS 128 -14.655 4.948 -6.820 1012 HA LYS 128 HA LYS 128 -15.039 4.977 -9.549 1013 HB2 LYS 128 HB2 LYS 128 -16.984 3.746 -9.274 1014 HB3 LYS 128 HB3 LYS 128 -15.951 3.305 -7.935 1015 HG2 LYS 128 HG2 LYS 128 -18.370 5.157 -7.834 1016 HG3 LYS 128 HG3 LYS 128 -18.290 3.485 -7.270 1017 HD2 LYS 128 HD2 LYS 128 -16.536 4.234 -5.590 1018 HD3 LYS 128 HD3 LYS 128 -16.859 5.888 -6.101 1019 HE2 LYS 128 HE2 LYS 128 -18.370 5.871 -4.422 1020 HE3 LYS 128 HE3 LYS 128 -19.398 5.156 -5.668 1021 HZ1 LYS 128 HZ1 LYS 128 -19.497 3.810 -3.666 1022 HZ2 LYS 128 HZ2 LYS 128 -18.636 2.919 -4.751 1023 HZ3 LYS 128 HZ3 LYS 128 -17.862 3.704 -3.576 1024 H TRP 129 H TRP 129 -16.044 7.553 -7.528 1025 HA TRP 129 HA TRP 129 -17.707 8.761 -9.702 1026 HB2 TRP 129 HB2 TRP 129 -18.427 10.357 -8.085 1027 HB3 TRP 129 HB3 TRP 129 -18.645 8.742 -7.431 1028 HD1 TRP 129 HD1 TRP 129 -16.744 7.965 -5.575 1029 HE1 TRP 129 HE1 TRP 129 -15.371 9.262 -3.896 1030 HE3 TRP 129 HE3 TRP 129 -17.577 12.686 -7.377 1031 HZ2 TRP 129 HZ2 TRP 129 -14.945 12.053 -3.189 1032 HZ3 TRP 129 HZ3 TRP 129 -16.748 14.658 -6.115 1033 HH2 TRP 129 HH2 TRP 129 -15.436 14.357 -4.024 1034 H VAL 130 H VAL 130 -14.491 8.883 -8.498 1035 HA VAL 130 HA VAL 130 -13.982 11.681 -9.353 1036 HB VAL 130 HB VAL 130 -12.068 9.698 -8.079 1037 HG11 VAL 130 HG11 VAL 130 -10.818 11.734 -7.410 1038 HG12 VAL 130 HG12 VAL 130 -10.924 11.597 -9.162 1039 HG13 VAL 130 HG13 VAL 130 -11.980 12.739 -8.302 1040 HG21 VAL 130 HG21 VAL 130 -12.489 10.966 -5.951 1041 HG22 VAL 130 HG22 VAL 130 -13.840 11.790 -6.757 1042 HG23 VAL 130 HG23 VAL 130 -13.879 10.032 -6.497 1043 H LYS 131 H LYS 131 -13.107 8.339 -10.227 1044 HA LYS 131 HA LYS 131 -11.289 9.269 -12.349 1045 HB2 LYS 131 HB2 LYS 131 -10.610 7.541 -10.697 1046 HB3 LYS 131 HB3 LYS 131 -11.850 6.461 -11.316 1047 HG2 LYS 131 HG2 LYS 131 -9.532 5.963 -12.090 1048 HG3 LYS 131 HG3 LYS 131 -10.670 6.183 -13.404 1049 HD2 LYS 131 HD2 LYS 131 -9.809 8.515 -13.743 1050 HD3 LYS 131 HD3 LYS 131 -8.631 8.240 -12.436 1051 HE2 LYS 131 HE2 LYS 131 -7.686 6.338 -13.735 1052 HE3 LYS 131 HE3 LYS 131 -8.915 6.599 -14.987 1053 HZ1 LYS 131 HZ1 LYS 131 -6.853 7.665 -15.632 1054 HZ2 LYS 131 HZ2 LYS 131 -7.976 8.825 -15.355 1055 HZ3 LYS 131 HZ3 LYS 131 -6.793 8.545 -14.257 1056 H GLN 132 H GLN 132 -13.940 9.927 -12.716 1057 HA GLN 132 HA GLN 132 -14.994 8.171 -14.847 1058 HB2 GLN 132 HB2 GLN 132 -16.187 10.523 -13.349 1059 HB3 GLN 132 HB3 GLN 132 -16.941 9.795 -14.769 1060 HG2 GLN 132 HG2 GLN 132 -16.249 8.270 -12.218 1061 HG3 GLN 132 HG3 GLN 132 -17.833 8.946 -12.571 1062 HE21 GLN 132 HE21 GLN 132 -17.845 5.320 -13.546 1063 HE22 GLN 132 HE22 GLN 132 -17.453 6.188 -12.055 1064 H GLU 133 H GLU 133 -13.764 8.480 -16.526 1065 HA GLU 133 HA GLU 133 -13.547 11.162 -17.845 1066 HB2 GLU 133 HB2 GLU 133 -11.321 9.104 -17.562 1067 HB3 GLU 133 HB3 GLU 133 -11.270 10.539 -18.591 1068 HG2 GLU 133 HG2 GLU 133 -11.584 11.974 -16.553 1069 HG3 GLU 133 HG3 GLU 133 -11.473 10.524 -15.548 Start of MODEL 26 1 H1 GLY -4 H1 GLY -4 -6.512 35.935 5.261 2 H2 GLY -4 H2 GLY -4 -5.673 36.737 4.104 3 H3 GLY -4 H3 GLY -4 -5.031 36.549 5.600 4 HA2 GLY -4 HA2 GLY -4 -4.878 34.167 5.312 5 HA3 GLY -4 HA3 GLY -4 -5.596 34.360 3.702 6 H SER -3 H SER -3 -2.983 33.249 4.526 7 HA SER -3 HA SER -3 -1.167 34.853 2.782 8 HB2 SER -3 HB2 SER -3 -0.742 35.414 5.176 9 HB3 SER -3 HB3 SER -3 -0.543 33.694 5.535 10 HG SER -3 HG SER -3 1.108 35.419 4.022 11 HA PRO -2 HA PRO -2 0.167 30.680 1.376 12 HB2 PRO -2 HB2 PRO -2 2.894 31.982 1.493 13 HB3 PRO -2 HB3 PRO -2 2.210 30.912 0.228 14 HG2 PRO -2 HG2 PRO -2 2.286 33.577 -0.186 15 HG3 PRO -2 HG3 PRO -2 0.787 32.673 -0.584 16 HD2 PRO -2 HD2 PRO -2 1.404 34.291 1.901 17 HD3 PRO -2 HD3 PRO -2 -0.072 34.308 0.887 18 H ASN -1 H ASN -1 1.352 32.399 4.182 19 HA ASN -1 HA ASN -1 2.673 30.101 5.439 20 HB2 ASN -1 HB2 ASN -1 1.920 32.856 6.514 21 HB3 ASN -1 HB3 ASN -1 2.929 31.674 7.337 22 HD21 ASN -1 HD21 ASN -1 4.567 34.012 4.450 23 HD22 ASN -1 HD22 ASN -1 2.841 34.089 4.808 24 H SER 0 H SER 0 -0.641 30.953 5.103 25 HA SER 0 HA SER 0 -1.561 30.298 7.757 26 HB2 SER 0 HB2 SER 0 -3.075 30.443 5.125 27 HB3 SER 0 HB3 SER 0 -3.806 30.386 6.736 28 HG SER 0 HG SER 0 -2.811 32.364 7.229 29 H MET 1 H MET 1 -0.482 28.212 5.311 30 HA MET 1 HA MET 1 -1.593 25.851 6.678 31 HB2 MET 1 HB2 MET 1 -2.347 24.816 4.609 32 HB3 MET 1 HB3 MET 1 -3.254 26.282 4.936 33 HG2 MET 1 HG2 MET 1 -0.922 26.150 2.979 34 HG3 MET 1 HG3 MET 1 -2.595 25.857 2.532 35 HE1 MET 1 HE1 MET 1 -2.215 27.612 0.577 36 HE2 MET 1 HE2 MET 1 -1.749 29.306 0.848 37 HE3 MET 1 HE3 MET 1 -0.579 28.003 1.160 38 H ALA 2 H ALA 2 -0.447 23.900 6.277 39 HA ALA 2 HA ALA 2 2.131 24.078 4.798 40 HB1 ALA 2 HB1 ALA 2 3.346 23.244 6.761 41 HB2 ALA 2 HB2 ALA 2 2.531 24.766 7.150 42 HB3 ALA 2 HB3 ALA 2 1.844 23.226 7.713 43 H THR 3 H THR 3 -0.430 22.673 4.335 44 HA THR 3 HA THR 3 -1.450 20.717 3.918 45 HB THR 3 HB THR 3 1.194 19.258 4.164 46 HG1 THR 3 HG1 THR 3 1.129 20.721 2.445 47 HG21 THR 3 HG21 THR 3 -0.730 17.754 4.489 48 HG22 THR 3 HG22 THR 3 -1.527 18.431 3.053 49 HG23 THR 3 HG23 THR 3 -0.017 17.504 2.890 50 H GLU 4 H GLU 4 -2.864 20.390 5.452 51 HA GLU 4 HA GLU 4 -2.046 19.658 8.203 52 HB2 GLU 4 HB2 GLU 4 -1.761 22.146 7.838 53 HB3 GLU 4 HB3 GLU 4 -3.489 22.249 7.479 54 HG2 GLU 4 HG2 GLU 4 -3.947 21.247 9.752 55 HG3 GLU 4 HG3 GLU 4 -2.202 21.272 10.052 56 H LEU 5 H LEU 5 -3.397 18.135 8.781 57 HA LEU 5 HA LEU 5 -6.285 18.437 8.453 58 HB2 LEU 5 HB2 LEU 5 -6.658 16.280 7.575 59 HB3 LEU 5 HB3 LEU 5 -5.762 17.282 6.441 60 HG LEU 5 HG LEU 5 -4.403 15.209 8.183 61 HD11 LEU 5 HD11 LEU 5 -6.179 14.091 6.925 62 HD12 LEU 5 HD12 LEU 5 -5.619 14.851 5.421 63 HD13 LEU 5 HD13 LEU 5 -4.598 13.657 6.258 64 HD21 LEU 5 HD21 LEU 5 -2.765 15.183 6.274 65 HD22 LEU 5 HD22 LEU 5 -3.666 16.532 5.539 66 HD23 LEU 5 HD23 LEU 5 -2.840 16.739 7.097 67 H GLU 6 H GLU 6 -7.511 17.426 9.929 68 HA GLU 6 HA GLU 6 -6.262 15.732 12.036 69 HB2 GLU 6 HB2 GLU 6 -6.427 18.213 12.667 70 HB3 GLU 6 HB3 GLU 6 -8.177 17.997 12.696 71 HG2 GLU 6 HG2 GLU 6 -7.871 16.203 14.442 72 HG3 GLU 6 HG3 GLU 6 -6.128 16.435 14.347 73 H TYR 7 H TYR 7 -7.522 14.633 9.933 74 HA TYR 7 HA TYR 7 -10.021 13.487 10.895 75 HB2 TYR 7 HB2 TYR 7 -11.167 14.108 8.765 76 HB3 TYR 7 HB3 TYR 7 -10.878 15.444 9.852 77 HD1 TYR 7 HD1 TYR 7 -10.193 17.458 8.910 78 HD2 TYR 7 HD2 TYR 7 -9.140 13.782 6.898 79 HE1 TYR 7 HE1 TYR 7 -9.283 18.750 6.993 80 HE2 TYR 7 HE2 TYR 7 -8.308 15.057 4.980 81 HH TYR 7 HH TYR 7 -8.351 18.659 4.899 82 H GLU 8 H GLU 8 -10.636 11.644 9.600 83 HA GLU 8 HA GLU 8 -9.140 10.523 7.447 84 HB2 GLU 8 HB2 GLU 8 -7.992 10.185 10.139 85 HB3 GLU 8 HB3 GLU 8 -8.482 8.620 9.482 86 HG2 GLU 8 HG2 GLU 8 -7.101 8.947 7.506 87 HG3 GLU 8 HG3 GLU 8 -6.683 10.573 7.999 88 H SER 9 H SER 9 -11.052 9.785 6.549 89 HA SER 9 HA SER 9 -12.913 8.136 8.199 90 HB2 SER 9 HB2 SER 9 -13.100 9.560 5.590 91 HB3 SER 9 HB3 SER 9 -13.959 8.016 5.711 92 HG SER 9 HG SER 9 -15.096 8.780 7.466 93 H VAL 10 H VAL 10 -12.155 6.132 8.547 94 HA VAL 10 HA VAL 10 -10.435 4.643 6.839 95 HB VAL 10 HB VAL 10 -11.474 2.658 8.147 96 HG11 VAL 10 HG11 VAL 10 -9.869 4.832 9.512 97 HG12 VAL 10 HG12 VAL 10 -10.036 3.156 10.088 98 HG13 VAL 10 HG13 VAL 10 -9.259 3.468 8.532 99 HG21 VAL 10 HG21 VAL 10 -13.494 3.855 8.975 100 HG22 VAL 10 HG22 VAL 10 -12.515 3.106 10.244 101 HG23 VAL 10 HG23 VAL 10 -12.434 4.858 9.999 102 H LEU 11 H LEU 11 -10.668 2.975 5.549 103 HA LEU 11 HA LEU 11 -13.307 2.491 4.209 104 HB2 LEU 11 HB2 LEU 11 -10.527 2.678 2.967 105 HB3 LEU 11 HB3 LEU 11 -12.001 2.250 2.108 106 HG LEU 11 HG LEU 11 -11.457 4.959 3.415 107 HD11 LEU 11 HD11 LEU 11 -11.319 5.746 1.059 108 HD12 LEU 11 HD12 LEU 11 -10.019 4.630 1.491 109 HD13 LEU 11 HD13 LEU 11 -11.388 4.061 0.511 110 HD21 LEU 11 HD21 LEU 11 -13.437 5.713 2.150 111 HD22 LEU 11 HD22 LEU 11 -13.731 4.052 1.594 112 HD23 LEU 11 HD23 LEU 11 -13.880 4.469 3.318 113 H CYS 12 H CYS 12 -10.110 1.220 5.126 114 HA CYS 12 HA CYS 12 -11.281 -1.326 5.883 115 HB2 CYS 12 HB2 CYS 12 -10.778 -1.584 3.411 116 HB3 CYS 12 HB3 CYS 12 -9.061 -1.351 3.814 117 HG CYS 12 HG CYS 12 -10.090 -3.953 3.416 118 H VAL 13 H VAL 13 -10.066 -2.403 7.302 119 HA VAL 13 HA VAL 13 -7.362 -1.451 8.055 120 HB VAL 13 HB VAL 13 -9.597 -1.764 10.098 121 HG11 VAL 13 HG11 VAL 13 -6.667 -1.022 10.525 122 HG12 VAL 13 HG12 VAL 13 -7.933 -1.063 11.765 123 HG13 VAL 13 HG13 VAL 13 -7.419 -2.566 10.997 124 HG21 VAL 13 HG21 VAL 13 -9.756 0.417 8.980 125 HG22 VAL 13 HG22 VAL 13 -9.119 0.639 10.610 126 HG23 VAL 13 HG23 VAL 13 -8.019 0.693 9.218 127 H LYS 14 H LYS 14 -6.028 -3.165 8.192 128 HA LYS 14 HA LYS 14 -7.140 -5.815 8.928 129 HB2 LYS 14 HB2 LYS 14 -5.169 -5.381 6.658 130 HB3 LYS 14 HB3 LYS 14 -5.701 -6.937 7.291 131 HG2 LYS 14 HG2 LYS 14 -8.078 -6.291 6.750 132 HG3 LYS 14 HG3 LYS 14 -7.449 -4.841 5.944 133 HD2 LYS 14 HD2 LYS 14 -6.082 -6.322 4.447 134 HD3 LYS 14 HD3 LYS 14 -6.848 -7.737 5.182 135 HE2 LYS 14 HE2 LYS 14 -8.327 -5.462 3.786 136 HE3 LYS 14 HE3 LYS 14 -7.874 -6.976 3.001 137 HZ1 LYS 14 HZ1 LYS 14 -9.615 -6.860 5.398 138 HZ2 LYS 14 HZ2 LYS 14 -10.182 -6.929 3.871 139 HZ3 LYS 14 HZ3 LYS 14 -9.281 -8.188 4.478 140 HA PRO 15 HA PRO 15 -4.018 -5.796 11.943 141 HB2 PRO 15 HB2 PRO 15 -3.879 -8.426 12.669 142 HB3 PRO 15 HB3 PRO 15 -5.317 -7.398 12.979 143 HG2 PRO 15 HG2 PRO 15 -4.849 -9.281 10.627 144 HG3 PRO 15 HG3 PRO 15 -6.281 -9.215 11.717 145 HD2 PRO 15 HD2 PRO 15 -6.281 -7.984 9.333 146 HD3 PRO 15 HD3 PRO 15 -7.000 -7.183 10.764 147 H ASP 16 H ASP 16 -3.333 -7.702 9.070 148 HA ASP 16 HA ASP 16 -0.444 -7.904 9.839 149 HB2 ASP 16 HB2 ASP 16 -2.257 -10.038 8.668 150 HB3 ASP 16 HB3 ASP 16 -0.499 -10.108 8.584 151 H VAL 17 H VAL 17 0.589 -6.588 8.607 152 HA VAL 17 HA VAL 17 0.674 -7.154 5.722 153 HB VAL 17 HB VAL 17 -0.865 -5.229 5.908 154 HG11 VAL 17 HG11 VAL 17 1.518 -3.648 6.950 155 HG12 VAL 17 HG12 VAL 17 -0.075 -3.006 6.507 156 HG13 VAL 17 HG13 VAL 17 0.083 -4.099 7.889 157 HG21 VAL 17 HG21 VAL 17 0.526 -5.555 3.894 158 HG22 VAL 17 HG22 VAL 17 0.153 -3.855 4.207 159 HG23 VAL 17 HG23 VAL 17 1.766 -4.479 4.590 160 H SER 18 H SER 18 2.689 -6.936 4.836 161 HA SER 18 HA SER 18 4.949 -6.397 6.748 162 HB2 SER 18 HB2 SER 18 4.743 -8.568 4.636 163 HB3 SER 18 HB3 SER 18 6.116 -8.274 5.724 164 HG SER 18 HG SER 18 4.675 -9.956 6.449 165 H VAL 19 H VAL 19 6.491 -5.042 6.070 166 HA VAL 19 HA VAL 19 6.366 -3.949 3.311 167 HB VAL 19 HB VAL 19 7.616 -2.878 5.839 168 HG11 VAL 19 HG11 VAL 19 7.728 -1.715 3.013 169 HG12 VAL 19 HG12 VAL 19 8.098 -0.806 4.497 170 HG13 VAL 19 HG13 VAL 19 9.108 -2.169 4.036 171 HG21 VAL 19 HG21 VAL 19 5.084 -2.664 5.444 172 HG22 VAL 19 HG22 VAL 19 5.975 -1.154 5.671 173 HG23 VAL 19 HG23 VAL 19 5.490 -1.653 4.043 174 H TYR 20 H TYR 20 7.839 -4.022 1.883 175 HA TYR 20 HA TYR 20 10.582 -4.927 2.592 176 HB2 TYR 20 HB2 TYR 20 9.441 -5.607 -0.096 177 HB3 TYR 20 HB3 TYR 20 10.771 -6.342 0.796 178 HD1 TYR 20 HD1 TYR 20 7.204 -6.386 0.089 179 HD2 TYR 20 HD2 TYR 20 10.261 -7.906 2.708 180 HE1 TYR 20 HE1 TYR 20 5.642 -8.151 0.866 181 HE2 TYR 20 HE2 TYR 20 8.698 -9.676 3.504 182 HH TYR 20 HH TYR 20 5.343 -9.957 2.299 183 H ARG 21 H ARG 21 11.977 -3.387 2.108 184 HA ARG 21 HA ARG 21 11.448 -1.192 0.245 185 HB2 ARG 21 HB2 ARG 21 13.008 -1.056 2.218 186 HB3 ARG 21 HB3 ARG 21 14.139 -2.107 1.347 187 HG2 ARG 21 HG2 ARG 21 14.251 -0.435 -0.496 188 HG3 ARG 21 HG3 ARG 21 13.076 0.584 0.363 189 HD2 ARG 21 HD2 ARG 21 14.676 0.784 2.270 190 HD3 ARG 21 HD3 ARG 21 15.830 -0.219 1.392 191 HE ARG 21 HE ARG 21 16.333 1.538 -0.060 192 HH11 ARG 21 HH11 ARG 21 16.511 3.674 -0.609 193 HH12 ARG 21 HH12 ARG 21 15.445 4.850 0.099 194 HH21 ARG 21 HH21 ARG 21 13.715 2.600 2.021 195 HH22 ARG 21 HH22 ARG 21 13.906 4.266 1.552 196 H ILE 22 H ILE 22 11.470 -1.331 -1.892 197 HA ILE 22 HA ILE 22 12.195 -3.895 -3.103 198 HB ILE 22 HB ILE 22 10.884 -3.162 -5.024 199 HG12 ILE 22 HG12 ILE 22 10.462 -0.547 -3.512 200 HG13 ILE 22 HG13 ILE 22 11.340 -0.761 -5.031 201 HG21 ILE 22 HG21 ILE 22 9.357 -2.663 -2.451 202 HG22 ILE 22 HG22 ILE 22 8.738 -3.322 -3.981 203 HG23 ILE 22 HG23 ILE 22 9.867 -4.268 -3.008 204 HD11 ILE 22 HD11 ILE 22 9.193 0.072 -5.614 205 HD12 ILE 22 HD12 ILE 22 9.178 -1.660 -6.036 206 HD13 ILE 22 HD13 ILE 22 8.369 -1.087 -4.560 207 HA PRO 23 HA PRO 23 15.634 -2.359 -5.613 208 HB2 PRO 23 HB2 PRO 23 15.508 -4.019 -7.784 209 HB3 PRO 23 HB3 PRO 23 16.073 -4.569 -6.177 210 HG2 PRO 23 HG2 PRO 23 13.292 -4.849 -7.368 211 HG3 PRO 23 HG3 PRO 23 14.298 -6.121 -6.603 212 HD2 PRO 23 HD2 PRO 23 12.373 -4.797 -5.224 213 HD3 PRO 23 HD3 PRO 23 13.911 -5.256 -4.440 214 HA PRO 24 HA PRO 24 13.635 0.494 -8.399 215 HB2 PRO 24 HB2 PRO 24 15.553 1.043 -10.285 216 HB3 PRO 24 HB3 PRO 24 15.644 1.606 -8.588 217 HG2 PRO 24 HG2 PRO 24 16.952 -0.850 -9.804 218 HG3 PRO 24 HG3 PRO 24 17.709 0.412 -8.780 219 HD2 PRO 24 HD2 PRO 24 16.847 -1.936 -7.728 220 HD3 PRO 24 HD3 PRO 24 16.641 -0.402 -6.829 221 H ARG 25 H ARG 25 12.372 0.522 -10.235 222 HA ARG 25 HA ARG 25 11.874 -2.046 -11.463 223 HB2 ARG 25 HB2 ARG 25 10.207 -0.069 -10.850 224 HB3 ARG 25 HB3 ARG 25 10.624 0.525 -12.441 225 HG2 ARG 25 HG2 ARG 25 9.985 -2.292 -12.703 226 HG3 ARG 25 HG3 ARG 25 8.768 -1.581 -11.663 227 HD2 ARG 25 HD2 ARG 25 9.554 -0.499 -14.400 228 HD3 ARG 25 HD3 ARG 25 8.192 -1.574 -14.113 229 HE ARG 25 HE ARG 25 8.333 1.291 -13.543 230 HH11 ARG 25 HH11 ARG 25 6.480 2.366 -12.782 231 HH12 ARG 25 HH12 ARG 25 5.151 1.364 -12.186 232 HH21 ARG 25 HH21 ARG 25 6.500 -1.622 -12.665 233 HH22 ARG 25 HH22 ARG 25 5.154 -0.609 -12.126 234 H ALA 26 H ALA 26 11.874 -2.633 -13.569 235 HA ALA 26 HA ALA 26 12.320 -0.680 -15.659 236 HB1 ALA 26 HB1 ALA 26 14.093 -3.156 -15.520 237 HB2 ALA 26 HB2 ALA 26 13.985 -2.030 -16.895 238 HB3 ALA 26 HB3 ALA 26 14.625 -1.471 -15.335 239 H SER 27 H SER 27 11.203 -1.292 -17.532 240 HA SER 27 HA SER 27 8.916 -2.871 -17.249 241 HB2 SER 27 HB2 SER 27 10.230 -1.944 -19.827 242 HB3 SER 27 HB3 SER 27 8.521 -2.383 -19.610 243 HG SER 27 HG SER 27 8.850 -0.106 -19.500 244 H ASN 28 H ASN 28 12.041 -3.823 -18.563 245 HA ASN 28 HA ASN 28 11.095 -6.396 -19.615 246 HB2 ASN 28 HB2 ASN 28 13.893 -5.282 -19.134 247 HB3 ASN 28 HB3 ASN 28 13.541 -6.816 -19.920 248 HD21 ASN 28 HD21 ASN 28 13.423 -3.507 -22.165 249 HD22 ASN 28 HD22 ASN 28 14.088 -3.524 -20.540 250 H ARG 29 H ARG 29 11.432 -5.279 -16.509 251 HA ARG 29 HA ARG 29 12.043 -7.971 -15.329 252 HB2 ARG 29 HB2 ARG 29 12.375 -5.263 -14.015 253 HB3 ARG 29 HB3 ARG 29 12.729 -6.849 -13.328 254 HG2 ARG 29 HG2 ARG 29 14.489 -7.193 -15.076 255 HG3 ARG 29 HG3 ARG 29 14.148 -5.558 -15.708 256 HD2 ARG 29 HD2 ARG 29 14.578 -4.625 -13.447 257 HD3 ARG 29 HD3 ARG 29 14.988 -6.255 -12.872 258 HE ARG 29 HE ARG 29 16.677 -5.873 -15.036 259 HH11 ARG 29 HH11 ARG 29 18.760 -5.115 -14.945 260 HH12 ARG 29 HH12 ARG 29 19.259 -4.090 -13.631 261 HH21 ARG 29 HH21 ARG 29 16.208 -4.069 -12.061 262 HH22 ARG 29 HH22 ARG 29 17.859 -3.513 -12.040 263 H GLY 30 H GLY 30 10.210 -4.935 -14.617 264 HA2 GLY 30 HA2 GLY 30 8.234 -4.588 -13.568 265 HA3 GLY 30 HA3 GLY 30 7.796 -6.297 -13.740 266 H TYR 31 H TYR 31 7.279 -4.953 -11.426 267 HA TYR 31 HA TYR 31 9.074 -6.129 -9.381 268 HB2 TYR 31 HB2 TYR 31 6.265 -5.015 -9.128 269 HB3 TYR 31 HB3 TYR 31 7.367 -5.435 -7.822 270 HD1 TYR 31 HD1 TYR 31 5.906 -2.852 -8.174 271 HD2 TYR 31 HD2 TYR 31 9.850 -4.047 -9.498 272 HE1 TYR 31 HE1 TYR 31 6.684 -0.506 -7.999 273 HE2 TYR 31 HE2 TYR 31 10.651 -1.739 -9.168 274 HH TYR 31 HH TYR 31 8.459 0.945 -8.208 275 H ARG 32 H ARG 32 8.823 -8.225 -8.692 276 HA ARG 32 HA ARG 32 6.448 -9.788 -9.673 277 HB2 ARG 32 HB2 ARG 32 7.963 -11.657 -10.225 278 HB3 ARG 32 HB3 ARG 32 8.146 -10.256 -11.257 279 HG2 ARG 32 HG2 ARG 32 9.981 -10.548 -8.874 280 HG3 ARG 32 HG3 ARG 32 10.249 -11.570 -10.283 281 HD2 ARG 32 HD2 ARG 32 9.942 -8.568 -10.556 282 HD3 ARG 32 HD3 ARG 32 11.500 -9.274 -10.182 283 HE ARG 32 HE ARG 32 10.159 -9.198 -12.739 284 HH11 ARG 32 HH11 ARG 32 10.999 -10.116 -14.498 285 HH12 ARG 32 HH12 ARG 32 12.372 -11.190 -14.396 286 HH21 ARG 32 HH21 ARG 32 12.561 -11.060 -10.940 287 HH22 ARG 32 HH22 ARG 32 13.233 -11.720 -12.414 288 H ALA 33 H ALA 33 7.070 -8.714 -7.039 289 HA ALA 33 HA ALA 33 7.188 -9.173 -4.849 290 HB1 ALA 33 HB1 ALA 33 5.708 -11.667 -5.737 291 HB2 ALA 33 HB2 ALA 33 5.681 -10.927 -4.113 292 HB3 ALA 33 HB3 ALA 33 5.020 -10.056 -5.522 293 H SER 34 H SER 34 8.213 -12.204 -6.503 294 HA SER 34 HA SER 34 9.731 -13.272 -4.382 295 HB2 SER 34 HB2 SER 34 10.033 -13.692 -7.375 296 HB3 SER 34 HB3 SER 34 10.703 -14.739 -6.107 297 HG SER 34 HG SER 34 8.686 -15.513 -6.903 298 H ASP 35 H ASP 35 10.626 -10.652 -6.471 299 HA ASP 35 HA ASP 35 13.516 -10.911 -5.842 300 HB2 ASP 35 HB2 ASP 35 11.888 -9.173 -7.686 301 HB3 ASP 35 HB3 ASP 35 13.455 -8.606 -7.142 302 H TRP 36 H TRP 36 10.882 -9.861 -4.082 303 HA TRP 36 HA TRP 36 12.328 -7.703 -2.671 304 HB2 TRP 36 HB2 TRP 36 9.563 -8.818 -2.156 305 HB3 TRP 36 HB3 TRP 36 10.252 -7.338 -1.544 306 HD1 TRP 36 HD1 TRP 36 11.138 -6.844 -4.947 307 HE1 TRP 36 HE1 TRP 36 9.329 -5.589 -6.285 308 HE3 TRP 36 HE3 TRP 36 7.157 -7.618 -1.837 309 HZ2 TRP 36 HZ2 TRP 36 6.615 -4.723 -5.853 310 HZ3 TRP 36 HZ3 TRP 36 4.970 -6.498 -2.290 311 HH2 TRP 36 HH2 TRP 36 4.705 -5.056 -4.271 312 H LYS 37 H LYS 37 12.180 -7.880 -0.266 313 HA LYS 37 HA LYS 37 13.464 -10.322 0.646 314 HB2 LYS 37 HB2 LYS 37 12.774 -7.685 2.011 315 HB3 LYS 37 HB3 LYS 37 13.607 -9.003 2.821 316 HG2 LYS 37 HG2 LYS 37 14.663 -7.553 0.390 317 HG3 LYS 37 HG3 LYS 37 15.162 -7.346 2.080 318 HD2 LYS 37 HD2 LYS 37 15.561 -9.997 1.898 319 HD3 LYS 37 HD3 LYS 37 15.747 -9.622 0.184 320 HE2 LYS 37 HE2 LYS 37 17.242 -8.328 2.509 321 HE3 LYS 37 HE3 LYS 37 17.866 -9.657 1.529 322 HZ1 LYS 37 HZ1 LYS 37 17.216 -6.948 0.481 323 HZ2 LYS 37 HZ2 LYS 37 18.719 -7.531 0.732 324 HZ3 LYS 37 HZ3 LYS 37 17.777 -8.193 -0.422 325 H LEU 38 H LEU 38 11.193 -11.345 -0.022 326 HA LEU 38 HA LEU 38 9.022 -11.330 1.765 327 HB2 LEU 38 HB2 LEU 38 10.012 -13.655 0.078 328 HB3 LEU 38 HB3 LEU 38 8.391 -13.465 0.742 329 HG LEU 38 HG LEU 38 9.694 -11.735 -1.386 330 HD11 LEU 38 HD11 LEU 38 7.311 -13.655 -1.417 331 HD12 LEU 38 HD12 LEU 38 7.863 -12.696 -2.797 332 HD13 LEU 38 HD13 LEU 38 8.908 -13.965 -2.136 333 HD21 LEU 38 HD21 LEU 38 8.283 -10.254 -0.113 334 HD22 LEU 38 HD22 LEU 38 7.407 -10.679 -1.584 335 HD23 LEU 38 HD23 LEU 38 6.986 -11.470 -0.046 336 H ASP 39 H ASP 39 12.092 -12.873 2.341 337 HA ASP 39 HA ASP 39 10.913 -14.516 4.545 338 HB2 ASP 39 HB2 ASP 39 12.307 -15.612 2.776 339 HB3 ASP 39 HB3 ASP 39 13.690 -14.694 3.357 340 H GLN 40 H GLN 40 12.171 -11.477 4.183 341 HA GLN 40 HA GLN 40 12.538 -11.170 7.049 342 HB2 GLN 40 HB2 GLN 40 14.776 -9.984 6.797 343 HB3 GLN 40 HB3 GLN 40 14.769 -11.724 6.873 344 HG2 GLN 40 HG2 GLN 40 14.825 -10.363 4.170 345 HG3 GLN 40 HG3 GLN 40 16.281 -10.415 5.146 346 HE21 GLN 40 HE21 GLN 40 15.705 -13.567 2.900 347 HE22 GLN 40 HE22 GLN 40 15.086 -11.960 2.561 348 HA PRO 41 HA PRO 41 10.419 -7.596 4.968 349 HB2 PRO 41 HB2 PRO 41 9.266 -7.539 7.751 350 HB3 PRO 41 HB3 PRO 41 8.442 -7.229 6.202 351 HG2 PRO 41 HG2 PRO 41 8.146 -9.614 7.482 352 HG3 PRO 41 HG3 PRO 41 8.335 -9.565 5.707 353 HD2 PRO 41 HD2 PRO 41 10.405 -10.222 7.805 354 HD3 PRO 41 HD3 PRO 41 10.111 -11.000 6.221 355 H ASP 42 H ASP 42 10.832 -5.421 5.226 356 HA ASP 42 HA ASP 42 13.037 -4.547 6.954 357 HB2 ASP 42 HB2 ASP 42 12.627 -3.630 4.674 358 HB3 ASP 42 HB3 ASP 42 11.083 -2.976 5.224 359 H TRP 43 H TRP 43 9.520 -4.509 6.990 360 HA TRP 43 HA TRP 43 9.441 -4.051 9.881 361 HB2 TRP 43 HB2 TRP 43 9.522 -1.745 9.168 362 HB3 TRP 43 HB3 TRP 43 8.341 -2.024 7.906 363 HD1 TRP 43 HD1 TRP 43 8.610 -1.182 11.575 364 HE1 TRP 43 HE1 TRP 43 6.289 -0.527 12.462 365 HE3 TRP 43 HE3 TRP 43 5.781 -2.784 7.645 366 HZ2 TRP 43 HZ2 TRP 43 3.564 -0.485 11.463 367 HZ3 TRP 43 HZ3 TRP 43 3.332 -2.304 7.576 368 HH2 TRP 43 HH2 TRP 43 2.214 -1.195 9.492 369 H THR 44 H THR 44 7.315 -4.550 10.792 370 HA THR 44 HA THR 44 5.217 -5.476 8.930 371 HB THR 44 HB THR 44 4.642 -7.398 10.336 372 HG1 THR 44 HG1 THR 44 7.205 -7.035 11.490 373 HG21 THR 44 HG21 THR 44 7.478 -7.666 9.292 374 HG22 THR 44 HG22 THR 44 6.272 -8.956 9.523 375 HG23 THR 44 HG23 THR 44 6.006 -7.710 8.296 376 H GLY 45 H GLY 45 3.123 -5.290 9.668 377 HA2 GLY 45 HA2 GLY 45 2.326 -4.682 12.337 378 HA3 GLY 45 HA3 GLY 45 2.593 -3.166 11.488 379 H ARG 46 H ARG 46 0.553 -2.468 11.373 380 HA ARG 46 HA ARG 46 -1.630 -4.169 10.220 381 HB2 ARG 46 HB2 ARG 46 -1.829 -1.675 11.935 382 HB3 ARG 46 HB3 ARG 46 -3.166 -2.692 11.387 383 HG2 ARG 46 HG2 ARG 46 -2.171 -4.592 12.718 384 HG3 ARG 46 HG3 ARG 46 -0.969 -3.466 13.359 385 HD2 ARG 46 HD2 ARG 46 -3.995 -3.144 13.655 386 HD3 ARG 46 HD3 ARG 46 -2.938 -3.864 14.862 387 HE ARG 46 HE ARG 46 -1.890 -1.764 15.286 388 HH11 ARG 46 HH11 ARG 46 -1.965 0.317 15.578 389 HH12 ARG 46 HH12 ARG 46 -3.072 1.348 14.676 390 HH21 ARG 46 HH21 ARG 46 -4.474 -1.261 12.940 391 HH22 ARG 46 HH22 ARG 46 -4.336 0.472 13.091 392 H LEU 47 H LEU 47 -3.054 -3.332 8.810 393 HA LEU 47 HA LEU 47 -2.155 -1.138 7.006 394 HB2 LEU 47 HB2 LEU 47 -2.644 -3.343 6.001 395 HB3 LEU 47 HB3 LEU 47 -4.213 -3.371 6.807 396 HG LEU 47 HG LEU 47 -4.936 -1.393 5.427 397 HD11 LEU 47 HD11 LEU 47 -2.726 -0.440 4.838 398 HD12 LEU 47 HD12 LEU 47 -2.321 -1.923 3.944 399 HD13 LEU 47 HD13 LEU 47 -3.636 -0.870 3.385 400 HD21 LEU 47 HD21 LEU 47 -5.508 -3.693 4.830 401 HD22 LEU 47 HD22 LEU 47 -5.255 -2.708 3.391 402 HD23 LEU 47 HD23 LEU 47 -3.985 -3.838 3.925 403 H ARG 48 H ARG 48 -3.263 0.757 6.925 404 HA ARG 48 HA ARG 48 -6.157 0.812 7.646 405 HB2 ARG 48 HB2 ARG 48 -4.825 1.821 9.518 406 HB3 ARG 48 HB3 ARG 48 -4.124 2.972 8.379 407 HG2 ARG 48 HG2 ARG 48 -6.579 3.643 7.836 408 HG3 ARG 48 HG3 ARG 48 -7.020 2.740 9.284 409 HD2 ARG 48 HD2 ARG 48 -5.113 5.113 9.158 410 HD3 ARG 48 HD3 ARG 48 -6.819 5.162 9.629 411 HE ARG 48 HE ARG 48 -5.196 3.326 11.251 412 HH11 ARG 48 HH11 ARG 48 -4.900 3.799 13.399 413 HH12 ARG 48 HH12 ARG 48 -5.503 5.298 14.051 414 HH21 ARG 48 HH21 ARG 48 -6.113 6.726 11.006 415 HH22 ARG 48 HH22 ARG 48 -6.172 6.903 12.740 416 H ILE 49 H ILE 49 -7.037 0.968 5.710 417 HA ILE 49 HA ILE 49 -6.032 2.944 3.724 418 HB ILE 49 HB ILE 49 -8.490 1.211 3.405 419 HG12 ILE 49 HG12 ILE 49 -5.647 0.514 2.532 420 HG13 ILE 49 HG13 ILE 49 -6.616 -0.334 3.747 421 HG21 ILE 49 HG21 ILE 49 -8.235 3.245 1.976 422 HG22 ILE 49 HG22 ILE 49 -6.659 2.647 1.420 423 HG23 ILE 49 HG23 ILE 49 -8.158 1.777 1.017 424 HD11 ILE 49 HD11 ILE 49 -6.915 -1.673 1.898 425 HD12 ILE 49 HD12 ILE 49 -8.361 -0.668 1.859 426 HD13 ILE 49 HD13 ILE 49 -7.011 -0.305 0.761 427 H THR 50 H THR 50 -6.904 4.871 3.601 428 HA THR 50 HA THR 50 -9.359 5.631 5.100 429 HB THR 50 HB THR 50 -7.573 7.678 5.676 430 HG1 THR 50 HG1 THR 50 -5.872 6.025 5.032 431 HG21 THR 50 HG21 THR 50 -7.523 6.684 7.977 432 HG22 THR 50 HG22 THR 50 -9.145 6.773 7.283 433 HG23 THR 50 HG23 THR 50 -8.265 5.222 7.318 434 H SER 51 H SER 51 -10.093 7.875 4.594 435 HA SER 51 HA SER 51 -8.779 9.338 2.426 436 HB2 SER 51 HB2 SER 51 -10.132 7.721 1.138 437 HB3 SER 51 HB3 SER 51 -11.572 8.166 2.068 438 HG SER 51 HG SER 51 -10.044 10.007 0.501 439 H LYS 52 H LYS 52 -9.548 11.445 2.202 440 HA LYS 52 HA LYS 52 -12.139 12.102 3.245 441 HB2 LYS 52 HB2 LYS 52 -9.738 13.313 4.528 442 HB3 LYS 52 HB3 LYS 52 -11.138 14.360 4.220 443 HG2 LYS 52 HG2 LYS 52 -10.980 11.983 6.068 444 HG3 LYS 52 HG3 LYS 52 -11.303 13.666 6.422 445 HD2 LYS 52 HD2 LYS 52 -13.483 13.539 5.246 446 HD3 LYS 52 HD3 LYS 52 -13.249 11.772 5.110 447 HE2 LYS 52 HE2 LYS 52 -12.848 11.652 7.555 448 HE3 LYS 52 HE3 LYS 52 -13.102 13.401 7.683 449 HZ1 LYS 52 HZ1 LYS 52 -15.409 12.961 6.788 450 HZ2 LYS 52 HZ2 LYS 52 -15.102 11.346 6.941 451 HZ3 LYS 52 HZ3 LYS 52 -15.142 12.294 8.259 452 H GLY 53 H GLY 53 -13.119 13.072 1.715 453 HA2 GLY 53 HA2 GLY 53 -13.682 14.681 0.111 454 HA3 GLY 53 HA3 GLY 53 -12.019 15.276 0.114 455 H LYS 54 H LYS 54 -11.147 14.957 -1.776 456 HA LYS 54 HA LYS 54 -11.628 12.470 -3.371 457 HB2 LYS 54 HB2 LYS 54 -10.821 15.289 -4.087 458 HB3 LYS 54 HB3 LYS 54 -10.767 13.939 -5.252 459 HG2 LYS 54 HG2 LYS 54 -13.190 13.560 -4.930 460 HG3 LYS 54 HG3 LYS 54 -13.261 14.926 -3.802 461 HD2 LYS 54 HD2 LYS 54 -12.492 16.454 -5.605 462 HD3 LYS 54 HD3 LYS 54 -12.468 15.087 -6.744 463 HE2 LYS 54 HE2 LYS 54 -14.888 14.712 -6.340 464 HE3 LYS 54 HE3 LYS 54 -14.911 16.053 -5.187 465 HZ1 LYS 54 HZ1 LYS 54 -14.281 16.315 -8.084 466 HZ2 LYS 54 HZ2 LYS 54 -15.684 16.762 -7.383 467 HZ3 LYS 54 HZ3 LYS 54 -14.306 17.551 -7.016 468 H THR 55 H THR 55 -9.750 12.846 -1.072 469 HA THR 55 HA THR 55 -7.313 11.788 -2.435 470 HB THR 55 HB THR 55 -7.324 13.426 0.124 471 HG1 THR 55 HG1 THR 55 -6.468 15.060 -1.157 472 HG21 THR 55 HG21 THR 55 -5.102 12.484 -1.754 473 HG22 THR 55 HG22 THR 55 -4.874 13.538 -0.338 474 HG23 THR 55 HG23 THR 55 -5.411 11.868 -0.115 475 H ALA 56 H ALA 56 -6.867 9.783 -1.879 476 HA ALA 56 HA ALA 56 -7.936 8.626 0.652 477 HB1 ALA 56 HB1 ALA 56 -7.510 6.442 -0.298 478 HB2 ALA 56 HB2 ALA 56 -8.557 7.382 -1.371 479 HB3 ALA 56 HB3 ALA 56 -6.828 7.173 -1.759 480 H TYR 57 H TYR 57 -6.484 7.237 1.823 481 HA TYR 57 HA TYR 57 -3.593 7.941 1.736 482 HB2 TYR 57 HB2 TYR 57 -5.363 8.085 4.214 483 HB3 TYR 57 HB3 TYR 57 -3.648 8.443 4.116 484 HD1 TYR 57 HD1 TYR 57 -2.915 10.463 2.695 485 HD2 TYR 57 HD2 TYR 57 -7.006 9.818 3.935 486 HE1 TYR 57 HE1 TYR 57 -3.429 12.867 2.292 487 HE2 TYR 57 HE2 TYR 57 -7.515 12.206 3.492 488 HH TYR 57 HH TYR 57 -5.029 14.506 2.334 489 H ILE 58 H ILE 58 -2.646 5.937 1.499 490 HA ILE 58 HA ILE 58 -3.666 3.626 3.129 491 HB ILE 58 HB ILE 58 -1.442 3.682 1.054 492 HG12 ILE 58 HG12 ILE 58 -2.980 1.963 -0.086 493 HG13 ILE 58 HG13 ILE 58 -4.283 2.595 0.919 494 HG21 ILE 58 HG21 ILE 58 -0.984 2.055 2.860 495 HG22 ILE 58 HG22 ILE 58 -2.621 1.384 2.685 496 HG23 ILE 58 HG23 ILE 58 -1.422 1.216 1.383 497 HD11 ILE 58 HD11 ILE 58 -4.124 3.507 -1.430 498 HD12 ILE 58 HD12 ILE 58 -4.083 4.774 -0.199 499 HD13 ILE 58 HD13 ILE 58 -2.574 4.251 -1.001 500 H LYS 59 H LYS 59 -3.184 3.886 5.157 501 HA LYS 59 HA LYS 59 -0.432 4.768 5.907 502 HB2 LYS 59 HB2 LYS 59 -2.959 4.912 7.586 503 HB3 LYS 59 HB3 LYS 59 -1.341 5.480 8.021 504 HG2 LYS 59 HG2 LYS 59 -1.534 6.916 5.816 505 HG3 LYS 59 HG3 LYS 59 -3.265 6.598 5.954 506 HD2 LYS 59 HD2 LYS 59 -3.275 7.618 8.214 507 HD3 LYS 59 HD3 LYS 59 -1.523 7.890 8.102 508 HE2 LYS 59 HE2 LYS 59 -1.936 9.271 6.019 509 HE3 LYS 59 HE3 LYS 59 -3.675 9.106 6.318 510 HZ1 LYS 59 HZ1 LYS 59 -3.327 10.181 8.475 511 HZ2 LYS 59 HZ2 LYS 59 -1.718 10.394 8.141 512 HZ3 LYS 59 HZ3 LYS 59 -2.845 11.166 7.253 513 H LEU 60 H LEU 60 0.769 3.667 7.202 514 HA LEU 60 HA LEU 60 -0.009 0.873 7.957 515 HB2 LEU 60 HB2 LEU 60 2.443 2.117 6.776 516 HB3 LEU 60 HB3 LEU 60 2.706 0.909 8.024 517 HG LEU 60 HG LEU 60 1.525 -0.780 6.840 518 HD11 LEU 60 HD11 LEU 60 0.720 -0.439 4.482 519 HD12 LEU 60 HD12 LEU 60 -0.267 0.395 5.677 520 HD13 LEU 60 HD13 LEU 60 0.908 1.314 4.707 521 HD21 LEU 60 HD21 LEU 60 3.902 -0.278 6.264 522 HD22 LEU 60 HD22 LEU 60 3.017 -1.032 4.934 523 HD23 LEU 60 HD23 LEU 60 3.347 0.716 4.903 524 H GLU 61 H GLU 61 0.053 0.257 10.007 525 HA GLU 61 HA GLU 61 0.973 2.234 12.070 526 HB2 GLU 61 HB2 GLU 61 -1.512 0.508 12.086 527 HB3 GLU 61 HB3 GLU 61 -0.919 1.504 13.420 528 HG2 GLU 61 HG2 GLU 61 -1.306 3.541 12.080 529 HG3 GLU 61 HG3 GLU 61 -1.953 2.539 10.761 530 H ASP 62 H ASP 62 1.567 1.439 14.157 531 HA ASP 62 HA ASP 62 2.871 -1.150 14.118 532 HB2 ASP 62 HB2 ASP 62 3.695 0.897 15.288 533 HB3 ASP 62 HB3 ASP 62 2.354 0.692 16.443 534 H LYS 63 H LYS 63 2.330 -2.968 15.153 535 HA LYS 63 HA LYS 63 -0.494 -3.437 15.706 536 HB2 LYS 63 HB2 LYS 63 0.317 -5.892 15.766 537 HB3 LYS 63 HB3 LYS 63 0.476 -5.035 14.237 538 HG2 LYS 63 HG2 LYS 63 2.822 -4.640 14.570 539 HG3 LYS 63 HG3 LYS 63 2.772 -5.278 16.222 540 HD2 LYS 63 HD2 LYS 63 2.466 -7.507 15.462 541 HD3 LYS 63 HD3 LYS 63 2.016 -6.976 13.820 542 HE2 LYS 63 HE2 LYS 63 4.289 -6.033 13.501 543 HE3 LYS 63 HE3 LYS 63 4.767 -6.602 15.100 544 HZ1 LYS 63 HZ1 LYS 63 4.571 -8.853 14.364 545 HZ2 LYS 63 HZ2 LYS 63 3.798 -8.442 12.980 546 HZ3 LYS 63 HZ3 LYS 63 5.371 -8.066 13.157 547 H VAL 64 H VAL 64 1.883 -2.469 17.743 548 HA VAL 64 HA VAL 64 0.490 -3.737 20.072 549 HB VAL 64 HB VAL 64 3.434 -3.099 19.680 550 HG11 VAL 64 HG11 VAL 64 2.022 -4.183 22.163 551 HG12 VAL 64 HG12 VAL 64 3.784 -4.129 21.933 552 HG13 VAL 64 HG13 VAL 64 2.873 -2.625 22.026 553 HG21 VAL 64 HG21 VAL 64 2.791 -5.218 18.617 554 HG22 VAL 64 HG22 VAL 64 3.759 -5.542 20.052 555 HG23 VAL 64 HG23 VAL 64 1.995 -5.755 20.113 556 H SER 65 H SER 65 2.186 -0.832 18.857 557 HA SER 65 HA SER 65 1.228 0.669 21.265 558 HB2 SER 65 HB2 SER 65 3.499 1.169 19.324 559 HB3 SER 65 HB3 SER 65 3.035 2.268 20.639 560 HG SER 65 HG SER 65 4.717 0.823 21.264 561 H GLY 66 H GLY 66 0.608 0.448 17.862 562 HA2 GLY 66 HA2 GLY 66 -0.927 1.619 16.584 563 HA3 GLY 66 HA3 GLY 66 -1.403 2.549 18.010 564 H GLU 67 H GLU 67 1.950 2.503 17.065 565 HA GLU 67 HA GLU 67 2.175 5.314 16.496 566 HB2 GLU 67 HB2 GLU 67 4.018 3.040 15.683 567 HB3 GLU 67 HB3 GLU 67 4.445 4.742 15.755 568 HG2 GLU 67 HG2 GLU 67 3.761 2.907 18.067 569 HG3 GLU 67 HG3 GLU 67 5.356 3.506 17.637 570 H LEU 68 H LEU 68 2.907 6.186 14.433 571 HA LEU 68 HA LEU 68 1.691 4.901 12.021 572 HB2 LEU 68 HB2 LEU 68 1.028 7.239 12.496 573 HB3 LEU 68 HB3 LEU 68 2.721 7.725 12.476 574 HG LEU 68 HG LEU 68 2.847 7.003 10.051 575 HD11 LEU 68 HD11 LEU 68 -0.188 6.802 10.325 576 HD12 LEU 68 HD12 LEU 68 0.735 6.753 8.804 577 HD13 LEU 68 HD13 LEU 68 0.912 5.454 9.981 578 HD21 LEU 68 HD21 LEU 68 2.504 9.356 10.684 579 HD22 LEU 68 HD22 LEU 68 1.623 8.964 9.198 580 HD23 LEU 68 HD23 LEU 68 0.746 9.099 10.740 581 H PHE 69 H PHE 69 3.018 3.714 10.779 582 HA PHE 69 HA PHE 69 5.966 4.002 10.945 583 HB2 PHE 69 HB2 PHE 69 5.154 1.761 10.905 584 HB3 PHE 69 HB3 PHE 69 4.121 2.072 9.517 585 HD1 PHE 69 HD1 PHE 69 7.747 2.076 10.528 586 HD2 PHE 69 HD2 PHE 69 4.901 1.592 7.323 587 HE1 PHE 69 HE1 PHE 69 9.587 1.452 8.979 588 HE2 PHE 69 HE2 PHE 69 6.745 1.029 5.773 589 HZ PHE 69 HZ PHE 69 9.088 0.942 6.595 590 H ALA 70 H ALA 70 3.438 4.199 8.395 591 HA ALA 70 HA ALA 70 4.808 6.398 7.050 592 HB1 ALA 70 HB1 ALA 70 4.558 3.692 5.649 593 HB2 ALA 70 HB2 ALA 70 5.203 5.203 4.965 594 HB3 ALA 70 HB3 ALA 70 6.080 4.385 6.257 595 H GLN 71 H GLN 71 3.606 7.141 5.127 596 HA GLN 71 HA GLN 71 0.792 6.268 4.876 597 HB2 GLN 71 HB2 GLN 71 0.086 8.693 5.001 598 HB3 GLN 71 HB3 GLN 71 0.504 7.927 6.537 599 HG2 GLN 71 HG2 GLN 71 2.467 9.161 6.812 600 HG3 GLN 71 HG3 GLN 71 2.654 9.469 5.096 601 HE21 GLN 71 HE21 GLN 71 1.376 12.686 5.497 602 HE22 GLN 71 HE22 GLN 71 2.600 11.609 4.804 603 H ALA 72 H ALA 72 0.093 6.308 2.817 604 HA ALA 72 HA ALA 72 1.611 7.866 0.751 605 HB1 ALA 72 HB1 ALA 72 2.049 5.508 0.558 606 HB2 ALA 72 HB2 ALA 72 0.319 5.124 0.607 607 HB3 ALA 72 HB3 ALA 72 0.997 6.012 -0.774 608 HA PRO 73 HA PRO 73 -2.561 9.691 0.326 609 HB2 PRO 73 HB2 PRO 73 -0.949 11.833 -1.003 610 HB3 PRO 73 HB3 PRO 73 -2.246 11.985 0.216 611 HG2 PRO 73 HG2 PRO 73 0.367 12.328 0.887 612 HG3 PRO 73 HG3 PRO 73 -0.750 11.447 1.986 613 HD2 PRO 73 HD2 PRO 73 1.197 10.285 -0.030 614 HD3 PRO 73 HD3 PRO 73 0.965 9.849 1.692 615 H VAL 74 H VAL 74 -3.877 9.621 -1.464 616 HA VAL 74 HA VAL 74 -2.720 9.203 -4.182 617 HB VAL 74 HB VAL 74 -5.123 7.649 -3.172 618 HG11 VAL 74 HG11 VAL 74 -3.112 7.098 -5.390 619 HG12 VAL 74 HG12 VAL 74 -4.529 6.105 -4.988 620 HG13 VAL 74 HG13 VAL 74 -4.756 7.747 -5.589 621 HG21 VAL 74 HG21 VAL 74 -3.432 6.927 -1.620 622 HG22 VAL 74 HG22 VAL 74 -3.721 5.666 -2.816 623 HG23 VAL 74 HG23 VAL 74 -2.262 6.671 -2.931 624 H GLU 75 H GLU 75 -3.761 10.457 -5.737 625 HA GLU 75 HA GLU 75 -6.167 12.001 -4.906 626 HB2 GLU 75 HB2 GLU 75 -4.361 12.195 -7.343 627 HB3 GLU 75 HB3 GLU 75 -5.744 13.247 -7.014 628 HG2 GLU 75 HG2 GLU 75 -4.689 13.949 -4.865 629 HG3 GLU 75 HG3 GLU 75 -3.270 12.975 -5.253 630 H GLN 76 H GLN 76 -5.443 9.301 -6.959 631 HA GLN 76 HA GLN 76 -8.201 8.626 -7.232 632 HB2 GLN 76 HB2 GLN 76 -8.523 8.639 -9.572 633 HB3 GLN 76 HB3 GLN 76 -8.049 10.264 -9.135 634 HG2 GLN 76 HG2 GLN 76 -6.297 8.175 -10.502 635 HG3 GLN 76 HG3 GLN 76 -7.075 9.547 -11.260 636 HE21 GLN 76 HE21 GLN 76 -3.548 10.109 -9.276 637 HE22 GLN 76 HE22 GLN 76 -4.445 8.589 -9.086 638 H TYR 77 H TYR 77 -8.462 6.420 -7.852 639 HA TYR 77 HA TYR 77 -5.949 4.861 -8.156 640 HB2 TYR 77 HB2 TYR 77 -7.076 4.517 -6.006 641 HB3 TYR 77 HB3 TYR 77 -8.535 3.999 -6.862 642 HD1 TYR 77 HD1 TYR 77 -8.796 1.732 -7.502 643 HD2 TYR 77 HD2 TYR 77 -4.889 3.228 -6.455 644 HE1 TYR 77 HE1 TYR 77 -7.873 -0.571 -7.671 645 HE2 TYR 77 HE2 TYR 77 -3.957 0.932 -6.709 646 HH TYR 77 HH TYR 77 -5.962 -1.859 -7.674 647 HA PRO 78 HA PRO 78 -5.028 3.140 -9.238 648 HB2 PRO 78 HB2 PRO 78 -3.918 2.714 -11.683 649 HB3 PRO 78 HB3 PRO 78 -4.972 1.518 -10.865 650 HG2 PRO 78 HG2 PRO 78 -5.767 3.557 -12.974 651 HG3 PRO 78 HG3 PRO 78 -6.119 1.798 -12.950 652 HD2 PRO 78 HD2 PRO 78 -7.931 3.626 -12.070 653 HD3 PRO 78 HD3 PRO 78 -7.738 2.052 -11.244 654 H GLY 79 H GLY 79 -3.129 4.333 -9.170 655 HA2 GLY 79 HA2 GLY 79 -2.616 6.674 -10.844 656 HA3 GLY 79 HA3 GLY 79 -3.138 7.068 -9.207 657 H ILE 80 H ILE 80 -0.889 8.108 -9.566 658 HA ILE 80 HA ILE 80 1.485 6.673 -9.780 659 HB ILE 80 HB ILE 80 1.290 9.068 -10.118 660 HG12 ILE 80 HG12 ILE 80 3.268 9.960 -9.000 661 HG13 ILE 80 HG13 ILE 80 3.271 8.632 -7.844 662 HG21 ILE 80 HG21 ILE 80 1.006 9.430 -7.098 663 HG22 ILE 80 HG22 ILE 80 1.117 10.710 -8.314 664 HG23 ILE 80 HG23 ILE 80 -0.297 9.663 -8.285 665 HD11 ILE 80 HD11 ILE 80 4.953 8.360 -9.623 666 HD12 ILE 80 HD12 ILE 80 3.778 7.036 -9.658 667 HD13 ILE 80 HD13 ILE 80 3.670 8.353 -10.853 668 H ALA 81 H ALA 81 -0.339 7.169 -6.805 669 HA ALA 81 HA ALA 81 1.956 6.372 -5.139 670 HB1 ALA 81 HB1 ALA 81 0.687 8.348 -4.544 671 HB2 ALA 81 HB2 ALA 81 -0.808 7.399 -4.464 672 HB3 ALA 81 HB3 ALA 81 0.499 7.108 -3.292 673 H VAL 82 H VAL 82 0.007 4.438 -6.825 674 HA VAL 82 HA VAL 82 0.296 2.254 -4.873 675 HB VAL 82 HB VAL 82 -2.406 2.743 -6.116 676 HG11 VAL 82 HG11 VAL 82 -1.909 0.363 -5.596 677 HG12 VAL 82 HG12 VAL 82 -1.440 0.808 -3.947 678 HG13 VAL 82 HG13 VAL 82 -3.123 0.976 -4.469 679 HG21 VAL 82 HG21 VAL 82 -2.196 4.482 -4.455 680 HG22 VAL 82 HG22 VAL 82 -3.309 3.245 -3.888 681 HG23 VAL 82 HG23 VAL 82 -1.662 3.305 -3.234 682 H GLU 83 H GLU 83 0.965 0.493 -5.862 683 HA GLU 83 HA GLU 83 0.538 -0.012 -8.768 684 HB2 GLU 83 HB2 GLU 83 3.015 0.850 -7.364 685 HB3 GLU 83 HB3 GLU 83 3.244 -0.598 -8.326 686 HG2 GLU 83 HG2 GLU 83 1.831 1.807 -9.516 687 HG3 GLU 83 HG3 GLU 83 3.591 1.749 -9.401 688 H THR 84 H THR 84 1.375 -2.141 -9.455 689 HA THR 84 HA THR 84 0.880 -4.291 -7.386 690 HB THR 84 HB THR 84 -0.268 -5.522 -9.132 691 HG1 THR 84 HG1 THR 84 -0.730 -4.540 -11.106 692 HG21 THR 84 HG21 THR 84 -2.292 -4.154 -9.384 693 HG22 THR 84 HG22 THR 84 -1.629 -3.980 -7.760 694 HG23 THR 84 HG23 THR 84 -1.388 -2.682 -8.948 695 H VAL 85 H VAL 85 1.780 -6.393 -7.873 696 HA VAL 85 HA VAL 85 4.342 -6.345 -9.337 697 HB VAL 85 HB VAL 85 4.744 -8.503 -8.331 698 HG11 VAL 85 HG11 VAL 85 4.930 -7.822 -6.012 699 HG12 VAL 85 HG12 VAL 85 5.241 -6.425 -7.055 700 HG13 VAL 85 HG13 VAL 85 3.684 -6.584 -6.220 701 HG21 VAL 85 HG21 VAL 85 2.404 -9.378 -8.324 702 HG22 VAL 85 HG22 VAL 85 3.221 -9.555 -6.778 703 HG23 VAL 85 HG23 VAL 85 2.017 -8.268 -6.999 704 H THR 86 H THR 86 4.750 -8.471 -10.593 705 HA THR 86 HA THR 86 2.597 -8.933 -12.565 706 HB THR 86 HB THR 86 4.340 -9.992 -13.889 707 HG1 THR 86 HG1 THR 86 6.428 -10.127 -13.093 708 HG21 THR 86 HG21 THR 86 5.437 -7.456 -12.606 709 HG22 THR 86 HG22 THR 86 5.864 -8.101 -14.200 710 HG23 THR 86 HG23 THR 86 4.217 -7.493 -13.891 711 H ASP 87 H ASP 87 4.432 -10.762 -10.151 712 HA ASP 87 HA ASP 87 3.581 -13.302 -11.260 713 HB2 ASP 87 HB2 ASP 87 5.837 -12.819 -10.304 714 HB3 ASP 87 HB3 ASP 87 5.089 -12.778 -8.698 715 H SER 88 H SER 88 2.777 -11.607 -8.203 716 HA SER 88 HA SER 88 0.449 -13.461 -7.884 717 HB2 SER 88 HB2 SER 88 2.277 -14.458 -6.596 718 HB3 SER 88 HB3 SER 88 2.424 -12.964 -5.650 719 HG SER 88 HG SER 88 1.066 -14.555 -4.649 720 H SER 89 H SER 89 -1.362 -12.436 -7.546 721 HA SER 89 HA SER 89 -1.480 -9.656 -7.188 722 HB2 SER 89 HB2 SER 89 -3.778 -11.594 -6.829 723 HB3 SER 89 HB3 SER 89 -3.858 -9.895 -7.331 724 HG SER 89 HG SER 89 -3.990 -11.282 -9.138 725 H ARG 90 H ARG 90 -0.535 -11.425 -4.684 726 HA ARG 90 HA ARG 90 -2.103 -9.926 -2.668 727 HB2 ARG 90 HB2 ARG 90 -1.698 -11.445 -1.023 728 HB3 ARG 90 HB3 ARG 90 -2.141 -12.365 -2.457 729 HG2 ARG 90 HG2 ARG 90 0.252 -12.914 -2.828 730 HG3 ARG 90 HG3 ARG 90 0.661 -12.042 -1.328 731 HD2 ARG 90 HD2 ARG 90 -0.781 -13.552 -0.020 732 HD3 ARG 90 HD3 ARG 90 -1.297 -14.369 -1.491 733 HE ARG 90 HE ARG 90 0.711 -15.520 -1.630 734 HH11 ARG 90 HH11 ARG 90 2.535 -16.439 -0.802 735 HH12 ARG 90 HH12 ARG 90 3.287 -15.765 0.612 736 HH21 ARG 90 HH21 ARG 90 1.012 -13.237 1.052 737 HH22 ARG 90 HH22 ARG 90 2.494 -13.984 1.585 738 H TYR 91 H TYR 91 0.090 -8.780 -4.372 739 HA TYR 91 HA TYR 91 1.644 -7.578 -2.164 740 HB2 TYR 91 HB2 TYR 91 2.732 -8.772 -4.729 741 HB3 TYR 91 HB3 TYR 91 3.656 -7.786 -3.622 742 HD1 TYR 91 HD1 TYR 91 2.293 -11.129 -4.281 743 HD2 TYR 91 HD2 TYR 91 4.234 -8.622 -1.354 744 HE1 TYR 91 HE1 TYR 91 2.992 -13.150 -3.015 745 HE2 TYR 91 HE2 TYR 91 4.888 -10.652 -0.061 746 HH TYR 91 HH TYR 91 4.171 -13.958 -1.216 747 H PHE 92 H PHE 92 1.985 -5.437 -2.398 748 HA PHE 92 HA PHE 92 1.395 -4.080 -4.985 749 HB2 PHE 92 HB2 PHE 92 0.301 -3.269 -2.261 750 HB3 PHE 92 HB3 PHE 92 0.146 -2.336 -3.738 751 HD1 PHE 92 HD1 PHE 92 -1.215 -5.053 -1.776 752 HD2 PHE 92 HD2 PHE 92 -1.167 -3.275 -5.687 753 HE1 PHE 92 HE1 PHE 92 -3.275 -6.276 -2.350 754 HE2 PHE 92 HE2 PHE 92 -3.181 -4.607 -6.314 755 HZ PHE 92 HZ PHE 92 -4.234 -6.105 -4.664 756 H VAL 93 H VAL 93 2.214 -1.897 -5.051 757 HA VAL 93 HA VAL 93 4.325 -1.239 -3.037 758 HB VAL 93 HB VAL 93 4.365 -0.669 -6.020 759 HG11 VAL 93 HG11 VAL 93 6.383 0.200 -3.912 760 HG12 VAL 93 HG12 VAL 93 6.518 0.425 -5.666 761 HG13 VAL 93 HG13 VAL 93 5.257 1.269 -4.774 762 HG21 VAL 93 HG21 VAL 93 5.085 -2.922 -5.541 763 HG22 VAL 93 HG22 VAL 93 6.530 -1.961 -5.860 764 HG23 VAL 93 HG23 VAL 93 6.115 -2.372 -4.199 765 H ILE 94 H ILE 94 4.225 0.867 -2.180 766 HA ILE 94 HA ILE 94 2.240 2.682 -3.425 767 HB ILE 94 HB ILE 94 1.404 3.491 -1.353 768 HG12 ILE 94 HG12 ILE 94 3.272 2.653 0.158 769 HG13 ILE 94 HG13 ILE 94 1.631 2.576 0.767 770 HG21 ILE 94 HG21 ILE 94 0.797 0.551 -1.805 771 HG22 ILE 94 HG22 ILE 94 -0.213 1.705 -0.901 772 HG23 ILE 94 HG23 ILE 94 0.088 1.945 -2.626 773 HD11 ILE 94 HD11 ILE 94 3.195 0.182 -0.291 774 HD12 ILE 94 HD12 ILE 94 2.911 0.602 1.407 775 HD13 ILE 94 HD13 ILE 94 1.550 0.154 0.374 776 H ARG 95 H ARG 95 2.570 4.842 -3.230 777 HA ARG 95 HA ARG 95 5.415 5.572 -2.705 778 HB2 ARG 95 HB2 ARG 95 4.206 6.255 -4.849 779 HB3 ARG 95 HB3 ARG 95 3.342 7.448 -3.870 780 HG2 ARG 95 HG2 ARG 95 5.563 8.358 -3.111 781 HG3 ARG 95 HG3 ARG 95 6.365 7.177 -4.153 782 HD2 ARG 95 HD2 ARG 95 6.400 9.144 -5.396 783 HD3 ARG 95 HD3 ARG 95 5.076 8.212 -6.111 784 HE ARG 95 HE ARG 95 3.908 9.863 -4.143 785 HH11 ARG 95 HH11 ARG 95 3.211 11.996 -4.426 786 HH12 ARG 95 HH12 ARG 95 3.521 12.780 -5.946 787 HH21 ARG 95 HH21 ARG 95 5.591 10.355 -7.175 788 HH22 ARG 95 HH22 ARG 95 4.891 11.929 -7.418 789 H ILE 96 H ILE 96 5.562 5.555 -0.496 790 HA ILE 96 HA ILE 96 3.678 7.102 1.112 791 HB ILE 96 HB ILE 96 4.907 6.555 3.051 792 HG12 ILE 96 HG12 ILE 96 6.785 4.633 2.583 793 HG13 ILE 96 HG13 ILE 96 7.078 5.643 1.179 794 HG21 ILE 96 HG21 ILE 96 4.453 4.170 1.252 795 HG22 ILE 96 HG22 ILE 96 4.594 4.108 3.012 796 HG23 ILE 96 HG23 ILE 96 3.260 4.989 2.294 797 HD11 ILE 96 HD11 ILE 96 7.423 7.599 2.729 798 HD12 ILE 96 HD12 ILE 96 7.125 6.506 4.106 799 HD13 ILE 96 HD13 ILE 96 8.530 6.252 3.059 800 H GLN 97 H GLN 97 3.935 9.045 2.071 801 HA GLN 97 HA GLN 97 6.120 10.839 1.112 802 HB2 GLN 97 HB2 GLN 97 3.143 11.132 0.618 803 HB3 GLN 97 HB3 GLN 97 4.263 12.492 0.527 804 HG2 GLN 97 HG2 GLN 97 5.324 11.728 -1.379 805 HG3 GLN 97 HG3 GLN 97 4.896 10.042 -1.118 806 HE21 GLN 97 HE21 GLN 97 1.802 10.229 -2.831 807 HE22 GLN 97 HE22 GLN 97 2.873 9.242 -1.847 808 H ASP 98 H ASP 98 6.532 12.545 2.332 809 HA ASP 98 HA ASP 98 5.576 12.402 5.124 810 HB2 ASP 98 HB2 ASP 98 8.007 12.363 4.397 811 HB3 ASP 98 HB3 ASP 98 7.820 14.064 3.972 812 H GLY 99 H GLY 99 4.301 13.956 2.630 813 HA2 GLY 99 HA2 GLY 99 2.669 15.597 2.529 814 HA3 GLY 99 HA3 GLY 99 2.919 15.945 4.242 815 H THR 100 H THR 100 5.775 16.089 2.395 816 HA THR 100 HA THR 100 5.694 19.064 2.106 817 HB THR 100 HB THR 100 6.548 18.258 4.323 818 HG1 THR 100 HG1 THR 100 8.245 19.698 4.340 819 HG21 THR 100 HG21 THR 100 7.831 16.273 3.424 820 HG22 THR 100 HG22 THR 100 9.039 17.419 2.800 821 HG23 THR 100 HG23 THR 100 8.731 17.306 4.544 822 H GLY 101 H GLY 101 5.910 16.520 0.239 823 HA2 GLY 101 HA2 GLY 101 6.632 16.487 -1.993 824 HA3 GLY 101 HA3 GLY 101 7.836 17.727 -1.661 825 H ARG 102 H ARG 102 8.174 15.414 0.733 826 HA ARG 102 HA ARG 102 10.383 13.919 -0.519 827 HB2 ARG 102 HB2 ARG 102 9.021 13.641 2.197 828 HB3 ARG 102 HB3 ARG 102 10.431 12.722 1.669 829 HG2 ARG 102 HG2 ARG 102 11.762 14.750 1.513 830 HG3 ARG 102 HG3 ARG 102 10.345 15.741 1.903 831 HD2 ARG 102 HD2 ARG 102 11.637 15.567 3.911 832 HD3 ARG 102 HD3 ARG 102 10.165 14.609 4.106 833 HE ARG 102 HE ARG 102 12.616 13.201 3.202 834 HH11 ARG 102 HH11 ARG 102 13.504 11.633 4.468 835 HH12 ARG 102 HH12 ARG 102 12.908 11.365 6.079 836 HH21 ARG 102 HH21 ARG 102 10.464 13.777 5.970 837 HH22 ARG 102 HH22 ARG 102 11.288 12.564 6.908 838 H SER 103 H SER 103 10.252 11.867 -1.087 839 HA SER 103 HA SER 103 7.920 10.274 -0.452 840 HB2 SER 103 HB2 SER 103 7.296 9.646 -2.727 841 HB3 SER 103 HB3 SER 103 7.162 11.395 -2.527 842 HG SER 103 HG SER 103 9.136 11.637 -3.613 843 H ALA 104 H ALA 104 8.039 8.038 -0.807 844 HA ALA 104 HA ALA 104 10.397 6.856 -2.114 845 HB1 ALA 104 HB1 ALA 104 10.830 5.331 -0.212 846 HB2 ALA 104 HB2 ALA 104 11.096 7.021 0.259 847 HB3 ALA 104 HB3 ALA 104 9.611 6.182 0.759 848 H PHE 105 H PHE 105 9.982 4.822 -2.986 849 HA PHE 105 HA PHE 105 7.155 3.858 -2.900 850 HB2 PHE 105 HB2 PHE 105 9.448 3.316 -4.799 851 HB3 PHE 105 HB3 PHE 105 8.002 2.328 -4.742 852 HD1 PHE 105 HD1 PHE 105 5.741 3.322 -5.238 853 HD2 PHE 105 HD2 PHE 105 9.405 5.479 -5.940 854 HE1 PHE 105 HE1 PHE 105 4.563 4.766 -6.866 855 HE2 PHE 105 HE2 PHE 105 8.213 6.964 -7.536 856 HZ PHE 105 HZ PHE 105 5.798 6.594 -8.020 857 H ILE 106 H ILE 106 6.687 2.366 -1.467 858 HA ILE 106 HA ILE 106 8.756 0.335 -0.696 859 HB ILE 106 HB ILE 106 7.863 0.134 1.471 860 HG12 ILE 106 HG12 ILE 106 5.798 2.283 0.837 861 HG13 ILE 106 HG13 ILE 106 5.455 0.560 1.003 862 HG21 ILE 106 HG21 ILE 106 8.184 3.106 0.911 863 HG22 ILE 106 HG22 ILE 106 8.581 2.242 2.415 864 HG23 ILE 106 HG23 ILE 106 9.531 1.945 0.955 865 HD11 ILE 106 HD11 ILE 106 6.441 2.361 3.234 866 HD12 ILE 106 HD12 ILE 106 4.837 1.634 3.045 867 HD13 ILE 106 HD13 ILE 106 6.243 0.598 3.346 868 H GLY 107 H GLY 107 8.163 -1.814 -0.522 869 HA2 GLY 107 HA2 GLY 107 5.716 -2.604 -2.012 870 HA3 GLY 107 HA3 GLY 107 7.089 -3.636 -1.618 871 H ILE 108 H ILE 108 4.118 -3.814 -1.065 872 HA ILE 108 HA ILE 108 4.436 -4.712 1.719 873 HB ILE 108 HB ILE 108 2.075 -4.258 2.203 874 HG12 ILE 108 HG12 ILE 108 2.090 -2.351 -0.172 875 HG13 ILE 108 HG13 ILE 108 1.269 -3.912 -0.149 876 HG21 ILE 108 HG21 ILE 108 3.798 -1.806 1.705 877 HG22 ILE 108 HG22 ILE 108 2.461 -1.936 2.868 878 HG23 ILE 108 HG23 ILE 108 3.907 -2.923 3.084 879 HD11 ILE 108 HD11 ILE 108 0.612 -1.554 1.668 880 HD12 ILE 108 HD12 ILE 108 -0.353 -2.186 0.327 881 HD13 ILE 108 HD13 ILE 108 -0.116 -3.164 1.788 882 H GLY 109 H GLY 109 3.653 -6.647 2.216 883 HA2 GLY 109 HA2 GLY 109 2.267 -8.255 0.091 884 HA3 GLY 109 HA3 GLY 109 3.415 -8.926 1.242 885 H PHE 110 H PHE 110 0.558 -9.466 0.595 886 HA PHE 110 HA PHE 110 -0.744 -9.122 3.261 887 HB2 PHE 110 HB2 PHE 110 -1.803 -9.642 0.471 888 HB3 PHE 110 HB3 PHE 110 -2.784 -9.885 1.901 889 HD1 PHE 110 HD1 PHE 110 -4.086 -8.136 2.731 890 HD2 PHE 110 HD2 PHE 110 -0.656 -7.215 0.275 891 HE1 PHE 110 HE1 PHE 110 -4.680 -5.727 2.788 892 HE2 PHE 110 HE2 PHE 110 -1.215 -4.806 0.415 893 HZ PHE 110 HZ PHE 110 -3.245 -4.066 1.618 894 H THR 111 H THR 111 -1.820 -10.890 4.216 895 HA THR 111 HA THR 111 -0.310 -13.362 4.102 896 HB THR 111 HB THR 111 -1.222 -12.245 6.145 897 HG1 THR 111 HG1 THR 111 -1.887 -14.963 5.709 898 HG21 THR 111 HG21 THR 111 -3.549 -11.803 5.410 899 HG22 THR 111 HG22 THR 111 -3.869 -13.551 5.401 900 HG23 THR 111 HG23 THR 111 -3.465 -12.725 6.917 901 H ASP 112 H ASP 112 -3.107 -12.275 2.428 902 HA ASP 112 HA ASP 112 -3.455 -14.863 1.162 903 HB2 ASP 112 HB2 ASP 112 -4.907 -14.947 3.264 904 HB3 ASP 112 HB3 ASP 112 -5.857 -13.632 2.576 905 H ARG 113 H ARG 113 -4.450 -14.711 -0.868 906 HA ARG 113 HA ARG 113 -4.318 -12.136 -2.163 907 HB2 ARG 113 HB2 ARG 113 -3.766 -14.334 -3.206 908 HB3 ARG 113 HB3 ARG 113 -5.483 -14.765 -3.169 909 HG2 ARG 113 HG2 ARG 113 -6.026 -12.878 -4.640 910 HG3 ARG 113 HG3 ARG 113 -4.346 -12.320 -4.614 911 HD2 ARG 113 HD2 ARG 113 -5.249 -15.046 -5.633 912 HD3 ARG 113 HD3 ARG 113 -5.068 -13.621 -6.669 913 HE ARG 113 HE ARG 113 -2.623 -14.046 -5.225 914 HH11 ARG 113 HH11 ARG 113 -0.807 -14.903 -6.225 915 HH12 ARG 113 HH12 ARG 113 -1.011 -15.869 -7.659 916 HH21 ARG 113 HH21 ARG 113 -4.410 -15.539 -7.843 917 HH22 ARG 113 HH22 ARG 113 -2.971 -16.193 -8.574 918 H GLY 114 H GLY 114 -7.048 -13.909 -0.771 919 HA2 GLY 114 HA2 GLY 114 -9.162 -12.329 -1.932 920 HA3 GLY 114 HA3 GLY 114 -9.226 -13.240 -0.418 921 H ASP 115 H ASP 115 -7.007 -11.773 0.854 922 HA ASP 115 HA ASP 115 -8.490 -9.377 1.740 923 HB2 ASP 115 HB2 ASP 115 -5.996 -10.804 2.694 924 HB3 ASP 115 HB3 ASP 115 -6.387 -9.180 3.246 925 H ALA 116 H ALA 116 -5.570 -10.068 -0.203 926 HA ALA 116 HA ALA 116 -4.870 -7.312 -0.650 927 HB1 ALA 116 HB1 ALA 116 -3.379 -9.155 -1.077 928 HB2 ALA 116 HB2 ALA 116 -4.498 -9.858 -2.273 929 HB3 ALA 116 HB3 ALA 116 -3.703 -8.326 -2.614 930 H PHE 117 H PHE 117 -7.139 -9.529 -2.377 931 HA PHE 117 HA PHE 117 -8.036 -7.609 -4.312 932 HB2 PHE 117 HB2 PHE 117 -9.039 -10.199 -3.229 933 HB3 PHE 117 HB3 PHE 117 -10.251 -9.113 -3.874 934 HD1 PHE 117 HD1 PHE 117 -6.825 -10.392 -4.854 935 HD2 PHE 117 HD2 PHE 117 -10.788 -9.261 -6.129 936 HE1 PHE 117 HE1 PHE 117 -6.283 -11.095 -7.171 937 HE2 PHE 117 HE2 PHE 117 -10.234 -9.952 -8.448 938 HZ PHE 117 HZ PHE 117 -7.983 -10.874 -8.973 939 H ASP 118 H ASP 118 -9.163 -8.262 -0.952 940 HA ASP 118 HA ASP 118 -11.180 -6.268 -0.968 941 HB2 ASP 118 HB2 ASP 118 -10.784 -8.157 0.700 942 HB3 ASP 118 HB3 ASP 118 -9.561 -7.131 1.450 943 H PHE 119 H PHE 119 -7.671 -5.921 -0.287 944 HA PHE 119 HA PHE 119 -7.667 -3.121 0.347 945 HB2 PHE 119 HB2 PHE 119 -5.727 -4.338 0.800 946 HB3 PHE 119 HB3 PHE 119 -5.607 -4.994 -0.811 947 HD1 PHE 119 HD1 PHE 119 -4.837 -2.106 1.302 948 HD2 PHE 119 HD2 PHE 119 -4.765 -3.638 -2.719 949 HE1 PHE 119 HE1 PHE 119 -3.356 -0.264 0.637 950 HE2 PHE 119 HE2 PHE 119 -3.256 -1.798 -3.393 951 HZ PHE 119 HZ PHE 119 -2.540 -0.093 -1.720 952 H ASN 120 H ASN 120 -7.159 -4.649 -2.927 953 HA ASN 120 HA ASN 120 -7.227 -2.027 -4.132 954 HB2 ASN 120 HB2 ASN 120 -7.176 -3.107 -6.281 955 HB3 ASN 120 HB3 ASN 120 -5.952 -3.740 -5.190 956 HD21 ASN 120 HD21 ASN 120 -8.960 -6.271 -6.396 957 HD22 ASN 120 HD22 ASN 120 -9.372 -4.578 -6.219 958 H VAL 121 H VAL 121 -9.858 -4.240 -3.411 959 HA VAL 121 HA VAL 121 -11.804 -2.786 -5.007 960 HB VAL 121 HB VAL 121 -12.045 -4.810 -2.776 961 HG11 VAL 121 HG11 VAL 121 -14.324 -3.434 -4.272 962 HG12 VAL 121 HG12 VAL 121 -14.489 -4.905 -3.286 963 HG13 VAL 121 HG13 VAL 121 -14.027 -3.388 -2.518 964 HG21 VAL 121 HG21 VAL 121 -11.371 -5.600 -5.059 965 HG22 VAL 121 HG22 VAL 121 -12.954 -6.215 -4.580 966 HG23 VAL 121 HG23 VAL 121 -12.837 -4.864 -5.730 967 H SER 122 H SER 122 -10.769 -2.594 -1.560 968 HA SER 122 HA SER 122 -12.611 -0.541 -0.818 969 HB2 SER 122 HB2 SER 122 -9.880 -1.197 0.350 970 HB3 SER 122 HB3 SER 122 -11.098 -0.159 1.114 971 HG SER 122 HG SER 122 -11.198 -2.925 0.563 972 H LEU 123 H LEU 123 -9.771 -0.297 -2.785 973 HA LEU 123 HA LEU 123 -9.747 2.669 -2.637 974 HB2 LEU 123 HB2 LEU 123 -8.097 0.684 -4.233 975 HB3 LEU 123 HB3 LEU 123 -7.954 2.435 -4.369 976 HG LEU 123 HG LEU 123 -7.447 0.891 -1.786 977 HD11 LEU 123 HD11 LEU 123 -5.793 0.359 -3.534 978 HD12 LEU 123 HD12 LEU 123 -5.497 2.092 -3.787 979 HD13 LEU 123 HD13 LEU 123 -5.080 1.326 -2.236 980 HD21 LEU 123 HD21 LEU 123 -6.899 3.794 -2.542 981 HD22 LEU 123 HD22 LEU 123 -8.099 3.230 -1.354 982 HD23 LEU 123 HD23 LEU 123 -6.386 2.990 -1.043 983 H GLN 124 H GLN 124 -10.365 0.201 -5.242 984 HA GLN 124 HA GLN 124 -11.166 2.258 -7.053 985 HB2 GLN 124 HB2 GLN 124 -11.526 0.581 -8.623 986 HB3 GLN 124 HB3 GLN 124 -10.275 -0.066 -7.561 987 HG2 GLN 124 HG2 GLN 124 -12.173 -1.269 -6.328 988 HG3 GLN 124 HG3 GLN 124 -13.198 -0.855 -7.700 989 HE21 GLN 124 HE21 GLN 124 -10.075 -3.498 -8.319 990 HE22 GLN 124 HE22 GLN 124 -9.979 -2.319 -6.991 991 H ASP 125 H ASP 125 -13.135 0.342 -4.804 992 HA ASP 125 HA ASP 125 -15.641 1.480 -5.860 993 HB2 ASP 125 HB2 ASP 125 -15.397 -0.935 -5.139 994 HB3 ASP 125 HB3 ASP 125 -15.218 -0.361 -3.479 995 H HIS 126 H HIS 126 -13.251 2.747 -4.047 996 HA HIS 126 HA HIS 126 -15.148 4.570 -2.634 997 HB2 HIS 126 HB2 HIS 126 -13.283 3.812 -1.257 998 HB3 HIS 126 HB3 HIS 126 -12.123 4.397 -2.455 999 HD2 HIS 126 HD2 HIS 126 -11.268 6.810 -2.078 1000 HE1 HIS 126 HE1 HIS 126 -14.390 8.318 0.405 1001 HE2 HIS 126 HE2 HIS 126 -12.113 8.820 -0.593 1002 H PHE 127 H PHE 127 -12.561 4.525 -5.135 1003 HA PHE 127 HA PHE 127 -13.005 7.344 -5.745 1004 HB2 PHE 127 HB2 PHE 127 -11.138 5.175 -6.745 1005 HB3 PHE 127 HB3 PHE 127 -11.254 6.706 -7.585 1006 HD1 PHE 127 HD1 PHE 127 -11.172 8.879 -6.005 1007 HD2 PHE 127 HD2 PHE 127 -9.425 5.050 -5.092 1008 HE1 PHE 127 HE1 PHE 127 -9.408 10.005 -4.674 1009 HE2 PHE 127 HE2 PHE 127 -7.637 6.175 -3.798 1010 HZ PHE 127 HZ PHE 127 -7.623 8.662 -3.604 1011 H LYS 128 H LYS 128 -14.740 4.674 -6.836 1012 HA LYS 128 HA LYS 128 -15.037 5.032 -9.519 1013 HB2 LYS 128 HB2 LYS 128 -17.083 3.915 -9.465 1014 HB3 LYS 128 HB3 LYS 128 -16.121 3.250 -8.162 1015 HG2 LYS 128 HG2 LYS 128 -18.372 5.298 -7.818 1016 HG3 LYS 128 HG3 LYS 128 -18.540 3.557 -7.649 1017 HD2 LYS 128 HD2 LYS 128 -16.934 3.543 -5.797 1018 HD3 LYS 128 HD3 LYS 128 -16.781 5.311 -5.882 1019 HE2 LYS 128 HE2 LYS 128 -19.171 5.577 -5.426 1020 HE3 LYS 128 HE3 LYS 128 -19.380 3.817 -5.410 1021 HZ1 LYS 128 HZ1 LYS 128 -19.184 4.583 -3.157 1022 HZ2 LYS 128 HZ2 LYS 128 -17.809 3.759 -3.509 1023 HZ3 LYS 128 HZ3 LYS 128 -17.798 5.396 -3.454 1024 H TRP 129 H TRP 129 -16.481 7.204 -7.174 1025 HA TRP 129 HA TRP 129 -18.047 8.664 -9.185 1026 HB2 TRP 129 HB2 TRP 129 -18.807 10.006 -7.366 1027 HB3 TRP 129 HB3 TRP 129 -18.849 8.326 -6.859 1028 HD1 TRP 129 HD1 TRP 129 -16.860 7.555 -5.133 1029 HE1 TRP 129 HE1 TRP 129 -15.470 8.826 -3.425 1030 HE3 TRP 129 HE3 TRP 129 -17.944 12.331 -6.634 1031 HZ2 TRP 129 HZ2 TRP 129 -15.064 11.588 -2.632 1032 HZ3 TRP 129 HZ3 TRP 129 -17.094 14.268 -5.332 1033 HH2 TRP 129 HH2 TRP 129 -15.651 13.911 -3.338 1034 H VAL 130 H VAL 130 -14.828 8.886 -7.913 1035 HA VAL 130 HA VAL 130 -14.419 11.710 -8.667 1036 HB VAL 130 HB VAL 130 -12.363 9.677 -7.745 1037 HG11 VAL 130 HG11 VAL 130 -12.337 12.726 -7.760 1038 HG12 VAL 130 HG12 VAL 130 -11.073 11.683 -7.072 1039 HG13 VAL 130 HG13 VAL 130 -11.368 11.667 -8.809 1040 HG21 VAL 130 HG21 VAL 130 -13.995 9.858 -5.963 1041 HG22 VAL 130 HG22 VAL 130 -12.590 10.814 -5.501 1042 HG23 VAL 130 HG23 VAL 130 -14.043 11.627 -6.118 1043 H LYS 131 H LYS 131 -13.573 8.452 -9.823 1044 HA LYS 131 HA LYS 131 -12.057 9.521 -12.120 1045 HB2 LYS 131 HB2 LYS 131 -11.317 7.566 -10.577 1046 HB3 LYS 131 HB3 LYS 131 -12.501 6.604 -11.459 1047 HG2 LYS 131 HG2 LYS 131 -11.203 7.661 -13.595 1048 HG3 LYS 131 HG3 LYS 131 -9.948 7.949 -12.409 1049 HD2 LYS 131 HD2 LYS 131 -9.545 5.871 -13.617 1050 HD3 LYS 131 HD3 LYS 131 -9.813 5.547 -11.907 1051 HE2 LYS 131 HE2 LYS 131 -10.897 3.895 -13.423 1052 HE3 LYS 131 HE3 LYS 131 -12.031 4.681 -12.325 1053 HZ1 LYS 131 HZ1 LYS 131 -12.828 4.536 -14.665 1054 HZ2 LYS 131 HZ2 LYS 131 -12.787 6.080 -14.121 1055 HZ3 LYS 131 HZ3 LYS 131 -11.628 5.549 -15.147 1056 H GLN 132 H GLN 132 -14.654 10.277 -12.288 1057 HA GLN 132 HA GLN 132 -16.128 8.501 -14.098 1058 HB2 GLN 132 HB2 GLN 132 -16.672 11.260 -12.966 1059 HB3 GLN 132 HB3 GLN 132 -17.665 10.538 -14.236 1060 HG2 GLN 132 HG2 GLN 132 -17.166 9.206 -11.543 1061 HG3 GLN 132 HG3 GLN 132 -18.553 10.235 -11.883 1062 HE21 GLN 132 HE21 GLN 132 -18.831 6.380 -12.907 1063 HE22 GLN 132 HE22 GLN 132 -17.624 7.009 -11.783 1064 H GLU 133 H GLU 133 -14.946 8.244 -15.811 1065 HA GLU 133 HA GLU 133 -13.822 10.454 -17.442 1066 HB2 GLU 133 HB2 GLU 133 -13.596 7.433 -17.657 1067 HB3 GLU 133 HB3 GLU 133 -12.876 8.571 -18.801 1068 HG2 GLU 133 HG2 GLU 133 -11.516 9.578 -17.016 1069 HG3 GLU 133 HG3 GLU 133 -12.247 8.513 -15.816 Start of MODEL 27 1 H1 GLY -4 H1 GLY -4 -5.024 41.374 5.480 2 H2 GLY -4 H2 GLY -4 -3.734 40.367 5.486 3 H3 GLY -4 H3 GLY -4 -3.683 41.766 6.337 4 HA2 GLY -4 HA2 GLY -4 -4.012 39.907 7.828 5 HA3 GLY -4 HA3 GLY -4 -5.399 41.012 7.834 6 H SER -3 H SER -3 -5.478 38.279 8.624 7 HA SER -3 HA SER -3 -7.120 36.960 6.484 8 HB2 SER -3 HB2 SER -3 -5.373 35.689 8.603 9 HB3 SER -3 HB3 SER -3 -6.408 34.833 7.444 10 HG SER -3 HG SER -3 -4.221 34.997 6.728 11 HA PRO -2 HA PRO -2 -10.060 37.551 9.945 12 HB2 PRO -2 HB2 PRO -2 -12.337 37.987 8.550 13 HB3 PRO -2 HB3 PRO -2 -11.006 39.182 8.568 14 HG2 PRO -2 HG2 PRO -2 -11.554 37.054 6.465 15 HG3 PRO -2 HG3 PRO -2 -11.303 38.814 6.212 16 HD2 PRO -2 HD2 PRO -2 -9.278 36.983 5.976 17 HD3 PRO -2 HD3 PRO -2 -8.995 38.637 6.600 18 H ASN -1 H ASN -1 -9.473 34.884 8.166 19 HA ASN -1 HA ASN -1 -11.858 33.405 8.042 20 HB2 ASN -1 HB2 ASN -1 -8.990 32.383 8.245 21 HB3 ASN -1 HB3 ASN -1 -10.362 31.492 7.595 22 HD21 ASN -1 HD21 ASN -1 -10.243 33.144 4.436 23 HD22 ASN -1 HD22 ASN -1 -11.176 32.072 5.470 24 H SER 0 H SER 0 -12.792 31.773 9.253 25 HA SER 0 HA SER 0 -12.437 31.889 12.142 26 HB2 SER 0 HB2 SER 0 -14.396 30.366 12.140 27 HB3 SER 0 HB3 SER 0 -14.654 31.847 11.203 28 HG SER 0 HG SER 0 -15.371 29.978 10.071 29 H MET 1 H MET 1 -11.142 29.852 9.694 30 HA MET 1 HA MET 1 -10.029 27.982 11.723 31 HB2 MET 1 HB2 MET 1 -11.275 27.154 9.068 32 HB3 MET 1 HB3 MET 1 -10.338 26.100 10.137 33 HG2 MET 1 HG2 MET 1 -11.990 26.521 11.959 34 HG3 MET 1 HG3 MET 1 -12.991 27.413 10.813 35 HE1 MET 1 HE1 MET 1 -14.271 24.669 8.367 36 HE2 MET 1 HE2 MET 1 -14.327 26.378 8.846 37 HE3 MET 1 HE3 MET 1 -12.855 25.706 8.105 38 H ALA 2 H ALA 2 -8.113 26.883 11.004 39 HA ALA 2 HA ALA 2 -6.616 27.879 8.697 40 HB1 ALA 2 HB1 ALA 2 -5.684 28.562 11.529 41 HB2 ALA 2 HB2 ALA 2 -4.753 28.816 10.037 42 HB3 ALA 2 HB3 ALA 2 -6.253 29.721 10.307 43 H THR 3 H THR 3 -6.503 26.039 11.766 44 HA THR 3 HA THR 3 -5.179 23.777 10.335 45 HB THR 3 HB THR 3 -4.539 24.625 13.188 46 HG1 THR 3 HG1 THR 3 -2.529 25.143 12.353 47 HG21 THR 3 HG21 THR 3 -2.751 22.903 12.993 48 HG22 THR 3 HG22 THR 3 -4.355 22.181 12.844 49 HG23 THR 3 HG23 THR 3 -3.367 22.446 11.389 50 H GLU 4 H GLU 4 -6.831 22.444 10.129 51 HA GLU 4 HA GLU 4 -8.600 21.785 12.435 52 HB2 GLU 4 HB2 GLU 4 -10.547 22.181 11.092 53 HB3 GLU 4 HB3 GLU 4 -9.571 23.632 11.159 54 HG2 GLU 4 HG2 GLU 4 -9.735 21.724 8.784 55 HG3 GLU 4 HG3 GLU 4 -10.585 23.253 8.951 56 H LEU 5 H LEU 5 -6.431 20.255 11.069 57 HA LEU 5 HA LEU 5 -7.672 18.174 9.525 58 HB2 LEU 5 HB2 LEU 5 -5.239 19.216 9.517 59 HB3 LEU 5 HB3 LEU 5 -4.888 17.945 10.674 60 HG LEU 5 HG LEU 5 -5.974 17.673 7.847 61 HD11 LEU 5 HD11 LEU 5 -3.583 18.244 8.005 62 HD12 LEU 5 HD12 LEU 5 -3.306 16.830 9.048 63 HD13 LEU 5 HD13 LEU 5 -3.812 16.613 7.356 64 HD21 LEU 5 HD21 LEU 5 -6.917 15.807 9.121 65 HD22 LEU 5 HD22 LEU 5 -5.638 15.216 8.064 66 HD23 LEU 5 HD23 LEU 5 -5.313 15.428 9.800 67 H GLU 6 H GLU 6 -9.316 17.803 11.218 68 HA GLU 6 HA GLU 6 -8.561 15.445 12.906 69 HB2 GLU 6 HB2 GLU 6 -9.016 17.554 14.216 70 HB3 GLU 6 HB3 GLU 6 -10.681 17.502 13.632 71 HG2 GLU 6 HG2 GLU 6 -10.934 15.234 14.690 72 HG3 GLU 6 HG3 GLU 6 -9.257 15.310 15.221 73 H TYR 7 H TYR 7 -8.982 14.544 10.662 74 HA TYR 7 HA TYR 7 -11.715 13.526 10.390 75 HB2 TYR 7 HB2 TYR 7 -11.910 14.268 8.070 76 HB3 TYR 7 HB3 TYR 7 -11.846 15.628 9.165 77 HD1 TYR 7 HD1 TYR 7 -10.379 17.419 8.719 78 HD2 TYR 7 HD2 TYR 7 -9.650 13.595 6.826 79 HE1 TYR 7 HE1 TYR 7 -8.680 18.458 7.234 80 HE2 TYR 7 HE2 TYR 7 -7.980 14.629 5.364 81 HH TYR 7 HH TYR 7 -7.203 18.141 5.503 82 H GLU 8 H GLU 8 -11.815 11.655 9.154 83 HA GLU 8 HA GLU 8 -10.084 10.811 7.154 84 HB2 GLU 8 HB2 GLU 8 -9.068 10.153 9.858 85 HB3 GLU 8 HB3 GLU 8 -9.466 8.680 8.980 86 HG2 GLU 8 HG2 GLU 8 -8.002 9.242 7.159 87 HG3 GLU 8 HG3 GLU 8 -7.722 10.861 7.779 88 H SER 9 H SER 9 -11.539 9.694 5.981 89 HA SER 9 HA SER 9 -13.577 7.988 7.335 90 HB2 SER 9 HB2 SER 9 -13.203 8.925 4.487 91 HB3 SER 9 HB3 SER 9 -14.326 7.618 4.930 92 HG SER 9 HG SER 9 -15.561 9.376 5.098 93 H VAL 10 H VAL 10 -12.718 6.083 7.967 94 HA VAL 10 HA VAL 10 -10.598 4.657 6.616 95 HB VAL 10 HB VAL 10 -11.131 4.484 9.015 96 HG11 VAL 10 HG11 VAL 10 -13.405 2.637 8.177 97 HG12 VAL 10 HG12 VAL 10 -12.836 2.952 9.827 98 HG13 VAL 10 HG13 VAL 10 -13.604 4.248 8.899 99 HG21 VAL 10 HG21 VAL 10 -9.682 2.837 7.858 100 HG22 VAL 10 HG22 VAL 10 -10.539 2.173 9.254 101 HG23 VAL 10 HG23 VAL 10 -11.101 1.786 7.619 102 H LEU 11 H LEU 11 -10.618 2.761 5.417 103 HA LEU 11 HA LEU 11 -13.109 2.162 3.849 104 HB2 LEU 11 HB2 LEU 11 -10.307 2.748 2.810 105 HB3 LEU 11 HB3 LEU 11 -11.619 2.125 1.824 106 HG LEU 11 HG LEU 11 -11.634 4.842 3.206 107 HD11 LEU 11 HD11 LEU 11 -11.181 4.063 0.298 108 HD12 LEU 11 HD12 LEU 11 -11.388 5.719 0.902 109 HD13 LEU 11 HD13 LEU 11 -9.984 4.771 1.409 110 HD21 LEU 11 HD21 LEU 11 -13.926 3.982 2.863 111 HD22 LEU 11 HD22 LEU 11 -13.581 5.298 1.741 112 HD23 LEU 11 HD23 LEU 11 -13.545 3.619 1.163 113 H CYS 12 H CYS 12 -9.871 1.038 4.862 114 HA CYS 12 HA CYS 12 -10.894 -1.698 5.091 115 HB2 CYS 12 HB2 CYS 12 -10.063 -1.511 2.701 116 HB3 CYS 12 HB3 CYS 12 -8.454 -1.146 3.364 117 HG CYS 12 HG CYS 12 -8.560 -3.632 2.520 118 H VAL 13 H VAL 13 -9.966 -2.713 6.756 119 HA VAL 13 HA VAL 13 -7.298 -1.852 7.750 120 HB VAL 13 HB VAL 13 -9.720 -2.378 9.507 121 HG11 VAL 13 HG11 VAL 13 -8.221 -1.882 11.412 122 HG12 VAL 13 HG12 VAL 13 -7.706 -3.341 10.567 123 HG13 VAL 13 HG13 VAL 13 -6.830 -1.812 10.312 124 HG21 VAL 13 HG21 VAL 13 -9.319 -0.065 10.306 125 HG22 VAL 13 HG22 VAL 13 -8.008 0.119 9.119 126 HG23 VAL 13 HG23 VAL 13 -9.686 -0.095 8.580 127 H LYS 14 H LYS 14 -5.946 -3.482 7.876 128 HA LYS 14 HA LYS 14 -6.927 -6.261 8.248 129 HB2 LYS 14 HB2 LYS 14 -4.772 -5.475 6.253 130 HB3 LYS 14 HB3 LYS 14 -5.223 -7.115 6.669 131 HG2 LYS 14 HG2 LYS 14 -7.091 -5.095 5.351 132 HG3 LYS 14 HG3 LYS 14 -6.159 -6.333 4.508 133 HD2 LYS 14 HD2 LYS 14 -7.354 -8.108 5.755 134 HD3 LYS 14 HD3 LYS 14 -8.334 -6.875 6.577 135 HE2 LYS 14 HE2 LYS 14 -9.199 -6.098 4.400 136 HE3 LYS 14 HE3 LYS 14 -8.211 -7.310 3.573 137 HZ1 LYS 14 HZ1 LYS 14 -10.408 -7.899 5.485 138 HZ2 LYS 14 HZ2 LYS 14 -10.446 -8.137 3.859 139 HZ3 LYS 14 HZ3 LYS 14 -9.442 -9.036 4.798 140 HA PRO 15 HA PRO 15 -3.994 -5.948 11.495 141 HB2 PRO 15 HB2 PRO 15 -4.028 -8.460 12.530 142 HB3 PRO 15 HB3 PRO 15 -5.456 -7.373 12.576 143 HG2 PRO 15 HG2 PRO 15 -4.839 -9.558 10.551 144 HG3 PRO 15 HG3 PRO 15 -6.364 -9.302 11.466 145 HD2 PRO 15 HD2 PRO 15 -6.036 -8.391 8.927 146 HD3 PRO 15 HD3 PRO 15 -6.947 -7.452 10.151 147 H ASP 16 H ASP 16 -3.184 -7.997 8.807 148 HA ASP 16 HA ASP 16 -0.355 -8.241 9.766 149 HB2 ASP 16 HB2 ASP 16 -2.114 -10.357 8.481 150 HB3 ASP 16 HB3 ASP 16 -0.355 -10.446 8.513 151 H VAL 17 H VAL 17 0.644 -6.773 8.605 152 HA VAL 17 HA VAL 17 0.879 -7.296 5.718 153 HB VAL 17 HB VAL 17 -0.767 -5.479 5.851 154 HG11 VAL 17 HG11 VAL 17 1.441 -3.794 7.101 155 HG12 VAL 17 HG12 VAL 17 -0.129 -3.211 6.517 156 HG13 VAL 17 HG13 VAL 17 -0.060 -4.326 7.887 157 HG21 VAL 17 HG21 VAL 17 0.745 -5.660 3.914 158 HG22 VAL 17 HG22 VAL 17 0.255 -3.993 4.244 159 HG23 VAL 17 HG23 VAL 17 1.882 -4.534 4.702 160 H SER 18 H SER 18 2.882 -7.069 4.933 161 HA SER 18 HA SER 18 5.077 -6.417 6.882 162 HB2 SER 18 HB2 SER 18 4.935 -8.606 4.783 163 HB3 SER 18 HB3 SER 18 6.308 -8.276 5.858 164 HG SER 18 HG SER 18 4.907 -9.977 6.610 165 H VAL 19 H VAL 19 6.563 -4.989 6.231 166 HA VAL 19 HA VAL 19 6.506 -3.940 3.451 167 HB VAL 19 HB VAL 19 7.671 -2.822 6.001 168 HG11 VAL 19 HG11 VAL 19 7.833 -1.710 3.155 169 HG12 VAL 19 HG12 VAL 19 8.144 -0.761 4.630 170 HG13 VAL 19 HG13 VAL 19 9.192 -2.117 4.229 171 HG21 VAL 19 HG21 VAL 19 5.567 -1.648 4.146 172 HG22 VAL 19 HG22 VAL 19 5.141 -2.658 5.541 173 HG23 VAL 19 HG23 VAL 19 6.001 -1.134 5.783 174 H TYR 20 H TYR 20 7.986 -4.026 2.063 175 HA TYR 20 HA TYR 20 10.724 -4.867 2.831 176 HB2 TYR 20 HB2 TYR 20 9.691 -5.683 0.152 177 HB3 TYR 20 HB3 TYR 20 10.964 -6.382 1.150 178 HD1 TYR 20 HD1 TYR 20 7.448 -6.456 0.237 179 HD2 TYR 20 HD2 TYR 20 10.332 -7.852 3.099 180 HE1 TYR 20 HE1 TYR 20 5.834 -8.187 0.998 181 HE2 TYR 20 HE2 TYR 20 8.719 -9.592 3.883 182 HH TYR 20 HH TYR 20 5.463 -9.955 2.455 183 H ARG 21 H ARG 21 12.152 -3.464 2.216 184 HA ARG 21 HA ARG 21 11.837 -1.366 0.206 185 HB2 ARG 21 HB2 ARG 21 14.308 -2.766 1.320 186 HB3 ARG 21 HB3 ARG 21 14.389 -1.442 0.171 187 HG2 ARG 21 HG2 ARG 21 13.200 -1.289 2.978 188 HG3 ARG 21 HG3 ARG 21 14.780 -0.686 2.480 189 HD2 ARG 21 HD2 ARG 21 12.048 0.372 1.726 190 HD3 ARG 21 HD3 ARG 21 13.295 1.173 2.663 191 HE ARG 21 HE ARG 21 14.691 1.331 0.628 192 HH11 ARG 21 HH11 ARG 21 14.717 2.029 -1.503 193 HH12 ARG 21 HH12 ARG 21 13.240 2.050 -2.418 194 HH21 ARG 21 HH21 ARG 21 11.279 0.937 0.150 195 HH22 ARG 21 HH22 ARG 21 11.303 1.472 -1.503 196 H ILE 22 H ILE 22 11.981 -1.429 -1.934 197 HA ILE 22 HA ILE 22 12.194 -4.102 -3.212 198 HB ILE 22 HB ILE 22 10.837 -3.221 -5.018 199 HG12 ILE 22 HG12 ILE 22 10.692 -0.618 -3.436 200 HG13 ILE 22 HG13 ILE 22 11.485 -0.857 -4.997 201 HG21 ILE 22 HG21 ILE 22 9.503 -2.650 -2.352 202 HG22 ILE 22 HG22 ILE 22 8.748 -3.245 -3.850 203 HG23 ILE 22 HG23 ILE 22 9.859 -4.280 -2.949 204 HD11 ILE 22 HD11 ILE 22 9.390 0.168 -5.453 205 HD12 ILE 22 HD12 ILE 22 9.231 -1.532 -5.948 206 HD13 ILE 22 HD13 ILE 22 8.513 -0.968 -4.418 207 HA PRO 23 HA PRO 23 15.667 -2.720 -5.740 208 HB2 PRO 23 HB2 PRO 23 15.476 -4.395 -7.888 209 HB3 PRO 23 HB3 PRO 23 15.992 -4.961 -6.269 210 HG2 PRO 23 HG2 PRO 23 13.221 -5.111 -7.503 211 HG3 PRO 23 HG3 PRO 23 14.150 -6.415 -6.693 212 HD2 PRO 23 HD2 PRO 23 12.257 -4.932 -5.399 213 HD3 PRO 23 HD3 PRO 23 13.721 -5.526 -4.560 214 HA PRO 24 HA PRO 24 13.837 0.217 -8.494 215 HB2 PRO 24 HB2 PRO 24 15.725 0.634 -10.445 216 HB3 PRO 24 HB3 PRO 24 15.909 1.179 -8.750 217 HG2 PRO 24 HG2 PRO 24 16.995 -1.360 -10.016 218 HG3 PRO 24 HG3 PRO 24 17.873 -0.162 -9.009 219 HD2 PRO 24 HD2 PRO 24 16.878 -2.443 -7.936 220 HD3 PRO 24 HD3 PRO 24 16.800 -0.902 -7.030 221 H ARG 25 H ARG 25 12.531 0.383 -10.235 222 HA ARG 25 HA ARG 25 11.816 -1.972 -11.798 223 HB2 ARG 25 HB2 ARG 25 10.238 -0.241 -10.926 224 HB3 ARG 25 HB3 ARG 25 10.972 0.924 -12.038 225 HG2 ARG 25 HG2 ARG 25 8.845 0.327 -12.803 226 HG3 ARG 25 HG3 ARG 25 10.013 -0.308 -13.943 227 HD2 ARG 25 HD2 ARG 25 9.595 -2.560 -13.267 228 HD3 ARG 25 HD3 ARG 25 8.854 -2.055 -11.749 229 HE ARG 25 HE ARG 25 7.618 -1.768 -14.475 230 HH11 ARG 25 HH11 ARG 25 5.398 -1.474 -14.568 231 HH12 ARG 25 HH12 ARG 25 4.514 -1.325 -13.039 232 HH21 ARG 25 HH21 ARG 25 7.076 -1.680 -10.953 233 HH22 ARG 25 HH22 ARG 25 5.352 -1.422 -11.244 234 H ALA 26 H ALA 26 11.857 -2.195 -13.948 235 HA ALA 26 HA ALA 26 13.734 -0.655 -15.653 236 HB1 ALA 26 HB1 ALA 26 12.013 -3.120 -16.044 237 HB2 ALA 26 HB2 ALA 26 13.117 -2.439 -17.285 238 HB3 ALA 26 HB3 ALA 26 13.758 -3.069 -15.746 239 H SER 27 H SER 27 10.814 -1.831 -17.062 240 HA SER 27 HA SER 27 9.084 0.378 -16.302 241 HB2 SER 27 HB2 SER 27 9.949 0.121 -19.205 242 HB3 SER 27 HB3 SER 27 8.400 0.845 -18.734 243 HG SER 27 HG SER 27 10.805 1.704 -17.527 244 H ASN 28 H ASN 28 9.092 -1.959 -19.041 245 HA ASN 28 HA ASN 28 6.379 -2.768 -18.330 246 HB2 ASN 28 HB2 ASN 28 6.378 -3.848 -20.510 247 HB3 ASN 28 HB3 ASN 28 6.967 -2.200 -20.626 248 HD21 ASN 28 HD21 ASN 28 9.982 -3.235 -22.142 249 HD22 ASN 28 HD22 ASN 28 8.844 -1.937 -21.823 250 H ARG 29 H ARG 29 9.378 -4.066 -17.425 251 HA ARG 29 HA ARG 29 8.843 -6.904 -17.439 252 HB2 ARG 29 HB2 ARG 29 10.615 -5.253 -15.599 253 HB3 ARG 29 HB3 ARG 29 10.568 -7.016 -15.681 254 HG2 ARG 29 HG2 ARG 29 11.281 -6.911 -18.081 255 HG3 ARG 29 HG3 ARG 29 11.428 -5.137 -17.926 256 HD2 ARG 29 HD2 ARG 29 12.913 -5.487 -15.950 257 HD3 ARG 29 HD3 ARG 29 12.818 -7.233 -16.227 258 HE ARG 29 HE ARG 29 13.679 -5.987 -18.651 259 HH11 ARG 29 HH11 ARG 29 15.787 -6.011 -19.343 260 HH12 ARG 29 HH12 ARG 29 17.072 -6.303 -18.208 261 HH21 ARG 29 HH21 ARG 29 15.023 -6.642 -15.481 262 HH22 ARG 29 HH22 ARG 29 16.660 -6.649 -16.079 263 H GLY 30 H GLY 30 8.663 -4.537 -14.767 264 HA2 GLY 30 HA2 GLY 30 7.002 -4.299 -13.190 265 HA3 GLY 30 HA3 GLY 30 6.300 -5.858 -13.629 266 H TYR 31 H TYR 31 6.770 -4.888 -11.021 267 HA TYR 31 HA TYR 31 8.941 -6.342 -9.782 268 HB2 TYR 31 HB2 TYR 31 6.313 -5.359 -8.632 269 HB3 TYR 31 HB3 TYR 31 7.771 -5.771 -7.739 270 HD1 TYR 31 HD1 TYR 31 5.986 -3.164 -7.936 271 HD2 TYR 31 HD2 TYR 31 9.778 -4.282 -9.671 272 HE1 TYR 31 HE1 TYR 31 6.705 -0.786 -7.911 273 HE2 TYR 31 HE2 TYR 31 10.557 -1.949 -9.474 274 HH TYR 31 HH TYR 31 8.422 0.693 -8.279 275 H ARG 32 H ARG 32 8.688 -8.387 -8.729 276 HA ARG 32 HA ARG 32 6.293 -10.024 -9.519 277 HB2 ARG 32 HB2 ARG 32 7.858 -11.901 -10.091 278 HB3 ARG 32 HB3 ARG 32 7.771 -10.575 -11.219 279 HG2 ARG 32 HG2 ARG 32 9.975 -10.574 -9.139 280 HG3 ARG 32 HG3 ARG 32 10.098 -11.633 -10.552 281 HD2 ARG 32 HD2 ARG 32 9.866 -9.774 -12.088 282 HD3 ARG 32 HD3 ARG 32 9.584 -8.649 -10.763 283 HE ARG 32 HE ARG 32 12.121 -9.909 -10.358 284 HH11 ARG 32 HH11 ARG 32 13.917 -8.903 -10.662 285 HH12 ARG 32 HH12 ARG 32 14.061 -7.479 -11.691 286 HH21 ARG 32 HH21 ARG 32 10.649 -7.388 -12.345 287 HH22 ARG 32 HH22 ARG 32 12.201 -6.631 -12.615 288 H ALA 33 H ALA 33 7.039 -8.889 -6.995 289 HA ALA 33 HA ALA 33 7.196 -9.255 -4.790 290 HB1 ALA 33 HB1 ALA 33 5.845 -11.862 -5.547 291 HB2 ALA 33 HB2 ALA 33 5.759 -11.019 -3.975 292 HB3 ALA 33 HB3 ALA 33 5.066 -10.287 -5.449 293 H SER 34 H SER 34 8.333 -12.248 -6.407 294 HA SER 34 HA SER 34 9.914 -13.277 -4.298 295 HB2 SER 34 HB2 SER 34 10.848 -14.710 -6.053 296 HB3 SER 34 HB3 SER 34 9.084 -14.559 -6.209 297 HG SER 34 HG SER 34 10.169 -14.321 -8.228 298 H ASP 35 H ASP 35 10.621 -10.652 -6.460 299 HA ASP 35 HA ASP 35 13.520 -10.747 -6.022 300 HB2 ASP 35 HB2 ASP 35 11.741 -9.465 -7.870 301 HB3 ASP 35 HB3 ASP 35 12.584 -8.191 -7.022 302 H TRP 36 H TRP 36 10.932 -9.759 -4.036 303 HA TRP 36 HA TRP 36 12.441 -7.636 -2.651 304 HB2 TRP 36 HB2 TRP 36 9.705 -8.748 -2.016 305 HB3 TRP 36 HB3 TRP 36 10.417 -7.247 -1.471 306 HD1 TRP 36 HD1 TRP 36 11.156 -6.816 -4.902 307 HE1 TRP 36 HE1 TRP 36 9.280 -5.615 -6.209 308 HE3 TRP 36 HE3 TRP 36 7.274 -7.600 -1.668 309 HZ2 TRP 36 HZ2 TRP 36 6.547 -4.914 -5.793 310 HZ3 TRP 36 HZ3 TRP 36 5.045 -6.566 -2.107 311 HH2 TRP 36 HH2 TRP 36 4.681 -5.231 -4.153 312 H LYS 37 H LYS 37 12.292 -7.799 -0.228 313 HA LYS 37 HA LYS 37 13.624 -10.252 0.641 314 HB2 LYS 37 HB2 LYS 37 13.024 -7.704 2.193 315 HB3 LYS 37 HB3 LYS 37 14.041 -9.050 2.704 316 HG2 LYS 37 HG2 LYS 37 15.258 -8.546 0.356 317 HG3 LYS 37 HG3 LYS 37 14.608 -6.933 0.668 318 HD2 LYS 37 HD2 LYS 37 16.463 -8.607 2.399 319 HD3 LYS 37 HD3 LYS 37 16.863 -7.099 1.582 320 HE2 LYS 37 HE2 LYS 37 14.849 -7.383 3.871 321 HE3 LYS 37 HE3 LYS 37 16.539 -6.931 4.081 322 HZ1 LYS 37 HZ1 LYS 37 14.510 -5.356 2.591 323 HZ2 LYS 37 HZ2 LYS 37 15.183 -4.945 3.990 324 HZ3 LYS 37 HZ3 LYS 37 16.113 -4.976 2.644 325 H LEU 38 H LEU 38 11.336 -11.248 0.067 326 HA LEU 38 HA LEU 38 9.110 -11.058 1.710 327 HB2 LEU 38 HB2 LEU 38 10.220 -13.503 0.283 328 HB3 LEU 38 HB3 LEU 38 8.570 -13.358 0.891 329 HG LEU 38 HG LEU 38 9.824 -11.694 -1.327 330 HD11 LEU 38 HD11 LEU 38 7.565 -13.753 -1.286 331 HD12 LEU 38 HD12 LEU 38 8.100 -12.846 -2.708 332 HD13 LEU 38 HD13 LEU 38 9.198 -14.009 -1.944 333 HD21 LEU 38 HD21 LEU 38 8.288 -10.227 -0.175 334 HD22 LEU 38 HD22 LEU 38 7.469 -10.810 -1.625 335 HD23 LEU 38 HD23 LEU 38 7.080 -11.526 -0.045 336 H ASP 39 H ASP 39 12.009 -12.884 2.519 337 HA ASP 39 HA ASP 39 10.671 -14.255 4.791 338 HB2 ASP 39 HB2 ASP 39 12.235 -15.437 3.247 339 HB3 ASP 39 HB3 ASP 39 13.536 -14.380 3.789 340 H GLN 40 H GLN 40 12.080 -11.267 4.276 341 HA GLN 40 HA GLN 40 13.240 -10.926 7.018 342 HB2 GLN 40 HB2 GLN 40 14.522 -10.389 4.310 343 HB3 GLN 40 HB3 GLN 40 15.202 -9.828 5.842 344 HG2 GLN 40 HG2 GLN 40 15.741 -11.961 6.551 345 HG3 GLN 40 HG3 GLN 40 14.634 -12.747 5.425 346 HE21 GLN 40 HE21 GLN 40 16.806 -12.561 2.578 347 HE22 GLN 40 HE22 GLN 40 15.112 -12.607 3.044 348 HA PRO 41 HA PRO 41 10.713 -7.522 5.217 349 HB2 PRO 41 HB2 PRO 41 8.824 -7.023 7.261 350 HB3 PRO 41 HB3 PRO 41 8.591 -8.160 5.907 351 HG2 PRO 41 HG2 PRO 41 9.632 -8.774 8.691 352 HG3 PRO 41 HG3 PRO 41 8.393 -9.666 7.752 353 HD2 PRO 41 HD2 PRO 41 10.970 -10.519 7.868 354 HD3 PRO 41 HD3 PRO 41 10.030 -10.639 6.348 355 H ASP 42 H ASP 42 11.009 -5.346 5.518 356 HA ASP 42 HA ASP 42 13.051 -4.500 7.432 357 HB2 ASP 42 HB2 ASP 42 11.358 -2.969 5.413 358 HB3 ASP 42 HB3 ASP 42 12.683 -2.274 6.353 359 H TRP 43 H TRP 43 9.566 -4.419 7.253 360 HA TRP 43 HA TRP 43 9.381 -3.895 10.117 361 HB2 TRP 43 HB2 TRP 43 9.424 -1.592 9.394 362 HB3 TRP 43 HB3 TRP 43 8.291 -1.910 8.095 363 HD1 TRP 43 HD1 TRP 43 8.419 -1.072 11.775 364 HE1 TRP 43 HE1 TRP 43 6.054 -0.482 12.585 365 HE3 TRP 43 HE3 TRP 43 5.758 -2.777 7.768 366 HZ2 TRP 43 HZ2 TRP 43 3.378 -0.451 11.473 367 HZ3 TRP 43 HZ3 TRP 43 3.300 -2.306 7.601 368 HH2 TRP 43 HH2 TRP 43 2.109 -1.188 9.459 369 H THR 44 H THR 44 7.292 -4.495 10.980 370 HA THR 44 HA THR 44 5.256 -5.507 9.074 371 HB THR 44 HB THR 44 4.761 -7.434 10.532 372 HG1 THR 44 HG1 THR 44 6.404 -8.117 11.964 373 HG21 THR 44 HG21 THR 44 6.488 -8.897 9.725 374 HG22 THR 44 HG22 THR 44 6.108 -7.689 8.491 375 HG23 THR 44 HG23 THR 44 7.593 -7.522 9.459 376 H GLY 45 H GLY 45 3.163 -5.291 9.684 377 HA2 GLY 45 HA2 GLY 45 2.233 -4.627 12.315 378 HA3 GLY 45 HA3 GLY 45 2.504 -3.155 11.402 379 H ARG 46 H ARG 46 0.475 -2.522 11.193 380 HA ARG 46 HA ARG 46 -1.618 -4.299 10.000 381 HB2 ARG 46 HB2 ARG 46 -1.954 -1.939 11.876 382 HB3 ARG 46 HB3 ARG 46 -3.224 -3.027 11.305 383 HG2 ARG 46 HG2 ARG 46 -2.109 -4.917 12.550 384 HG3 ARG 46 HG3 ARG 46 -0.916 -3.787 13.171 385 HD2 ARG 46 HD2 ARG 46 -3.920 -3.512 13.629 386 HD3 ARG 46 HD3 ARG 46 -2.799 -4.283 14.747 387 HE ARG 46 HE ARG 46 -1.717 -2.192 15.182 388 HH11 ARG 46 HH11 ARG 46 -1.604 -0.085 15.321 389 HH12 ARG 46 HH12 ARG 46 -2.830 0.926 14.516 390 HH21 ARG 46 HH21 ARG 46 -4.541 -1.560 13.103 391 HH22 ARG 46 HH22 ARG 46 -4.256 0.172 13.317 392 H LEU 47 H LEU 47 -3.047 -3.440 8.579 393 HA LEU 47 HA LEU 47 -2.174 -1.114 6.950 394 HB2 LEU 47 HB2 LEU 47 -2.585 -3.290 5.843 395 HB3 LEU 47 HB3 LEU 47 -4.193 -3.347 6.559 396 HG LEU 47 HG LEU 47 -4.840 -1.314 5.219 397 HD11 LEU 47 HD11 LEU 47 -2.159 -1.826 3.850 398 HD12 LEU 47 HD12 LEU 47 -3.436 -0.742 3.260 399 HD13 LEU 47 HD13 LEU 47 -2.595 -0.368 4.769 400 HD21 LEU 47 HD21 LEU 47 -5.409 -3.580 4.522 401 HD22 LEU 47 HD22 LEU 47 -5.062 -2.566 3.124 402 HD23 LEU 47 HD23 LEU 47 -3.840 -3.728 3.700 403 H ARG 48 H ARG 48 -3.354 0.728 6.786 404 HA ARG 48 HA ARG 48 -6.242 0.791 7.515 405 HB2 ARG 48 HB2 ARG 48 -5.064 1.567 9.503 406 HB3 ARG 48 HB3 ARG 48 -4.040 2.633 8.549 407 HG2 ARG 48 HG2 ARG 48 -5.986 4.085 8.024 408 HG3 ARG 48 HG3 ARG 48 -7.046 2.997 8.959 409 HD2 ARG 48 HD2 ARG 48 -5.700 3.360 10.954 410 HD3 ARG 48 HD3 ARG 48 -4.545 4.360 10.050 411 HE ARG 48 HE ARG 48 -6.669 5.888 9.704 412 HH11 ARG 48 HH11 ARG 48 -7.542 7.181 12.743 413 HH12 ARG 48 HH12 ARG 48 -7.438 7.407 11.005 414 HH21 ARG 48 HH21 ARG 48 -5.378 4.543 12.657 415 HH22 ARG 48 HH22 ARG 48 -6.396 5.539 13.665 416 H ILE 49 H ILE 49 -6.937 0.956 5.496 417 HA ILE 49 HA ILE 49 -5.912 3.111 3.719 418 HB ILE 49 HB ILE 49 -8.172 1.176 3.157 419 HG12 ILE 49 HG12 ILE 49 -5.204 1.008 2.444 420 HG13 ILE 49 HG13 ILE 49 -6.123 -0.101 3.470 421 HG21 ILE 49 HG21 ILE 49 -6.546 2.992 1.314 422 HG22 ILE 49 HG22 ILE 49 -7.879 1.923 0.826 423 HG23 ILE 49 HG23 ILE 49 -8.206 3.307 1.852 424 HD11 ILE 49 HD11 ILE 49 -7.595 -0.554 1.421 425 HD12 ILE 49 HD12 ILE 49 -6.283 0.195 0.476 426 HD13 ILE 49 HD13 ILE 49 -5.980 -1.240 1.479 427 H THR 50 H THR 50 -6.895 4.959 3.497 428 HA THR 50 HA THR 50 -9.439 5.612 4.865 429 HB THR 50 HB THR 50 -7.764 7.676 5.644 430 HG1 THR 50 HG1 THR 50 -5.975 6.071 5.035 431 HG21 THR 50 HG21 THR 50 -8.417 5.119 7.162 432 HG22 THR 50 HG22 THR 50 -7.815 6.607 7.898 433 HG23 THR 50 HG23 THR 50 -9.396 6.615 7.111 434 H SER 51 H SER 51 -10.121 7.964 4.371 435 HA SER 51 HA SER 51 -8.696 9.335 2.194 436 HB2 SER 51 HB2 SER 51 -10.099 7.738 0.944 437 HB3 SER 51 HB3 SER 51 -11.528 8.274 1.843 438 HG SER 51 HG SER 51 -9.896 9.996 0.245 439 H LYS 52 H LYS 52 -9.135 11.441 1.993 440 HA LYS 52 HA LYS 52 -11.743 12.310 2.712 441 HB2 LYS 52 HB2 LYS 52 -10.357 12.692 4.839 442 HB3 LYS 52 HB3 LYS 52 -9.519 13.944 3.924 443 HG2 LYS 52 HG2 LYS 52 -11.315 14.852 5.311 444 HG3 LYS 52 HG3 LYS 52 -11.589 15.166 3.605 445 HD2 LYS 52 HD2 LYS 52 -13.651 14.607 4.829 446 HD3 LYS 52 HD3 LYS 52 -13.330 13.432 3.550 447 HE2 LYS 52 HE2 LYS 52 -12.513 11.802 5.134 448 HE3 LYS 52 HE3 LYS 52 -12.585 12.968 6.465 449 HZ1 LYS 52 HZ1 LYS 52 -14.985 12.155 4.924 450 HZ2 LYS 52 HZ2 LYS 52 -14.530 11.372 6.261 451 HZ3 LYS 52 HZ3 LYS 52 -14.964 12.961 6.346 452 H GLY 53 H GLY 53 -12.492 13.635 1.232 453 HA2 GLY 53 HA2 GLY 53 -12.688 15.395 -0.251 454 HA3 GLY 53 HA3 GLY 53 -11.143 15.985 0.361 455 H LYS 54 H LYS 54 -12.063 13.104 -1.541 456 HA LYS 54 HA LYS 54 -11.318 12.164 -3.461 457 HB2 LYS 54 HB2 LYS 54 -10.814 14.996 -4.425 458 HB3 LYS 54 HB3 LYS 54 -10.869 13.546 -5.432 459 HG2 LYS 54 HG2 LYS 54 -13.211 13.134 -4.743 460 HG3 LYS 54 HG3 LYS 54 -13.209 14.638 -3.812 461 HD2 LYS 54 HD2 LYS 54 -12.768 14.414 -6.821 462 HD3 LYS 54 HD3 LYS 54 -14.280 14.877 -6.026 463 HE2 LYS 54 HE2 LYS 54 -13.138 16.840 -4.999 464 HE3 LYS 54 HE3 LYS 54 -11.646 16.407 -5.845 465 HZ1 LYS 54 HZ1 LYS 54 -12.828 16.722 -7.955 466 HZ2 LYS 54 HZ2 LYS 54 -14.207 17.127 -7.173 467 HZ3 LYS 54 HZ3 LYS 54 -12.895 18.088 -7.068 468 H THR 55 H THR 55 -9.503 12.613 -1.256 469 HA THR 55 HA THR 55 -7.058 11.701 -2.673 470 HB THR 55 HB THR 55 -7.060 13.349 -0.111 471 HG1 THR 55 HG1 THR 55 -7.465 14.670 -1.871 472 HG21 THR 55 HG21 THR 55 -4.813 12.301 -1.876 473 HG22 THR 55 HG22 THR 55 -4.615 13.401 -0.490 474 HG23 THR 55 HG23 THR 55 -5.208 11.754 -0.229 475 H ALA 56 H ALA 56 -6.619 9.663 -2.085 476 HA ALA 56 HA ALA 56 -7.798 8.536 0.411 477 HB1 ALA 56 HB1 ALA 56 -6.593 7.084 -1.955 478 HB2 ALA 56 HB2 ALA 56 -7.302 6.343 -0.509 479 HB3 ALA 56 HB3 ALA 56 -8.331 7.276 -1.607 480 H TYR 57 H TYR 57 -6.427 7.200 1.696 481 HA TYR 57 HA TYR 57 -3.557 8.007 1.845 482 HB2 TYR 57 HB2 TYR 57 -5.622 8.105 4.092 483 HB3 TYR 57 HB3 TYR 57 -3.912 8.472 4.234 484 HD1 TYR 57 HD1 TYR 57 -3.079 10.395 2.537 485 HD2 TYR 57 HD2 TYR 57 -7.117 9.968 4.038 486 HE1 TYR 57 HE1 TYR 57 -3.506 12.809 2.119 487 HE2 TYR 57 HE2 TYR 57 -7.523 12.368 3.615 488 HH TYR 57 HH TYR 57 -5.011 14.532 2.261 489 H ILE 58 H ILE 58 -2.610 5.987 1.547 490 HA ILE 58 HA ILE 58 -3.617 3.658 3.145 491 HB ILE 58 HB ILE 58 -1.317 3.798 1.158 492 HG12 ILE 58 HG12 ILE 58 -2.790 2.001 -0.001 493 HG13 ILE 58 HG13 ILE 58 -4.124 2.632 0.956 494 HG21 ILE 58 HG21 ILE 58 -2.442 1.435 2.723 495 HG22 ILE 58 HG22 ILE 58 -1.172 1.360 1.479 496 HG23 ILE 58 HG23 ILE 58 -0.854 2.190 2.985 497 HD11 ILE 58 HD11 ILE 58 -3.950 3.515 -1.385 498 HD12 ILE 58 HD12 ILE 58 -3.905 4.808 -0.182 499 HD13 ILE 58 HD13 ILE 58 -2.397 4.258 -0.966 500 H LYS 59 H LYS 59 -3.245 3.983 5.210 501 HA LYS 59 HA LYS 59 -0.533 4.870 6.091 502 HB2 LYS 59 HB2 LYS 59 -3.146 4.837 7.653 503 HB3 LYS 59 HB3 LYS 59 -1.576 5.440 8.202 504 HG2 LYS 59 HG2 LYS 59 -1.692 6.941 6.038 505 HG3 LYS 59 HG3 LYS 59 -3.416 6.580 6.071 506 HD2 LYS 59 HD2 LYS 59 -3.598 7.575 8.323 507 HD3 LYS 59 HD3 LYS 59 -1.838 7.862 8.349 508 HE2 LYS 59 HE2 LYS 59 -2.029 9.321 6.357 509 HE3 LYS 59 HE3 LYS 59 -3.778 9.039 6.313 510 HZ1 LYS 59 HZ1 LYS 59 -2.386 10.315 8.603 511 HZ2 LYS 59 HZ2 LYS 59 -3.187 11.131 7.431 512 HZ3 LYS 59 HZ3 LYS 59 -4.011 10.126 8.415 513 H LEU 60 H LEU 60 0.726 3.686 7.271 514 HA LEU 60 HA LEU 60 -0.054 0.881 7.989 515 HB2 LEU 60 HB2 LEU 60 2.417 2.163 6.871 516 HB3 LEU 60 HB3 LEU 60 2.652 0.915 8.081 517 HG LEU 60 HG LEU 60 1.488 -0.736 6.805 518 HD11 LEU 60 HD11 LEU 60 -0.261 0.505 5.646 519 HD12 LEU 60 HD12 LEU 60 0.949 1.444 4.738 520 HD13 LEU 60 HD13 LEU 60 0.746 -0.299 4.447 521 HD21 LEU 60 HD21 LEU 60 3.032 -0.917 4.926 522 HD22 LEU 60 HD22 LEU 60 3.385 0.825 4.994 523 HD23 LEU 60 HD23 LEU 60 3.883 -0.245 6.319 524 H GLU 61 H GLU 61 -0.000 0.257 10.056 525 HA GLU 61 HA GLU 61 1.029 2.164 12.142 526 HB2 GLU 61 HB2 GLU 61 -1.583 0.633 12.204 527 HB3 GLU 61 HB3 GLU 61 -0.909 1.652 13.492 528 HG2 GLU 61 HG2 GLU 61 -1.133 3.634 12.015 529 HG3 GLU 61 HG3 GLU 61 -1.934 2.616 10.804 530 H ASP 62 H ASP 62 1.756 1.226 14.135 531 HA ASP 62 HA ASP 62 2.685 -1.502 13.861 532 HB2 ASP 62 HB2 ASP 62 3.990 0.292 14.971 533 HB3 ASP 62 HB3 ASP 62 2.756 0.337 16.256 534 H LYS 63 H LYS 63 2.296 -3.210 15.253 535 HA LYS 63 HA LYS 63 -0.520 -3.475 16.071 536 HB2 LYS 63 HB2 LYS 63 -0.314 -5.816 15.729 537 HB3 LYS 63 HB3 LYS 63 0.364 -5.021 14.324 538 HG2 LYS 63 HG2 LYS 63 2.057 -6.131 16.570 539 HG3 LYS 63 HG3 LYS 63 1.530 -7.045 15.153 540 HD2 LYS 63 HD2 LYS 63 3.037 -6.130 13.752 541 HD3 LYS 63 HD3 LYS 63 2.918 -4.528 14.448 542 HE2 LYS 63 HE2 LYS 63 4.233 -5.571 16.474 543 HE3 LYS 63 HE3 LYS 63 4.654 -6.832 15.305 544 HZ1 LYS 63 HZ1 LYS 63 5.190 -3.910 15.079 545 HZ2 LYS 63 HZ2 LYS 63 6.312 -5.100 15.213 546 HZ3 LYS 63 HZ3 LYS 63 5.428 -4.939 13.833 547 H VAL 64 H VAL 64 2.186 -2.729 17.723 548 HA VAL 64 HA VAL 64 1.019 -3.839 20.247 549 HB VAL 64 HB VAL 64 3.911 -3.063 19.702 550 HG11 VAL 64 HG11 VAL 64 2.604 -4.329 22.149 551 HG12 VAL 64 HG12 VAL 64 4.353 -4.123 21.907 552 HG13 VAL 64 HG13 VAL 64 3.321 -2.703 22.054 553 HG21 VAL 64 HG21 VAL 64 3.393 -5.172 18.556 554 HG22 VAL 64 HG22 VAL 64 4.390 -5.495 19.973 555 HG23 VAL 64 HG23 VAL 64 2.641 -5.821 20.032 556 H SER 65 H SER 65 2.684 -0.990 18.793 557 HA SER 65 HA SER 65 1.910 0.622 21.157 558 HB2 SER 65 HB2 SER 65 3.679 1.231 18.766 559 HB3 SER 65 HB3 SER 65 3.396 2.328 20.133 560 HG SER 65 HG SER 65 5.308 1.067 20.374 561 H GLY 66 H GLY 66 0.848 0.207 17.863 562 HA2 GLY 66 HA2 GLY 66 -1.035 1.078 16.815 563 HA3 GLY 66 HA3 GLY 66 -1.356 2.105 18.213 564 H GLU 67 H GLU 67 1.852 2.458 17.176 565 HA GLU 67 HA GLU 67 1.364 5.196 16.374 566 HB2 GLU 67 HB2 GLU 67 3.701 5.489 16.586 567 HB3 GLU 67 HB3 GLU 67 3.156 4.456 17.916 568 HG2 GLU 67 HG2 GLU 67 4.009 2.458 16.709 569 HG3 GLU 67 HG3 GLU 67 4.579 3.491 15.397 570 H LEU 68 H LEU 68 2.065 6.224 14.460 571 HA LEU 68 HA LEU 68 1.549 4.725 12.035 572 HB2 LEU 68 HB2 LEU 68 0.877 7.120 12.437 573 HB3 LEU 68 HB3 LEU 68 2.583 7.561 12.418 574 HG LEU 68 HG LEU 68 2.670 6.586 10.026 575 HD11 LEU 68 HD11 LEU 68 -0.359 6.863 10.289 576 HD12 LEU 68 HD12 LEU 68 0.554 6.485 8.808 577 HD13 LEU 68 HD13 LEU 68 0.504 5.325 10.136 578 HD21 LEU 68 HD21 LEU 68 0.881 8.991 10.559 579 HD22 LEU 68 HD22 LEU 68 2.658 9.001 10.486 580 HD23 LEU 68 HD23 LEU 68 1.721 8.621 9.033 581 H PHE 69 H PHE 69 2.952 3.662 10.793 582 HA PHE 69 HA PHE 69 5.891 3.952 11.119 583 HB2 PHE 69 HB2 PHE 69 5.126 1.712 10.998 584 HB3 PHE 69 HB3 PHE 69 4.095 2.035 9.614 585 HD1 PHE 69 HD1 PHE 69 7.719 2.065 10.629 586 HD2 PHE 69 HD2 PHE 69 4.872 1.592 7.422 587 HE1 PHE 69 HE1 PHE 69 9.562 1.465 9.075 588 HE2 PHE 69 HE2 PHE 69 6.722 1.055 5.864 589 HZ PHE 69 HZ PHE 69 9.067 0.966 6.687 590 H ALA 70 H ALA 70 3.484 4.131 8.448 591 HA ALA 70 HA ALA 70 4.867 6.393 7.206 592 HB1 ALA 70 HB1 ALA 70 5.312 5.208 5.108 593 HB2 ALA 70 HB2 ALA 70 6.169 4.401 6.422 594 HB3 ALA 70 HB3 ALA 70 4.668 3.694 5.781 595 H GLN 71 H GLN 71 3.656 7.255 5.341 596 HA GLN 71 HA GLN 71 0.922 6.210 4.959 597 HB2 GLN 71 HB2 GLN 71 -0.140 8.339 5.325 598 HB3 GLN 71 HB3 GLN 71 0.686 7.788 6.769 599 HG2 GLN 71 HG2 GLN 71 1.411 9.920 6.893 600 HG3 GLN 71 HG3 GLN 71 2.648 9.399 5.766 601 HE21 GLN 71 HE21 GLN 71 1.580 11.998 3.600 602 HE22 GLN 71 HE22 GLN 71 2.921 11.050 4.257 603 H ALA 72 H ALA 72 0.181 6.327 2.952 604 HA ALA 72 HA ALA 72 1.690 7.881 0.882 605 HB1 ALA 72 HB1 ALA 72 1.074 6.008 -0.630 606 HB2 ALA 72 HB2 ALA 72 2.119 5.501 0.706 607 HB3 ALA 72 HB3 ALA 72 0.391 5.137 0.755 608 HA PRO 73 HA PRO 73 -2.455 9.749 0.303 609 HB2 PRO 73 HB2 PRO 73 -0.586 11.753 -0.946 610 HB3 PRO 73 HB3 PRO 73 -2.071 12.035 0.015 611 HG2 PRO 73 HG2 PRO 73 0.377 12.334 1.131 612 HG3 PRO 73 HG3 PRO 73 -0.942 11.522 2.045 613 HD2 PRO 73 HD2 PRO 73 1.342 10.252 0.518 614 HD3 PRO 73 HD3 PRO 73 0.709 9.849 2.136 615 H VAL 74 H VAL 74 -3.631 9.553 -1.518 616 HA VAL 74 HA VAL 74 -2.358 9.121 -4.180 617 HB VAL 74 HB VAL 74 -4.760 7.547 -3.168 618 HG11 VAL 74 HG11 VAL 74 -4.514 7.651 -5.598 619 HG12 VAL 74 HG12 VAL 74 -2.845 7.048 -5.482 620 HG13 VAL 74 HG13 VAL 74 -4.212 6.015 -5.018 621 HG21 VAL 74 HG21 VAL 74 -2.990 6.840 -1.693 622 HG22 VAL 74 HG22 VAL 74 -3.338 5.582 -2.870 623 HG23 VAL 74 HG23 VAL 74 -1.885 6.587 -3.060 624 H GLU 75 H GLU 75 -3.297 10.461 -5.725 625 HA GLU 75 HA GLU 75 -5.685 12.027 -4.939 626 HB2 GLU 75 HB2 GLU 75 -3.889 12.137 -7.392 627 HB3 GLU 75 HB3 GLU 75 -5.237 13.235 -7.069 628 HG2 GLU 75 HG2 GLU 75 -4.150 13.935 -4.936 629 HG3 GLU 75 HG3 GLU 75 -2.765 12.909 -5.314 630 H GLN 76 H GLN 76 -5.027 9.325 -7.043 631 HA GLN 76 HA GLN 76 -7.812 8.712 -7.297 632 HB2 GLN 76 HB2 GLN 76 -8.155 8.824 -9.621 633 HB3 GLN 76 HB3 GLN 76 -7.606 10.410 -9.144 634 HG2 GLN 76 HG2 GLN 76 -5.956 8.292 -10.588 635 HG3 GLN 76 HG3 GLN 76 -6.677 9.722 -11.297 636 HE21 GLN 76 HE21 GLN 76 -3.114 10.061 -9.325 637 HE22 GLN 76 HE22 GLN 76 -4.076 8.578 -9.167 638 H TYR 77 H TYR 77 -8.155 6.545 -8.020 639 HA TYR 77 HA TYR 77 -5.706 4.906 -8.422 640 HB2 TYR 77 HB2 TYR 77 -6.700 4.626 -6.180 641 HB3 TYR 77 HB3 TYR 77 -8.205 4.106 -6.949 642 HD1 TYR 77 HD1 TYR 77 -4.539 3.310 -6.898 643 HD2 TYR 77 HD2 TYR 77 -8.560 1.821 -7.322 644 HE1 TYR 77 HE1 TYR 77 -3.663 0.991 -7.109 645 HE2 TYR 77 HE2 TYR 77 -7.683 -0.516 -7.425 646 HH TYR 77 HH TYR 77 -4.180 -1.235 -7.314 647 HA PRO 78 HA PRO 78 -4.946 3.100 -9.635 648 HB2 PRO 78 HB2 PRO 78 -4.801 3.243 -12.632 649 HB3 PRO 78 HB3 PRO 78 -4.138 2.006 -11.519 650 HG2 PRO 78 HG2 PRO 78 -6.400 1.493 -12.910 651 HG3 PRO 78 HG3 PRO 78 -6.315 1.056 -11.169 652 HD2 PRO 78 HD2 PRO 78 -7.541 3.544 -12.417 653 HD3 PRO 78 HD3 PRO 78 -8.254 2.423 -11.217 654 H GLY 79 H GLY 79 -3.000 4.226 -9.624 655 HA2 GLY 79 HA2 GLY 79 -2.526 6.693 -11.131 656 HA3 GLY 79 HA3 GLY 79 -2.830 6.924 -9.404 657 H ILE 80 H ILE 80 -0.586 7.827 -9.512 658 HA ILE 80 HA ILE 80 1.638 6.014 -9.990 659 HB ILE 80 HB ILE 80 1.847 8.365 -10.490 660 HG12 ILE 80 HG12 ILE 80 3.703 7.606 -8.195 661 HG13 ILE 80 HG13 ILE 80 3.839 7.000 -9.847 662 HG21 ILE 80 HG21 ILE 80 1.699 8.983 -7.501 663 HG22 ILE 80 HG22 ILE 80 1.912 10.135 -8.831 664 HG23 ILE 80 HG23 ILE 80 0.382 9.290 -8.655 665 HD11 ILE 80 HD11 ILE 80 5.449 8.754 -9.491 666 HD12 ILE 80 HD12 ILE 80 4.220 9.348 -10.631 667 HD13 ILE 80 HD13 ILE 80 4.206 9.879 -8.927 668 H ALA 81 H ALA 81 -0.029 7.071 -7.036 669 HA ALA 81 HA ALA 81 2.149 6.187 -5.305 670 HB1 ALA 81 HB1 ALA 81 -0.591 7.367 -4.738 671 HB2 ALA 81 HB2 ALA 81 0.689 7.118 -3.530 672 HB3 ALA 81 HB3 ALA 81 0.938 8.256 -4.867 673 H VAL 82 H VAL 82 0.230 4.234 -6.869 674 HA VAL 82 HA VAL 82 0.394 2.123 -4.855 675 HB VAL 82 HB VAL 82 -2.249 2.719 -6.190 676 HG11 VAL 82 HG11 VAL 82 -1.421 0.668 -4.072 677 HG12 VAL 82 HG12 VAL 82 -3.091 0.922 -4.616 678 HG13 VAL 82 HG13 VAL 82 -1.881 0.298 -5.740 679 HG21 VAL 82 HG21 VAL 82 -3.205 3.172 -3.968 680 HG22 VAL 82 HG22 VAL 82 -1.574 3.145 -3.267 681 HG23 VAL 82 HG23 VAL 82 -2.024 4.377 -4.465 682 H GLU 83 H GLU 83 1.020 0.300 -5.838 683 HA GLU 83 HA GLU 83 0.472 -0.233 -8.713 684 HB2 GLU 83 HB2 GLU 83 3.003 0.702 -7.606 685 HB3 GLU 83 HB3 GLU 83 3.217 -0.946 -8.169 686 HG2 GLU 83 HG2 GLU 83 1.925 1.209 -9.882 687 HG3 GLU 83 HG3 GLU 83 3.667 0.947 -9.815 688 H THR 84 H THR 84 1.064 -2.454 -9.365 689 HA THR 84 HA THR 84 0.739 -4.470 -7.130 690 HB THR 84 HB THR 84 -0.416 -5.884 -8.589 691 HG1 THR 84 HG1 THR 84 0.446 -5.786 -10.528 692 HG21 THR 84 HG21 THR 84 -1.765 -3.918 -7.750 693 HG22 THR 84 HG22 THR 84 -1.523 -3.144 -9.325 694 HG23 THR 84 HG23 THR 84 -2.399 -4.689 -9.208 695 H VAL 85 H VAL 85 1.722 -6.584 -7.533 696 HA VAL 85 HA VAL 85 4.229 -6.539 -9.122 697 HB VAL 85 HB VAL 85 4.668 -8.723 -8.191 698 HG11 VAL 85 HG11 VAL 85 3.768 -6.816 -5.999 699 HG12 VAL 85 HG12 VAL 85 4.980 -8.092 -5.859 700 HG13 VAL 85 HG13 VAL 85 5.289 -6.703 -6.908 701 HG21 VAL 85 HG21 VAL 85 2.342 -9.592 -8.076 702 HG22 VAL 85 HG22 VAL 85 3.223 -9.794 -6.570 703 HG23 VAL 85 HG23 VAL 85 2.019 -8.499 -6.722 704 H THR 86 H THR 86 4.476 -8.717 -10.419 705 HA THR 86 HA THR 86 2.142 -9.122 -12.203 706 HB THR 86 HB THR 86 3.756 -10.109 -13.724 707 HG1 THR 86 HG1 THR 86 5.928 -10.224 -13.127 708 HG21 THR 86 HG21 THR 86 4.987 -7.624 -12.463 709 HG22 THR 86 HG22 THR 86 5.187 -8.184 -14.135 710 HG23 THR 86 HG23 THR 86 3.603 -7.597 -13.573 711 H ASP 87 H ASP 87 4.103 -10.953 -9.920 712 HA ASP 87 HA ASP 87 3.263 -13.530 -10.967 713 HB2 ASP 87 HB2 ASP 87 5.554 -13.013 -10.166 714 HB3 ASP 87 HB3 ASP 87 4.916 -12.838 -8.526 715 H SER 88 H SER 88 2.635 -11.771 -7.902 716 HA SER 88 HA SER 88 0.308 -13.611 -7.407 717 HB2 SER 88 HB2 SER 88 2.217 -14.586 -6.259 718 HB3 SER 88 HB3 SER 88 2.493 -13.071 -5.380 719 HG SER 88 HG SER 88 1.179 -14.781 -4.313 720 H SER 89 H SER 89 -1.504 -12.578 -6.900 721 HA SER 89 HA SER 89 -1.556 -9.768 -6.752 722 HB2 SER 89 HB2 SER 89 -3.924 -11.365 -5.850 723 HB3 SER 89 HB3 SER 89 -3.865 -9.913 -6.845 724 HG SER 89 HG SER 89 -2.992 -11.214 -8.539 725 H ARG 90 H ARG 90 -0.749 -11.686 -4.151 726 HA ARG 90 HA ARG 90 -1.919 -9.911 -2.097 727 HB2 ARG 90 HB2 ARG 90 -0.934 -11.494 -0.441 728 HB3 ARG 90 HB3 ARG 90 -2.248 -12.070 -1.437 729 HG2 ARG 90 HG2 ARG 90 -0.783 -13.377 -2.808 730 HG3 ARG 90 HG3 ARG 90 0.664 -12.686 -2.050 731 HD2 ARG 90 HD2 ARG 90 -1.444 -14.262 -0.512 732 HD3 ARG 90 HD3 ARG 90 -0.076 -15.031 -1.306 733 HE ARG 90 HE ARG 90 0.140 -13.019 0.926 734 HH11 ARG 90 HH11 ARG 90 1.710 -13.201 2.317 735 HH12 ARG 90 HH12 ARG 90 2.962 -14.421 2.152 736 HH21 ARG 90 HH21 ARG 90 1.566 -15.813 -0.672 737 HH22 ARG 90 HH22 ARG 90 2.831 -15.918 0.522 738 H TYR 91 H TYR 91 0.119 -8.893 -4.000 739 HA TYR 91 HA TYR 91 1.825 -7.650 -1.947 740 HB2 TYR 91 HB2 TYR 91 2.827 -8.923 -4.504 741 HB3 TYR 91 HB3 TYR 91 3.785 -7.919 -3.443 742 HD1 TYR 91 HD1 TYR 91 2.420 -11.253 -4.018 743 HD2 TYR 91 HD2 TYR 91 4.370 -8.713 -1.137 744 HE1 TYR 91 HE1 TYR 91 3.101 -13.260 -2.722 745 HE2 TYR 91 HE2 TYR 91 4.990 -10.724 0.204 746 HH TYR 91 HH TYR 91 4.223 -14.046 -0.886 747 H PHE 92 H PHE 92 2.048 -5.514 -2.224 748 HA PHE 92 HA PHE 92 1.505 -4.236 -4.865 749 HB2 PHE 92 HB2 PHE 92 0.333 -3.380 -2.189 750 HB3 PHE 92 HB3 PHE 92 0.196 -2.482 -3.687 751 HD1 PHE 92 HD1 PHE 92 -1.152 -5.196 -1.703 752 HD2 PHE 92 HD2 PHE 92 -1.096 -3.459 -5.633 753 HE1 PHE 92 HE1 PHE 92 -3.213 -6.422 -2.272 754 HE2 PHE 92 HE2 PHE 92 -3.128 -4.778 -6.238 755 HZ PHE 92 HZ PHE 92 -4.174 -6.265 -4.573 756 H VAL 93 H VAL 93 2.266 -1.994 -4.955 757 HA VAL 93 HA VAL 93 4.398 -1.296 -2.982 758 HB VAL 93 HB VAL 93 4.409 -0.892 -5.986 759 HG11 VAL 93 HG11 VAL 93 6.294 0.385 -3.961 760 HG12 VAL 93 HG12 VAL 93 6.513 0.371 -5.721 761 HG13 VAL 93 HG13 VAL 93 5.144 1.232 -5.024 762 HG21 VAL 93 HG21 VAL 93 5.289 -3.027 -5.227 763 HG22 VAL 93 HG22 VAL 93 6.641 -2.013 -5.740 764 HG23 VAL 93 HG23 VAL 93 6.322 -2.225 -4.022 765 H ILE 94 H ILE 94 4.333 0.835 -2.184 766 HA ILE 94 HA ILE 94 2.361 2.638 -3.448 767 HB ILE 94 HB ILE 94 1.466 3.448 -1.412 768 HG12 ILE 94 HG12 ILE 94 3.301 2.679 0.163 769 HG13 ILE 94 HG13 ILE 94 1.650 2.554 0.732 770 HG21 ILE 94 HG21 ILE 94 0.898 0.491 -1.787 771 HG22 ILE 94 HG22 ILE 94 -0.138 1.664 -0.941 772 HG23 ILE 94 HG23 ILE 94 0.190 1.846 -2.669 773 HD11 ILE 94 HD11 ILE 94 2.979 0.627 1.425 774 HD12 ILE 94 HD12 ILE 94 1.660 0.120 0.369 775 HD13 ILE 94 HD13 ILE 94 3.317 0.199 -0.259 776 H ARG 95 H ARG 95 2.663 4.800 -3.216 777 HA ARG 95 HA ARG 95 5.480 5.618 -2.667 778 HB2 ARG 95 HB2 ARG 95 4.322 6.343 -4.771 779 HB3 ARG 95 HB3 ARG 95 3.208 7.295 -3.774 780 HG2 ARG 95 HG2 ARG 95 5.208 8.522 -2.841 781 HG3 ARG 95 HG3 ARG 95 6.220 7.666 -4.017 782 HD2 ARG 95 HD2 ARG 95 4.978 8.704 -5.865 783 HD3 ARG 95 HD3 ARG 95 3.822 9.412 -4.721 784 HE ARG 95 HE ARG 95 6.731 10.092 -4.531 785 HH11 ARG 95 HH11 ARG 95 7.274 12.069 -4.060 786 HH12 ARG 95 HH12 ARG 95 6.158 13.404 -4.209 787 HH21 ARG 95 HH21 ARG 95 3.514 11.372 -5.145 788 HH22 ARG 95 HH22 ARG 95 4.036 12.998 -4.805 789 H ILE 96 H ILE 96 5.538 5.419 -0.424 790 HA ILE 96 HA ILE 96 3.730 7.022 1.242 791 HB ILE 96 HB ILE 96 5.004 6.484 3.147 792 HG12 ILE 96 HG12 ILE 96 6.861 4.542 2.636 793 HG13 ILE 96 HG13 ILE 96 7.128 5.568 1.239 794 HG21 ILE 96 HG21 ILE 96 4.498 4.061 1.413 795 HG22 ILE 96 HG22 ILE 96 4.666 4.049 3.173 796 HG23 ILE 96 HG23 ILE 96 3.323 4.915 2.447 797 HD11 ILE 96 HD11 ILE 96 7.493 7.511 2.799 798 HD12 ILE 96 HD12 ILE 96 7.220 6.410 4.172 799 HD13 ILE 96 HD13 ILE 96 8.611 6.166 3.104 800 H GLN 97 H GLN 97 4.094 8.956 2.217 801 HA GLN 97 HA GLN 97 6.263 10.670 1.070 802 HB2 GLN 97 HB2 GLN 97 3.265 11.110 1.093 803 HB3 GLN 97 HB3 GLN 97 4.401 12.437 0.881 804 HG2 GLN 97 HG2 GLN 97 5.047 11.806 -1.228 805 HG3 GLN 97 HG3 GLN 97 4.748 10.089 -0.956 806 HE21 GLN 97 HE21 GLN 97 1.456 10.144 -2.208 807 HE22 GLN 97 HE22 GLN 97 2.802 9.199 -1.573 808 H ASP 98 H ASP 98 6.798 12.510 2.242 809 HA ASP 98 HA ASP 98 6.382 12.175 5.164 810 HB2 ASP 98 HB2 ASP 98 8.644 12.203 4.110 811 HB3 ASP 98 HB3 ASP 98 8.383 13.886 3.658 812 H GLY 99 H GLY 99 4.579 13.716 3.057 813 HA2 GLY 99 HA2 GLY 99 2.940 15.329 3.299 814 HA3 GLY 99 HA3 GLY 99 3.574 15.727 4.895 815 H THR 100 H THR 100 6.312 16.202 3.536 816 HA THR 100 HA THR 100 5.887 19.027 2.821 817 HB THR 100 HB THR 100 7.660 18.293 4.372 818 HG1 THR 100 HG1 THR 100 9.182 19.686 3.534 819 HG21 THR 100 HG21 THR 100 9.133 17.282 1.899 820 HG22 THR 100 HG22 THR 100 9.742 17.353 3.564 821 HG23 THR 100 HG23 THR 100 8.431 16.240 3.162 822 H GLY 101 H GLY 101 6.460 16.052 1.102 823 HA2 GLY 101 HA2 GLY 101 5.585 16.336 -1.289 824 HA3 GLY 101 HA3 GLY 101 6.917 17.476 -1.490 825 H ARG 102 H ARG 102 8.523 15.517 0.394 826 HA ARG 102 HA ARG 102 9.605 13.874 -1.763 827 HB2 ARG 102 HB2 ARG 102 11.524 13.594 -0.449 828 HB3 ARG 102 HB3 ARG 102 11.042 15.269 -0.322 829 HG2 ARG 102 HG2 ARG 102 11.769 14.707 1.816 830 HG3 ARG 102 HG3 ARG 102 10.019 14.750 1.941 831 HD2 ARG 102 HD2 ARG 102 11.037 12.909 3.224 832 HD3 ARG 102 HD3 ARG 102 9.918 12.311 2.006 833 HE ARG 102 HE ARG 102 12.732 12.416 1.153 834 HH11 ARG 102 HH11 ARG 102 13.773 10.530 0.644 835 HH12 ARG 102 HH12 ARG 102 13.126 9.008 1.171 836 HH21 ARG 102 HH21 ARG 102 10.402 10.352 2.762 837 HH22 ARG 102 HH22 ARG 102 11.280 8.904 2.360 838 H SER 103 H SER 103 10.094 11.741 -1.486 839 HA SER 103 HA SER 103 8.141 10.077 0.027 840 HB2 SER 103 HB2 SER 103 7.301 9.154 -2.142 841 HB3 SER 103 HB3 SER 103 6.906 10.851 -1.863 842 HG SER 103 HG SER 103 9.111 9.978 -3.457 843 H ALA 104 H ALA 104 8.223 7.801 -0.422 844 HA ALA 104 HA ALA 104 10.518 6.737 -1.934 845 HB1 ALA 104 HB1 ALA 104 9.809 5.797 0.882 846 HB2 ALA 104 HB2 ALA 104 10.992 5.036 -0.202 847 HB3 ALA 104 HB3 ALA 104 11.286 6.672 0.416 848 H PHE 105 H PHE 105 10.066 4.718 -2.906 849 HA PHE 105 HA PHE 105 7.211 3.828 -2.879 850 HB2 PHE 105 HB2 PHE 105 9.499 3.381 -4.810 851 HB3 PHE 105 HB3 PHE 105 8.046 2.398 -4.819 852 HD1 PHE 105 HD1 PHE 105 5.918 3.230 -5.595 853 HD2 PHE 105 HD2 PHE 105 9.347 5.839 -5.431 854 HE1 PHE 105 HE1 PHE 105 4.744 4.848 -7.033 855 HE2 PHE 105 HE2 PHE 105 8.157 7.481 -6.858 856 HZ PHE 105 HZ PHE 105 5.867 6.987 -7.680 857 H ILE 106 H ILE 106 6.769 2.331 -1.393 858 HA ILE 106 HA ILE 106 8.857 0.298 -0.685 859 HB ILE 106 HB ILE 106 7.924 0.067 1.485 860 HG12 ILE 106 HG12 ILE 106 5.921 2.274 0.852 861 HG13 ILE 106 HG13 ILE 106 5.529 0.558 0.971 862 HG21 ILE 106 HG21 ILE 106 9.642 1.825 1.031 863 HG22 ILE 106 HG22 ILE 106 8.333 3.026 0.915 864 HG23 ILE 106 HG23 ILE 106 8.652 2.175 2.445 865 HD11 ILE 106 HD11 ILE 106 6.519 2.285 3.261 866 HD12 ILE 106 HD12 ILE 106 4.906 1.594 3.035 867 HD13 ILE 106 HD13 ILE 106 6.285 0.526 3.332 868 H GLY 107 H GLY 107 8.257 -1.861 -0.390 869 HA2 GLY 107 HA2 GLY 107 5.840 -2.701 -1.918 870 HA3 GLY 107 HA3 GLY 107 7.232 -3.707 -1.525 871 H ILE 108 H ILE 108 4.252 -3.888 -0.956 872 HA ILE 108 HA ILE 108 4.580 -4.739 1.851 873 HB ILE 108 HB ILE 108 2.206 -4.301 2.288 874 HG12 ILE 108 HG12 ILE 108 2.250 -2.412 -0.102 875 HG13 ILE 108 HG13 ILE 108 1.441 -3.979 -0.087 876 HG21 ILE 108 HG21 ILE 108 4.018 -2.945 3.181 877 HG22 ILE 108 HG22 ILE 108 3.928 -1.846 1.785 878 HG23 ILE 108 HG23 ILE 108 2.573 -1.966 2.928 879 HD11 ILE 108 HD11 ILE 108 0.034 -3.228 1.842 880 HD12 ILE 108 HD12 ILE 108 0.738 -1.609 1.692 881 HD13 ILE 108 HD13 ILE 108 -0.208 -2.284 0.358 882 H GLY 109 H GLY 109 3.851 -6.663 2.378 883 HA2 GLY 109 HA2 GLY 109 2.430 -8.336 0.334 884 HA3 GLY 109 HA3 GLY 109 3.649 -8.969 1.436 885 H PHE 110 H PHE 110 0.777 -9.576 0.954 886 HA PHE 110 HA PHE 110 -0.481 -9.037 3.607 887 HB2 PHE 110 HB2 PHE 110 -1.532 -9.780 0.866 888 HB3 PHE 110 HB3 PHE 110 -2.526 -9.921 2.300 889 HD1 PHE 110 HD1 PHE 110 -0.342 -7.360 0.556 890 HD2 PHE 110 HD2 PHE 110 -3.892 -8.144 2.890 891 HE1 PHE 110 HE1 PHE 110 -0.927 -4.960 0.485 892 HE2 PHE 110 HE2 PHE 110 -4.524 -5.758 2.713 893 HZ PHE 110 HZ PHE 110 -3.016 -4.158 1.536 894 H THR 111 H THR 111 -1.751 -10.743 4.591 895 HA THR 111 HA THR 111 -0.281 -13.234 4.798 896 HB THR 111 HB THR 111 -1.364 -12.065 6.684 897 HG1 THR 111 HG1 THR 111 -2.086 -13.954 7.654 898 HG21 THR 111 HG21 THR 111 -3.541 -11.444 5.638 899 HG22 THR 111 HG22 THR 111 -4.002 -13.161 5.621 900 HG23 THR 111 HG23 THR 111 -3.732 -12.320 7.160 901 H ASP 112 H ASP 112 -3.099 -12.254 2.935 902 HA ASP 112 HA ASP 112 -3.145 -14.833 1.586 903 HB2 ASP 112 HB2 ASP 112 -4.595 -15.154 3.648 904 HB3 ASP 112 HB3 ASP 112 -5.653 -13.886 3.032 905 H ARG 113 H ARG 113 -4.295 -14.812 -0.392 906 HA ARG 113 HA ARG 113 -4.346 -12.321 -1.820 907 HB2 ARG 113 HB2 ARG 113 -3.896 -14.617 -2.736 908 HB3 ARG 113 HB3 ARG 113 -5.619 -14.993 -2.566 909 HG2 ARG 113 HG2 ARG 113 -6.190 -13.198 -4.153 910 HG3 ARG 113 HG3 ARG 113 -4.493 -12.681 -4.197 911 HD2 ARG 113 HD2 ARG 113 -3.870 -14.933 -5.109 912 HD3 ARG 113 HD3 ARG 113 -5.577 -15.370 -5.152 913 HE ARG 113 HE ARG 113 -4.227 -13.243 -6.801 914 HH11 ARG 113 HH11 ARG 113 -4.989 -12.722 -8.683 915 HH12 ARG 113 HH12 ARG 113 -6.424 -13.481 -9.345 916 HH21 ARG 113 HH21 ARG 113 -7.004 -15.381 -6.521 917 HH22 ARG 113 HH22 ARG 113 -7.566 -14.952 -8.112 918 H GLY 114 H GLY 114 -6.961 -14.099 -0.175 919 HA2 GLY 114 HA2 GLY 114 -9.143 -12.539 -1.265 920 HA3 GLY 114 HA3 GLY 114 -9.160 -13.534 0.199 921 H ASP 115 H ASP 115 -6.856 -11.964 1.365 922 HA ASP 115 HA ASP 115 -8.391 -9.663 2.438 923 HB2 ASP 115 HB2 ASP 115 -5.762 -10.974 3.220 924 HB3 ASP 115 HB3 ASP 115 -6.328 -9.458 3.916 925 H ALA 116 H ALA 116 -5.517 -10.296 0.412 926 HA ALA 116 HA ALA 116 -4.794 -7.543 0.026 927 HB1 ALA 116 HB1 ALA 116 -3.373 -9.509 -0.446 928 HB2 ALA 116 HB2 ALA 116 -4.444 -9.956 -1.795 929 HB3 ALA 116 HB3 ALA 116 -3.538 -8.438 -1.850 930 H PHE 117 H PHE 117 -7.167 -9.646 -1.667 931 HA PHE 117 HA PHE 117 -7.877 -7.850 -3.737 932 HB2 PHE 117 HB2 PHE 117 -9.225 -10.110 -2.322 933 HB3 PHE 117 HB3 PHE 117 -10.266 -8.979 -3.162 934 HD1 PHE 117 HD1 PHE 117 -6.822 -10.176 -4.195 935 HD2 PHE 117 HD2 PHE 117 -11.058 -10.132 -5.024 936 HE1 PHE 117 HE1 PHE 117 -6.410 -11.267 -6.376 937 HE2 PHE 117 HE2 PHE 117 -10.637 -11.242 -7.203 938 HZ PHE 117 HZ PHE 117 -8.313 -11.807 -7.886 939 H ASP 118 H ASP 118 -8.893 -7.742 -0.300 940 HA ASP 118 HA ASP 118 -10.810 -5.616 -0.693 941 HB2 ASP 118 HB2 ASP 118 -9.306 -6.599 1.759 942 HB3 ASP 118 HB3 ASP 118 -10.451 -5.266 1.808 943 H PHE 119 H PHE 119 -7.274 -5.534 -0.348 944 HA PHE 119 HA PHE 119 -7.041 -2.709 0.196 945 HB2 PHE 119 HB2 PHE 119 -5.203 -4.130 0.638 946 HB3 PHE 119 HB3 PHE 119 -5.159 -4.752 -0.997 947 HD1 PHE 119 HD1 PHE 119 -4.358 -3.407 -2.901 948 HD2 PHE 119 HD2 PHE 119 -4.008 -2.070 1.174 949 HE1 PHE 119 HE1 PHE 119 -2.757 -1.651 -3.610 950 HE2 PHE 119 HE2 PHE 119 -2.424 -0.324 0.476 951 HZ PHE 119 HZ PHE 119 -1.782 -0.097 -1.920 952 H ASN 120 H ASN 120 -7.052 -4.521 -2.921 953 HA ASN 120 HA ASN 120 -6.937 -1.968 -4.374 954 HB2 ASN 120 HB2 ASN 120 -6.797 -3.266 -6.384 955 HB3 ASN 120 HB3 ASN 120 -5.665 -3.877 -5.188 956 HD21 ASN 120 HD21 ASN 120 -8.723 -6.281 -6.469 957 HD22 ASN 120 HD22 ASN 120 -8.832 -4.556 -6.767 958 H VAL 121 H VAL 121 -9.549 -4.154 -3.441 959 HA VAL 121 HA VAL 121 -11.458 -2.923 -5.273 960 HB VAL 121 HB VAL 121 -11.788 -4.807 -2.927 961 HG11 VAL 121 HG11 VAL 121 -13.953 -3.721 -4.786 962 HG12 VAL 121 HG12 VAL 121 -14.144 -5.117 -3.702 963 HG13 VAL 121 HG13 VAL 121 -13.869 -3.516 -3.021 964 HG21 VAL 121 HG21 VAL 121 -12.400 -6.413 -4.697 965 HG22 VAL 121 HG22 VAL 121 -12.216 -5.153 -5.938 966 HG23 VAL 121 HG23 VAL 121 -10.807 -5.737 -5.037 967 H SER 122 H SER 122 -10.696 -2.451 -1.768 968 HA SER 122 HA SER 122 -12.819 -0.585 -1.322 969 HB2 SER 122 HB2 SER 122 -11.618 0.058 0.691 970 HB3 SER 122 HB3 SER 122 -11.643 -1.709 0.507 971 HG SER 122 HG SER 122 -9.572 -1.726 -0.017 972 H LEU 123 H LEU 123 -9.579 -0.086 -2.653 973 HA LEU 123 HA LEU 123 -9.763 2.815 -2.742 974 HB2 LEU 123 HB2 LEU 123 -8.057 0.758 -4.187 975 HB3 LEU 123 HB3 LEU 123 -7.907 2.490 -4.478 976 HG LEU 123 HG LEU 123 -7.488 1.207 -1.743 977 HD11 LEU 123 HD11 LEU 123 -5.458 2.129 -3.824 978 HD12 LEU 123 HD12 LEU 123 -5.091 1.525 -2.188 979 HD13 LEU 123 HD13 LEU 123 -5.806 0.443 -3.386 980 HD21 LEU 123 HD21 LEU 123 -8.078 3.600 -1.598 981 HD22 LEU 123 HD22 LEU 123 -6.376 3.352 -1.216 982 HD23 LEU 123 HD23 LEU 123 -6.832 3.990 -2.808 983 H GLN 124 H GLN 124 -10.252 0.302 -5.332 984 HA GLN 124 HA GLN 124 -10.974 2.313 -7.228 985 HB2 GLN 124 HB2 GLN 124 -11.288 0.611 -8.773 986 HB3 GLN 124 HB3 GLN 124 -10.057 -0.006 -7.672 987 HG2 GLN 124 HG2 GLN 124 -11.899 -1.270 -6.485 988 HG3 GLN 124 HG3 GLN 124 -12.985 -0.811 -7.798 989 HE21 GLN 124 HE21 GLN 124 -9.898 -3.428 -8.632 990 HE22 GLN 124 HE22 GLN 124 -9.766 -2.331 -7.237 991 H ASP 125 H ASP 125 -13.029 0.435 -5.011 992 HA ASP 125 HA ASP 125 -15.472 1.573 -6.186 993 HB2 ASP 125 HB2 ASP 125 -15.305 -0.816 -5.417 994 HB3 ASP 125 HB3 ASP 125 -15.195 -0.215 -3.758 995 H HIS 126 H HIS 126 -13.168 2.914 -4.345 996 HA HIS 126 HA HIS 126 -15.136 4.768 -3.080 997 HB2 HIS 126 HB2 HIS 126 -13.421 3.959 -1.545 998 HB3 HIS 126 HB3 HIS 126 -12.144 4.515 -2.634 999 HD2 HIS 126 HD2 HIS 126 -11.275 6.914 -2.214 1000 HE1 HIS 126 HE1 HIS 126 -14.442 8.417 0.215 1001 HE2 HIS 126 HE2 HIS 126 -12.116 8.894 -0.696 1002 H PHE 127 H PHE 127 -12.457 4.592 -5.440 1003 HA PHE 127 HA PHE 127 -12.812 7.406 -6.189 1004 HB2 PHE 127 HB2 PHE 127 -10.945 5.185 -7.046 1005 HB3 PHE 127 HB3 PHE 127 -11.003 6.713 -7.896 1006 HD1 PHE 127 HD1 PHE 127 -9.299 5.040 -5.341 1007 HD2 PHE 127 HD2 PHE 127 -10.952 8.898 -6.298 1008 HE1 PHE 127 HE1 PHE 127 -7.508 6.124 -4.026 1009 HE2 PHE 127 HE2 PHE 127 -9.201 9.989 -4.917 1010 HZ PHE 127 HZ PHE 127 -7.453 8.609 -3.818 1011 H LYS 128 H LYS 128 -14.539 4.672 -7.211 1012 HA LYS 128 HA LYS 128 -14.651 4.938 -9.941 1013 HB2 LYS 128 HB2 LYS 128 -16.578 3.659 -9.998 1014 HB3 LYS 128 HB3 LYS 128 -15.687 3.116 -8.596 1015 HG2 LYS 128 HG2 LYS 128 -18.139 4.936 -8.574 1016 HG3 LYS 128 HG3 LYS 128 -18.114 3.205 -8.229 1017 HD2 LYS 128 HD2 LYS 128 -16.573 3.701 -6.280 1018 HD3 LYS 128 HD3 LYS 128 -16.850 5.416 -6.582 1019 HE2 LYS 128 HE2 LYS 128 -18.606 5.241 -5.200 1020 HE3 LYS 128 HE3 LYS 128 -19.425 4.519 -6.589 1021 HZ1 LYS 128 HZ1 LYS 128 -19.651 3.079 -4.656 1022 HZ2 LYS 128 HZ2 LYS 128 -18.634 2.298 -5.688 1023 HZ3 LYS 128 HZ3 LYS 128 -18.028 3.060 -4.405 1024 H TRP 129 H TRP 129 -16.156 7.221 -7.815 1025 HA TRP 129 HA TRP 129 -17.687 8.530 -9.987 1026 HB2 TRP 129 HB2 TRP 129 -18.483 10.016 -8.279 1027 HB3 TRP 129 HB3 TRP 129 -18.658 8.353 -7.745 1028 HD1 TRP 129 HD1 TRP 129 -16.764 7.497 -5.914 1029 HE1 TRP 129 HE1 TRP 129 -15.473 8.710 -4.123 1030 HE3 TRP 129 HE3 TRP 129 -17.683 12.311 -7.417 1031 HZ2 TRP 129 HZ2 TRP 129 -15.200 11.459 -3.179 1032 HZ3 TRP 129 HZ3 TRP 129 -16.965 14.213 -5.989 1033 HH2 TRP 129 HH2 TRP 129 -15.744 13.801 -3.865 1034 H VAL 130 H VAL 130 -14.552 8.822 -8.500 1035 HA VAL 130 HA VAL 130 -14.007 11.552 -9.469 1036 HB VAL 130 HB VAL 130 -12.116 9.522 -8.223 1037 HG11 VAL 130 HG11 VAL 130 -11.901 12.548 -8.535 1038 HG12 VAL 130 HG12 VAL 130 -10.776 11.525 -7.613 1039 HG13 VAL 130 HG13 VAL 130 -10.901 11.329 -9.358 1040 HG21 VAL 130 HG21 VAL 130 -13.778 11.718 -6.912 1041 HG22 VAL 130 HG22 VAL 130 -13.878 9.972 -6.605 1042 HG23 VAL 130 HG23 VAL 130 -12.441 10.863 -6.116 1043 H LYS 131 H LYS 131 -13.561 8.240 -10.519 1044 HA LYS 131 HA LYS 131 -11.736 8.926 -12.731 1045 HB2 LYS 131 HB2 LYS 131 -12.907 6.322 -11.658 1046 HB3 LYS 131 HB3 LYS 131 -11.953 6.367 -13.124 1047 HG2 LYS 131 HG2 LYS 131 -10.982 7.190 -10.357 1048 HG3 LYS 131 HG3 LYS 131 -10.618 5.683 -11.191 1049 HD2 LYS 131 HD2 LYS 131 -9.722 8.471 -12.037 1050 HD3 LYS 131 HD3 LYS 131 -8.721 7.213 -11.313 1051 HE2 LYS 131 HE2 LYS 131 -8.889 5.796 -13.245 1052 HE3 LYS 131 HE3 LYS 131 -10.160 6.797 -13.960 1053 HZ1 LYS 131 HZ1 LYS 131 -7.393 7.763 -13.526 1054 HZ2 LYS 131 HZ2 LYS 131 -7.988 7.239 -14.957 1055 HZ3 LYS 131 HZ3 LYS 131 -8.623 8.576 -14.273 1056 H GLN 132 H GLN 132 -14.516 9.931 -12.590 1057 HA GLN 132 HA GLN 132 -15.663 8.828 -15.069 1058 HB2 GLN 132 HB2 GLN 132 -16.697 10.992 -13.213 1059 HB3 GLN 132 HB3 GLN 132 -17.495 10.439 -14.691 1060 HG2 GLN 132 HG2 GLN 132 -16.872 8.712 -12.256 1061 HG3 GLN 132 HG3 GLN 132 -18.448 9.392 -12.633 1062 HE21 GLN 132 HE21 GLN 132 -17.864 5.777 -13.978 1063 HE22 GLN 132 HE22 GLN 132 -17.214 6.496 -12.500 1064 H GLU 133 H GLU 133 -14.239 9.356 -16.567 1065 HA GLU 133 HA GLU 133 -13.520 12.212 -17.140 1066 HB2 GLU 133 HB2 GLU 133 -11.659 9.801 -17.105 1067 HB3 GLU 133 HB3 GLU 133 -11.242 11.412 -17.695 1068 HG2 GLU 133 HG2 GLU 133 -11.685 12.349 -15.422 1069 HG3 GLU 133 HG3 GLU 133 -12.016 10.721 -14.825 Start of MODEL 28 1 H1 GLY -4 H1 GLY -4 -20.038 22.057 28.895 2 H2 GLY -4 H2 GLY -4 -18.557 21.355 28.939 3 H3 GLY -4 H3 GLY -4 -19.835 20.530 28.335 4 HA2 GLY -4 HA2 GLY -4 -20.048 22.073 26.496 5 HA3 GLY -4 HA3 GLY -4 -18.653 22.954 27.146 6 H SER -3 H SER -3 -17.885 22.505 24.886 7 HA SER -3 HA SER -3 -17.158 19.854 24.053 8 HB2 SER -3 HB2 SER -3 -17.495 21.696 22.490 9 HB3 SER -3 HB3 SER -3 -16.102 22.559 23.165 10 HG SER -3 HG SER -3 -15.733 21.323 21.207 11 HA PRO -2 HA PRO -2 -13.200 19.566 26.281 12 HB2 PRO -2 HB2 PRO -2 -12.145 17.342 25.137 13 HB3 PRO -2 HB3 PRO -2 -13.586 17.266 26.196 14 HG2 PRO -2 HG2 PRO -2 -13.519 17.367 23.159 15 HG3 PRO -2 HG3 PRO -2 -14.401 16.206 24.202 16 HD2 PRO -2 HD2 PRO -2 -15.598 18.428 23.163 17 HD3 PRO -2 HD3 PRO -2 -16.016 17.816 24.790 18 H ASN -1 H ASN -1 -13.621 20.369 22.980 19 HA ASN -1 HA ASN -1 -10.787 20.473 22.227 20 HB2 ASN -1 HB2 ASN -1 -13.275 21.487 20.783 21 HB3 ASN -1 HB3 ASN -1 -11.654 21.379 20.106 22 HD21 ASN -1 HD21 ASN -1 -13.945 18.020 20.283 23 HD22 ASN -1 HD22 ASN -1 -14.502 19.502 21.052 24 H SER 0 H SER 0 -9.674 22.415 21.583 25 HA SER 0 HA SER 0 -10.074 24.674 23.386 26 HB2 SER 0 HB2 SER 0 -7.990 25.489 22.398 27 HB3 SER 0 HB3 SER 0 -7.850 23.784 22.858 28 HG SER 0 HG SER 0 -7.006 24.116 20.795 29 H MET 1 H MET 1 -11.514 23.973 20.468 30 HA MET 1 HA MET 1 -12.395 25.028 18.706 31 HB2 MET 1 HB2 MET 1 -12.528 27.520 20.430 32 HB3 MET 1 HB3 MET 1 -13.413 27.218 18.931 33 HG2 MET 1 HG2 MET 1 -14.515 25.255 19.978 34 HG3 MET 1 HG3 MET 1 -13.685 25.612 21.498 35 HE1 MET 1 HE1 MET 1 -16.801 25.176 21.293 36 HE2 MET 1 HE2 MET 1 -15.944 25.553 22.805 37 HE3 MET 1 HE3 MET 1 -17.386 26.484 22.345 38 H ALA 2 H ALA 2 -9.410 25.159 19.238 39 HA ALA 2 HA ALA 2 -8.765 26.788 16.821 40 HB1 ALA 2 HB1 ALA 2 -6.643 27.437 17.894 41 HB2 ALA 2 HB2 ALA 2 -8.032 28.012 18.836 42 HB3 ALA 2 HB3 ALA 2 -7.116 26.587 19.380 43 H THR 3 H THR 3 -8.089 23.923 18.809 44 HA THR 3 HA THR 3 -6.875 22.565 16.438 45 HB THR 3 HB THR 3 -6.066 22.154 19.343 46 HG1 THR 3 HG1 THR 3 -4.136 23.087 18.697 47 HG21 THR 3 HG21 THR 3 -5.839 20.097 17.987 48 HG22 THR 3 HG22 THR 3 -4.963 21.004 16.733 49 HG23 THR 3 HG23 THR 3 -4.250 20.778 18.347 50 H GLU 4 H GLU 4 -8.461 21.319 15.757 51 HA GLU 4 HA GLU 4 -9.838 19.427 17.586 52 HB2 GLU 4 HB2 GLU 4 -12.049 20.110 16.753 53 HB3 GLU 4 HB3 GLU 4 -11.228 21.386 17.636 54 HG2 GLU 4 HG2 GLU 4 -10.603 22.507 15.523 55 HG3 GLU 4 HG3 GLU 4 -11.377 21.220 14.596 56 H LEU 5 H LEU 5 -7.823 19.131 15.405 57 HA LEU 5 HA LEU 5 -8.991 17.982 13.075 58 HB2 LEU 5 HB2 LEU 5 -6.639 18.941 13.560 59 HB3 LEU 5 HB3 LEU 5 -6.241 17.359 14.218 60 HG LEU 5 HG LEU 5 -7.252 17.956 11.413 61 HD11 LEU 5 HD11 LEU 5 -4.938 17.504 10.684 62 HD12 LEU 5 HD12 LEU 5 -4.992 18.853 11.827 63 HD13 LEU 5 HD13 LEU 5 -4.448 17.251 12.376 64 HD21 LEU 5 HD21 LEU 5 -6.392 15.640 10.865 65 HD22 LEU 5 HD22 LEU 5 -6.201 15.354 12.608 66 HD23 LEU 5 HD23 LEU 5 -7.810 15.646 11.901 67 H GLU 6 H GLU 6 -10.430 16.445 13.277 68 HA GLU 6 HA GLU 6 -9.533 13.757 14.112 69 HB2 GLU 6 HB2 GLU 6 -10.694 14.830 16.079 70 HB3 GLU 6 HB3 GLU 6 -12.164 14.939 15.109 71 HG2 GLU 6 HG2 GLU 6 -12.129 12.437 14.854 72 HG3 GLU 6 HG3 GLU 6 -10.644 12.376 15.799 73 H TYR 7 H TYR 7 -9.353 13.831 11.714 74 HA TYR 7 HA TYR 7 -11.874 12.889 10.490 75 HB2 TYR 7 HB2 TYR 7 -11.603 14.069 8.494 76 HB3 TYR 7 HB3 TYR 7 -11.471 15.263 9.761 77 HD1 TYR 7 HD1 TYR 7 -9.519 16.668 9.903 78 HD2 TYR 7 HD2 TYR 7 -9.487 13.227 7.280 79 HE1 TYR 7 HE1 TYR 7 -7.459 17.513 8.788 80 HE2 TYR 7 HE2 TYR 7 -7.500 14.100 6.136 81 HH TYR 7 HH TYR 7 -5.909 17.175 7.135 82 H GLU 8 H GLU 8 -11.658 11.116 9.322 83 HA GLU 8 HA GLU 8 -9.719 10.463 7.476 84 HB2 GLU 8 HB2 GLU 8 -8.947 9.614 10.237 85 HB3 GLU 8 HB3 GLU 8 -9.056 8.241 9.139 86 HG2 GLU 8 HG2 GLU 8 -7.404 9.075 7.677 87 HG3 GLU 8 HG3 GLU 8 -7.453 10.687 8.362 88 H SER 9 H SER 9 -11.274 9.541 6.164 89 HA SER 9 HA SER 9 -13.350 7.759 7.316 90 HB2 SER 9 HB2 SER 9 -12.863 8.986 4.605 91 HB3 SER 9 HB3 SER 9 -14.087 7.721 4.861 92 HG SER 9 HG SER 9 -15.169 9.017 6.281 93 H VAL 10 H VAL 10 -12.760 5.737 7.723 94 HA VAL 10 HA VAL 10 -10.538 4.385 6.488 95 HB VAL 10 HB VAL 10 -12.777 3.319 8.249 96 HG11 VAL 10 HG11 VAL 10 -10.103 2.071 7.482 97 HG12 VAL 10 HG12 VAL 10 -11.170 1.487 8.783 98 HG13 VAL 10 HG13 VAL 10 -11.723 1.422 7.115 99 HG21 VAL 10 HG21 VAL 10 -9.917 4.167 8.900 100 HG22 VAL 10 HG22 VAL 10 -11.384 5.067 9.348 101 HG23 VAL 10 HG23 VAL 10 -11.088 3.474 10.047 102 H LEU 11 H LEU 11 -10.395 2.744 5.072 103 HA LEU 11 HA LEU 11 -12.763 2.122 3.331 104 HB2 LEU 11 HB2 LEU 11 -9.892 2.729 2.518 105 HB3 LEU 11 HB3 LEU 11 -11.147 2.161 1.427 106 HG LEU 11 HG LEU 11 -11.180 4.828 2.906 107 HD11 LEU 11 HD11 LEU 11 -10.873 5.762 0.626 108 HD12 LEU 11 HD12 LEU 11 -9.496 4.792 1.151 109 HD13 LEU 11 HD13 LEU 11 -10.663 4.117 -0.009 110 HD21 LEU 11 HD21 LEU 11 -13.080 5.363 1.392 111 HD22 LEU 11 HD22 LEU 11 -13.081 3.684 0.810 112 HD23 LEU 11 HD23 LEU 11 -13.481 4.055 2.502 113 H CYS 12 H CYS 12 -9.571 0.979 4.499 114 HA CYS 12 HA CYS 12 -10.656 -1.728 4.738 115 HB2 CYS 12 HB2 CYS 12 -9.763 -1.670 2.395 116 HB3 CYS 12 HB3 CYS 12 -8.164 -1.251 3.051 117 HG CYS 12 HG CYS 12 -8.215 -3.776 2.342 118 H VAL 13 H VAL 13 -9.844 -2.688 6.495 119 HA VAL 13 HA VAL 13 -7.175 -1.891 7.542 120 HB VAL 13 HB VAL 13 -9.697 -2.266 9.188 121 HG11 VAL 13 HG11 VAL 13 -6.810 -2.012 10.156 122 HG12 VAL 13 HG12 VAL 13 -8.253 -1.900 11.182 123 HG13 VAL 13 HG13 VAL 13 -7.874 -3.421 10.376 124 HG21 VAL 13 HG21 VAL 13 -9.192 -0.009 9.997 125 HG22 VAL 13 HG22 VAL 13 -7.704 0.030 9.024 126 HG23 VAL 13 HG23 VAL 13 -9.288 0.011 8.230 127 H LYS 14 H LYS 14 -5.870 -3.531 7.736 128 HA LYS 14 HA LYS 14 -6.941 -6.283 8.150 129 HB2 LYS 14 HB2 LYS 14 -4.670 -5.595 6.261 130 HB3 LYS 14 HB3 LYS 14 -5.138 -7.217 6.731 131 HG2 LYS 14 HG2 LYS 14 -6.961 -5.270 5.250 132 HG3 LYS 14 HG3 LYS 14 -5.990 -6.534 4.495 133 HD2 LYS 14 HD2 LYS 14 -7.201 -8.268 5.771 134 HD3 LYS 14 HD3 LYS 14 -8.227 -7.018 6.510 135 HE2 LYS 14 HE2 LYS 14 -9.061 -6.343 4.311 136 HE3 LYS 14 HE3 LYS 14 -7.986 -7.507 3.522 137 HZ1 LYS 14 HZ1 LYS 14 -10.189 -8.225 5.381 138 HZ2 LYS 14 HZ2 LYS 14 -10.209 -8.417 3.750 139 HZ3 LYS 14 HZ3 LYS 14 -9.162 -9.296 4.673 140 HA PRO 15 HA PRO 15 -4.177 -6.105 11.638 141 HB2 PRO 15 HB2 PRO 15 -4.243 -9.115 11.463 142 HB3 PRO 15 HB3 PRO 15 -4.513 -8.060 12.885 143 HG2 PRO 15 HG2 PRO 15 -6.602 -9.224 11.613 144 HG3 PRO 15 HG3 PRO 15 -6.714 -7.510 12.146 145 HD2 PRO 15 HD2 PRO 15 -6.095 -8.587 9.383 146 HD3 PRO 15 HD3 PRO 15 -7.214 -7.281 9.884 147 H ASP 16 H ASP 16 -3.417 -8.097 8.827 148 HA ASP 16 HA ASP 16 -0.511 -8.029 9.470 149 HB2 ASP 16 HB2 ASP 16 -0.220 -9.938 8.114 150 HB3 ASP 16 HB3 ASP 16 -1.501 -10.273 9.269 151 H VAL 17 H VAL 17 0.767 -6.768 8.395 152 HA VAL 17 HA VAL 17 0.860 -7.005 5.544 153 HB VAL 17 HB VAL 17 -0.606 -5.004 5.720 154 HG11 VAL 17 HG11 VAL 17 0.226 -2.861 6.445 155 HG12 VAL 17 HG12 VAL 17 0.349 -4.007 7.791 156 HG13 VAL 17 HG13 VAL 17 1.798 -3.560 6.879 157 HG21 VAL 17 HG21 VAL 17 0.574 -3.635 4.126 158 HG22 VAL 17 HG22 VAL 17 2.125 -4.378 4.557 159 HG23 VAL 17 HG23 VAL 17 0.851 -5.348 3.771 160 H SER 18 H SER 18 2.950 -6.877 4.835 161 HA SER 18 HA SER 18 5.097 -6.262 6.856 162 HB2 SER 18 HB2 SER 18 5.058 -8.470 4.769 163 HB3 SER 18 HB3 SER 18 6.402 -8.084 5.863 164 HG SER 18 HG SER 18 5.030 -9.824 6.606 165 H VAL 19 H VAL 19 6.759 -4.979 6.189 166 HA VAL 19 HA VAL 19 6.639 -3.901 3.408 167 HB VAL 19 HB VAL 19 7.795 -2.705 5.936 168 HG11 VAL 19 HG11 VAL 19 7.831 -1.655 3.060 169 HG12 VAL 19 HG12 VAL 19 8.146 -0.653 4.499 170 HG13 VAL 19 HG13 VAL 19 9.233 -1.977 4.101 171 HG21 VAL 19 HG21 VAL 19 5.246 -2.638 5.553 172 HG22 VAL 19 HG22 VAL 19 6.064 -1.086 5.761 173 HG23 VAL 19 HG23 VAL 19 5.594 -1.619 4.142 174 H TYR 20 H TYR 20 8.189 -4.099 2.025 175 HA TYR 20 HA TYR 20 10.958 -4.648 2.903 176 HB2 TYR 20 HB2 TYR 20 10.559 -6.170 0.518 177 HB3 TYR 20 HB3 TYR 20 11.082 -6.702 2.098 178 HD1 TYR 20 HD1 TYR 20 8.088 -6.178 -0.053 179 HD2 TYR 20 HD2 TYR 20 9.632 -7.962 3.553 180 HE1 TYR 20 HE1 TYR 20 5.977 -7.479 0.208 181 HE2 TYR 20 HE2 TYR 20 7.520 -9.258 3.819 182 HH TYR 20 HH TYR 20 4.843 -9.010 1.475 183 H ARG 21 H ARG 21 12.126 -3.085 2.145 184 HA ARG 21 HA ARG 21 11.352 -1.269 0.060 185 HB2 ARG 21 HB2 ARG 21 12.960 -0.814 1.940 186 HB3 ARG 21 HB3 ARG 21 14.164 -1.805 1.103 187 HG2 ARG 21 HG2 ARG 21 14.042 -0.245 -0.855 188 HG3 ARG 21 HG3 ARG 21 12.834 0.723 0.013 189 HD2 ARG 21 HD2 ARG 21 14.518 1.117 1.833 190 HD3 ARG 21 HD3 ARG 21 15.698 0.189 0.910 191 HE ARG 21 HE ARG 21 15.906 1.917 -0.666 192 HH11 ARG 21 HH11 ARG 21 15.913 4.053 -1.240 193 HH12 ARG 21 HH12 ARG 21 14.880 5.183 -0.419 194 HH21 ARG 21 HH21 ARG 21 13.497 2.869 1.700 195 HH22 ARG 21 HH22 ARG 21 13.558 4.540 1.216 196 H ILE 22 H ILE 22 11.572 -1.292 -2.072 197 HA ILE 22 HA ILE 22 12.564 -3.761 -3.345 198 HB ILE 22 HB ILE 22 11.231 -3.177 -5.241 199 HG12 ILE 22 HG12 ILE 22 10.624 -0.523 -3.865 200 HG13 ILE 22 HG13 ILE 22 11.564 -0.755 -5.345 201 HG21 ILE 22 HG21 ILE 22 9.549 -2.630 -2.769 202 HG22 ILE 22 HG22 ILE 22 9.049 -3.401 -4.287 203 HG23 ILE 22 HG23 ILE 22 10.174 -4.231 -3.205 204 HD11 ILE 22 HD11 ILE 22 8.610 -1.216 -4.973 205 HD12 ILE 22 HD12 ILE 22 9.410 -0.039 -6.021 206 HD13 ILE 22 HD13 ILE 22 9.504 -1.782 -6.403 207 HA PRO 23 HA PRO 23 15.713 -1.483 -5.744 208 HB2 PRO 23 HB2 PRO 23 16.056 -3.138 -7.874 209 HB3 PRO 23 HB3 PRO 23 16.684 -3.534 -6.243 210 HG2 PRO 23 HG2 PRO 23 14.113 -4.504 -7.536 211 HG3 PRO 23 HG3 PRO 23 15.356 -5.461 -6.667 212 HD2 PRO 23 HD2 PRO 23 13.045 -4.561 -5.481 213 HD3 PRO 23 HD3 PRO 23 14.575 -4.759 -4.577 214 HA PRO 24 HA PRO 24 12.840 0.600 -8.516 215 HB2 PRO 24 HB2 PRO 24 14.510 2.160 -10.016 216 HB3 PRO 24 HB3 PRO 24 14.180 2.467 -8.283 217 HG2 PRO 24 HG2 PRO 24 16.546 0.998 -9.495 218 HG3 PRO 24 HG3 PRO 24 16.564 2.291 -8.255 219 HD2 PRO 24 HD2 PRO 24 16.705 -0.356 -7.599 220 HD3 PRO 24 HD3 PRO 24 15.826 0.816 -6.570 221 H ARG 25 H ARG 25 11.836 0.048 -10.377 222 HA ARG 25 HA ARG 25 13.251 -0.996 -12.715 223 HB2 ARG 25 HB2 ARG 25 12.688 -2.875 -10.876 224 HB3 ARG 25 HB3 ARG 25 11.134 -2.866 -11.703 225 HG2 ARG 25 HG2 ARG 25 12.195 -3.442 -13.822 226 HG3 ARG 25 HG3 ARG 25 13.814 -3.163 -13.161 227 HD2 ARG 25 HD2 ARG 25 11.896 -5.214 -12.043 228 HD3 ARG 25 HD3 ARG 25 13.029 -5.593 -13.353 229 HE ARG 25 HE ARG 25 14.651 -4.477 -11.424 230 HH11 ARG 25 HH11 ARG 25 15.780 -5.583 -9.835 231 HH12 ARG 25 HH12 ARG 25 15.052 -7.008 -9.123 232 HH21 ARG 25 HH21 ARG 25 12.373 -7.178 -11.182 233 HH22 ARG 25 HH22 ARG 25 13.500 -8.042 -10.134 234 H ALA 26 H ALA 26 11.264 -1.983 -14.186 235 HA ALA 26 HA ALA 26 9.706 0.285 -15.053 236 HB1 ALA 26 HB1 ALA 26 8.919 -1.337 -16.757 237 HB2 ALA 26 HB2 ALA 26 10.684 -1.420 -16.568 238 HB3 ALA 26 HB3 ALA 26 9.642 -2.666 -15.829 239 H SER 27 H SER 27 9.088 -1.599 -12.435 240 HA SER 27 HA SER 27 7.403 -2.364 -11.231 241 HB2 SER 27 HB2 SER 27 5.570 -0.387 -12.595 242 HB3 SER 27 HB3 SER 27 5.403 -1.120 -10.993 243 HG SER 27 HG SER 27 6.341 0.680 -10.447 244 H ASN 28 H ASN 28 5.519 -1.799 -14.191 245 HA ASN 28 HA ASN 28 3.717 -3.855 -13.604 246 HB2 ASN 28 HB2 ASN 28 4.298 -2.533 -16.296 247 HB3 ASN 28 HB3 ASN 28 2.832 -3.416 -15.886 248 HD21 ASN 28 HD21 ASN 28 3.179 0.448 -14.731 249 HD22 ASN 28 HD22 ASN 28 4.457 -0.334 -15.644 250 H ARG 29 H ARG 29 6.624 -4.080 -15.552 251 HA ARG 29 HA ARG 29 6.044 -6.920 -16.299 252 HB2 ARG 29 HB2 ARG 29 7.716 -6.761 -17.919 253 HB3 ARG 29 HB3 ARG 29 6.472 -5.525 -18.127 254 HG2 ARG 29 HG2 ARG 29 7.977 -3.785 -17.293 255 HG3 ARG 29 HG3 ARG 29 9.221 -5.007 -16.885 256 HD2 ARG 29 HD2 ARG 29 9.274 -5.745 -19.206 257 HD3 ARG 29 HD3 ARG 29 8.031 -4.581 -19.645 258 HE ARG 29 HE ARG 29 10.899 -4.053 -19.087 259 HH11 ARG 29 HH11 ARG 29 11.767 -2.088 -19.624 260 HH12 ARG 29 HH12 ARG 29 10.726 -0.764 -20.057 261 HH21 ARG 29 HH21 ARG 29 7.804 -2.516 -19.694 262 HH22 ARG 29 HH22 ARG 29 8.544 -0.993 -20.099 263 H GLY 30 H GLY 30 7.822 -5.286 -13.917 264 HA2 GLY 30 HA2 GLY 30 9.872 -7.480 -13.786 265 HA3 GLY 30 HA3 GLY 30 10.302 -5.769 -13.766 266 H TYR 31 H TYR 31 7.845 -5.397 -11.709 267 HA TYR 31 HA TYR 31 9.213 -6.416 -9.297 268 HB2 TYR 31 HB2 TYR 31 6.477 -5.159 -9.718 269 HB3 TYR 31 HB3 TYR 31 7.203 -5.559 -8.175 270 HD1 TYR 31 HD1 TYR 31 6.072 -3.010 -8.429 271 HD2 TYR 31 HD2 TYR 31 10.040 -4.240 -9.719 272 HE1 TYR 31 HE1 TYR 31 6.859 -0.688 -8.285 273 HE2 TYR 31 HE2 TYR 31 10.796 -1.918 -9.524 274 HH TYR 31 HH TYR 31 8.618 0.771 -8.665 275 H ARG 32 H ARG 32 9.043 -8.590 -8.859 276 HA ARG 32 HA ARG 32 6.531 -10.050 -9.628 277 HB2 ARG 32 HB2 ARG 32 7.792 -12.051 -10.140 278 HB3 ARG 32 HB3 ARG 32 8.145 -10.742 -11.243 279 HG2 ARG 32 HG2 ARG 32 9.990 -11.302 -8.895 280 HG3 ARG 32 HG3 ARG 32 10.020 -12.331 -10.332 281 HD2 ARG 32 HD2 ARG 32 10.352 -10.291 -11.763 282 HD3 ARG 32 HD3 ARG 32 10.455 -9.336 -10.284 283 HE ARG 32 HE ARG 32 12.584 -10.151 -9.840 284 HH11 ARG 32 HH11 ARG 32 14.450 -10.809 -10.318 285 HH12 ARG 32 HH12 ARG 32 14.750 -11.970 -11.608 286 HH21 ARG 32 HH21 ARG 32 11.408 -12.079 -12.536 287 HH22 ARG 32 HH22 ARG 32 13.017 -12.661 -12.873 288 H ALA 33 H ALA 33 7.160 -8.862 -7.126 289 HA ALA 33 HA ALA 33 7.308 -9.150 -4.907 290 HB1 ALA 33 HB1 ALA 33 5.149 -10.207 -5.454 291 HB2 ALA 33 HB2 ALA 33 5.932 -11.791 -5.480 292 HB3 ALA 33 HB3 ALA 33 5.893 -10.852 -3.967 293 H SER 34 H SER 34 8.298 -12.302 -6.325 294 HA SER 34 HA SER 34 9.944 -13.175 -4.230 295 HB2 SER 34 HB2 SER 34 10.136 -13.806 -7.193 296 HB3 SER 34 HB3 SER 34 10.855 -14.759 -5.879 297 HG SER 34 HG SER 34 8.821 -15.599 -6.544 298 H ASP 35 H ASP 35 10.653 -10.653 -6.428 299 HA ASP 35 HA ASP 35 13.567 -10.811 -6.359 300 HB2 ASP 35 HB2 ASP 35 11.817 -9.587 -7.993 301 HB3 ASP 35 HB3 ASP 35 12.031 -8.262 -6.870 302 H TRP 36 H TRP 36 11.074 -9.628 -4.209 303 HA TRP 36 HA TRP 36 12.740 -7.653 -2.837 304 HB2 TRP 36 HB2 TRP 36 9.948 -8.585 -2.151 305 HB3 TRP 36 HB3 TRP 36 10.716 -7.079 -1.705 306 HD1 TRP 36 HD1 TRP 36 11.495 -6.720 -5.079 307 HE1 TRP 36 HE1 TRP 36 9.614 -5.634 -6.487 308 HE3 TRP 36 HE3 TRP 36 7.522 -7.530 -1.945 309 HZ2 TRP 36 HZ2 TRP 36 6.886 -4.910 -6.131 310 HZ3 TRP 36 HZ3 TRP 36 5.281 -6.579 -2.498 311 HH2 TRP 36 HH2 TRP 36 4.970 -5.251 -4.559 312 H LYS 37 H LYS 37 12.654 -7.675 -0.456 313 HA LYS 37 HA LYS 37 13.652 -10.177 0.693 314 HB2 LYS 37 HB2 LYS 37 13.354 -7.383 1.836 315 HB3 LYS 37 HB3 LYS 37 13.985 -8.761 2.716 316 HG2 LYS 37 HG2 LYS 37 15.586 -8.986 0.565 317 HG3 LYS 37 HG3 LYS 37 15.209 -7.263 0.437 318 HD2 LYS 37 HD2 LYS 37 17.029 -7.104 1.859 319 HD3 LYS 37 HD3 LYS 37 15.754 -7.329 3.065 320 HE2 LYS 37 HE2 LYS 37 17.430 -8.794 3.752 321 HE3 LYS 37 HE3 LYS 37 16.230 -9.822 2.965 322 HZ1 LYS 37 HZ1 LYS 37 18.487 -10.382 2.280 323 HZ2 LYS 37 HZ2 LYS 37 17.667 -9.833 0.977 324 HZ3 LYS 37 HZ3 LYS 37 18.761 -8.875 1.724 325 H LEU 38 H LEU 38 11.272 -10.919 0.031 326 HA LEU 38 HA LEU 38 9.023 -10.371 1.607 327 HB2 LEU 38 HB2 LEU 38 9.798 -13.029 0.341 328 HB3 LEU 38 HB3 LEU 38 8.187 -12.593 0.902 329 HG LEU 38 HG LEU 38 9.695 -11.380 -1.440 330 HD11 LEU 38 HD11 LEU 38 7.099 -12.972 -1.212 331 HD12 LEU 38 HD12 LEU 38 7.781 -12.328 -2.711 332 HD13 LEU 38 HD13 LEU 38 8.653 -13.584 -1.822 333 HD21 LEU 38 HD21 LEU 38 7.030 -10.559 -0.222 334 HD22 LEU 38 HD22 LEU 38 8.471 -9.549 -0.435 335 HD23 LEU 38 HD23 LEU 38 7.566 -10.092 -1.850 336 H ASP 39 H ASP 39 11.552 -12.760 2.330 337 HA ASP 39 HA ASP 39 10.186 -13.692 4.767 338 HB2 ASP 39 HB2 ASP 39 11.421 -15.174 3.159 339 HB3 ASP 39 HB3 ASP 39 12.922 -14.388 3.645 340 H GLN 40 H GLN 40 11.915 -10.956 4.143 341 HA GLN 40 HA GLN 40 13.281 -10.761 6.804 342 HB2 GLN 40 HB2 GLN 40 14.368 -10.398 3.996 343 HB3 GLN 40 HB3 GLN 40 15.180 -9.673 5.395 344 HG2 GLN 40 HG2 GLN 40 15.784 -11.675 6.287 345 HG3 GLN 40 HG3 GLN 40 14.547 -12.594 5.414 346 HE21 GLN 40 HE21 GLN 40 16.444 -12.878 2.373 347 HE22 GLN 40 HE22 GLN 40 14.804 -12.804 2.989 348 HA PRO 41 HA PRO 41 10.847 -7.196 5.283 349 HB2 PRO 41 HB2 PRO 41 9.436 -7.128 7.957 350 HB3 PRO 41 HB3 PRO 41 8.719 -6.947 6.338 351 HG2 PRO 41 HG2 PRO 41 8.474 -9.294 7.685 352 HG3 PRO 41 HG3 PRO 41 8.840 -9.304 5.929 353 HD2 PRO 41 HD2 PRO 41 10.790 -9.568 8.243 354 HD3 PRO 41 HD3 PRO 41 10.608 -10.610 6.810 355 H ASP 42 H ASP 42 11.051 -4.968 5.640 356 HA ASP 42 HA ASP 42 13.140 -4.002 7.464 357 HB2 ASP 42 HB2 ASP 42 11.155 -2.635 5.597 358 HB3 ASP 42 HB3 ASP 42 12.338 -1.764 6.572 359 H TRP 43 H TRP 43 9.629 -4.225 7.428 360 HA TRP 43 HA TRP 43 9.374 -3.769 10.285 361 HB2 TRP 43 HB2 TRP 43 9.434 -1.446 9.605 362 HB3 TRP 43 HB3 TRP 43 8.351 -1.749 8.259 363 HD1 TRP 43 HD1 TRP 43 8.329 -0.953 11.954 364 HE1 TRP 43 HE1 TRP 43 5.927 -0.396 12.678 365 HE3 TRP 43 HE3 TRP 43 5.864 -2.562 7.794 366 HZ2 TRP 43 HZ2 TRP 43 3.274 -0.458 11.490 367 HZ3 TRP 43 HZ3 TRP 43 3.411 -2.198 7.562 368 HH2 TRP 43 HH2 TRP 43 2.104 -1.184 9.412 369 H THR 44 H THR 44 7.237 -4.364 11.041 370 HA THR 44 HA THR 44 5.274 -5.345 9.053 371 HB THR 44 HB THR 44 4.741 -7.312 10.441 372 HG1 THR 44 HG1 THR 44 6.305 -8.028 11.924 373 HG21 THR 44 HG21 THR 44 6.482 -8.751 9.642 374 HG22 THR 44 HG22 THR 44 6.246 -7.470 8.445 375 HG23 THR 44 HG23 THR 44 7.642 -7.402 9.541 376 H GLY 45 H GLY 45 3.141 -5.232 9.661 377 HA2 GLY 45 HA2 GLY 45 2.158 -4.673 12.264 378 HA3 GLY 45 HA3 GLY 45 2.430 -3.132 11.459 379 H ARG 46 H ARG 46 0.398 -2.480 11.183 380 HA ARG 46 HA ARG 46 -1.682 -4.270 10.002 381 HB2 ARG 46 HB2 ARG 46 -2.162 -1.622 11.384 382 HB3 ARG 46 HB3 ARG 46 -3.314 -2.917 11.059 383 HG2 ARG 46 HG2 ARG 46 -2.002 -4.349 12.720 384 HG3 ARG 46 HG3 ARG 46 -1.075 -2.904 13.133 385 HD2 ARG 46 HD2 ARG 46 -4.079 -3.305 13.436 386 HD3 ARG 46 HD3 ARG 46 -2.878 -3.238 14.730 387 HE ARG 46 HE ARG 46 -3.081 -0.824 13.027 388 HH11 ARG 46 HH11 ARG 46 -3.947 1.076 13.855 389 HH12 ARG 46 HH12 ARG 46 -4.588 1.057 15.473 390 HH21 ARG 46 HH21 ARG 46 -4.088 -2.272 16.050 391 HH22 ARG 46 HH22 ARG 46 -4.670 -0.758 16.682 392 H LEU 47 H LEU 47 -2.919 -3.631 8.319 393 HA LEU 47 HA LEU 47 -2.123 -1.285 6.667 394 HB2 LEU 47 HB2 LEU 47 -2.685 -3.452 5.536 395 HB3 LEU 47 HB3 LEU 47 -4.258 -3.423 6.329 396 HG LEU 47 HG LEU 47 -4.706 -1.196 5.104 397 HD11 LEU 47 HD11 LEU 47 -2.354 -0.720 4.460 398 HD12 LEU 47 HD12 LEU 47 -2.351 -2.176 3.442 399 HD13 LEU 47 HD13 LEU 47 -3.424 -0.810 3.062 400 HD21 LEU 47 HD21 LEU 47 -5.391 -2.343 3.057 401 HD22 LEU 47 HD22 LEU 47 -4.416 -3.746 3.523 402 HD23 LEU 47 HD23 LEU 47 -5.804 -3.256 4.507 403 H ARG 48 H ARG 48 -3.267 0.612 6.729 404 HA ARG 48 HA ARG 48 -6.146 0.499 7.322 405 HB2 ARG 48 HB2 ARG 48 -5.239 0.968 9.520 406 HB3 ARG 48 HB3 ARG 48 -4.303 2.335 8.907 407 HG2 ARG 48 HG2 ARG 48 -6.180 3.685 8.641 408 HG3 ARG 48 HG3 ARG 48 -7.306 2.330 8.489 409 HD2 ARG 48 HD2 ARG 48 -7.251 1.850 10.826 410 HD3 ARG 48 HD3 ARG 48 -5.859 2.882 11.099 411 HE ARG 48 HE ARG 48 -8.644 3.717 10.918 412 HH11 ARG 48 HH11 ARG 48 -9.170 5.939 10.994 413 HH12 ARG 48 HH12 ARG 48 -7.832 7.087 10.882 414 HH21 ARG 48 HH21 ARG 48 -5.293 4.936 10.907 415 HH22 ARG 48 HH22 ARG 48 -5.911 6.596 10.763 416 H ILE 49 H ILE 49 -6.538 0.811 5.250 417 HA ILE 49 HA ILE 49 -5.585 3.187 3.796 418 HB ILE 49 HB ILE 49 -7.872 1.367 2.994 419 HG12 ILE 49 HG12 ILE 49 -4.897 1.075 2.404 420 HG13 ILE 49 HG13 ILE 49 -5.942 -0.050 3.278 421 HG21 ILE 49 HG21 ILE 49 -6.056 3.172 1.325 422 HG22 ILE 49 HG22 ILE 49 -7.477 2.271 0.755 423 HG23 ILE 49 HG23 ILE 49 -7.683 3.619 1.866 424 HD11 ILE 49 HD11 ILE 49 -5.959 0.537 0.311 425 HD12 ILE 49 HD12 ILE 49 -5.706 -0.996 1.157 426 HD13 ILE 49 HD13 ILE 49 -7.313 -0.275 1.141 427 H THR 50 H THR 50 -6.487 5.085 3.884 428 HA THR 50 HA THR 50 -9.202 5.545 5.001 429 HB THR 50 HB THR 50 -7.977 7.642 6.056 430 HG1 THR 50 HG1 THR 50 -5.908 5.742 5.991 431 HG21 THR 50 HG21 THR 50 -7.875 4.856 7.253 432 HG22 THR 50 HG22 THR 50 -7.574 6.363 8.151 433 HG23 THR 50 HG23 THR 50 -9.165 6.074 7.430 434 H SER 51 H SER 51 -9.813 8.022 4.604 435 HA SER 51 HA SER 51 -8.426 9.335 2.380 436 HB2 SER 51 HB2 SER 51 -9.924 7.787 1.181 437 HB3 SER 51 HB3 SER 51 -11.308 8.371 2.117 438 HG SER 51 HG SER 51 -11.207 10.306 1.065 439 H LYS 52 H LYS 52 -8.758 11.461 2.283 440 HA LYS 52 HA LYS 52 -11.312 12.430 3.100 441 HB2 LYS 52 HB2 LYS 52 -9.868 12.606 5.192 442 HB3 LYS 52 HB3 LYS 52 -8.976 13.875 4.358 443 HG2 LYS 52 HG2 LYS 52 -10.731 14.697 5.876 444 HG3 LYS 52 HG3 LYS 52 -10.930 15.255 4.221 445 HD2 LYS 52 HD2 LYS 52 -13.069 14.716 5.319 446 HD3 LYS 52 HD3 LYS 52 -12.802 13.696 3.907 447 HE2 LYS 52 HE2 LYS 52 -12.095 11.832 5.339 448 HE3 LYS 52 HE3 LYS 52 -12.287 12.835 6.784 449 HZ1 LYS 52 HZ1 LYS 52 -14.514 12.253 4.905 450 HZ2 LYS 52 HZ2 LYS 52 -14.228 11.351 6.212 451 HZ3 LYS 52 HZ3 LYS 52 -14.644 12.936 6.387 452 H GLY 53 H GLY 53 -12.038 13.842 1.692 453 HA2 GLY 53 HA2 GLY 53 -12.188 15.634 0.235 454 HA3 GLY 53 HA3 GLY 53 -10.565 16.110 0.734 455 H LYS 54 H LYS 54 -11.858 13.291 -1.033 456 HA LYS 54 HA LYS 54 -11.326 12.235 -2.967 457 HB2 LYS 54 HB2 LYS 54 -10.600 14.982 -4.034 458 HB3 LYS 54 HB3 LYS 54 -10.867 13.530 -4.998 459 HG2 LYS 54 HG2 LYS 54 -13.214 13.426 -4.315 460 HG3 LYS 54 HG3 LYS 54 -12.998 14.837 -3.256 461 HD2 LYS 54 HD2 LYS 54 -12.347 16.209 -5.230 462 HD3 LYS 54 HD3 LYS 54 -12.632 14.807 -6.286 463 HE2 LYS 54 HE2 LYS 54 -14.989 14.729 -5.562 464 HE3 LYS 54 HE3 LYS 54 -14.713 16.079 -4.451 465 HZ1 LYS 54 HZ1 LYS 54 -14.459 16.231 -7.413 466 HZ2 LYS 54 HZ2 LYS 54 -15.697 16.841 -6.541 467 HZ3 LYS 54 HZ3 LYS 54 -14.204 17.477 -6.386 468 H THR 55 H THR 55 -9.281 12.645 -0.877 469 HA THR 55 HA THR 55 -6.965 11.649 -2.457 470 HB THR 55 HB THR 55 -6.722 13.338 0.053 471 HG1 THR 55 HG1 THR 55 -7.396 14.658 -1.633 472 HG21 THR 55 HG21 THR 55 -4.716 12.364 -2.017 473 HG22 THR 55 HG22 THR 55 -4.353 13.443 -0.645 474 HG23 THR 55 HG23 THR 55 -4.873 11.776 -0.344 475 H ALA 56 H ALA 56 -6.778 9.577 -1.981 476 HA ALA 56 HA ALA 56 -7.689 8.487 0.615 477 HB1 ALA 56 HB1 ALA 56 -7.249 6.305 -0.345 478 HB2 ALA 56 HB2 ALA 56 -8.297 7.257 -1.413 479 HB3 ALA 56 HB3 ALA 56 -6.570 7.050 -1.803 480 H TYR 57 H TYR 57 -6.236 7.166 1.851 481 HA TYR 57 HA TYR 57 -3.341 7.878 1.725 482 HB2 TYR 57 HB2 TYR 57 -5.109 7.991 4.198 483 HB3 TYR 57 HB3 TYR 57 -3.400 8.376 4.103 484 HD1 TYR 57 HD1 TYR 57 -2.824 10.342 2.365 485 HD2 TYR 57 HD2 TYR 57 -6.646 9.804 4.327 486 HE1 TYR 57 HE1 TYR 57 -3.354 12.750 2.027 487 HE2 TYR 57 HE2 TYR 57 -7.144 12.198 4.004 488 HH TYR 57 HH TYR 57 -4.858 14.438 2.389 489 H ILE 58 H ILE 58 -2.471 5.825 1.352 490 HA ILE 58 HA ILE 58 -3.461 3.489 2.931 491 HB ILE 58 HB ILE 58 -1.089 3.732 1.043 492 HG12 ILE 58 HG12 ILE 58 -2.387 1.899 -0.198 493 HG13 ILE 58 HG13 ILE 58 -3.792 2.349 0.760 494 HG21 ILE 58 HG21 ILE 58 -2.135 1.302 2.568 495 HG22 ILE 58 HG22 ILE 58 -0.837 1.293 1.352 496 HG23 ILE 58 HG23 ILE 58 -0.590 2.124 2.866 497 HD11 ILE 58 HD11 ILE 58 -2.230 4.226 -1.065 498 HD12 ILE 58 HD12 ILE 58 -3.681 3.325 -1.541 499 HD13 ILE 58 HD13 ILE 58 -3.805 4.567 -0.290 500 H LYS 59 H LYS 59 -3.267 4.143 5.063 501 HA LYS 59 HA LYS 59 -0.538 4.866 6.005 502 HB2 LYS 59 HB2 LYS 59 -3.122 4.783 7.601 503 HB3 LYS 59 HB3 LYS 59 -1.554 5.428 8.097 504 HG2 LYS 59 HG2 LYS 59 -1.771 6.923 5.939 505 HG3 LYS 59 HG3 LYS 59 -3.480 6.508 6.014 506 HD2 LYS 59 HD2 LYS 59 -3.607 7.492 8.297 507 HD3 LYS 59 HD3 LYS 59 -1.868 7.877 8.212 508 HE2 LYS 59 HE2 LYS 59 -2.319 9.234 6.139 509 HE3 LYS 59 HE3 LYS 59 -4.050 8.926 6.357 510 HZ1 LYS 59 HZ1 LYS 59 -2.326 10.346 8.323 511 HZ2 LYS 59 HZ2 LYS 59 -3.393 11.063 7.310 512 HZ3 LYS 59 HZ3 LYS 59 -3.934 10.069 8.491 513 H LEU 60 H LEU 60 0.738 3.667 7.164 514 HA LEU 60 HA LEU 60 -0.019 0.847 7.837 515 HB2 LEU 60 HB2 LEU 60 2.413 2.159 6.689 516 HB3 LEU 60 HB3 LEU 60 2.710 0.956 7.933 517 HG LEU 60 HG LEU 60 1.561 -0.759 6.738 518 HD11 LEU 60 HD11 LEU 60 0.958 1.335 4.600 519 HD12 LEU 60 HD12 LEU 60 0.773 -0.420 4.375 520 HD13 LEU 60 HD13 LEU 60 -0.230 0.420 5.557 521 HD21 LEU 60 HD21 LEU 60 3.938 -0.224 6.196 522 HD22 LEU 60 HD22 LEU 60 3.081 -0.982 4.846 523 HD23 LEU 60 HD23 LEU 60 3.391 0.770 4.834 524 H GLU 61 H GLU 61 -0.006 0.205 9.898 525 HA GLU 61 HA GLU 61 0.874 2.179 11.978 526 HB2 GLU 61 HB2 GLU 61 -1.750 0.684 11.765 527 HB3 GLU 61 HB3 GLU 61 -1.234 1.643 13.157 528 HG2 GLU 61 HG2 GLU 61 -1.127 3.671 11.736 529 HG3 GLU 61 HG3 GLU 61 -1.679 2.728 10.344 530 H ASP 62 H ASP 62 1.463 1.392 14.053 531 HA ASP 62 HA ASP 62 2.633 -1.185 14.147 532 HB2 ASP 62 HB2 ASP 62 3.406 0.686 15.500 533 HB3 ASP 62 HB3 ASP 62 1.870 0.634 16.411 534 H LYS 63 H LYS 63 2.108 -3.062 15.062 535 HA LYS 63 HA LYS 63 -0.678 -3.689 15.333 536 HB2 LYS 63 HB2 LYS 63 0.386 -6.095 15.793 537 HB3 LYS 63 HB3 LYS 63 0.350 -5.377 14.197 538 HG2 LYS 63 HG2 LYS 63 2.504 -6.446 14.672 539 HG3 LYS 63 HG3 LYS 63 2.647 -4.735 14.300 540 HD2 LYS 63 HD2 LYS 63 2.830 -4.277 16.790 541 HD3 LYS 63 HD3 LYS 63 2.947 -6.025 17.039 542 HE2 LYS 63 HE2 LYS 63 5.050 -6.149 16.026 543 HE3 LYS 63 HE3 LYS 63 4.727 -4.784 14.951 544 HZ1 LYS 63 HZ1 LYS 63 6.329 -4.169 16.650 545 HZ2 LYS 63 HZ2 LYS 63 4.969 -3.270 16.801 546 HZ3 LYS 63 HZ3 LYS 63 5.271 -4.501 17.852 547 H VAL 64 H VAL 64 1.216 -2.479 17.735 548 HA VAL 64 HA VAL 64 -0.590 -3.711 19.783 549 HB VAL 64 HB VAL 64 2.164 -2.514 20.262 550 HG11 VAL 64 HG11 VAL 64 0.274 -4.039 22.108 551 HG12 VAL 64 HG12 VAL 64 1.934 -3.546 22.509 552 HG13 VAL 64 HG13 VAL 64 0.703 -2.317 22.231 553 HG21 VAL 64 HG21 VAL 64 2.863 -4.856 20.781 554 HG22 VAL 64 HG22 VAL 64 1.292 -5.437 20.181 555 HG23 VAL 64 HG23 VAL 64 2.441 -4.637 19.085 556 H SER 65 H SER 65 1.049 -0.685 18.796 557 HA SER 65 HA SER 65 -0.865 0.831 20.538 558 HB2 SER 65 HB2 SER 65 1.993 1.384 19.719 559 HB3 SER 65 HB3 SER 65 0.968 2.545 20.586 560 HG SER 65 HG SER 65 2.252 1.267 22.011 561 H GLY 66 H GLY 66 -0.359 0.288 17.246 562 HA2 GLY 66 HA2 GLY 66 -1.460 1.220 15.449 563 HA3 GLY 66 HA3 GLY 66 -2.278 2.343 16.538 564 H GLU 67 H GLU 67 1.148 2.370 16.719 565 HA GLU 67 HA GLU 67 1.461 5.101 16.111 566 HB2 GLU 67 HB2 GLU 67 3.560 2.902 16.026 567 HB3 GLU 67 HB3 GLU 67 3.855 4.641 16.223 568 HG2 GLU 67 HG2 GLU 67 2.423 4.447 18.363 569 HG3 GLU 67 HG3 GLU 67 2.544 2.693 18.128 570 H LEU 68 H LEU 68 1.831 6.208 14.217 571 HA LEU 68 HA LEU 68 1.502 4.859 11.707 572 HB2 LEU 68 HB2 LEU 68 0.716 7.170 12.200 573 HB3 LEU 68 HB3 LEU 68 2.393 7.708 12.297 574 HG LEU 68 HG LEU 68 2.696 7.022 9.876 575 HD11 LEU 68 HD11 LEU 68 0.644 6.714 8.516 576 HD12 LEU 68 HD12 LEU 68 0.857 5.395 9.656 577 HD13 LEU 68 HD13 LEU 68 -0.334 6.664 10.001 578 HD21 LEU 68 HD21 LEU 68 1.465 8.940 8.960 579 HD22 LEU 68 HD22 LEU 68 0.465 9.022 10.430 580 HD23 LEU 68 HD23 LEU 68 2.209 9.356 10.511 581 H PHE 69 H PHE 69 2.969 3.677 10.695 582 HA PHE 69 HA PHE 69 5.880 4.071 10.999 583 HB2 PHE 69 HB2 PHE 69 5.134 1.819 10.910 584 HB3 PHE 69 HB3 PHE 69 4.122 2.107 9.504 585 HD1 PHE 69 HD1 PHE 69 7.720 2.098 10.589 586 HD2 PHE 69 HD2 PHE 69 4.940 1.698 7.314 587 HE1 PHE 69 HE1 PHE 69 9.587 1.468 9.075 588 HE2 PHE 69 HE2 PHE 69 6.812 1.122 5.798 589 HZ PHE 69 HZ PHE 69 9.136 0.983 6.676 590 H ALA 70 H ALA 70 3.505 4.195 8.309 591 HA ALA 70 HA ALA 70 4.874 6.434 7.027 592 HB1 ALA 70 HB1 ALA 70 4.732 3.709 5.642 593 HB2 ALA 70 HB2 ALA 70 5.361 5.222 4.953 594 HB3 ALA 70 HB3 ALA 70 6.217 4.446 6.287 595 H GLN 71 H GLN 71 3.662 7.229 5.135 596 HA GLN 71 HA GLN 71 0.993 6.077 4.700 597 HB2 GLN 71 HB2 GLN 71 -0.186 8.154 4.975 598 HB3 GLN 71 HB3 GLN 71 0.608 7.678 6.460 599 HG2 GLN 71 HG2 GLN 71 1.248 9.833 6.573 600 HG3 GLN 71 HG3 GLN 71 2.529 9.361 5.473 601 HE21 GLN 71 HE21 GLN 71 1.376 11.895 3.273 602 HE22 GLN 71 HE22 GLN 71 2.747 11.021 3.965 603 H ALA 72 H ALA 72 0.302 6.150 2.654 604 HA ALA 72 HA ALA 72 1.824 7.786 0.649 605 HB1 ALA 72 HB1 ALA 72 2.284 5.424 0.420 606 HB2 ALA 72 HB2 ALA 72 0.558 5.043 0.377 607 HB3 ALA 72 HB3 ALA 72 1.292 5.979 -0.938 608 HA PRO 73 HA PRO 73 -2.339 9.609 0.159 609 HB2 PRO 73 HB2 PRO 73 -0.692 11.685 -1.244 610 HB3 PRO 73 HB3 PRO 73 -2.007 11.898 -0.050 611 HG2 PRO 73 HG2 PRO 73 0.591 12.238 0.658 612 HG3 PRO 73 HG3 PRO 73 -0.553 11.391 1.756 613 HD2 PRO 73 HD2 PRO 73 1.435 10.167 -0.183 614 HD3 PRO 73 HD3 PRO 73 1.155 9.770 1.538 615 H VAL 74 H VAL 74 -3.670 9.440 -1.585 616 HA VAL 74 HA VAL 74 -2.549 9.012 -4.321 617 HB VAL 74 HB VAL 74 -4.921 7.444 -3.260 618 HG11 VAL 74 HG11 VAL 74 -4.610 7.542 -5.681 619 HG12 VAL 74 HG12 VAL 74 -2.953 6.915 -5.520 620 HG13 VAL 74 HG13 VAL 74 -4.347 5.903 -5.086 621 HG21 VAL 74 HG21 VAL 74 -3.180 6.748 -1.745 622 HG22 VAL 74 HG22 VAL 74 -3.489 5.480 -2.928 623 HG23 VAL 74 HG23 VAL 74 -2.043 6.500 -3.086 624 H GLU 75 H GLU 75 -3.546 10.355 -5.805 625 HA GLU 75 HA GLU 75 -5.983 11.841 -4.972 626 HB2 GLU 75 HB2 GLU 75 -4.167 12.096 -7.397 627 HB3 GLU 75 HB3 GLU 75 -5.564 13.125 -7.060 628 HG2 GLU 75 HG2 GLU 75 -4.530 13.812 -4.896 629 HG3 GLU 75 HG3 GLU 75 -3.099 12.856 -5.286 630 H GLN 76 H GLN 76 -5.185 9.208 -7.086 631 HA GLN 76 HA GLN 76 -7.930 8.474 -7.398 632 HB2 GLN 76 HB2 GLN 76 -8.196 8.521 -9.744 633 HB3 GLN 76 HB3 GLN 76 -7.757 10.148 -9.272 634 HG2 GLN 76 HG2 GLN 76 -5.941 8.101 -10.625 635 HG3 GLN 76 HG3 GLN 76 -6.710 9.475 -11.384 636 HE21 GLN 76 HE21 GLN 76 -3.241 10.044 -9.309 637 HE22 GLN 76 HE22 GLN 76 -4.123 8.511 -9.160 638 H TYR 77 H TYR 77 -8.137 6.273 -8.067 639 HA TYR 77 HA TYR 77 -5.595 4.766 -8.400 640 HB2 TYR 77 HB2 TYR 77 -6.567 4.441 -6.178 641 HB3 TYR 77 HB3 TYR 77 -8.071 3.890 -6.926 642 HD1 TYR 77 HD1 TYR 77 -8.369 1.644 -7.553 643 HD2 TYR 77 HD2 TYR 77 -4.417 3.130 -6.710 644 HE1 TYR 77 HE1 TYR 77 -7.473 -0.666 -7.743 645 HE2 TYR 77 HE2 TYR 77 -3.502 0.825 -7.013 646 HH TYR 77 HH TYR 77 -5.571 -1.964 -7.843 647 HA PRO 78 HA PRO 78 -4.733 2.919 -9.495 648 HB2 PRO 78 HB2 PRO 78 -4.498 2.938 -12.491 649 HB3 PRO 78 HB3 PRO 78 -3.821 1.779 -11.304 650 HG2 PRO 78 HG2 PRO 78 -6.019 1.111 -12.730 651 HG3 PRO 78 HG3 PRO 78 -5.972 0.764 -10.967 652 HD2 PRO 78 HD2 PRO 78 -7.249 3.139 -12.373 653 HD3 PRO 78 HD3 PRO 78 -7.959 2.052 -11.141 654 H GLY 79 H GLY 79 -2.842 4.127 -9.441 655 HA2 GLY 79 HA2 GLY 79 -2.377 6.523 -11.047 656 HA3 GLY 79 HA3 GLY 79 -2.871 6.865 -9.388 657 H ILE 80 H ILE 80 -0.668 7.942 -9.603 658 HA ILE 80 HA ILE 80 1.719 6.491 -9.939 659 HB ILE 80 HB ILE 80 1.562 8.880 -10.242 660 HG12 ILE 80 HG12 ILE 80 3.556 9.710 -9.063 661 HG13 ILE 80 HG13 ILE 80 3.526 8.319 -7.977 662 HG21 ILE 80 HG21 ILE 80 -0.023 9.476 -8.408 663 HG22 ILE 80 HG22 ILE 80 1.274 9.218 -7.220 664 HG23 ILE 80 HG23 ILE 80 1.403 10.504 -8.429 665 HD11 ILE 80 HD11 ILE 80 3.918 8.185 -10.996 666 HD12 ILE 80 HD12 ILE 80 5.204 8.116 -9.770 667 HD13 ILE 80 HD13 ILE 80 4.008 6.813 -9.859 668 H ALA 81 H ALA 81 -0.071 7.024 -6.940 669 HA ALA 81 HA ALA 81 2.221 6.224 -5.291 670 HB1 ALA 81 HB1 ALA 81 0.917 8.189 -4.711 671 HB2 ALA 81 HB2 ALA 81 -0.561 7.213 -4.611 672 HB3 ALA 81 HB3 ALA 81 0.758 6.962 -3.443 673 H VAL 82 H VAL 82 0.299 4.251 -6.936 674 HA VAL 82 HA VAL 82 0.567 2.089 -4.960 675 HB VAL 82 HB VAL 82 -2.126 2.609 -6.212 676 HG11 VAL 82 HG11 VAL 82 -1.209 0.678 -4.024 677 HG12 VAL 82 HG12 VAL 82 -2.882 0.856 -4.583 678 HG13 VAL 82 HG13 VAL 82 -1.649 0.223 -5.676 679 HG21 VAL 82 HG21 VAL 82 -1.904 4.351 -4.563 680 HG22 VAL 82 HG22 VAL 82 -3.035 3.131 -3.994 681 HG23 VAL 82 HG23 VAL 82 -1.390 3.177 -3.330 682 H GLU 83 H GLU 83 1.280 0.356 -5.951 683 HA GLU 83 HA GLU 83 0.808 -0.183 -8.849 684 HB2 GLU 83 HB2 GLU 83 3.362 0.486 -7.403 685 HB3 GLU 83 HB3 GLU 83 3.436 -0.796 -8.624 686 HG2 GLU 83 HG2 GLU 83 2.617 0.626 -10.331 687 HG3 GLU 83 HG3 GLU 83 2.210 1.924 -9.184 688 H THR 84 H THR 84 1.357 -2.342 -9.513 689 HA THR 84 HA THR 84 1.028 -4.461 -7.393 690 HB THR 84 HB THR 84 0.043 -5.768 -9.283 691 HG1 THR 84 HG1 THR 84 -0.592 -4.636 -11.120 692 HG21 THR 84 HG21 THR 84 -2.128 -4.586 -9.335 693 HG22 THR 84 HG22 THR 84 -1.436 -4.632 -7.711 694 HG23 THR 84 HG23 THR 84 -1.359 -3.129 -8.663 695 H VAL 85 H VAL 85 1.936 -6.547 -7.939 696 HA VAL 85 HA VAL 85 4.514 -6.508 -9.374 697 HB VAL 85 HB VAL 85 4.866 -8.688 -8.386 698 HG11 VAL 85 HG11 VAL 85 5.418 -6.635 -7.100 699 HG12 VAL 85 HG12 VAL 85 3.866 -6.767 -6.250 700 HG13 VAL 85 HG13 VAL 85 5.086 -8.031 -6.063 701 HG21 VAL 85 HG21 VAL 85 2.515 -9.520 -8.354 702 HG22 VAL 85 HG22 VAL 85 3.348 -9.713 -6.815 703 HG23 VAL 85 HG23 VAL 85 2.164 -8.407 -7.019 704 H THR 86 H THR 86 4.768 -8.707 -10.576 705 HA THR 86 HA THR 86 2.465 -9.069 -12.457 706 HB THR 86 HB THR 86 4.541 -8.196 -13.364 707 HG1 THR 86 HG1 THR 86 4.633 -9.613 -15.096 708 HG21 THR 86 HG21 THR 86 6.059 -9.526 -11.830 709 HG22 THR 86 HG22 THR 86 5.779 -10.925 -12.866 710 HG23 THR 86 HG23 THR 86 6.559 -9.448 -13.519 711 H ASP 87 H ASP 87 4.331 -10.903 -10.109 712 HA ASP 87 HA ASP 87 3.531 -13.485 -11.229 713 HB2 ASP 87 HB2 ASP 87 5.758 -13.089 -10.275 714 HB3 ASP 87 HB3 ASP 87 5.027 -12.831 -8.684 715 H SER 88 H SER 88 2.816 -11.829 -8.068 716 HA SER 88 HA SER 88 0.361 -13.542 -7.843 717 HB2 SER 88 HB2 SER 88 2.108 -14.677 -6.615 718 HB3 SER 88 HB3 SER 88 2.468 -13.203 -5.695 719 HG SER 88 HG SER 88 0.984 -14.803 -4.697 720 H SER 89 H SER 89 -1.433 -12.510 -7.251 721 HA SER 89 HA SER 89 -1.402 -9.692 -7.064 722 HB2 SER 89 HB2 SER 89 -3.818 -11.233 -6.196 723 HB3 SER 89 HB3 SER 89 -3.711 -9.766 -7.166 724 HG SER 89 HG SER 89 -2.871 -11.071 -8.881 725 H ARG 90 H ARG 90 -0.604 -11.676 -4.483 726 HA ARG 90 HA ARG 90 -1.918 -10.036 -2.442 727 HB2 ARG 90 HB2 ARG 90 -1.416 -11.553 -0.832 728 HB3 ARG 90 HB3 ARG 90 -1.876 -12.492 -2.247 729 HG2 ARG 90 HG2 ARG 90 0.528 -12.919 -2.726 730 HG3 ARG 90 HG3 ARG 90 0.958 -11.998 -1.267 731 HD2 ARG 90 HD2 ARG 90 -0.411 -13.613 0.087 732 HD3 ARG 90 HD3 ARG 90 -0.623 -14.590 -1.382 733 HE ARG 90 HE ARG 90 2.164 -14.030 -0.967 734 HH11 ARG 90 HH11 ARG 90 3.565 -15.522 -0.325 735 HH12 ARG 90 HH12 ARG 90 3.045 -16.925 0.578 736 HH21 ARG 90 HH21 ARG 90 -0.262 -15.985 0.654 737 HH22 ARG 90 HH22 ARG 90 0.909 -17.183 1.108 738 H TYR 91 H TYR 91 0.275 -8.890 -4.253 739 HA TYR 91 HA TYR 91 1.924 -7.707 -2.112 740 HB2 TYR 91 HB2 TYR 91 2.952 -8.946 -4.684 741 HB3 TYR 91 HB3 TYR 91 3.915 -8.048 -3.532 742 HD1 TYR 91 HD1 TYR 91 4.325 -8.981 -1.235 743 HD2 TYR 91 HD2 TYR 91 2.479 -11.296 -4.367 744 HE1 TYR 91 HE1 TYR 91 4.796 -11.080 0.034 745 HE2 TYR 91 HE2 TYR 91 3.065 -13.396 -3.162 746 HH TYR 91 HH TYR 91 4.689 -13.356 0.031 747 H PHE 92 H PHE 92 2.365 -5.588 -2.430 748 HA PHE 92 HA PHE 92 1.754 -4.272 -5.031 749 HB2 PHE 92 HB2 PHE 92 0.717 -3.338 -2.325 750 HB3 PHE 92 HB3 PHE 92 0.515 -2.495 -3.847 751 HD1 PHE 92 HD1 PHE 92 -0.941 -3.472 -5.661 752 HD2 PHE 92 HD2 PHE 92 -0.703 -5.147 -1.710 753 HE1 PHE 92 HE1 PHE 92 -3.012 -4.790 -6.092 754 HE2 PHE 92 HE2 PHE 92 -2.816 -6.380 -2.096 755 HZ PHE 92 HZ PHE 92 -3.943 -6.253 -4.320 756 H VAL 93 H VAL 93 2.550 -2.067 -5.099 757 HA VAL 93 HA VAL 93 4.663 -1.382 -3.101 758 HB VAL 93 HB VAL 93 4.669 -0.747 -6.069 759 HG11 VAL 93 HG11 VAL 93 6.761 -0.032 -3.977 760 HG12 VAL 93 HG12 VAL 93 6.808 0.327 -5.719 761 HG13 VAL 93 HG13 VAL 93 5.609 1.110 -4.694 762 HG21 VAL 93 HG21 VAL 93 5.349 -3.041 -5.688 763 HG22 VAL 93 HG22 VAL 93 6.779 -2.085 -6.054 764 HG23 VAL 93 HG23 VAL 93 6.445 -2.547 -4.377 765 H ILE 94 H ILE 94 4.505 0.718 -2.228 766 HA ILE 94 HA ILE 94 2.553 2.532 -3.524 767 HB ILE 94 HB ILE 94 1.688 3.376 -1.469 768 HG12 ILE 94 HG12 ILE 94 3.536 2.499 0.065 769 HG13 ILE 94 HG13 ILE 94 1.887 2.502 0.658 770 HG21 ILE 94 HG21 ILE 94 0.376 1.835 -2.753 771 HG22 ILE 94 HG22 ILE 94 1.058 0.440 -1.912 772 HG23 ILE 94 HG23 ILE 94 0.048 1.613 -1.032 773 HD11 ILE 94 HD11 ILE 94 3.094 0.492 1.339 774 HD12 ILE 94 HD12 ILE 94 1.707 0.081 0.325 775 HD13 ILE 94 HD13 ILE 94 3.349 0.025 -0.353 776 H ARG 95 H ARG 95 2.862 4.691 -3.329 777 HA ARG 95 HA ARG 95 5.693 5.462 -2.786 778 HB2 ARG 95 HB2 ARG 95 4.538 6.087 -4.951 779 HB3 ARG 95 HB3 ARG 95 3.566 7.233 -4.011 780 HG2 ARG 95 HG2 ARG 95 5.687 8.297 -3.196 781 HG3 ARG 95 HG3 ARG 95 6.605 7.203 -4.248 782 HD2 ARG 95 HD2 ARG 95 5.395 8.138 -6.219 783 HD3 ARG 95 HD3 ARG 95 4.512 9.235 -5.138 784 HE ARG 95 HE ARG 95 7.323 9.570 -4.701 785 HH11 ARG 95 HH11 ARG 95 8.399 11.269 -5.377 786 HH12 ARG 95 HH12 ARG 95 7.861 12.221 -6.746 787 HH21 ARG 95 HH21 ARG 95 4.992 10.361 -7.202 788 HH22 ARG 95 HH22 ARG 95 5.942 11.713 -7.756 789 H ILE 96 H ILE 96 5.670 5.340 -0.530 790 HA ILE 96 HA ILE 96 3.856 7.010 1.024 791 HB ILE 96 HB ILE 96 5.079 6.476 2.978 792 HG12 ILE 96 HG12 ILE 96 6.894 4.501 2.568 793 HG13 ILE 96 HG13 ILE 96 7.200 5.428 1.113 794 HG21 ILE 96 HG21 ILE 96 4.544 4.057 1.252 795 HG22 ILE 96 HG22 ILE 96 4.684 4.050 3.015 796 HG23 ILE 96 HG23 ILE 96 3.375 4.943 2.264 797 HD11 ILE 96 HD11 ILE 96 8.700 6.069 2.949 798 HD12 ILE 96 HD12 ILE 96 7.650 7.442 2.554 799 HD13 ILE 96 HD13 ILE 96 7.316 6.442 3.991 800 H GLN 97 H GLN 97 4.205 8.913 2.054 801 HA GLN 97 HA GLN 97 6.426 10.655 1.066 802 HB2 GLN 97 HB2 GLN 97 3.436 11.022 0.703 803 HB3 GLN 97 HB3 GLN 97 4.560 12.384 0.652 804 HG2 GLN 97 HG2 GLN 97 5.577 11.713 -1.308 805 HG3 GLN 97 HG3 GLN 97 5.140 10.016 -1.126 806 HE21 GLN 97 HE21 GLN 97 2.182 10.295 -2.997 807 HE22 GLN 97 HE22 GLN 97 3.268 9.246 -2.087 808 H ASP 98 H ASP 98 6.817 12.468 2.249 809 HA ASP 98 HA ASP 98 5.917 12.368 5.089 810 HB2 ASP 98 HB2 ASP 98 8.360 12.327 4.372 811 HB3 ASP 98 HB3 ASP 98 8.139 14.010 3.886 812 H GLY 99 H GLY 99 4.767 13.868 2.441 813 HA2 GLY 99 HA2 GLY 99 3.104 15.479 2.255 814 HA3 GLY 99 HA3 GLY 99 3.316 15.905 3.953 815 H THR 100 H THR 100 6.228 15.966 2.199 816 HA THR 100 HA THR 100 6.146 18.917 1.735 817 HB THR 100 HB THR 100 6.919 18.264 4.023 818 HG1 THR 100 HG1 THR 100 8.612 19.703 4.014 819 HG21 THR 100 HG21 THR 100 8.222 16.222 3.335 820 HG22 THR 100 HG22 THR 100 9.455 17.304 2.648 821 HG23 THR 100 HG23 THR 100 9.100 17.342 4.387 822 H GLY 101 H GLY 101 6.403 16.308 -0.000 823 HA2 GLY 101 HA2 GLY 101 7.204 16.164 -2.202 824 HA3 GLY 101 HA3 GLY 101 8.415 17.399 -1.880 825 H ARG 102 H ARG 102 8.688 15.271 0.641 826 HA ARG 102 HA ARG 102 10.868 13.614 -0.446 827 HB2 ARG 102 HB2 ARG 102 9.419 13.579 2.232 828 HB3 ARG 102 HB3 ARG 102 10.819 12.586 1.830 829 HG2 ARG 102 HG2 ARG 102 12.233 14.513 1.640 830 HG3 ARG 102 HG3 ARG 102 10.848 15.617 1.823 831 HD2 ARG 102 HD2 ARG 102 10.424 14.741 4.085 832 HD3 ARG 102 HD3 ARG 102 11.827 13.668 3.953 833 HE ARG 102 HE ARG 102 13.077 15.954 3.533 834 HH11 ARG 102 HH11 ARG 102 13.844 17.490 4.907 835 HH12 ARG 102 HH12 ARG 102 13.025 17.815 6.406 836 HH21 ARG 102 HH21 ARG 102 10.511 15.513 5.966 837 HH22 ARG 102 HH22 ARG 102 11.231 16.728 6.983 838 H SER 103 H SER 103 10.601 11.614 -1.113 839 HA SER 103 HA SER 103 8.334 10.051 -0.222 840 HB2 SER 103 HB2 SER 103 7.400 9.473 -2.376 841 HB3 SER 103 HB3 SER 103 7.444 11.236 -2.245 842 HG SER 103 HG SER 103 9.559 11.022 -3.384 843 H ALA 104 H ALA 104 8.339 7.795 -0.752 844 HA ALA 104 HA ALA 104 10.660 6.658 -2.159 845 HB1 ALA 104 HB1 ALA 104 9.925 5.843 0.692 846 HB2 ALA 104 HB2 ALA 104 11.120 5.036 -0.346 847 HB3 ALA 104 HB3 ALA 104 11.406 6.700 0.204 848 H PHE 105 H PHE 105 10.210 4.636 -3.094 849 HA PHE 105 HA PHE 105 7.379 3.703 -3.013 850 HB2 PHE 105 HB2 PHE 105 9.678 3.199 -4.914 851 HB3 PHE 105 HB3 PHE 105 8.253 2.182 -4.871 852 HD1 PHE 105 HD1 PHE 105 9.494 5.573 -5.730 853 HD2 PHE 105 HD2 PHE 105 6.072 2.956 -5.642 854 HE1 PHE 105 HE1 PHE 105 8.269 7.100 -7.264 855 HE2 PHE 105 HE2 PHE 105 4.857 4.458 -7.170 856 HZ PHE 105 HZ PHE 105 5.960 6.534 -8.003 857 H ILE 106 H ILE 106 6.921 2.252 -1.512 858 HA ILE 106 HA ILE 106 9.021 0.294 -0.654 859 HB ILE 106 HB ILE 106 8.039 0.129 1.488 860 HG12 ILE 106 HG12 ILE 106 6.019 2.289 0.763 861 HG13 ILE 106 HG13 ILE 106 5.638 0.571 0.872 862 HG21 ILE 106 HG21 ILE 106 8.390 3.079 0.826 863 HG22 ILE 106 HG22 ILE 106 8.709 2.284 2.382 864 HG23 ILE 106 HG23 ILE 106 9.725 1.917 0.983 865 HD11 ILE 106 HD11 ILE 106 4.950 1.623 2.912 866 HD12 ILE 106 HD12 ILE 106 6.301 0.529 3.246 867 HD13 ILE 106 HD13 ILE 106 6.569 2.284 3.197 868 H GLY 107 H GLY 107 8.506 -1.877 -0.451 869 HA2 GLY 107 HA2 GLY 107 6.162 -2.776 -2.044 870 HA3 GLY 107 HA3 GLY 107 7.554 -3.750 -1.571 871 H ILE 108 H ILE 108 4.519 -3.923 -1.131 872 HA ILE 108 HA ILE 108 4.751 -4.843 1.648 873 HB ILE 108 HB ILE 108 2.469 -4.293 2.184 874 HG12 ILE 108 HG12 ILE 108 2.298 -2.561 -0.304 875 HG13 ILE 108 HG13 ILE 108 1.548 -4.155 -0.150 876 HG21 ILE 108 HG21 ILE 108 4.078 -1.832 1.425 877 HG22 ILE 108 HG22 ILE 108 2.831 -1.939 2.688 878 HG23 ILE 108 HG23 ILE 108 4.327 -2.862 2.850 879 HD11 ILE 108 HD11 ILE 108 0.861 -1.761 1.615 880 HD12 ILE 108 HD12 ILE 108 -0.099 -2.417 0.284 881 HD13 ILE 108 HD13 ILE 108 0.167 -3.388 1.739 882 H GLY 109 H GLY 109 3.450 -6.641 2.229 883 HA2 GLY 109 HA2 GLY 109 1.756 -7.819 0.140 884 HA3 GLY 109 HA3 GLY 109 3.084 -8.842 0.672 885 H PHE 110 H PHE 110 0.615 -9.709 0.810 886 HA PHE 110 HA PHE 110 -0.313 -9.535 3.657 887 HB2 PHE 110 HB2 PHE 110 -1.809 -10.106 1.073 888 HB3 PHE 110 HB3 PHE 110 -2.514 -10.218 2.674 889 HD1 PHE 110 HD1 PHE 110 -3.325 -8.310 3.836 890 HD2 PHE 110 HD2 PHE 110 -0.968 -7.783 0.254 891 HE1 PHE 110 HE1 PHE 110 -3.873 -5.900 3.813 892 HE2 PHE 110 HE2 PHE 110 -1.533 -5.370 0.254 893 HZ PHE 110 HZ PHE 110 -3.015 -4.435 1.969 894 H THR 111 H THR 111 -1.310 -11.497 4.534 895 HA THR 111 HA THR 111 0.250 -13.881 4.050 896 HB THR 111 HB THR 111 -0.752 -13.094 6.228 897 HG1 THR 111 HG1 THR 111 -1.026 -15.197 6.928 898 HG21 THR 111 HG21 THR 111 -2.972 -13.772 6.862 899 HG22 THR 111 HG22 THR 111 -3.120 -12.758 5.420 900 HG23 THR 111 HG23 THR 111 -3.273 -14.523 5.283 901 H ASP 112 H ASP 112 -2.672 -12.664 2.585 902 HA ASP 112 HA ASP 112 -2.990 -15.114 1.038 903 HB2 ASP 112 HB2 ASP 112 -4.283 -15.493 3.180 904 HB3 ASP 112 HB3 ASP 112 -5.298 -14.115 2.752 905 H ARG 113 H ARG 113 -4.171 -14.889 -0.840 906 HA ARG 113 HA ARG 113 -4.153 -12.325 -2.103 907 HB2 ARG 113 HB2 ARG 113 -3.854 -14.600 -3.152 908 HB3 ARG 113 HB3 ARG 113 -5.594 -14.874 -2.965 909 HG2 ARG 113 HG2 ARG 113 -6.064 -12.944 -4.435 910 HG3 ARG 113 HG3 ARG 113 -4.327 -12.575 -4.511 911 HD2 ARG 113 HD2 ARG 113 -3.929 -14.826 -5.536 912 HD3 ARG 113 HD3 ARG 113 -5.665 -15.125 -5.529 913 HE ARG 113 HE ARG 113 -4.209 -13.055 -7.158 914 HH11 ARG 113 HH11 ARG 113 -4.982 -12.433 -9.006 915 HH12 ARG 113 HH12 ARG 113 -6.487 -13.068 -9.642 916 HH21 ARG 113 HH21 ARG 113 -7.132 -14.983 -6.842 917 HH22 ARG 113 HH22 ARG 113 -7.705 -14.474 -8.406 918 H GLY 114 H GLY 114 -6.782 -14.037 -0.430 919 HA2 GLY 114 HA2 GLY 114 -8.943 -12.378 -1.396 920 HA3 GLY 114 HA3 GLY 114 -8.938 -13.400 0.047 921 H ASP 115 H ASP 115 -6.538 -11.927 1.157 922 HA ASP 115 HA ASP 115 -8.005 -9.656 2.380 923 HB2 ASP 115 HB2 ASP 115 -5.343 -10.973 3.005 924 HB3 ASP 115 HB3 ASP 115 -5.922 -9.509 3.800 925 H ALA 116 H ALA 116 -5.158 -10.211 0.298 926 HA ALA 116 HA ALA 116 -4.506 -7.449 -0.129 927 HB1 ALA 116 HB1 ALA 116 -4.200 -9.964 -1.815 928 HB2 ALA 116 HB2 ALA 116 -3.439 -8.415 -2.185 929 HB3 ALA 116 HB3 ALA 116 -3.013 -9.265 -0.686 930 H PHE 117 H PHE 117 -6.922 -9.596 -1.735 931 HA PHE 117 HA PHE 117 -7.707 -7.777 -3.759 932 HB2 PHE 117 HB2 PHE 117 -8.923 -10.142 -2.435 933 HB3 PHE 117 HB3 PHE 117 -10.063 -9.004 -3.118 934 HD1 PHE 117 HD1 PHE 117 -6.647 -10.044 -4.385 935 HD2 PHE 117 HD2 PHE 117 -10.907 -9.951 -5.073 936 HE1 PHE 117 HE1 PHE 117 -6.301 -10.921 -6.675 937 HE2 PHE 117 HE2 PHE 117 -10.552 -10.846 -7.358 938 HZ PHE 117 HZ PHE 117 -8.251 -11.326 -8.168 939 H ASP 118 H ASP 118 -8.703 -7.777 -0.308 940 HA ASP 118 HA ASP 118 -10.634 -5.650 -0.668 941 HB2 ASP 118 HB2 ASP 118 -9.145 -6.670 1.773 942 HB3 ASP 118 HB3 ASP 118 -10.326 -5.365 1.834 943 H PHE 119 H PHE 119 -7.102 -5.577 -0.181 944 HA PHE 119 HA PHE 119 -6.834 -2.758 0.316 945 HB2 PHE 119 HB2 PHE 119 -4.996 -4.225 0.703 946 HB3 PHE 119 HB3 PHE 119 -4.981 -4.797 -0.945 947 HD1 PHE 119 HD1 PHE 119 -3.773 -2.230 1.283 948 HD2 PHE 119 HD2 PHE 119 -4.232 -3.342 -2.845 949 HE1 PHE 119 HE1 PHE 119 -2.190 -0.448 0.629 950 HE2 PHE 119 HE2 PHE 119 -2.627 -1.580 -3.503 951 HZ PHE 119 HZ PHE 119 -1.605 -0.115 -1.769 952 H ASN 120 H ASN 120 -6.777 -4.562 -2.806 953 HA ASN 120 HA ASN 120 -6.726 -2.000 -4.228 954 HB2 ASN 120 HB2 ASN 120 -6.475 -3.267 -6.247 955 HB3 ASN 120 HB3 ASN 120 -5.387 -3.890 -5.017 956 HD21 ASN 120 HD21 ASN 120 -8.386 -6.292 -6.454 957 HD22 ASN 120 HD22 ASN 120 -8.544 -4.557 -6.656 958 H VAL 121 H VAL 121 -9.352 -4.213 -3.425 959 HA VAL 121 HA VAL 121 -11.187 -3.001 -5.350 960 HB VAL 121 HB VAL 121 -11.606 -4.877 -3.015 961 HG11 VAL 121 HG11 VAL 121 -13.683 -3.590 -3.190 962 HG12 VAL 121 HG12 VAL 121 -13.700 -3.800 -4.956 963 HG13 VAL 121 HG13 VAL 121 -13.930 -5.194 -3.877 964 HG21 VAL 121 HG21 VAL 121 -10.544 -5.813 -5.084 965 HG22 VAL 121 HG22 VAL 121 -12.150 -6.487 -4.806 966 HG23 VAL 121 HG23 VAL 121 -11.917 -5.228 -6.040 967 H SER 122 H SER 122 -10.522 -2.498 -1.837 968 HA SER 122 HA SER 122 -12.630 -0.601 -1.454 969 HB2 SER 122 HB2 SER 122 -11.433 0.091 0.535 970 HB3 SER 122 HB3 SER 122 -11.460 -1.680 0.412 971 HG SER 122 HG SER 122 -9.381 -1.713 -0.108 972 H LEU 123 H LEU 123 -9.374 -0.177 -2.785 973 HA LEU 123 HA LEU 123 -9.501 2.716 -2.934 974 HB2 LEU 123 HB2 LEU 123 -7.815 0.611 -4.318 975 HB3 LEU 123 HB3 LEU 123 -7.631 2.338 -4.625 976 HG LEU 123 HG LEU 123 -7.316 1.116 -1.853 977 HD11 LEU 123 HD11 LEU 123 -5.194 1.890 -3.900 978 HD12 LEU 123 HD12 LEU 123 -4.897 1.333 -2.234 979 HD13 LEU 123 HD13 LEU 123 -5.614 0.234 -3.414 980 HD21 LEU 123 HD21 LEU 123 -7.820 3.535 -1.815 981 HD22 LEU 123 HD22 LEU 123 -6.143 3.236 -1.365 982 HD23 LEU 123 HD23 LEU 123 -6.520 3.832 -2.994 983 H GLN 124 H GLN 124 -10.063 0.187 -5.486 984 HA GLN 124 HA GLN 124 -10.772 2.191 -7.408 985 HB2 GLN 124 HB2 GLN 124 -11.181 0.456 -8.913 986 HB3 GLN 124 HB3 GLN 124 -9.904 -0.132 -7.848 987 HG2 GLN 124 HG2 GLN 124 -11.733 -1.339 -6.542 988 HG3 GLN 124 HG3 GLN 124 -12.828 -0.954 -7.869 989 HE21 GLN 124 HE21 GLN 124 -9.727 -3.599 -8.557 990 HE22 GLN 124 HE22 GLN 124 -9.599 -2.430 -7.223 991 H ASP 125 H ASP 125 -12.791 0.439 -5.084 992 HA ASP 125 HA ASP 125 -15.253 1.630 -6.175 993 HB2 ASP 125 HB2 ASP 125 -15.186 -0.728 -5.370 994 HB3 ASP 125 HB3 ASP 125 -14.789 -0.150 -3.749 995 H HIS 126 H HIS 126 -12.788 2.874 -4.328 996 HA HIS 126 HA HIS 126 -14.624 4.750 -2.908 997 HB2 HIS 126 HB2 HIS 126 -12.736 4.059 -1.590 998 HB3 HIS 126 HB3 HIS 126 -11.601 4.468 -2.883 999 HD2 HIS 126 HD2 HIS 126 -10.452 6.740 -2.581 1000 HE1 HIS 126 HE1 HIS 126 -13.361 8.737 -0.189 1001 HE2 HIS 126 HE2 HIS 126 -11.034 8.898 -1.173 1002 H PHE 127 H PHE 127 -12.234 4.687 -5.583 1003 HA PHE 127 HA PHE 127 -12.765 7.517 -6.103 1004 HB2 PHE 127 HB2 PHE 127 -10.887 5.487 -7.333 1005 HB3 PHE 127 HB3 PHE 127 -11.035 7.130 -7.933 1006 HD1 PHE 127 HD1 PHE 127 -9.273 5.098 -5.628 1007 HD2 PHE 127 HD2 PHE 127 -10.850 9.069 -6.135 1008 HE1 PHE 127 HE1 PHE 127 -7.516 5.976 -4.116 1009 HE2 PHE 127 HE2 PHE 127 -9.113 9.951 -4.594 1010 HZ PHE 127 HZ PHE 127 -7.434 8.411 -3.610 1011 H LYS 128 H LYS 128 -14.537 4.856 -7.148 1012 HA LYS 128 HA LYS 128 -14.802 5.294 -9.853 1013 HB2 LYS 128 HB2 LYS 128 -16.759 4.087 -9.934 1014 HB3 LYS 128 HB3 LYS 128 -15.801 3.373 -8.657 1015 HG2 LYS 128 HG2 LYS 128 -18.066 5.354 -8.071 1016 HG3 LYS 128 HG3 LYS 128 -18.356 3.649 -8.365 1017 HD2 LYS 128 HD2 LYS 128 -16.966 2.984 -6.526 1018 HD3 LYS 128 HD3 LYS 128 -16.523 4.665 -6.154 1019 HE2 LYS 128 HE2 LYS 128 -18.609 5.199 -5.325 1020 HE3 LYS 128 HE3 LYS 128 -19.444 3.983 -6.314 1021 HZ1 LYS 128 HZ1 LYS 128 -19.380 3.297 -3.976 1022 HZ2 LYS 128 HZ2 LYS 128 -18.481 2.253 -4.890 1023 HZ3 LYS 128 HZ3 LYS 128 -17.728 3.351 -3.983 1024 H TRP 129 H TRP 129 -16.327 7.279 -7.404 1025 HA TRP 129 HA TRP 129 -17.993 8.756 -9.305 1026 HB2 TRP 129 HB2 TRP 129 -18.674 10.061 -7.407 1027 HB3 TRP 129 HB3 TRP 129 -18.716 8.358 -6.989 1028 HD1 TRP 129 HD1 TRP 129 -16.601 7.474 -5.430 1029 HE1 TRP 129 HE1 TRP 129 -15.204 8.638 -3.664 1030 HE3 TRP 129 HE3 TRP 129 -17.898 12.335 -6.449 1031 HZ2 TRP 129 HZ2 TRP 129 -14.932 11.316 -2.577 1032 HZ3 TRP 129 HZ3 TRP 129 -17.143 14.158 -4.948 1033 HH2 TRP 129 HH2 TRP 129 -15.657 13.667 -3.015 1034 H VAL 130 H VAL 130 -14.787 9.156 -7.924 1035 HA VAL 130 HA VAL 130 -14.415 11.938 -8.733 1036 HB VAL 130 HB VAL 130 -12.334 9.839 -7.988 1037 HG11 VAL 130 HG11 VAL 130 -12.191 12.885 -8.011 1038 HG12 VAL 130 HG12 VAL 130 -10.943 11.799 -7.359 1039 HG13 VAL 130 HG13 VAL 130 -11.302 11.779 -9.083 1040 HG21 VAL 130 HG21 VAL 130 -13.864 10.078 -6.113 1041 HG22 VAL 130 HG22 VAL 130 -12.385 10.953 -5.729 1042 HG23 VAL 130 HG23 VAL 130 -13.828 11.850 -6.249 1043 H LYS 131 H LYS 131 -13.952 8.776 -10.192 1044 HA LYS 131 HA LYS 131 -12.708 9.957 -12.628 1045 HB2 LYS 131 HB2 LYS 131 -12.602 7.156 -11.453 1046 HB3 LYS 131 HB3 LYS 131 -12.003 7.544 -13.056 1047 HG2 LYS 131 HG2 LYS 131 -10.978 8.703 -10.431 1048 HG3 LYS 131 HG3 LYS 131 -10.171 7.507 -11.435 1049 HD2 LYS 131 HD2 LYS 131 -10.708 10.414 -12.198 1050 HD3 LYS 131 HD3 LYS 131 -9.169 9.743 -11.707 1051 HE2 LYS 131 HE2 LYS 131 -8.903 8.469 -13.678 1052 HE3 LYS 131 HE3 LYS 131 -10.614 8.575 -14.103 1053 HZ1 LYS 131 HZ1 LYS 131 -8.847 10.950 -14.101 1054 HZ2 LYS 131 HZ2 LYS 131 -9.189 10.064 -15.434 1055 HZ3 LYS 131 HZ3 LYS 131 -10.395 10.841 -14.669 1056 H GLN 132 H GLN 132 -15.358 10.421 -12.252 1057 HA GLN 132 HA GLN 132 -16.592 8.902 -14.446 1058 HB2 GLN 132 HB2 GLN 132 -17.603 11.262 -12.804 1059 HB3 GLN 132 HB3 GLN 132 -18.512 10.549 -14.135 1060 HG2 GLN 132 HG2 GLN 132 -17.686 9.084 -11.606 1061 HG3 GLN 132 HG3 GLN 132 -19.286 9.727 -11.942 1062 HE21 GLN 132 HE21 GLN 132 -18.447 6.035 -13.254 1063 HE22 GLN 132 HE22 GLN 132 -17.484 6.894 -12.045 1064 H GLU 133 H GLU 133 -14.221 10.871 -14.421 1065 HA GLU 133 HA GLU 133 -14.479 11.823 -17.159 1066 HB2 GLU 133 HB2 GLU 133 -13.928 14.150 -16.698 1067 HB3 GLU 133 HB3 GLU 133 -15.474 13.717 -15.981 1068 HG2 GLU 133 HG2 GLU 133 -14.367 13.512 -13.743 1069 HG3 GLU 133 HG3 GLU 133 -12.831 13.981 -14.476 Start of MODEL 29 1 H1 GLY -4 H1 GLY -4 -1.190 37.664 17.337 2 H2 GLY -4 H2 GLY -4 -0.392 38.103 15.975 3 H3 GLY -4 H3 GLY -4 -0.530 36.519 16.368 4 HA2 GLY -4 HA2 GLY -4 -2.913 36.577 16.056 5 HA3 GLY -4 HA3 GLY -4 -2.772 38.298 15.648 6 H SER -3 H SER -3 -3.786 36.015 14.053 7 HA SER -3 HA SER -3 -2.041 36.243 11.637 8 HB2 SER -3 HB2 SER -3 -3.344 33.708 12.687 9 HB3 SER -3 HB3 SER -3 -2.494 33.876 11.140 10 HG SER -3 HG SER -3 -1.154 33.022 12.825 11 HA PRO -2 HA PRO -2 -6.012 37.076 9.657 12 HB2 PRO -2 HB2 PRO -2 -5.380 36.622 7.027 13 HB3 PRO -2 HB3 PRO -2 -4.815 38.056 7.940 14 HG2 PRO -2 HG2 PRO -2 -3.314 35.485 7.374 15 HG3 PRO -2 HG3 PRO -2 -2.735 37.170 7.199 16 HD2 PRO -2 HD2 PRO -2 -2.174 35.661 9.403 17 HD3 PRO -2 HD3 PRO -2 -2.461 37.422 9.520 18 H ASN -1 H ASN -1 -4.235 34.110 8.917 19 HA ASN -1 HA ASN -1 -6.569 32.493 8.234 20 HB2 ASN -1 HB2 ASN -1 -4.832 30.663 8.222 21 HB3 ASN -1 HB3 ASN -1 -4.504 31.997 7.125 22 HD21 ASN -1 HD21 ASN -1 -1.777 31.171 9.971 23 HD22 ASN -1 HD22 ASN -1 -3.160 30.110 9.685 24 H SER 0 H SER 0 -7.676 31.111 9.535 25 HA SER 0 HA SER 0 -7.454 31.430 12.436 26 HB2 SER 0 HB2 SER 0 -9.561 30.117 12.431 27 HB3 SER 0 HB3 SER 0 -9.622 31.553 11.394 28 HG SER 0 HG SER 0 -10.479 29.678 10.355 29 H MET 1 H MET 1 -6.136 29.216 10.235 30 HA MET 1 HA MET 1 -5.366 27.326 12.373 31 HB2 MET 1 HB2 MET 1 -6.028 25.371 11.096 32 HB3 MET 1 HB3 MET 1 -7.416 26.408 11.374 33 HG2 MET 1 HG2 MET 1 -7.684 25.722 9.181 34 HG3 MET 1 HG3 MET 1 -7.036 27.342 9.007 35 HE1 MET 1 HE1 MET 1 -7.256 25.210 6.659 36 HE2 MET 1 HE2 MET 1 -6.583 26.843 6.449 37 HE3 MET 1 HE3 MET 1 -5.686 25.429 5.855 38 H ALA 2 H ALA 2 -3.741 25.711 11.468 39 HA ALA 2 HA ALA 2 -2.081 26.745 9.234 40 HB1 ALA 2 HB1 ALA 2 -0.019 26.534 10.571 41 HB2 ALA 2 HB2 ALA 2 -1.112 27.742 11.270 42 HB3 ALA 2 HB3 ALA 2 -0.977 26.132 12.014 43 H THR 3 H THR 3 -2.683 24.084 11.551 44 HA THR 3 HA THR 3 -2.474 22.121 9.357 45 HB THR 3 HB THR 3 -1.108 21.722 12.057 46 HG1 THR 3 HG1 THR 3 0.103 22.984 10.609 47 HG21 THR 3 HG21 THR 3 -0.293 19.601 11.022 48 HG22 THR 3 HG22 THR 3 -2.045 19.604 11.245 49 HG23 THR 3 HG23 THR 3 -1.356 19.887 9.627 50 H GLU 4 H GLU 4 -4.334 21.079 9.350 51 HA GLU 4 HA GLU 4 -5.791 20.452 11.872 52 HB2 GLU 4 HB2 GLU 4 -7.908 21.197 10.891 53 HB3 GLU 4 HB3 GLU 4 -6.765 22.509 11.145 54 HG2 GLU 4 HG2 GLU 4 -6.289 22.728 8.823 55 HG3 GLU 4 HG3 GLU 4 -7.031 21.175 8.433 56 H LEU 5 H LEU 5 -4.196 18.698 10.263 57 HA LEU 5 HA LEU 5 -5.998 16.994 8.767 58 HB2 LEU 5 HB2 LEU 5 -3.380 17.514 8.527 59 HB3 LEU 5 HB3 LEU 5 -3.238 16.075 9.523 60 HG LEU 5 HG LEU 5 -4.666 16.371 6.851 61 HD11 LEU 5 HD11 LEU 5 -2.146 14.834 7.601 62 HD12 LEU 5 HD12 LEU 5 -2.884 14.913 5.984 63 HD13 LEU 5 HD13 LEU 5 -2.206 16.376 6.716 64 HD21 LEU 5 HD21 LEU 5 -5.858 14.634 8.105 65 HD22 LEU 5 HD22 LEU 5 -4.896 13.896 6.828 66 HD23 LEU 5 HD23 LEU 5 -4.318 13.838 8.510 67 H GLU 6 H GLU 6 -7.351 17.110 10.802 68 HA GLU 6 HA GLU 6 -6.948 14.690 12.512 69 HB2 GLU 6 HB2 GLU 6 -8.270 15.806 14.216 70 HB3 GLU 6 HB3 GLU 6 -6.819 16.706 13.786 71 HG2 GLU 6 HG2 GLU 6 -8.128 18.307 12.470 72 HG3 GLU 6 HG3 GLU 6 -9.609 17.401 12.768 73 H TYR 7 H TYR 7 -7.850 14.206 10.012 74 HA TYR 7 HA TYR 7 -10.667 13.377 10.283 75 HB2 TYR 7 HB2 TYR 7 -11.204 14.309 8.089 76 HB3 TYR 7 HB3 TYR 7 -10.803 15.578 9.228 77 HD1 TYR 7 HD1 TYR 7 -9.170 17.212 8.666 78 HD2 TYR 7 HD2 TYR 7 -9.319 13.519 6.419 79 HE1 TYR 7 HE1 TYR 7 -7.567 18.139 7.014 80 HE2 TYR 7 HE2 TYR 7 -7.724 14.439 4.791 81 HH TYR 7 HH TYR 7 -6.408 17.780 5.065 82 H GLU 8 H GLU 8 -11.139 11.578 9.059 83 HA GLU 8 HA GLU 8 -9.779 10.650 6.824 84 HB2 GLU 8 HB2 GLU 8 -8.709 8.595 7.766 85 HB3 GLU 8 HB3 GLU 8 -7.859 10.069 8.172 86 HG2 GLU 8 HG2 GLU 8 -8.906 9.979 10.468 87 HG3 GLU 8 HG3 GLU 8 -9.643 8.435 10.009 88 H SER 9 H SER 9 -11.373 9.625 5.815 89 HA SER 9 HA SER 9 -13.389 8.073 7.362 90 HB2 SER 9 HB2 SER 9 -13.144 8.813 4.442 91 HB3 SER 9 HB3 SER 9 -14.315 7.619 5.042 92 HG SER 9 HG SER 9 -15.394 9.508 5.106 93 H VAL 10 H VAL 10 -12.673 6.110 7.983 94 HA VAL 10 HA VAL 10 -10.595 4.563 6.739 95 HB VAL 10 HB VAL 10 -12.803 3.640 8.616 96 HG11 VAL 10 HG11 VAL 10 -10.114 2.384 7.903 97 HG12 VAL 10 HG12 VAL 10 -11.162 1.863 9.243 98 HG13 VAL 10 HG13 VAL 10 -11.728 1.693 7.586 99 HG21 VAL 10 HG21 VAL 10 -11.428 5.466 9.606 100 HG22 VAL 10 HG22 VAL 10 -11.109 3.920 10.387 101 HG23 VAL 10 HG23 VAL 10 -9.951 4.562 9.205 102 H LEU 11 H LEU 11 -10.557 2.859 5.387 103 HA LEU 11 HA LEU 11 -13.041 2.132 3.863 104 HB2 LEU 11 HB2 LEU 11 -10.245 2.680 2.785 105 HB3 LEU 11 HB3 LEU 11 -11.582 2.033 1.844 106 HG LEU 11 HG LEU 11 -11.488 4.811 3.093 107 HD11 LEU 11 HD11 LEU 11 -11.403 5.514 0.692 108 HD12 LEU 11 HD12 LEU 11 -9.968 4.619 1.208 109 HD13 LEU 11 HD13 LEU 11 -11.215 3.817 0.227 110 HD21 LEU 11 HD21 LEU 11 -13.510 5.255 1.755 111 HD22 LEU 11 HD22 LEU 11 -13.562 3.554 1.239 112 HD23 LEU 11 HD23 LEU 11 -13.824 3.995 2.943 113 H CYS 12 H CYS 12 -9.760 1.093 4.874 114 HA CYS 12 HA CYS 12 -10.751 -1.656 5.193 115 HB2 CYS 12 HB2 CYS 12 -9.918 -1.488 2.801 116 HB3 CYS 12 HB3 CYS 12 -8.308 -1.123 3.466 117 HG CYS 12 HG CYS 12 -8.427 -3.619 2.651 118 H VAL 13 H VAL 13 -9.882 -2.532 6.953 119 HA VAL 13 HA VAL 13 -7.184 -1.680 7.879 120 HB VAL 13 HB VAL 13 -9.626 -2.038 9.639 121 HG11 VAL 13 HG11 VAL 13 -6.708 -1.646 10.452 122 HG12 VAL 13 HG12 VAL 13 -8.104 -1.542 11.545 123 HG13 VAL 13 HG13 VAL 13 -7.707 -3.081 10.783 124 HG21 VAL 13 HG21 VAL 13 -9.379 0.204 8.591 125 HG22 VAL 13 HG22 VAL 13 -9.133 0.270 10.340 126 HG23 VAL 13 HG23 VAL 13 -7.734 0.313 9.242 127 H LYS 14 H LYS 14 -5.851 -3.290 8.119 128 HA LYS 14 HA LYS 14 -6.848 -6.047 8.628 129 HB2 LYS 14 HB2 LYS 14 -4.649 -5.394 6.628 130 HB3 LYS 14 HB3 LYS 14 -5.175 -6.999 7.088 131 HG2 LYS 14 HG2 LYS 14 -6.976 -4.955 5.713 132 HG3 LYS 14 HG3 LYS 14 -6.044 -6.192 4.875 133 HD2 LYS 14 HD2 LYS 14 -7.264 -7.973 5.973 134 HD3 LYS 14 HD3 LYS 14 -8.155 -6.820 6.987 135 HE2 LYS 14 HE2 LYS 14 -9.200 -5.819 5.030 136 HE3 LYS 14 HE3 LYS 14 -8.250 -6.854 3.951 137 HZ1 LYS 14 HZ1 LYS 14 -10.515 -7.681 4.338 138 HZ2 LYS 14 HZ2 LYS 14 -9.366 -8.777 4.842 139 HZ3 LYS 14 HZ3 LYS 14 -10.206 -7.875 5.934 140 HA PRO 15 HA PRO 15 -3.909 -5.568 11.877 141 HB2 PRO 15 HB2 PRO 15 -3.887 -8.060 12.972 142 HB3 PRO 15 HB3 PRO 15 -5.316 -6.975 13.052 143 HG2 PRO 15 HG2 PRO 15 -4.771 -9.210 11.060 144 HG3 PRO 15 HG3 PRO 15 -6.264 -8.930 12.022 145 HD2 PRO 15 HD2 PRO 15 -6.037 -8.083 9.454 146 HD3 PRO 15 HD3 PRO 15 -6.890 -7.100 10.684 147 H ASP 16 H ASP 16 -3.202 -7.688 9.229 148 HA ASP 16 HA ASP 16 -0.343 -7.923 10.063 149 HB2 ASP 16 HB2 ASP 16 -1.535 -10.017 10.558 150 HB3 ASP 16 HB3 ASP 16 -2.111 -10.092 8.889 151 H VAL 17 H VAL 17 0.599 -6.576 8.741 152 HA VAL 17 HA VAL 17 0.735 -7.364 5.904 153 HB VAL 17 HB VAL 17 -0.920 -5.496 6.041 154 HG11 VAL 17 HG11 VAL 17 1.481 -3.733 6.700 155 HG12 VAL 17 HG12 VAL 17 -0.169 -3.198 6.332 156 HG13 VAL 17 HG13 VAL 17 0.149 -4.125 7.807 157 HG21 VAL 17 HG21 VAL 17 0.309 -6.005 3.966 158 HG22 VAL 17 HG22 VAL 17 -0.061 -4.284 4.121 159 HG23 VAL 17 HG23 VAL 17 1.587 -4.857 4.440 160 H SER 18 H SER 18 2.719 -7.039 4.961 161 HA SER 18 HA SER 18 4.964 -6.325 6.837 162 HB2 SER 18 HB2 SER 18 4.944 -8.368 4.592 163 HB3 SER 18 HB3 SER 18 6.295 -7.979 5.672 164 HG SER 18 HG SER 18 3.796 -9.154 6.374 165 H VAL 19 H VAL 19 6.594 -5.029 6.110 166 HA VAL 19 HA VAL 19 6.410 -3.872 3.355 167 HB VAL 19 HB VAL 19 7.529 -2.693 5.897 168 HG11 VAL 19 HG11 VAL 19 7.749 -1.641 3.035 169 HG12 VAL 19 HG12 VAL 19 8.019 -0.656 4.493 170 HG13 VAL 19 HG13 VAL 19 9.084 -2.013 4.152 171 HG21 VAL 19 HG21 VAL 19 5.010 -2.542 5.385 172 HG22 VAL 19 HG22 VAL 19 5.865 -1.013 5.618 173 HG23 VAL 19 HG23 VAL 19 5.463 -1.553 3.981 174 H TYR 20 H TYR 20 7.915 -3.951 1.998 175 HA TYR 20 HA TYR 20 10.634 -4.884 2.784 176 HB2 TYR 20 HB2 TYR 20 9.559 -5.420 0.039 177 HB3 TYR 20 HB3 TYR 20 10.820 -6.249 0.942 178 HD1 TYR 20 HD1 TYR 20 10.122 -7.804 2.862 179 HD2 TYR 20 HD2 TYR 20 7.318 -6.155 0.045 180 HE1 TYR 20 HE1 TYR 20 8.463 -9.544 3.501 181 HE2 TYR 20 HE2 TYR 20 5.670 -7.924 0.650 182 HH TYR 20 HH TYR 20 6.372 -10.421 3.118 183 H ARG 21 H ARG 21 12.093 -3.398 2.376 184 HA ARG 21 HA ARG 21 11.676 -1.143 0.496 185 HB2 ARG 21 HB2 ARG 21 14.190 -1.993 1.990 186 HB3 ARG 21 HB3 ARG 21 13.988 -0.510 1.062 187 HG2 ARG 21 HG2 ARG 21 12.499 -1.284 3.603 188 HG3 ARG 21 HG3 ARG 21 13.767 -0.077 3.461 189 HD2 ARG 21 HD2 ARG 21 10.995 0.084 2.191 190 HD3 ARG 21 HD3 ARG 21 11.501 0.919 3.643 191 HE ARG 21 HE ARG 21 12.211 1.594 0.860 192 HH11 ARG 21 HH11 ARG 21 13.241 3.512 0.441 193 HH12 ARG 21 HH12 ARG 21 13.886 4.456 1.750 194 HH21 ARG 21 HH21 ARG 21 12.968 2.263 4.217 195 HH22 ARG 21 HH22 ARG 21 13.741 3.776 3.832 196 H ILE 22 H ILE 22 11.717 -1.454 -1.573 197 HA ILE 22 HA ILE 22 12.637 -4.001 -2.605 198 HB ILE 22 HB ILE 22 11.343 -3.441 -4.600 199 HG12 ILE 22 HG12 ILE 22 10.806 -0.743 -3.286 200 HG13 ILE 22 HG13 ILE 22 11.729 -1.030 -4.765 201 HG21 ILE 22 HG21 ILE 22 9.196 -3.615 -3.555 202 HG22 ILE 22 HG22 ILE 22 10.344 -4.409 -2.477 203 HG23 ILE 22 HG23 ILE 22 9.758 -2.779 -2.099 204 HD11 ILE 22 HD11 ILE 22 9.630 -2.039 -5.779 205 HD12 ILE 22 HD12 ILE 22 8.749 -1.459 -4.352 206 HD13 ILE 22 HD13 ILE 22 9.547 -0.297 -5.426 207 HA PRO 23 HA PRO 23 16.271 -2.723 -4.905 208 HB2 PRO 23 HB2 PRO 23 16.189 -4.397 -7.088 209 HB3 PRO 23 HB3 PRO 23 16.567 -4.972 -5.434 210 HG2 PRO 23 HG2 PRO 23 13.862 -4.964 -6.834 211 HG3 PRO 23 HG3 PRO 23 14.706 -6.353 -6.063 212 HD2 PRO 23 HD2 PRO 23 12.852 -4.967 -4.707 213 HD3 PRO 23 HD3 PRO 23 14.357 -5.453 -3.881 214 HA PRO 24 HA PRO 24 14.965 0.175 -8.015 215 HB2 PRO 24 HB2 PRO 24 17.002 0.268 -9.855 216 HB3 PRO 24 HB3 PRO 24 17.135 0.893 -8.186 217 HG2 PRO 24 HG2 PRO 24 18.017 -1.824 -9.218 218 HG3 PRO 24 HG3 PRO 24 18.960 -0.652 -8.240 219 HD2 PRO 24 HD2 PRO 24 17.680 -2.722 -7.076 220 HD3 PRO 24 HD3 PRO 24 17.692 -1.118 -6.294 221 H ARG 25 H ARG 25 13.167 -0.848 -8.630 222 HA ARG 25 HA ARG 25 13.015 -1.846 -11.424 223 HB2 ARG 25 HB2 ARG 25 12.186 -3.235 -8.897 224 HB3 ARG 25 HB3 ARG 25 10.949 -3.192 -10.143 225 HG2 ARG 25 HG2 ARG 25 13.733 -4.312 -10.588 226 HG3 ARG 25 HG3 ARG 25 12.291 -5.253 -10.191 227 HD2 ARG 25 HD2 ARG 25 11.516 -3.599 -12.358 228 HD3 ARG 25 HD3 ARG 25 13.131 -4.154 -12.777 229 HE ARG 25 HE ARG 25 10.689 -5.833 -12.274 230 HH11 ARG 25 HH11 ARG 25 10.357 -7.489 -13.528 231 HH12 ARG 25 HH12 ARG 25 11.642 -8.194 -14.492 232 HH21 ARG 25 HH21 ARG 25 13.987 -5.872 -13.490 233 HH22 ARG 25 HH22 ARG 25 13.669 -7.272 -14.475 234 H ALA 26 H ALA 26 10.813 -1.627 -12.300 235 HA ALA 26 HA ALA 26 9.112 0.469 -11.106 236 HB1 ALA 26 HB1 ALA 26 10.804 1.686 -12.446 237 HB2 ALA 26 HB2 ALA 26 10.397 0.691 -13.864 238 HB3 ALA 26 HB3 ALA 26 9.193 1.802 -13.180 239 H SER 27 H SER 27 7.079 0.668 -12.214 240 HA SER 27 HA SER 27 5.668 -1.710 -12.665 241 HB2 SER 27 HB2 SER 27 3.874 -0.192 -13.441 242 HB3 SER 27 HB3 SER 27 4.666 0.387 -11.956 243 HG SER 27 HG SER 27 4.405 2.082 -13.469 244 H ASN 28 H ASN 28 7.199 0.406 -15.044 245 HA ASN 28 HA ASN 28 6.008 -0.882 -17.381 246 HB2 ASN 28 HB2 ASN 28 8.106 1.266 -16.914 247 HB3 ASN 28 HB3 ASN 28 7.850 0.579 -18.512 248 HD21 ASN 28 HD21 ASN 28 4.737 2.786 -16.974 249 HD22 ASN 28 HD22 ASN 28 5.713 1.883 -15.832 250 H ARG 29 H ARG 29 8.314 -1.933 -15.276 251 HA ARG 29 HA ARG 29 9.665 -3.802 -17.206 252 HB2 ARG 29 HB2 ARG 29 10.524 -3.279 -14.377 253 HB3 ARG 29 HB3 ARG 29 11.423 -4.018 -15.699 254 HG2 ARG 29 HG2 ARG 29 11.536 -1.769 -16.825 255 HG3 ARG 29 HG3 ARG 29 10.655 -1.063 -15.434 256 HD2 ARG 29 HD2 ARG 29 12.345 -2.010 -13.916 257 HD3 ARG 29 HD3 ARG 29 13.267 -2.587 -15.322 258 HE ARG 29 HE ARG 29 12.844 0.197 -15.675 259 HH11 ARG 29 HH11 ARG 29 14.296 1.792 -15.150 260 HH12 ARG 29 HH12 ARG 29 15.599 1.455 -14.051 261 HH21 ARG 29 HH21 ARG 29 14.744 -1.816 -13.511 262 HH22 ARG 29 HH22 ARG 29 15.810 -0.514 -13.097 263 H GLY 30 H GLY 30 8.186 -3.425 -14.002 264 HA2 GLY 30 HA2 GLY 30 6.420 -4.599 -13.173 265 HA3 GLY 30 HA3 GLY 30 6.791 -6.006 -14.191 266 H TYR 31 H TYR 31 6.795 -4.872 -11.086 267 HA TYR 31 HA TYR 31 8.924 -6.387 -9.871 268 HB2 TYR 31 HB2 TYR 31 6.180 -5.735 -8.749 269 HB3 TYR 31 HB3 TYR 31 7.668 -6.048 -7.867 270 HD1 TYR 31 HD1 TYR 31 9.619 -4.332 -8.265 271 HD2 TYR 31 HD2 TYR 31 5.483 -3.533 -9.216 272 HE1 TYR 31 HE1 TYR 31 10.061 -1.901 -8.157 273 HE2 TYR 31 HE2 TYR 31 5.941 -1.098 -9.142 274 HH TYR 31 HH TYR 31 9.206 0.215 -8.466 275 H ARG 32 H ARG 32 8.803 -8.535 -9.182 276 HA ARG 32 HA ARG 32 6.327 -10.134 -9.870 277 HB2 ARG 32 HB2 ARG 32 7.808 -12.089 -10.413 278 HB3 ARG 32 HB3 ARG 32 7.791 -10.792 -11.580 279 HG2 ARG 32 HG2 ARG 32 9.957 -10.747 -9.482 280 HG3 ARG 32 HG3 ARG 32 10.049 -11.988 -10.746 281 HD2 ARG 32 HD2 ARG 32 10.000 -10.366 -12.520 282 HD3 ARG 32 HD3 ARG 32 9.569 -9.075 -11.397 283 HE ARG 32 HE ARG 32 11.713 -9.001 -10.493 284 HH11 ARG 32 HH11 ARG 32 13.751 -9.083 -10.530 285 HH12 ARG 32 HH12 ARG 32 14.671 -10.030 -11.707 286 HH21 ARG 32 HH21 ARG 32 11.783 -11.321 -13.146 287 HH22 ARG 32 HH22 ARG 32 13.526 -11.311 -13.180 288 H ALA 33 H ALA 33 6.982 -8.950 -7.416 289 HA ALA 33 HA ALA 33 7.114 -9.250 -5.195 290 HB1 ALA 33 HB1 ALA 33 6.115 -12.047 -5.786 291 HB2 ALA 33 HB2 ALA 33 5.825 -11.062 -4.324 292 HB3 ALA 33 HB3 ALA 33 5.122 -10.596 -5.899 293 H SER 34 H SER 34 8.561 -12.163 -6.727 294 HA SER 34 HA SER 34 10.373 -12.859 -4.686 295 HB2 SER 34 HB2 SER 34 10.608 -13.264 -7.689 296 HB3 SER 34 HB3 SER 34 11.524 -14.141 -6.446 297 HG SER 34 HG SER 34 9.667 -15.308 -7.141 298 H ASP 35 H ASP 35 10.565 -10.130 -6.786 299 HA ASP 35 HA ASP 35 13.382 -9.526 -6.702 300 HB2 ASP 35 HB2 ASP 35 10.876 -7.802 -6.588 301 HB3 ASP 35 HB3 ASP 35 12.501 -7.135 -6.745 302 H TRP 36 H TRP 36 10.842 -9.406 -4.208 303 HA TRP 36 HA TRP 36 12.346 -7.496 -2.566 304 HB2 TRP 36 HB2 TRP 36 9.591 -8.615 -2.073 305 HB3 TRP 36 HB3 TRP 36 10.275 -7.123 -1.466 306 HD1 TRP 36 HD1 TRP 36 11.158 -6.452 -4.756 307 HE1 TRP 36 HE1 TRP 36 9.260 -5.579 -6.292 308 HE3 TRP 36 HE3 TRP 36 7.122 -7.497 -1.795 309 HZ2 TRP 36 HZ2 TRP 36 6.502 -5.120 -6.127 310 HZ3 TRP 36 HZ3 TRP 36 4.888 -6.594 -2.402 311 HH2 TRP 36 HH2 TRP 36 4.553 -5.446 -4.579 312 H LYS 37 H LYS 37 12.056 -7.760 -0.198 313 HA LYS 37 HA LYS 37 13.431 -10.163 0.719 314 HB2 LYS 37 HB2 LYS 37 12.675 -7.586 2.089 315 HB3 LYS 37 HB3 LYS 37 13.477 -8.941 2.882 316 HG2 LYS 37 HG2 LYS 37 15.285 -8.884 1.124 317 HG3 LYS 37 HG3 LYS 37 14.547 -7.388 0.518 318 HD2 LYS 37 HD2 LYS 37 16.242 -6.692 1.977 319 HD3 LYS 37 HD3 LYS 37 14.721 -6.497 2.886 320 HE2 LYS 37 HE2 LYS 37 15.164 -8.584 4.109 321 HE3 LYS 37 HE3 LYS 37 16.646 -8.842 3.171 322 HZ1 LYS 37 HZ1 LYS 37 17.526 -6.784 4.149 323 HZ2 LYS 37 HZ2 LYS 37 16.157 -6.562 5.017 324 HZ3 LYS 37 HZ3 LYS 37 17.126 -7.837 5.329 325 H LEU 38 H LEU 38 11.110 -11.129 -0.077 326 HA LEU 38 HA LEU 38 8.815 -10.920 1.452 327 HB2 LEU 38 HB2 LEU 38 9.766 -13.389 -0.034 328 HB3 LEU 38 HB3 LEU 38 8.114 -13.084 0.498 329 HG LEU 38 HG LEU 38 9.662 -11.486 -1.574 330 HD11 LEU 38 HD11 LEU 38 7.208 -13.306 -1.739 331 HD12 LEU 38 HD12 LEU 38 7.911 -12.414 -3.095 332 HD13 LEU 38 HD13 LEU 38 8.842 -13.702 -2.320 333 HD21 LEU 38 HD21 LEU 38 7.458 -10.335 -1.982 334 HD22 LEU 38 HD22 LEU 38 6.868 -11.057 -0.469 335 HD23 LEU 38 HD23 LEU 38 8.219 -9.908 -0.450 336 H ASP 39 H ASP 39 11.474 -13.150 2.220 337 HA ASP 39 HA ASP 39 9.936 -14.260 4.498 338 HB2 ASP 39 HB2 ASP 39 11.159 -15.705 2.853 339 HB3 ASP 39 HB3 ASP 39 12.672 -15.055 3.472 340 H GLN 40 H GLN 40 11.747 -11.545 4.120 341 HA GLN 40 HA GLN 40 12.357 -11.331 6.994 342 HB2 GLN 40 HB2 GLN 40 14.667 -10.367 6.414 343 HB3 GLN 40 HB3 GLN 40 14.475 -12.099 6.543 344 HG2 GLN 40 HG2 GLN 40 14.366 -10.695 3.851 345 HG3 GLN 40 HG3 GLN 40 15.897 -11.102 4.608 346 HE21 GLN 40 HE21 GLN 40 14.709 -13.862 2.263 347 HE22 GLN 40 HE22 GLN 40 14.722 -12.120 2.045 348 HA PRO 41 HA PRO 41 10.377 -7.575 5.067 349 HB2 PRO 41 HB2 PRO 41 9.230 -7.527 7.849 350 HB3 PRO 41 HB3 PRO 41 8.431 -7.124 6.308 351 HG2 PRO 41 HG2 PRO 41 7.983 -9.523 7.510 352 HG3 PRO 41 HG3 PRO 41 8.206 -9.439 5.738 353 HD2 PRO 41 HD2 PRO 41 10.214 -10.241 7.848 354 HD3 PRO 41 HD3 PRO 41 9.874 -10.988 6.259 355 H ASP 42 H ASP 42 10.836 -5.407 5.411 356 HA ASP 42 HA ASP 42 13.063 -4.671 7.200 357 HB2 ASP 42 HB2 ASP 42 12.785 -3.689 4.931 358 HB3 ASP 42 HB3 ASP 42 11.245 -2.987 5.429 359 H TRP 43 H TRP 43 9.550 -4.480 7.117 360 HA TRP 43 HA TRP 43 9.404 -3.999 10.009 361 HB2 TRP 43 HB2 TRP 43 9.513 -1.710 9.256 362 HB3 TRP 43 HB3 TRP 43 8.376 -2.009 7.960 363 HD1 TRP 43 HD1 TRP 43 8.519 -1.164 11.644 364 HE1 TRP 43 HE1 TRP 43 6.185 -0.449 12.439 365 HE3 TRP 43 HE3 TRP 43 5.800 -2.673 7.596 366 HZ2 TRP 43 HZ2 TRP 43 3.516 -0.270 11.305 367 HZ3 TRP 43 HZ3 TRP 43 3.376 -2.081 7.417 368 HH2 TRP 43 HH2 TRP 43 2.228 -0.925 9.280 369 H THR 44 H THR 44 7.296 -4.504 10.874 370 HA THR 44 HA THR 44 5.223 -5.436 8.986 371 HB THR 44 HB THR 44 4.604 -7.328 10.408 372 HG1 THR 44 HG1 THR 44 7.142 -6.963 11.617 373 HG21 THR 44 HG21 THR 44 6.029 -7.669 8.405 374 HG22 THR 44 HG22 THR 44 7.468 -7.631 9.448 375 HG23 THR 44 HG23 THR 44 6.241 -8.906 9.653 376 H GLY 45 H GLY 45 3.135 -5.191 9.661 377 HA2 GLY 45 HA2 GLY 45 2.306 -4.426 12.300 378 HA3 GLY 45 HA3 GLY 45 2.605 -2.976 11.349 379 H ARG 46 H ARG 46 0.592 -2.247 11.119 380 HA ARG 46 HA ARG 46 -1.583 -4.015 10.074 381 HB2 ARG 46 HB2 ARG 46 -1.778 -1.473 11.731 382 HB3 ARG 46 HB3 ARG 46 -3.120 -2.510 11.229 383 HG2 ARG 46 HG2 ARG 46 -2.120 -4.384 12.570 384 HG3 ARG 46 HG3 ARG 46 -0.870 -3.281 13.152 385 HD2 ARG 46 HD2 ARG 46 -3.864 -2.845 13.559 386 HD3 ARG 46 HD3 ARG 46 -2.800 -3.624 14.724 387 HE ARG 46 HE ARG 46 -1.615 -1.577 15.091 388 HH11 ARG 46 HH11 ARG 46 -1.445 0.531 15.201 389 HH12 ARG 46 HH12 ARG 46 -2.626 1.567 14.363 390 HH21 ARG 46 HH21 ARG 46 -4.377 -0.897 12.949 391 HH22 ARG 46 HH22 ARG 46 -4.046 0.831 13.136 392 H LEU 47 H LEU 47 -2.912 -3.341 8.525 393 HA LEU 47 HA LEU 47 -2.151 -1.073 6.758 394 HB2 LEU 47 HB2 LEU 47 -2.730 -3.324 5.785 395 HB3 LEU 47 HB3 LEU 47 -4.298 -3.216 6.581 396 HG LEU 47 HG LEU 47 -4.723 -1.084 5.191 397 HD11 LEU 47 HD11 LEU 47 -2.374 -0.705 4.473 398 HD12 LEU 47 HD12 LEU 47 -2.410 -2.240 3.580 399 HD13 LEU 47 HD13 LEU 47 -3.470 -0.895 3.103 400 HD21 LEU 47 HD21 LEU 47 -5.870 -3.146 4.763 401 HD22 LEU 47 HD22 LEU 47 -5.410 -2.416 3.230 402 HD23 LEU 47 HD23 LEU 47 -4.483 -3.791 3.866 403 H ARG 48 H ARG 48 -3.322 0.806 6.704 404 HA ARG 48 HA ARG 48 -6.154 0.812 7.547 405 HB2 ARG 48 HB2 ARG 48 -4.860 1.456 9.574 406 HB3 ARG 48 HB3 ARG 48 -4.091 2.769 8.680 407 HG2 ARG 48 HG2 ARG 48 -6.281 3.887 8.397 408 HG3 ARG 48 HG3 ARG 48 -7.097 2.523 9.185 409 HD2 ARG 48 HD2 ARG 48 -5.684 2.961 11.237 410 HD3 ARG 48 HD3 ARG 48 -5.023 4.376 10.414 411 HE ARG 48 HE ARG 48 -6.991 5.562 10.781 412 HH11 ARG 48 HH11 ARG 48 -8.661 6.074 11.802 413 HH12 ARG 48 HH12 ARG 48 -9.673 4.919 12.681 414 HH21 ARG 48 HH21 ARG 48 -7.634 2.251 11.797 415 HH22 ARG 48 HH22 ARG 48 -9.066 2.745 12.660 416 H ILE 49 H ILE 49 -6.651 0.911 5.440 417 HA ILE 49 HA ILE 49 -5.800 3.198 3.780 418 HB ILE 49 HB ILE 49 -8.062 1.265 3.210 419 HG12 ILE 49 HG12 ILE 49 -5.114 1.106 2.425 420 HG13 ILE 49 HG13 ILE 49 -6.010 -0.018 3.454 421 HG21 ILE 49 HG21 ILE 49 -6.453 3.126 1.393 422 HG22 ILE 49 HG22 ILE 49 -7.822 2.098 0.908 423 HG23 ILE 49 HG23 ILE 49 -8.091 3.455 1.984 424 HD11 ILE 49 HD11 ILE 49 -7.538 -0.450 1.460 425 HD12 ILE 49 HD12 ILE 49 -6.288 0.358 0.476 426 HD13 ILE 49 HD13 ILE 49 -5.902 -1.099 1.405 427 H THR 50 H THR 50 -6.709 5.070 3.802 428 HA THR 50 HA THR 50 -9.411 5.563 4.916 429 HB THR 50 HB THR 50 -8.268 7.691 5.923 430 HG1 THR 50 HG1 THR 50 -6.087 5.929 5.757 431 HG21 THR 50 HG21 THR 50 -8.038 4.923 7.136 432 HG22 THR 50 HG22 THR 50 -7.613 6.403 8.016 433 HG23 THR 50 HG23 THR 50 -9.265 6.180 7.430 434 H SER 51 H SER 51 -10.114 7.926 4.336 435 HA SER 51 HA SER 51 -8.765 9.150 2.018 436 HB2 SER 51 HB2 SER 51 -10.143 7.349 1.018 437 HB3 SER 51 HB3 SER 51 -11.583 8.019 1.811 438 HG SER 51 HG SER 51 -11.266 8.678 -0.397 439 H LYS 52 H LYS 52 -9.294 11.221 1.645 440 HA LYS 52 HA LYS 52 -11.801 12.240 2.570 441 HB2 LYS 52 HB2 LYS 52 -10.220 12.542 4.573 442 HB3 LYS 52 HB3 LYS 52 -9.395 13.744 3.587 443 HG2 LYS 52 HG2 LYS 52 -11.001 14.764 5.128 444 HG3 LYS 52 HG3 LYS 52 -11.416 15.096 3.453 445 HD2 LYS 52 HD2 LYS 52 -13.382 14.644 4.854 446 HD3 LYS 52 HD3 LYS 52 -13.236 13.447 3.565 447 HE2 LYS 52 HE2 LYS 52 -12.345 11.795 5.099 448 HE3 LYS 52 HE3 LYS 52 -12.272 12.976 6.418 449 HZ1 LYS 52 HZ1 LYS 52 -14.280 11.443 6.370 450 HZ2 LYS 52 HZ2 LYS 52 -14.648 13.046 6.489 451 HZ3 LYS 52 HZ3 LYS 52 -14.812 12.243 5.074 452 H GLY 53 H GLY 53 -12.585 13.442 1.030 453 HA2 GLY 53 HA2 GLY 53 -12.843 15.158 -0.507 454 HA3 GLY 53 HA3 GLY 53 -11.299 15.797 0.062 455 H LYS 54 H LYS 54 -12.287 12.892 -1.762 456 HA LYS 54 HA LYS 54 -11.594 11.887 -3.670 457 HB2 LYS 54 HB2 LYS 54 -10.900 14.661 -4.694 458 HB3 LYS 54 HB3 LYS 54 -11.109 13.200 -5.659 459 HG2 LYS 54 HG2 LYS 54 -13.484 13.066 -5.003 460 HG3 LYS 54 HG3 LYS 54 -13.307 14.533 -4.021 461 HD2 LYS 54 HD2 LYS 54 -12.656 15.822 -6.029 462 HD3 LYS 54 HD3 LYS 54 -12.837 14.365 -7.031 463 HE2 LYS 54 HE2 LYS 54 -15.219 14.216 -6.422 464 HE3 LYS 54 HE3 LYS 54 -15.057 15.622 -5.358 465 HZ1 LYS 54 HZ1 LYS 54 -15.963 16.253 -7.524 466 HZ2 LYS 54 HZ2 LYS 54 -14.509 16.962 -7.321 467 HZ3 LYS 54 HZ3 LYS 54 -14.656 15.666 -8.307 468 H THR 55 H THR 55 -9.738 12.282 -1.466 469 HA THR 55 HA THR 55 -7.266 11.443 -2.883 470 HB THR 55 HB THR 55 -7.233 13.215 -0.417 471 HG1 THR 55 HG1 THR 55 -7.880 14.465 -2.147 472 HG21 THR 55 HG21 THR 55 -5.072 12.294 -2.351 473 HG22 THR 55 HG22 THR 55 -4.842 13.429 -0.995 474 HG23 THR 55 HG23 THR 55 -5.284 11.744 -0.671 475 H ALA 56 H ALA 56 -6.894 9.418 -2.299 476 HA ALA 56 HA ALA 56 -7.880 8.356 0.293 477 HB1 ALA 56 HB1 ALA 56 -6.665 6.887 -2.058 478 HB2 ALA 56 HB2 ALA 56 -7.360 6.164 -0.596 479 HB3 ALA 56 HB3 ALA 56 -8.407 7.055 -1.713 480 H TYR 57 H TYR 57 -6.437 7.106 1.598 481 HA TYR 57 HA TYR 57 -3.551 7.851 1.544 482 HB2 TYR 57 HB2 TYR 57 -5.436 8.078 3.921 483 HB3 TYR 57 HB3 TYR 57 -3.717 8.429 3.922 484 HD1 TYR 57 HD1 TYR 57 -2.938 10.339 2.284 485 HD2 TYR 57 HD2 TYR 57 -7.000 9.848 3.679 486 HE1 TYR 57 HE1 TYR 57 -3.417 12.729 1.767 487 HE2 TYR 57 HE2 TYR 57 -7.466 12.228 3.154 488 HH TYR 57 HH TYR 57 -4.971 14.411 1.803 489 H ILE 58 H ILE 58 -2.687 5.789 1.256 490 HA ILE 58 HA ILE 58 -3.680 3.518 2.925 491 HB ILE 58 HB ILE 58 -1.286 3.625 1.049 492 HG12 ILE 58 HG12 ILE 58 -2.694 1.826 -0.175 493 HG13 ILE 58 HG13 ILE 58 -4.083 2.466 0.695 494 HG21 ILE 58 HG21 ILE 58 -0.976 2.027 2.934 495 HG22 ILE 58 HG22 ILE 58 -2.536 1.279 2.545 496 HG23 ILE 58 HG23 ILE 58 -1.169 1.200 1.406 497 HD11 ILE 58 HD11 ILE 58 -3.815 4.617 -0.453 498 HD12 ILE 58 HD12 ILE 58 -2.248 4.088 -1.130 499 HD13 ILE 58 HD13 ILE 58 -3.756 3.311 -1.642 500 H LYS 59 H LYS 59 -3.454 4.360 5.008 501 HA LYS 59 HA LYS 59 -0.740 5.123 5.919 502 HB2 LYS 59 HB2 LYS 59 -3.252 4.801 7.595 503 HB3 LYS 59 HB3 LYS 59 -1.747 5.600 8.035 504 HG2 LYS 59 HG2 LYS 59 -2.191 7.219 6.082 505 HG3 LYS 59 HG3 LYS 59 -3.795 6.494 5.967 506 HD2 LYS 59 HD2 LYS 59 -4.175 7.138 8.383 507 HD3 LYS 59 HD3 LYS 59 -2.606 7.990 8.335 508 HE2 LYS 59 HE2 LYS 59 -3.446 9.368 6.426 509 HE3 LYS 59 HE3 LYS 59 -5.003 8.533 6.524 510 HZ1 LYS 59 HZ1 LYS 59 -3.832 10.203 8.684 511 HZ2 LYS 59 HZ2 LYS 59 -5.093 10.625 7.729 512 HZ3 LYS 59 HZ3 LYS 59 -5.249 9.394 8.797 513 H LEU 60 H LEU 60 0.631 3.887 7.015 514 HA LEU 60 HA LEU 60 -0.115 1.088 7.773 515 HB2 LEU 60 HB2 LEU 60 2.286 2.326 6.480 516 HB3 LEU 60 HB3 LEU 60 2.619 1.182 7.771 517 HG LEU 60 HG LEU 60 1.419 -0.579 6.703 518 HD11 LEU 60 HD11 LEU 60 0.791 1.411 4.475 519 HD12 LEU 60 HD12 LEU 60 0.583 -0.351 4.341 520 HD13 LEU 60 HD13 LEU 60 -0.385 0.556 5.502 521 HD21 LEU 60 HD21 LEU 60 3.791 -0.086 6.083 522 HD22 LEU 60 HD22 LEU 60 2.901 -0.914 4.797 523 HD23 LEU 60 HD23 LEU 60 3.217 0.833 4.680 524 H GLU 61 H GLU 61 0.089 0.488 9.856 525 HA GLU 61 HA GLU 61 1.208 2.463 11.824 526 HB2 GLU 61 HB2 GLU 61 -1.466 1.071 12.036 527 HB3 GLU 61 HB3 GLU 61 -0.705 2.132 13.241 528 HG2 GLU 61 HG2 GLU 61 -0.838 4.011 11.596 529 HG3 GLU 61 HG3 GLU 61 -1.805 2.964 10.542 530 H ASP 62 H ASP 62 1.793 1.677 13.875 531 HA ASP 62 HA ASP 62 2.891 -0.985 13.835 532 HB2 ASP 62 HB2 ASP 62 3.824 1.157 14.886 533 HB3 ASP 62 HB3 ASP 62 2.640 0.896 16.183 534 H LYS 63 H LYS 63 2.410 -2.717 15.047 535 HA LYS 63 HA LYS 63 -0.389 -3.098 15.854 536 HB2 LYS 63 HB2 LYS 63 0.362 -5.552 15.953 537 HB3 LYS 63 HB3 LYS 63 0.434 -4.779 14.372 538 HG2 LYS 63 HG2 LYS 63 2.821 -4.438 14.536 539 HG3 LYS 63 HG3 LYS 63 2.855 -5.019 16.209 540 HD2 LYS 63 HD2 LYS 63 2.394 -7.263 15.536 541 HD3 LYS 63 HD3 LYS 63 1.923 -6.753 13.891 542 HE2 LYS 63 HE2 LYS 63 4.222 -5.914 13.491 543 HE3 LYS 63 HE3 LYS 63 4.718 -6.452 15.095 544 HZ1 LYS 63 HZ1 LYS 63 5.233 -7.996 13.203 545 HZ2 LYS 63 HZ2 LYS 63 4.407 -8.718 14.432 546 HZ3 LYS 63 HZ3 LYS 63 3.644 -8.311 13.041 547 H VAL 64 H VAL 64 2.308 -2.191 17.537 548 HA VAL 64 HA VAL 64 1.108 -3.167 20.100 549 HB VAL 64 HB VAL 64 4.013 -2.678 19.354 550 HG11 VAL 64 HG11 VAL 64 3.706 -1.970 21.681 551 HG12 VAL 64 HG12 VAL 64 2.828 -3.475 22.052 552 HG13 VAL 64 HG13 VAL 64 4.559 -3.511 21.645 553 HG21 VAL 64 HG21 VAL 64 3.193 -4.846 18.550 554 HG22 VAL 64 HG22 VAL 64 4.300 -5.087 19.899 555 HG23 VAL 64 HG23 VAL 64 2.547 -5.228 20.161 556 H SER 65 H SER 65 2.891 -0.458 18.528 557 HA SER 65 HA SER 65 2.318 1.251 20.873 558 HB2 SER 65 HB2 SER 65 3.867 1.770 18.316 559 HB3 SER 65 HB3 SER 65 3.714 2.912 19.666 560 HG SER 65 HG SER 65 5.631 1.667 19.799 561 H GLY 66 H GLY 66 1.012 0.775 17.662 562 HA2 GLY 66 HA2 GLY 66 -0.956 1.625 16.756 563 HA3 GLY 66 HA3 GLY 66 -1.173 2.669 18.159 564 H GLU 67 H GLU 67 1.946 2.993 16.871 565 HA GLU 67 HA GLU 67 1.392 5.722 16.025 566 HB2 GLU 67 HB2 GLU 67 3.733 6.047 16.150 567 HB3 GLU 67 HB3 GLU 67 3.236 5.075 17.544 568 HG2 GLU 67 HG2 GLU 67 4.074 3.030 16.430 569 HG3 GLU 67 HG3 GLU 67 4.582 3.985 15.034 570 H LEU 68 H LEU 68 2.131 6.669 14.035 571 HA LEU 68 HA LEU 68 1.552 5.044 11.698 572 HB2 LEU 68 HB2 LEU 68 0.930 7.484 11.987 573 HB3 LEU 68 HB3 LEU 68 2.643 7.878 11.871 574 HG LEU 68 HG LEU 68 2.598 6.706 9.557 575 HD11 LEU 68 HD11 LEU 68 0.430 6.610 8.438 576 HD12 LEU 68 HD12 LEU 68 0.383 5.564 9.858 577 HD13 LEU 68 HD13 LEU 68 -0.401 7.150 9.915 578 HD21 LEU 68 HD21 LEU 68 1.693 8.700 8.440 579 HD22 LEU 68 HD22 LEU 68 0.947 9.230 9.966 580 HD23 LEU 68 HD23 LEU 68 2.717 9.147 9.815 581 H PHE 69 H PHE 69 2.931 3.907 10.492 582 HA PHE 69 HA PHE 69 5.876 4.135 10.801 583 HB2 PHE 69 HB2 PHE 69 5.039 1.911 10.722 584 HB3 PHE 69 HB3 PHE 69 4.023 2.243 9.329 585 HD1 PHE 69 HD1 PHE 69 4.822 1.878 7.105 586 HD2 PHE 69 HD2 PHE 69 7.609 2.022 10.398 587 HE1 PHE 69 HE1 PHE 69 6.660 1.219 5.586 588 HE2 PHE 69 HE2 PHE 69 9.437 1.306 8.875 589 HZ PHE 69 HZ PHE 69 8.967 0.910 6.465 590 H ALA 70 H ALA 70 3.458 4.331 8.159 591 HA ALA 70 HA ALA 70 4.773 6.594 6.880 592 HB1 ALA 70 HB1 ALA 70 4.689 3.869 5.481 593 HB2 ALA 70 HB2 ALA 70 5.237 5.400 4.772 594 HB3 ALA 70 HB3 ALA 70 6.162 4.662 6.082 595 H GLN 71 H GLN 71 3.481 7.285 4.901 596 HA GLN 71 HA GLN 71 0.987 5.854 4.472 597 HB2 GLN 71 HB2 GLN 71 -0.516 7.724 4.699 598 HB3 GLN 71 HB3 GLN 71 0.307 7.390 6.210 599 HG2 GLN 71 HG2 GLN 71 0.339 9.695 6.160 600 HG3 GLN 71 HG3 GLN 71 1.945 9.303 5.569 601 HE21 GLN 71 HE21 GLN 71 1.041 11.833 3.186 602 HE22 GLN 71 HE22 GLN 71 1.944 11.503 4.660 603 H ALA 72 H ALA 72 0.155 5.977 2.450 604 HA ALA 72 HA ALA 72 1.661 7.596 0.433 605 HB1 ALA 72 HB1 ALA 72 0.348 4.877 0.197 606 HB2 ALA 72 HB2 ALA 72 1.032 5.800 -1.153 607 HB3 ALA 72 HB3 ALA 72 2.081 5.254 0.164 608 HA PRO 73 HA PRO 73 -2.484 9.367 -0.108 609 HB2 PRO 73 HB2 PRO 73 -1.817 11.783 -1.106 610 HB3 PRO 73 HB3 PRO 73 -1.545 11.369 0.615 611 HG2 PRO 73 HG2 PRO 73 0.455 11.305 -1.652 612 HG3 PRO 73 HG3 PRO 73 0.660 12.002 -0.014 613 HD2 PRO 73 HD2 PRO 73 1.524 9.471 -0.741 614 HD3 PRO 73 HD3 PRO 73 1.050 9.899 0.927 615 H VAL 74 H VAL 74 -3.836 9.283 -1.853 616 HA VAL 74 HA VAL 74 -2.703 8.907 -4.605 617 HB VAL 74 HB VAL 74 -5.115 7.345 -3.703 618 HG11 VAL 74 HG11 VAL 74 -4.364 5.781 -5.411 619 HG12 VAL 74 HG12 VAL 74 -4.488 7.415 -6.067 620 HG13 VAL 74 HG13 VAL 74 -2.892 6.737 -5.682 621 HG21 VAL 74 HG21 VAL 74 -3.557 6.686 -1.966 622 HG22 VAL 74 HG22 VAL 74 -3.745 5.385 -3.141 623 HG23 VAL 74 HG23 VAL 74 -2.281 6.392 -3.165 624 H GLU 75 H GLU 75 -3.696 10.205 -6.116 625 HA GLU 75 HA GLU 75 -6.162 11.674 -5.333 626 HB2 GLU 75 HB2 GLU 75 -4.337 11.913 -7.749 627 HB3 GLU 75 HB3 GLU 75 -5.752 12.925 -7.437 628 HG2 GLU 75 HG2 GLU 75 -4.737 13.666 -5.280 629 HG3 GLU 75 HG3 GLU 75 -3.286 12.732 -5.654 630 H GLN 76 H GLN 76 -5.310 8.984 -7.364 631 HA GLN 76 HA GLN 76 -8.000 8.158 -7.629 632 HB2 GLN 76 HB2 GLN 76 -7.872 8.011 -10.256 633 HB3 GLN 76 HB3 GLN 76 -8.544 9.399 -9.437 634 HG2 GLN 76 HG2 GLN 76 -7.214 10.095 -11.329 635 HG3 GLN 76 HG3 GLN 76 -6.548 10.731 -9.843 636 HE21 GLN 76 HE21 GLN 76 -3.382 9.231 -10.423 637 HE22 GLN 76 HE22 GLN 76 -4.339 10.290 -9.402 638 H TYR 77 H TYR 77 -8.170 5.987 -8.313 639 HA TYR 77 HA TYR 77 -5.589 4.542 -8.618 640 HB2 TYR 77 HB2 TYR 77 -6.431 4.391 -6.334 641 HB3 TYR 77 HB3 TYR 77 -7.973 3.776 -6.934 642 HD1 TYR 77 HD1 TYR 77 -8.296 1.471 -7.072 643 HD2 TYR 77 HD2 TYR 77 -4.295 3.043 -7.105 644 HE1 TYR 77 HE1 TYR 77 -7.407 -0.844 -7.198 645 HE2 TYR 77 HE2 TYR 77 -3.397 0.725 -7.364 646 HH TYR 77 HH TYR 77 -5.511 -2.133 -7.599 647 HA PRO 78 HA PRO 78 -4.700 2.615 -9.582 648 HB2 PRO 78 HB2 PRO 78 -3.782 2.066 -12.084 649 HB3 PRO 78 HB3 PRO 78 -4.718 0.904 -11.093 650 HG2 PRO 78 HG2 PRO 78 -5.765 2.765 -13.255 651 HG3 PRO 78 HG3 PRO 78 -6.057 1.003 -13.075 652 HD2 PRO 78 HD2 PRO 78 -7.846 2.829 -12.166 653 HD3 PRO 78 HD3 PRO 78 -7.511 1.340 -11.235 654 H GLY 79 H GLY 79 -2.879 3.846 -9.607 655 HA2 GLY 79 HA2 GLY 79 -2.376 6.082 -11.398 656 HA3 GLY 79 HA3 GLY 79 -2.987 6.589 -9.825 657 H ILE 80 H ILE 80 -0.825 7.692 -9.848 658 HA ILE 80 HA ILE 80 1.628 6.380 -10.069 659 HB ILE 80 HB ILE 80 1.413 8.745 -10.319 660 HG12 ILE 80 HG12 ILE 80 3.264 9.654 -8.958 661 HG13 ILE 80 HG13 ILE 80 3.213 8.243 -7.906 662 HG21 ILE 80 HG21 ILE 80 -0.342 9.249 -8.616 663 HG22 ILE 80 HG22 ILE 80 0.870 9.039 -7.330 664 HG23 ILE 80 HG23 ILE 80 1.034 10.339 -8.515 665 HD11 ILE 80 HD11 ILE 80 3.905 6.801 -9.796 666 HD12 ILE 80 HD12 ILE 80 3.883 8.216 -10.879 667 HD13 ILE 80 HD13 ILE 80 5.044 8.130 -9.536 668 H ALA 81 H ALA 81 -0.227 6.852 -7.077 669 HA ALA 81 HA ALA 81 2.070 6.083 -5.430 670 HB1 ALA 81 HB1 ALA 81 -0.739 6.982 -4.731 671 HB2 ALA 81 HB2 ALA 81 0.606 6.791 -3.583 672 HB3 ALA 81 HB3 ALA 81 0.700 8.012 -4.862 673 H VAL 82 H VAL 82 0.165 4.055 -7.068 674 HA VAL 82 HA VAL 82 0.449 1.893 -5.093 675 HB VAL 82 HB VAL 82 -2.276 2.456 -6.251 676 HG11 VAL 82 HG11 VAL 82 -1.364 0.493 -4.089 677 HG12 VAL 82 HG12 VAL 82 -3.034 0.704 -4.649 678 HG13 VAL 82 HG13 VAL 82 -1.813 0.052 -5.744 679 HG21 VAL 82 HG21 VAL 82 -1.983 4.180 -4.596 680 HG22 VAL 82 HG22 VAL 82 -3.119 2.972 -4.015 681 HG23 VAL 82 HG23 VAL 82 -1.459 2.984 -3.386 682 H GLU 83 H GLU 83 1.184 0.188 -6.140 683 HA GLU 83 HA GLU 83 0.380 -0.476 -8.921 684 HB2 GLU 83 HB2 GLU 83 3.096 0.343 -7.909 685 HB3 GLU 83 HB3 GLU 83 3.066 -1.011 -9.021 686 HG2 GLU 83 HG2 GLU 83 1.750 1.669 -9.553 687 HG3 GLU 83 HG3 GLU 83 3.355 1.196 -10.122 688 H THR 84 H THR 84 1.300 -2.582 -9.615 689 HA THR 84 HA THR 84 0.872 -4.629 -7.430 690 HB THR 84 HB THR 84 -0.358 -5.924 -9.055 691 HG1 THR 84 HG1 THR 84 -0.831 -5.069 -11.085 692 HG21 THR 84 HG21 THR 84 -1.625 -4.223 -7.766 693 HG22 THR 84 HG22 THR 84 -1.380 -3.039 -9.068 694 HG23 THR 84 HG23 THR 84 -2.341 -4.510 -9.352 695 H VAL 85 H VAL 85 1.739 -6.737 -7.766 696 HA VAL 85 HA VAL 85 4.256 -6.880 -9.305 697 HB VAL 85 HB VAL 85 4.565 -9.041 -8.314 698 HG11 VAL 85 HG11 VAL 85 4.808 -8.356 -5.974 699 HG12 VAL 85 HG12 VAL 85 5.239 -7.027 -7.055 700 HG13 VAL 85 HG13 VAL 85 3.674 -7.024 -6.214 701 HG21 VAL 85 HG21 VAL 85 2.203 -9.819 -8.211 702 HG22 VAL 85 HG22 VAL 85 3.046 -9.990 -6.676 703 HG23 VAL 85 HG23 VAL 85 1.890 -8.663 -6.905 704 H THR 86 H THR 86 4.536 -8.845 -10.738 705 HA THR 86 HA THR 86 2.193 -9.305 -12.474 706 HB THR 86 HB THR 86 3.820 -10.190 -14.045 707 HG1 THR 86 HG1 THR 86 5.994 -10.258 -13.478 708 HG21 THR 86 HG21 THR 86 4.944 -7.685 -12.716 709 HG22 THR 86 HG22 THR 86 5.183 -8.194 -14.398 710 HG23 THR 86 HG23 THR 86 3.569 -7.700 -13.833 711 H ASP 87 H ASP 87 4.083 -11.112 -10.158 712 HA ASP 87 HA ASP 87 3.353 -13.694 -11.330 713 HB2 ASP 87 HB2 ASP 87 5.660 -13.111 -10.660 714 HB3 ASP 87 HB3 ASP 87 5.131 -13.023 -8.975 715 H SER 88 H SER 88 2.689 -12.004 -8.233 716 HA SER 88 HA SER 88 0.702 -14.164 -7.577 717 HB2 SER 88 HB2 SER 88 2.798 -14.718 -6.469 718 HB3 SER 88 HB3 SER 88 2.805 -13.140 -5.658 719 HG SER 88 HG SER 88 1.839 -15.053 -4.512 720 H SER 89 H SER 89 -1.216 -13.450 -7.080 721 HA SER 89 HA SER 89 -1.776 -10.678 -7.075 722 HB2 SER 89 HB2 SER 89 -3.687 -12.957 -6.489 723 HB3 SER 89 HB3 SER 89 -4.100 -11.336 -7.084 724 HG SER 89 HG SER 89 -4.005 -12.866 -8.789 725 H ARG 90 H ARG 90 -0.300 -11.438 -4.612 726 HA ARG 90 HA ARG 90 -2.133 -10.217 -2.626 727 HB2 ARG 90 HB2 ARG 90 -1.607 -11.630 -0.886 728 HB3 ARG 90 HB3 ARG 90 -2.043 -12.632 -2.267 729 HG2 ARG 90 HG2 ARG 90 0.382 -13.005 -2.727 730 HG3 ARG 90 HG3 ARG 90 0.761 -12.052 -1.272 731 HD2 ARG 90 HD2 ARG 90 -0.596 -13.715 0.064 732 HD3 ARG 90 HD3 ARG 90 -0.693 -14.718 -1.397 733 HE ARG 90 HE ARG 90 2.034 -13.964 -0.838 734 HH11 ARG 90 HH11 ARG 90 3.501 -15.399 -0.232 735 HH12 ARG 90 HH12 ARG 90 3.045 -16.872 0.593 736 HH21 ARG 90 HH21 ARG 90 -0.307 -16.112 0.676 737 HH22 ARG 90 HH22 ARG 90 0.922 -17.284 1.041 738 H TYR 91 H TYR 91 0.088 -9.041 -4.341 739 HA TYR 91 HA TYR 91 1.634 -7.756 -2.150 740 HB2 TYR 91 HB2 TYR 91 2.780 -9.026 -4.651 741 HB3 TYR 91 HB3 TYR 91 3.677 -8.061 -3.508 742 HD1 TYR 91 HD1 TYR 91 4.123 -8.904 -1.204 743 HD2 TYR 91 HD2 TYR 91 2.362 -11.376 -4.263 744 HE1 TYR 91 HE1 TYR 91 4.636 -10.935 0.146 745 HE2 TYR 91 HE2 TYR 91 2.990 -13.411 -2.974 746 HH TYR 91 HH TYR 91 4.583 -13.216 0.226 747 H PHE 92 H PHE 92 2.254 -5.657 -2.528 748 HA PHE 92 HA PHE 92 1.606 -4.346 -5.123 749 HB2 PHE 92 HB2 PHE 92 0.612 -3.412 -2.397 750 HB3 PHE 92 HB3 PHE 92 0.428 -2.534 -3.902 751 HD1 PHE 92 HD1 PHE 92 -1.081 -3.392 -5.702 752 HD2 PHE 92 HD2 PHE 92 -0.846 -5.236 -1.824 753 HE1 PHE 92 HE1 PHE 92 -3.170 -4.662 -6.181 754 HE2 PHE 92 HE2 PHE 92 -2.965 -6.426 -2.260 755 HZ PHE 92 HZ PHE 92 -4.102 -6.195 -4.485 756 H VAL 93 H VAL 93 2.581 -2.242 -5.367 757 HA VAL 93 HA VAL 93 4.630 -1.496 -3.312 758 HB VAL 93 HB VAL 93 4.679 -0.839 -6.278 759 HG11 VAL 93 HG11 VAL 93 6.728 -0.205 -4.111 760 HG12 VAL 93 HG12 VAL 93 6.859 0.167 -5.843 761 HG13 VAL 93 HG13 VAL 93 5.634 0.972 -4.858 762 HG21 VAL 93 HG21 VAL 93 6.817 -2.192 -6.202 763 HG22 VAL 93 HG22 VAL 93 6.376 -2.708 -4.566 764 HG23 VAL 93 HG23 VAL 93 5.346 -3.135 -5.956 765 H ILE 94 H ILE 94 4.396 0.563 -2.396 766 HA ILE 94 HA ILE 94 2.439 2.366 -3.707 767 HB ILE 94 HB ILE 94 1.556 3.192 -1.664 768 HG12 ILE 94 HG12 ILE 94 3.426 2.453 -0.113 769 HG13 ILE 94 HG13 ILE 94 1.778 2.376 0.475 770 HG21 ILE 94 HG21 ILE 94 -0.015 1.373 -1.176 771 HG22 ILE 94 HG22 ILE 94 0.295 1.568 -2.906 772 HG23 ILE 94 HG23 ILE 94 1.037 0.222 -2.036 773 HD11 ILE 94 HD11 ILE 94 1.728 -0.054 0.204 774 HD12 ILE 94 HD12 ILE 94 3.370 -0.040 -0.477 775 HD13 ILE 94 HD13 ILE 94 3.091 0.453 1.205 776 H ARG 95 H ARG 95 2.760 4.535 -3.546 777 HA ARG 95 HA ARG 95 5.575 5.307 -2.897 778 HB2 ARG 95 HB2 ARG 95 4.482 5.893 -5.153 779 HB3 ARG 95 HB3 ARG 95 3.598 7.136 -4.266 780 HG2 ARG 95 HG2 ARG 95 5.803 8.010 -3.403 781 HG3 ARG 95 HG3 ARG 95 6.632 6.811 -4.408 782 HD2 ARG 95 HD2 ARG 95 5.629 7.804 -6.431 783 HD3 ARG 95 HD3 ARG 95 4.781 9.005 -5.438 784 HE ARG 95 HE ARG 95 7.349 9.439 -4.666 785 HH11 ARG 95 HH11 ARG 95 8.823 10.724 -5.479 786 HH12 ARG 95 HH12 ARG 95 8.859 11.124 -7.185 787 HH21 ARG 95 HH21 ARG 95 6.038 9.285 -7.915 788 HH22 ARG 95 HH22 ARG 95 7.294 10.318 -8.543 789 H ILE 96 H ILE 96 5.640 5.454 -0.734 790 HA ILE 96 HA ILE 96 3.621 6.976 0.751 791 HB ILE 96 HB ILE 96 4.793 6.512 2.748 792 HG12 ILE 96 HG12 ILE 96 6.733 4.673 2.491 793 HG13 ILE 96 HG13 ILE 96 7.035 5.512 0.983 794 HG21 ILE 96 HG21 ILE 96 4.505 4.037 1.041 795 HG22 ILE 96 HG22 ILE 96 4.546 4.081 2.811 796 HG23 ILE 96 HG23 ILE 96 3.225 4.862 1.969 797 HD11 ILE 96 HD11 ILE 96 8.445 6.330 2.827 798 HD12 ILE 96 HD12 ILE 96 7.374 7.632 2.280 799 HD13 ILE 96 HD13 ILE 96 7.008 6.734 3.780 800 H GLN 97 H GLN 97 4.020 8.868 1.982 801 HA GLN 97 HA GLN 97 6.319 10.546 1.094 802 HB2 GLN 97 HB2 GLN 97 3.379 11.255 1.076 803 HB3 GLN 97 HB3 GLN 97 4.538 12.463 1.604 804 HG2 GLN 97 HG2 GLN 97 4.444 13.027 -0.564 805 HG3 GLN 97 HG3 GLN 97 5.825 11.955 -0.605 806 HE21 GLN 97 HE21 GLN 97 3.935 9.453 -2.522 807 HE22 GLN 97 HE22 GLN 97 5.232 9.557 -1.341 808 H ASP 98 H ASP 98 7.164 11.958 2.573 809 HA ASP 98 HA ASP 98 6.656 11.246 5.413 810 HB2 ASP 98 HB2 ASP 98 8.903 10.955 4.298 811 HB3 ASP 98 HB3 ASP 98 8.998 12.710 4.177 812 H GLY 99 H GLY 99 5.099 13.280 3.734 813 HA2 GLY 99 HA2 GLY 99 3.751 15.055 4.336 814 HA3 GLY 99 HA3 GLY 99 4.555 15.114 5.904 815 H THR 100 H THR 100 6.878 15.378 3.502 816 HA THR 100 HA THR 100 6.852 18.373 3.493 817 HB THR 100 HB THR 100 8.263 17.351 5.262 818 HG1 THR 100 HG1 THR 100 9.988 18.698 4.888 819 HG21 THR 100 HG21 THR 100 9.117 15.377 4.041 820 HG22 THR 100 HG22 THR 100 10.060 16.448 2.972 821 HG23 THR 100 HG23 THR 100 10.420 16.366 4.707 822 H GLY 101 H GLY 101 6.533 15.926 1.419 823 HA2 GLY 101 HA2 GLY 101 6.544 16.110 -0.945 824 HA3 GLY 101 HA3 GLY 101 7.796 17.350 -0.870 825 H ARG 102 H ARG 102 8.941 15.177 1.212 826 HA ARG 102 HA ARG 102 10.720 13.638 -0.491 827 HB2 ARG 102 HB2 ARG 102 11.465 14.446 1.667 828 HB3 ARG 102 HB3 ARG 102 10.037 13.787 2.472 829 HG2 ARG 102 HG2 ARG 102 10.802 11.493 1.974 830 HG3 ARG 102 HG3 ARG 102 12.271 12.167 1.218 831 HD2 ARG 102 HD2 ARG 102 12.775 13.301 3.418 832 HD3 ARG 102 HD3 ARG 102 11.345 12.518 4.099 833 HE ARG 102 HE ARG 102 13.480 10.825 2.894 834 HH11 ARG 102 HH11 ARG 102 14.532 9.354 4.144 835 HH12 ARG 102 HH12 ARG 102 14.214 9.264 5.851 836 HH21 ARG 102 HH21 ARG 102 11.856 11.758 5.915 837 HH22 ARG 102 HH22 ARG 102 12.798 10.606 6.817 838 H SER 103 H SER 103 10.344 11.706 -1.207 839 HA SER 103 HA SER 103 8.097 10.030 -0.229 840 HB2 SER 103 HB2 SER 103 7.257 9.589 -2.451 841 HB3 SER 103 HB3 SER 103 7.225 11.332 -2.151 842 HG SER 103 HG SER 103 9.157 11.516 -3.349 843 H ALA 104 H ALA 104 8.092 7.824 -0.872 844 HA ALA 104 HA ALA 104 10.450 6.702 -2.228 845 HB1 ALA 104 HB1 ALA 104 10.898 5.088 -0.404 846 HB2 ALA 104 HB2 ALA 104 11.161 6.753 0.148 847 HB3 ALA 104 HB3 ALA 104 9.680 5.886 0.613 848 H PHE 105 H PHE 105 10.040 4.729 -3.207 849 HA PHE 105 HA PHE 105 7.257 3.673 -3.117 850 HB2 PHE 105 HB2 PHE 105 9.611 3.129 -4.938 851 HB3 PHE 105 HB3 PHE 105 8.200 2.095 -4.877 852 HD1 PHE 105 HD1 PHE 105 9.536 5.207 -6.206 853 HD2 PHE 105 HD2 PHE 105 5.904 3.017 -5.445 854 HE1 PHE 105 HE1 PHE 105 8.351 6.555 -7.925 855 HE2 PHE 105 HE2 PHE 105 4.729 4.329 -7.188 856 HZ PHE 105 HZ PHE 105 5.961 6.093 -8.443 857 H ILE 106 H ILE 106 6.789 2.171 -1.685 858 HA ILE 106 HA ILE 106 8.899 0.244 -0.778 859 HB ILE 106 HB ILE 106 7.967 0.096 1.374 860 HG12 ILE 106 HG12 ILE 106 5.813 2.100 0.581 861 HG13 ILE 106 HG13 ILE 106 5.563 0.375 0.856 862 HG21 ILE 106 HG21 ILE 106 8.145 3.064 0.745 863 HG22 ILE 106 HG22 ILE 106 8.576 2.249 2.267 864 HG23 ILE 106 HG23 ILE 106 9.553 1.982 0.818 865 HD11 ILE 106 HD11 ILE 106 6.391 2.376 2.981 866 HD12 ILE 106 HD12 ILE 106 4.831 1.561 2.806 867 HD13 ILE 106 HD13 ILE 106 6.274 0.617 3.210 868 H GLY 107 H GLY 107 8.302 -1.918 -0.484 869 HA2 GLY 107 HA2 GLY 107 5.961 -2.798 -2.107 870 HA3 GLY 107 HA3 GLY 107 7.312 -3.799 -1.583 871 H ILE 108 H ILE 108 4.258 -3.885 -1.150 872 HA ILE 108 HA ILE 108 4.546 -4.737 1.640 873 HB ILE 108 HB ILE 108 2.220 -4.279 2.180 874 HG12 ILE 108 HG12 ILE 108 2.084 -2.489 -0.279 875 HG13 ILE 108 HG13 ILE 108 1.351 -4.089 -0.184 876 HG21 ILE 108 HG21 ILE 108 4.012 -2.862 2.943 877 HG22 ILE 108 HG22 ILE 108 3.883 -1.831 1.505 878 HG23 ILE 108 HG23 ILE 108 2.556 -1.900 2.685 879 HD11 ILE 108 HD11 ILE 108 -0.342 -2.427 0.271 880 HD12 ILE 108 HD12 ILE 108 -0.046 -3.376 1.738 881 HD13 ILE 108 HD13 ILE 108 0.601 -1.727 1.593 882 H GLY 109 H GLY 109 3.630 -6.580 2.260 883 HA2 GLY 109 HA2 GLY 109 2.355 -8.296 0.156 884 HA3 GLY 109 HA3 GLY 109 3.580 -8.898 1.272 885 H PHE 110 H PHE 110 0.649 -9.391 0.641 886 HA PHE 110 HA PHE 110 -0.356 -9.615 3.446 887 HB2 PHE 110 HB2 PHE 110 -1.786 -9.936 0.780 888 HB3 PHE 110 HB3 PHE 110 -2.512 -10.210 2.353 889 HD1 PHE 110 HD1 PHE 110 -3.095 -8.369 3.844 890 HD2 PHE 110 HD2 PHE 110 -1.278 -7.630 0.003 891 HE1 PHE 110 HE1 PHE 110 -3.732 -5.978 3.997 892 HE2 PHE 110 HE2 PHE 110 -1.952 -5.238 0.152 893 HZ PHE 110 HZ PHE 110 -3.202 -4.424 2.107 894 H THR 111 H THR 111 -1.272 -11.754 3.988 895 HA THR 111 HA THR 111 0.298 -13.993 2.828 896 HB THR 111 HB THR 111 0.107 -13.493 5.280 897 HG1 THR 111 HG1 THR 111 0.094 -15.680 5.769 898 HG21 THR 111 HG21 THR 111 -2.599 -14.879 5.075 899 HG22 THR 111 HG22 THR 111 -1.754 -14.372 6.550 900 HG23 THR 111 HG23 THR 111 -2.366 -13.151 5.427 901 H ASP 112 H ASP 112 -2.862 -12.695 2.490 902 HA ASP 112 HA ASP 112 -4.119 -15.368 2.490 903 HB2 ASP 112 HB2 ASP 112 -4.669 -13.577 4.130 904 HB3 ASP 112 HB3 ASP 112 -5.298 -12.598 2.804 905 H ARG 113 H ARG 113 -3.488 -12.981 0.152 906 HA ARG 113 HA ARG 113 -4.299 -12.306 -1.860 907 HB2 ARG 113 HB2 ARG 113 -4.030 -14.708 -2.474 908 HB3 ARG 113 HB3 ARG 113 -5.733 -14.969 -2.072 909 HG2 ARG 113 HG2 ARG 113 -6.341 -13.185 -3.773 910 HG3 ARG 113 HG3 ARG 113 -4.622 -13.082 -4.185 911 HD2 ARG 113 HD2 ARG 113 -5.639 -14.508 -5.802 912 HD3 ARG 113 HD3 ARG 113 -4.684 -15.547 -4.720 913 HE ARG 113 HE ARG 113 -7.418 -15.349 -3.816 914 HH11 ARG 113 HH11 ARG 113 -8.830 -17.052 -4.034 915 HH12 ARG 113 HH12 ARG 113 -8.506 -18.306 -5.195 916 HH21 ARG 113 HH21 ARG 113 -5.560 -16.955 -6.316 917 HH22 ARG 113 HH22 ARG 113 -6.705 -18.262 -6.452 918 H GLY 114 H GLY 114 -7.011 -13.835 -0.071 919 HA2 GLY 114 HA2 GLY 114 -9.092 -12.151 -1.007 920 HA3 GLY 114 HA3 GLY 114 -9.049 -12.947 0.568 921 H ASP 115 H ASP 115 -6.676 -11.495 1.541 922 HA ASP 115 HA ASP 115 -7.945 -8.964 2.330 923 HB2 ASP 115 HB2 ASP 115 -5.274 -10.198 3.059 924 HB3 ASP 115 HB3 ASP 115 -5.875 -8.667 3.692 925 H ALA 116 H ALA 116 -5.298 -9.900 0.135 926 HA ALA 116 HA ALA 116 -4.573 -7.198 -0.592 927 HB1 ALA 116 HB1 ALA 116 -3.096 -9.050 -1.008 928 HB2 ALA 116 HB2 ALA 116 -4.330 -9.909 -1.958 929 HB3 ALA 116 HB3 ALA 116 -3.620 -8.437 -2.596 930 H PHE 117 H PHE 117 -7.024 -9.497 -1.782 931 HA PHE 117 HA PHE 117 -8.136 -7.854 -3.855 932 HB2 PHE 117 HB2 PHE 117 -9.128 -10.145 -2.215 933 HB3 PHE 117 HB3 PHE 117 -10.297 -9.140 -3.046 934 HD1 PHE 117 HD1 PHE 117 -6.863 -10.402 -4.096 935 HD2 PHE 117 HD2 PHE 117 -11.099 -10.246 -4.916 936 HE1 PHE 117 HE1 PHE 117 -6.504 -11.651 -6.197 937 HE2 PHE 117 HE2 PHE 117 -10.729 -11.503 -7.022 938 HZ PHE 117 HZ PHE 117 -8.433 -12.210 -7.667 939 H ASP 118 H ASP 118 -8.963 -8.030 -0.336 940 HA ASP 118 HA ASP 118 -10.855 -5.946 -0.381 941 HB2 ASP 118 HB2 ASP 118 -9.946 -7.674 1.500 942 HB3 ASP 118 HB3 ASP 118 -9.093 -6.244 2.044 943 H PHE 119 H PHE 119 -7.302 -5.690 0.136 944 HA PHE 119 HA PHE 119 -7.021 -2.927 0.535 945 HB2 PHE 119 HB2 PHE 119 -5.177 -4.425 0.775 946 HB3 PHE 119 HB3 PHE 119 -5.273 -4.954 -0.889 947 HD1 PHE 119 HD1 PHE 119 -4.451 -3.554 -2.759 948 HD2 PHE 119 HD2 PHE 119 -4.030 -2.326 1.340 949 HE1 PHE 119 HE1 PHE 119 -2.893 -1.763 -3.460 950 HE2 PHE 119 HE2 PHE 119 -2.500 -0.510 0.637 951 HZ PHE 119 HZ PHE 119 -1.918 -0.226 -1.764 952 H ASN 120 H ASN 120 -6.959 -4.571 -2.676 953 HA ASN 120 HA ASN 120 -6.900 -1.940 -3.957 954 HB2 ASN 120 HB2 ASN 120 -6.478 -2.942 -5.951 955 HB3 ASN 120 HB3 ASN 120 -5.626 -3.961 -4.794 956 HD21 ASN 120 HD21 ASN 120 -7.663 -6.788 -5.627 957 HD22 ASN 120 HD22 ASN 120 -6.642 -6.130 -4.346 958 H VAL 121 H VAL 121 -9.502 -4.225 -3.308 959 HA VAL 121 HA VAL 121 -11.321 -2.967 -5.183 960 HB VAL 121 HB VAL 121 -11.745 -4.918 -2.915 961 HG11 VAL 121 HG11 VAL 121 -14.044 -5.260 -3.824 962 HG12 VAL 121 HG12 VAL 121 -13.843 -3.672 -3.086 963 HG13 VAL 121 HG13 VAL 121 -13.829 -3.830 -4.858 964 HG21 VAL 121 HG21 VAL 121 -12.186 -6.497 -4.746 965 HG22 VAL 121 HG22 VAL 121 -12.021 -5.198 -5.950 966 HG23 VAL 121 HG23 VAL 121 -10.614 -5.737 -5.019 967 H SER 122 H SER 122 -10.732 -2.595 -1.645 968 HA SER 122 HA SER 122 -12.798 -0.649 -1.229 969 HB2 SER 122 HB2 SER 122 -11.605 -0.078 0.814 970 HB3 SER 122 HB3 SER 122 -11.715 -1.839 0.616 971 HG SER 122 HG SER 122 -9.626 -1.945 0.095 972 H LEU 123 H LEU 123 -9.483 -0.291 -2.448 973 HA LEU 123 HA LEU 123 -9.516 2.597 -2.579 974 HB2 LEU 123 HB2 LEU 123 -7.907 0.442 -3.965 975 HB3 LEU 123 HB3 LEU 123 -7.695 2.149 -4.348 976 HG LEU 123 HG LEU 123 -7.361 1.031 -1.537 977 HD11 LEU 123 HD11 LEU 123 -5.253 1.665 -3.648 978 HD12 LEU 123 HD12 LEU 123 -4.940 1.182 -1.962 979 HD13 LEU 123 HD13 LEU 123 -5.699 0.044 -3.074 980 HD21 LEU 123 HD21 LEU 123 -7.804 3.465 -1.592 981 HD22 LEU 123 HD22 LEU 123 -6.135 3.137 -1.143 982 HD23 LEU 123 HD23 LEU 123 -6.508 3.680 -2.792 983 H GLN 124 H GLN 124 -10.042 0.178 -5.237 984 HA GLN 124 HA GLN 124 -10.658 2.233 -7.095 985 HB2 GLN 124 HB2 GLN 124 -11.129 0.535 -8.656 986 HB3 GLN 124 HB3 GLN 124 -9.878 -0.104 -7.592 987 HG2 GLN 124 HG2 GLN 124 -11.770 -1.260 -6.309 988 HG3 GLN 124 HG3 GLN 124 -12.819 -0.858 -7.667 989 HE21 GLN 124 HE21 GLN 124 -9.811 -3.673 -8.101 990 HE22 GLN 124 HE22 GLN 124 -9.712 -2.464 -6.834 991 H ASP 125 H ASP 125 -12.831 0.551 -4.872 992 HA ASP 125 HA ASP 125 -15.236 1.630 -6.136 993 HB2 ASP 125 HB2 ASP 125 -15.147 -0.637 -5.112 994 HB3 ASP 125 HB3 ASP 125 -14.823 0.093 -3.537 995 H HIS 126 H HIS 126 -12.904 3.026 -4.079 996 HA HIS 126 HA HIS 126 -14.938 4.980 -3.139 997 HB2 HIS 126 HB2 HIS 126 -13.120 4.073 -1.563 998 HB3 HIS 126 HB3 HIS 126 -12.007 5.132 -2.438 999 HD2 HIS 126 HD2 HIS 126 -15.457 5.350 -0.604 1000 HE1 HIS 126 HE1 HIS 126 -13.526 9.104 -0.022 1001 HE2 HIS 126 HE2 HIS 126 -15.593 7.725 0.527 1002 H PHE 127 H PHE 127 -12.806 4.517 -5.753 1003 HA PHE 127 HA PHE 127 -12.913 7.415 -6.453 1004 HB2 PHE 127 HB2 PHE 127 -11.093 5.164 -7.353 1005 HB3 PHE 127 HB3 PHE 127 -11.119 6.751 -8.114 1006 HD1 PHE 127 HD1 PHE 127 -10.914 8.833 -6.467 1007 HD2 PHE 127 HD2 PHE 127 -9.447 4.855 -5.704 1008 HE1 PHE 127 HE1 PHE 127 -9.155 9.761 -4.987 1009 HE2 PHE 127 HE2 PHE 127 -7.669 5.781 -4.250 1010 HZ PHE 127 HZ PHE 127 -7.516 8.243 -3.905 1011 H LYS 128 H LYS 128 -14.620 4.584 -7.402 1012 HA LYS 128 HA LYS 128 -14.725 4.889 -10.154 1013 HB2 LYS 128 HB2 LYS 128 -16.665 3.652 -10.282 1014 HB3 LYS 128 HB3 LYS 128 -15.768 3.009 -8.926 1015 HG2 LYS 128 HG2 LYS 128 -18.096 4.970 -8.565 1016 HG3 LYS 128 HG3 LYS 128 -18.331 3.244 -8.771 1017 HD2 LYS 128 HD2 LYS 128 -17.065 2.712 -6.820 1018 HD3 LYS 128 HD3 LYS 128 -16.615 4.409 -6.543 1019 HE2 LYS 128 HE2 LYS 128 -18.747 5.034 -5.882 1020 HE3 LYS 128 HE3 LYS 128 -19.535 3.699 -6.754 1021 HZ1 LYS 128 HZ1 LYS 128 -18.574 2.162 -5.109 1022 HZ2 LYS 128 HZ2 LYS 128 -17.891 3.384 -4.309 1023 HZ3 LYS 128 HZ3 LYS 128 -19.540 3.276 -4.358 1024 H TRP 129 H TRP 129 -16.512 6.859 -7.876 1025 HA TRP 129 HA TRP 129 -18.050 8.277 -9.875 1026 HB2 TRP 129 HB2 TRP 129 -18.788 9.645 -8.028 1027 HB3 TRP 129 HB3 TRP 129 -18.819 7.957 -7.553 1028 HD1 TRP 129 HD1 TRP 129 -16.653 7.163 -5.944 1029 HE1 TRP 129 HE1 TRP 129 -15.340 8.435 -4.179 1030 HE3 TRP 129 HE3 TRP 129 -18.167 11.933 -7.089 1031 HZ2 TRP 129 HZ2 TRP 129 -15.187 11.144 -3.174 1032 HZ3 TRP 129 HZ3 TRP 129 -17.494 13.829 -5.637 1033 HH2 TRP 129 HH2 TRP 129 -16.000 13.453 -3.683 1034 H VAL 130 H VAL 130 -14.936 8.864 -8.293 1035 HA VAL 130 HA VAL 130 -14.525 11.553 -9.303 1036 HB VAL 130 HB VAL 130 -12.442 9.497 -8.442 1037 HG11 VAL 130 HG11 VAL 130 -11.056 11.491 -7.933 1038 HG12 VAL 130 HG12 VAL 130 -11.428 11.380 -9.652 1039 HG13 VAL 130 HG13 VAL 130 -12.312 12.537 -8.632 1040 HG21 VAL 130 HG21 VAL 130 -13.972 9.823 -6.588 1041 HG22 VAL 130 HG22 VAL 130 -12.509 10.741 -6.249 1042 HG23 VAL 130 HG23 VAL 130 -13.966 11.581 -6.826 1043 H LYS 131 H LYS 131 -13.722 8.294 -10.462 1044 HA LYS 131 HA LYS 131 -12.573 9.272 -12.978 1045 HB2 LYS 131 HB2 LYS 131 -13.244 6.476 -11.985 1046 HB3 LYS 131 HB3 LYS 131 -12.354 6.816 -13.470 1047 HG2 LYS 131 HG2 LYS 131 -10.507 7.813 -12.245 1048 HG3 LYS 131 HG3 LYS 131 -11.342 7.616 -10.698 1049 HD2 LYS 131 HD2 LYS 131 -10.677 5.290 -12.546 1050 HD3 LYS 131 HD3 LYS 131 -9.601 5.832 -11.253 1051 HE2 LYS 131 HE2 LYS 131 -11.089 5.226 -9.542 1052 HE3 LYS 131 HE3 LYS 131 -12.493 5.197 -10.616 1053 HZ1 LYS 131 HZ1 LYS 131 -11.665 3.239 -11.654 1054 HZ2 LYS 131 HZ2 LYS 131 -10.270 3.251 -10.726 1055 HZ3 LYS 131 HZ3 LYS 131 -11.740 2.961 -10.048 1056 H GLN 132 H GLN 132 -15.559 9.183 -12.059 1057 HA GLN 132 HA GLN 132 -17.676 8.894 -12.907 1058 HB2 GLN 132 HB2 GLN 132 -16.321 10.044 -15.339 1059 HB3 GLN 132 HB3 GLN 132 -18.065 10.050 -15.003 1060 HG2 GLN 132 HG2 GLN 132 -17.665 11.416 -12.955 1061 HG3 GLN 132 HG3 GLN 132 -15.943 11.486 -13.340 1062 HE21 GLN 132 HE21 GLN 132 -17.278 14.667 -14.587 1063 HE22 GLN 132 HE22 GLN 132 -16.931 13.901 -13.042 1064 H GLU 133 H GLU 133 -16.534 6.583 -12.876 1065 HA GLU 133 HA GLU 133 -17.106 5.048 -15.338 1066 HB2 GLU 133 HB2 GLU 133 -16.087 4.129 -12.623 1067 HB3 GLU 133 HB3 GLU 133 -16.415 3.064 -13.992 1068 HG2 GLU 133 HG2 GLU 133 -14.770 4.424 -15.360 1069 HG3 GLU 133 HG3 GLU 133 -14.336 5.282 -13.881 Start of MODEL 30 1 H1 GLY -4 H1 GLY -4 -18.313 17.995 22.381 2 H2 GLY -4 H2 GLY -4 -19.248 17.575 23.657 3 H3 GLY -4 H3 GLY -4 -18.579 16.412 22.716 4 HA2 GLY -4 HA2 GLY -4 -17.374 16.573 24.787 5 HA3 GLY -4 HA3 GLY -4 -16.361 17.027 23.405 6 H SER -3 H SER -3 -15.404 17.911 25.668 7 HA SER -3 HA SER -3 -16.442 20.348 26.711 8 HB2 SER -3 HB2 SER -3 -13.597 19.273 26.781 9 HB3 SER -3 HB3 SER -3 -14.246 20.553 27.821 10 HG SER -3 HG SER -3 -14.300 18.491 28.842 11 HA PRO -2 HA PRO -2 -15.397 23.319 23.726 12 HB2 PRO -2 HB2 PRO -2 -15.118 25.645 25.158 13 HB3 PRO -2 HB3 PRO -2 -16.673 24.800 24.907 14 HG2 PRO -2 HG2 PRO -2 -14.823 24.603 27.307 15 HG3 PRO -2 HG3 PRO -2 -16.593 24.888 27.292 16 HD2 PRO -2 HD2 PRO -2 -15.576 22.414 27.693 17 HD3 PRO -2 HD3 PRO -2 -17.044 22.643 26.697 18 H ASN -1 H ASN -1 -13.576 22.824 22.751 19 HA ASN -1 HA ASN -1 -11.022 24.122 23.615 20 HB2 ASN -1 HB2 ASN -1 -11.410 21.319 22.467 21 HB3 ASN -1 HB3 ASN -1 -9.857 22.141 22.548 22 HD21 ASN -1 HD21 ASN -1 -11.387 20.506 25.946 23 HD22 ASN -1 HD22 ASN -1 -12.421 20.671 24.524 24 H SER 0 H SER 0 -9.714 24.931 21.962 25 HA SER 0 HA SER 0 -11.039 25.350 19.317 26 HB2 SER 0 HB2 SER 0 -8.733 26.841 20.611 27 HB3 SER 0 HB3 SER 0 -9.519 27.242 19.071 28 HG SER 0 HG SER 0 -10.347 28.485 20.824 29 H MET 1 H MET 1 -8.331 23.727 20.758 30 HA MET 1 HA MET 1 -7.633 22.500 18.198 31 HB2 MET 1 HB2 MET 1 -6.205 24.530 18.244 32 HB3 MET 1 HB3 MET 1 -5.538 24.038 19.805 33 HG2 MET 1 HG2 MET 1 -4.674 21.963 18.773 34 HG3 MET 1 HG3 MET 1 -5.350 22.445 17.216 35 HE1 MET 1 HE1 MET 1 -3.051 25.390 16.094 36 HE2 MET 1 HE2 MET 1 -4.385 24.300 15.662 37 HE3 MET 1 HE3 MET 1 -4.618 25.549 16.909 38 H ALA 2 H ALA 2 -8.100 20.492 18.875 39 HA ALA 2 HA ALA 2 -6.484 19.265 21.053 40 HB1 ALA 2 HB1 ALA 2 -8.626 20.011 22.041 41 HB2 ALA 2 HB2 ALA 2 -9.523 19.104 20.799 42 HB3 ALA 2 HB3 ALA 2 -8.528 18.246 21.998 43 H THR 3 H THR 3 -6.660 19.161 17.992 44 HA THR 3 HA THR 3 -6.667 17.749 16.244 45 HB THR 3 HB THR 3 -5.851 15.539 18.136 46 HG1 THR 3 HG1 THR 3 -3.762 16.300 17.801 47 HG21 THR 3 HG21 THR 3 -6.288 14.890 15.773 48 HG22 THR 3 HG22 THR 3 -5.218 16.193 15.218 49 HG23 THR 3 HG23 THR 3 -4.555 14.814 16.135 50 H GLU 4 H GLU 4 -8.874 18.150 16.169 51 HA GLU 4 HA GLU 4 -10.725 15.937 16.918 52 HB2 GLU 4 HB2 GLU 4 -12.345 17.633 17.421 53 HB3 GLU 4 HB3 GLU 4 -10.860 17.963 18.299 54 HG2 GLU 4 HG2 GLU 4 -11.598 19.377 15.688 55 HG3 GLU 4 HG3 GLU 4 -12.077 19.961 17.274 56 H LEU 5 H LEU 5 -9.349 16.453 14.263 57 HA LEU 5 HA LEU 5 -11.146 17.490 12.348 58 HB2 LEU 5 HB2 LEU 5 -8.803 15.564 12.151 59 HB3 LEU 5 HB3 LEU 5 -9.798 15.959 10.765 60 HG LEU 5 HG LEU 5 -9.286 18.388 11.070 61 HD11 LEU 5 HD11 LEU 5 -7.207 17.308 13.030 62 HD12 LEU 5 HD12 LEU 5 -7.208 18.944 12.336 63 HD13 LEU 5 HD13 LEU 5 -8.524 18.453 13.400 64 HD21 LEU 5 HD21 LEU 5 -8.167 16.984 9.397 65 HD22 LEU 5 HD22 LEU 5 -7.036 18.169 10.063 66 HD23 LEU 5 HD23 LEU 5 -6.961 16.473 10.597 67 H GLU 6 H GLU 6 -12.890 16.808 11.383 68 HA GLU 6 HA GLU 6 -13.785 13.987 11.516 69 HB2 GLU 6 HB2 GLU 6 -15.303 15.951 11.992 70 HB3 GLU 6 HB3 GLU 6 -15.227 16.354 10.275 71 HG2 GLU 6 HG2 GLU 6 -16.174 14.091 9.742 72 HG3 GLU 6 HG3 GLU 6 -16.173 13.697 11.458 73 H TYR 7 H TYR 7 -11.547 13.716 10.265 74 HA TYR 7 HA TYR 7 -12.045 13.440 7.394 75 HB2 TYR 7 HB2 TYR 7 -9.943 15.111 8.797 76 HB3 TYR 7 HB3 TYR 7 -9.441 14.212 7.407 77 HD1 TYR 7 HD1 TYR 7 -10.899 17.237 8.452 78 HD2 TYR 7 HD2 TYR 7 -10.851 14.351 5.263 79 HE1 TYR 7 HE1 TYR 7 -11.529 19.039 6.831 80 HE2 TYR 7 HE2 TYR 7 -11.419 16.149 3.613 81 HH TYR 7 HH TYR 7 -11.965 19.553 4.634 82 H GLU 8 H GLU 8 -10.413 12.130 6.484 83 HA GLU 8 HA GLU 8 -9.005 10.537 6.211 84 HB2 GLU 8 HB2 GLU 8 -7.948 11.518 8.531 85 HB3 GLU 8 HB3 GLU 8 -8.207 9.793 8.925 86 HG2 GLU 8 HG2 GLU 8 -6.705 9.072 7.303 87 HG3 GLU 8 HG3 GLU 8 -6.856 10.518 6.327 88 H SER 9 H SER 9 -11.092 9.981 5.618 89 HA SER 9 HA SER 9 -12.865 8.568 7.354 90 HB2 SER 9 HB2 SER 9 -13.279 10.166 5.283 91 HB3 SER 9 HB3 SER 9 -13.118 8.681 4.342 92 HG SER 9 HG SER 9 -15.311 9.094 4.996 93 H VAL 10 H VAL 10 -12.249 6.709 7.970 94 HA VAL 10 HA VAL 10 -10.514 4.840 6.824 95 HB VAL 10 HB VAL 10 -12.739 4.219 8.800 96 HG11 VAL 10 HG11 VAL 10 -10.142 2.735 8.177 97 HG12 VAL 10 HG12 VAL 10 -11.209 2.401 9.559 98 HG13 VAL 10 HG13 VAL 10 -11.800 2.126 7.924 99 HG21 VAL 10 HG21 VAL 10 -10.978 4.542 10.514 100 HG22 VAL 10 HG22 VAL 10 -9.829 5.032 9.253 101 HG23 VAL 10 HG23 VAL 10 -11.252 6.031 9.614 102 H LEU 11 H LEU 11 -10.576 3.050 5.613 103 HA LEU 11 HA LEU 11 -13.106 2.356 4.142 104 HB2 LEU 11 HB2 LEU 11 -10.280 2.687 3.052 105 HB3 LEU 11 HB3 LEU 11 -11.618 1.990 2.149 106 HG LEU 11 HG LEU 11 -11.495 4.860 3.157 107 HD11 LEU 11 HD11 LEU 11 -9.901 4.488 1.365 108 HD12 LEU 11 HD12 LEU 11 -11.132 3.655 0.389 109 HD13 LEU 11 HD13 LEU 11 -11.285 5.385 0.734 110 HD21 LEU 11 HD21 LEU 11 -13.835 4.104 2.980 111 HD22 LEU 11 HD22 LEU 11 -13.452 5.213 1.664 112 HD23 LEU 11 HD23 LEU 11 -13.520 3.466 1.347 113 H CYS 12 H CYS 12 -9.897 1.221 5.241 114 HA CYS 12 HA CYS 12 -10.994 -1.451 5.756 115 HB2 CYS 12 HB2 CYS 12 -10.256 -1.471 3.337 116 HB3 CYS 12 HB3 CYS 12 -8.607 -1.115 3.899 117 HG CYS 12 HG CYS 12 -8.933 -3.661 3.225 118 H VAL 13 H VAL 13 -10.064 -2.304 7.495 119 HA VAL 13 HA VAL 13 -7.319 -1.466 8.304 120 HB VAL 13 HB VAL 13 -9.649 -1.796 10.224 121 HG11 VAL 13 HG11 VAL 13 -8.039 -1.019 11.939 122 HG12 VAL 13 HG12 VAL 13 -7.509 -2.543 11.226 123 HG13 VAL 13 HG13 VAL 13 -6.739 -1.018 10.730 124 HG21 VAL 13 HG21 VAL 13 -9.807 0.352 9.047 125 HG22 VAL 13 HG22 VAL 13 -9.276 0.620 10.711 126 HG23 VAL 13 HG23 VAL 13 -8.098 0.681 9.381 127 H LYS 14 H LYS 14 -6.012 -3.146 8.529 128 HA LYS 14 HA LYS 14 -7.108 -5.798 9.272 129 HB2 LYS 14 HB2 LYS 14 -5.157 -5.410 6.971 130 HB3 LYS 14 HB3 LYS 14 -5.617 -6.954 7.679 131 HG2 LYS 14 HG2 LYS 14 -8.002 -6.498 7.102 132 HG3 LYS 14 HG3 LYS 14 -7.497 -5.005 6.288 133 HD2 LYS 14 HD2 LYS 14 -6.043 -6.334 4.769 134 HD3 LYS 14 HD3 LYS 14 -6.601 -7.829 5.537 135 HE2 LYS 14 HE2 LYS 14 -8.396 -5.779 4.164 136 HE3 LYS 14 HE3 LYS 14 -7.752 -7.214 3.364 137 HZ1 LYS 14 HZ1 LYS 14 -9.448 -7.345 5.792 138 HZ2 LYS 14 HZ2 LYS 14 -10.035 -7.461 4.278 139 HZ3 LYS 14 HZ3 LYS 14 -8.970 -8.608 4.850 140 HA PRO 15 HA PRO 15 -3.921 -5.637 12.251 141 HB2 PRO 15 HB2 PRO 15 -3.700 -8.255 13.016 142 HB3 PRO 15 HB3 PRO 15 -5.147 -7.253 13.364 143 HG2 PRO 15 HG2 PRO 15 -4.724 -9.171 11.033 144 HG3 PRO 15 HG3 PRO 15 -6.117 -9.111 12.172 145 HD2 PRO 15 HD2 PRO 15 -6.232 -7.923 9.766 146 HD3 PRO 15 HD3 PRO 15 -6.916 -7.109 11.207 147 H ASP 16 H ASP 16 -3.332 -7.557 9.381 148 HA ASP 16 HA ASP 16 -0.434 -7.836 10.063 149 HB2 ASP 16 HB2 ASP 16 -1.679 -9.902 10.552 150 HB3 ASP 16 HB3 ASP 16 -2.291 -9.933 8.897 151 H VAL 17 H VAL 17 0.618 -6.640 8.725 152 HA VAL 17 HA VAL 17 0.634 -7.351 5.882 153 HB VAL 17 HB VAL 17 -0.934 -5.441 5.991 154 HG11 VAL 17 HG11 VAL 17 1.448 -3.756 6.866 155 HG12 VAL 17 HG12 VAL 17 -0.164 -3.168 6.417 156 HG13 VAL 17 HG13 VAL 17 0.038 -4.161 7.866 157 HG21 VAL 17 HG21 VAL 17 0.393 -5.867 3.960 158 HG22 VAL 17 HG22 VAL 17 0.030 -4.151 4.181 159 HG23 VAL 17 HG23 VAL 17 1.655 -4.756 4.555 160 H SER 18 H SER 18 2.639 -7.179 4.965 161 HA SER 18 HA SER 18 4.914 -6.515 6.820 162 HB2 SER 18 HB2 SER 18 4.726 -8.655 4.675 163 HB3 SER 18 HB3 SER 18 6.132 -8.318 5.705 164 HG SER 18 HG SER 18 4.783 -10.066 6.466 165 H VAL 19 H VAL 19 6.418 -5.108 6.131 166 HA VAL 19 HA VAL 19 6.273 -4.017 3.370 167 HB VAL 19 HB VAL 19 7.514 -2.943 5.897 168 HG11 VAL 19 HG11 VAL 19 7.786 -1.808 3.074 169 HG12 VAL 19 HG12 VAL 19 8.127 -0.907 4.569 170 HG13 VAL 19 HG13 VAL 19 9.106 -2.308 4.158 171 HG21 VAL 19 HG21 VAL 19 5.486 -1.700 4.003 172 HG22 VAL 19 HG22 VAL 19 5.013 -2.669 5.414 173 HG23 VAL 19 HG23 VAL 19 5.928 -1.176 5.639 174 H TYR 20 H TYR 20 7.752 -4.051 1.951 175 HA TYR 20 HA TYR 20 10.424 -5.176 2.637 176 HB2 TYR 20 HB2 TYR 20 9.140 -5.482 -0.072 177 HB3 TYR 20 HB3 TYR 20 10.586 -6.267 0.583 178 HD1 TYR 20 HD1 TYR 20 6.988 -6.448 0.197 179 HD2 TYR 20 HD2 TYR 20 10.312 -7.947 2.485 180 HE1 TYR 20 HE1 TYR 20 5.549 -8.263 1.084 181 HE2 TYR 20 HE2 TYR 20 8.867 -9.757 3.397 182 HH TYR 20 HH TYR 20 5.416 -10.081 2.530 183 H ARG 21 H ARG 21 11.963 -3.811 2.366 184 HA ARG 21 HA ARG 21 11.722 -1.265 0.956 185 HB2 ARG 21 HB2 ARG 21 13.018 -1.888 3.149 186 HB3 ARG 21 HB3 ARG 21 14.282 -2.457 2.081 187 HG2 ARG 21 HG2 ARG 21 14.880 -0.249 2.583 188 HG3 ARG 21 HG3 ARG 21 14.160 -0.127 0.973 189 HD2 ARG 21 HD2 ARG 21 13.405 1.718 2.363 190 HD3 ARG 21 HD3 ARG 21 12.025 0.663 2.023 191 HE ARG 21 HE ARG 21 13.112 -0.255 4.459 192 HH11 ARG 21 HH11 ARG 21 12.449 0.161 6.342 193 HH12 ARG 21 HH12 ARG 21 11.616 1.661 6.760 194 HH21 ARG 21 HH21 ARG 21 11.663 2.793 3.480 195 HH22 ARG 21 HH22 ARG 21 11.135 3.125 5.108 196 H ILE 22 H ILE 22 11.103 -2.224 -1.032 197 HA ILE 22 HA ILE 22 12.410 -4.227 -2.384 198 HB ILE 22 HB ILE 22 11.099 -3.581 -4.374 199 HG12 ILE 22 HG12 ILE 22 10.382 -1.069 -2.800 200 HG13 ILE 22 HG13 ILE 22 11.282 -1.155 -4.318 201 HG21 ILE 22 HG21 ILE 22 9.470 -3.339 -1.830 202 HG22 ILE 22 HG22 ILE 22 8.960 -4.004 -3.380 203 HG23 ILE 22 HG23 ILE 22 10.170 -4.856 -2.416 204 HD11 ILE 22 HD11 ILE 22 8.351 -1.765 -3.866 205 HD12 ILE 22 HD12 ILE 22 9.071 -0.518 -4.898 206 HD13 ILE 22 HD13 ILE 22 9.205 -2.233 -5.350 207 HA PRO 23 HA PRO 23 15.883 -2.543 -4.648 208 HB2 PRO 23 HB2 PRO 23 15.961 -4.165 -6.860 209 HB3 PRO 23 HB3 PRO 23 16.412 -4.732 -5.222 210 HG2 PRO 23 HG2 PRO 23 13.719 -5.013 -6.612 211 HG3 PRO 23 HG3 PRO 23 14.701 -6.300 -5.835 212 HD2 PRO 23 HD2 PRO 23 12.693 -5.099 -4.501 213 HD3 PRO 23 HD3 PRO 23 14.225 -5.471 -3.662 214 HA PRO 24 HA PRO 24 14.201 0.323 -7.611 215 HB2 PRO 24 HB2 PRO 24 16.245 0.734 -9.405 216 HB3 PRO 24 HB3 PRO 24 16.247 1.360 -7.728 217 HG2 PRO 24 HG2 PRO 24 17.545 -1.182 -8.765 218 HG3 PRO 24 HG3 PRO 24 18.277 0.094 -7.738 219 HD2 PRO 24 HD2 PRO 24 17.279 -2.176 -6.657 220 HD3 PRO 24 HD3 PRO 24 17.043 -0.605 -5.837 221 H ARG 25 H ARG 25 13.048 0.357 -9.452 222 HA ARG 25 HA ARG 25 13.205 -1.857 -11.452 223 HB2 ARG 25 HB2 ARG 25 11.584 -2.323 -9.566 224 HB3 ARG 25 HB3 ARG 25 10.682 -0.903 -10.053 225 HG2 ARG 25 HG2 ARG 25 10.983 -2.511 -12.425 226 HG3 ARG 25 HG3 ARG 25 10.744 -3.649 -11.138 227 HD2 ARG 25 HD2 ARG 25 8.689 -2.904 -12.396 228 HD3 ARG 25 HD3 ARG 25 8.599 -2.890 -10.642 229 HE ARG 25 HE ARG 25 9.237 -0.264 -11.248 230 HH11 ARG 25 HH11 ARG 25 7.767 1.373 -11.433 231 HH12 ARG 25 HH12 ARG 25 6.061 0.953 -11.318 232 HH21 ARG 25 HH21 ARG 25 6.489 -2.373 -11.634 233 HH22 ARG 25 HH22 ARG 25 5.384 -1.015 -11.734 234 H ALA 26 H ALA 26 10.637 -0.745 -12.505 235 HA ALA 26 HA ALA 26 11.648 1.675 -13.957 236 HB1 ALA 26 HB1 ALA 26 10.311 -0.787 -15.163 237 HB2 ALA 26 HB2 ALA 26 10.872 0.657 -16.045 238 HB3 ALA 26 HB3 ALA 26 12.039 -0.401 -15.250 239 H SER 27 H SER 27 8.910 1.008 -15.463 240 HA SER 27 HA SER 27 7.054 2.415 -13.573 241 HB2 SER 27 HB2 SER 27 6.427 3.948 -15.366 242 HB3 SER 27 HB3 SER 27 8.152 4.088 -14.988 243 HG SER 27 HG SER 27 7.871 4.012 -17.221 244 H ASN 28 H ASN 28 7.447 0.475 -16.479 245 HA ASN 28 HA ASN 28 4.618 -0.483 -16.337 246 HB2 ASN 28 HB2 ASN 28 4.599 -0.368 -18.771 247 HB3 ASN 28 HB3 ASN 28 5.057 1.202 -18.123 248 HD21 ASN 28 HD21 ASN 28 8.338 1.094 -19.547 249 HD22 ASN 28 HD22 ASN 28 7.335 1.892 -18.345 250 H ARG 29 H ARG 29 7.703 -1.581 -15.879 251 HA ARG 29 HA ARG 29 7.521 -4.095 -17.440 252 HB2 ARG 29 HB2 ARG 29 9.724 -2.997 -15.627 253 HB3 ARG 29 HB3 ARG 29 9.815 -4.489 -16.550 254 HG2 ARG 29 HG2 ARG 29 9.656 -1.675 -17.713 255 HG3 ARG 29 HG3 ARG 29 11.031 -2.789 -17.721 256 HD2 ARG 29 HD2 ARG 29 9.388 -4.417 -18.952 257 HD3 ARG 29 HD3 ARG 29 8.427 -2.976 -19.261 258 HE ARG 29 HE ARG 29 11.258 -3.470 -20.162 259 HH11 ARG 29 HH11 ARG 29 11.904 -2.706 -22.109 260 HH12 ARG 29 HH12 ARG 29 10.857 -1.677 -23.039 261 HH21 ARG 29 HH21 ARG 29 8.286 -1.641 -20.772 262 HH22 ARG 29 HH22 ARG 29 8.870 -1.137 -22.332 263 H GLY 30 H GLY 30 7.062 -3.023 -14.133 264 HA2 GLY 30 HA2 GLY 30 5.636 -4.183 -12.697 265 HA3 GLY 30 HA3 GLY 30 5.839 -5.640 -13.650 266 H TYR 31 H TYR 31 6.127 -4.770 -10.695 267 HA TYR 31 HA TYR 31 8.691 -5.935 -9.879 268 HB2 TYR 31 HB2 TYR 31 6.126 -5.367 -8.353 269 HB3 TYR 31 HB3 TYR 31 7.702 -5.750 -7.671 270 HD1 TYR 31 HD1 TYR 31 9.642 -4.059 -8.082 271 HD2 TYR 31 HD2 TYR 31 5.523 -3.124 -8.997 272 HE1 TYR 31 HE1 TYR 31 10.118 -1.674 -7.774 273 HE2 TYR 31 HE2 TYR 31 6.018 -0.717 -8.680 274 HH TYR 31 HH TYR 31 9.291 0.478 -7.827 275 H ARG 32 H ARG 32 8.669 -8.075 -8.800 276 HA ARG 32 HA ARG 32 6.433 -9.884 -9.673 277 HB2 ARG 32 HB2 ARG 32 8.206 -11.583 -10.312 278 HB3 ARG 32 HB3 ARG 32 7.938 -10.247 -11.396 279 HG2 ARG 32 HG2 ARG 32 10.145 -10.006 -9.337 280 HG3 ARG 32 HG3 ARG 32 10.393 -11.024 -10.766 281 HD2 ARG 32 HD2 ARG 32 9.961 -9.223 -12.278 282 HD3 ARG 32 HD3 ARG 32 9.415 -8.163 -10.985 283 HE ARG 32 HE ARG 32 12.119 -8.962 -10.453 284 HH11 ARG 32 HH11 ARG 32 13.731 -7.718 -10.691 285 HH12 ARG 32 HH12 ARG 32 13.709 -6.278 -11.711 286 HH21 ARG 32 HH21 ARG 32 10.341 -6.673 -12.493 287 HH22 ARG 32 HH22 ARG 32 11.792 -5.745 -12.767 288 H ALA 33 H ALA 33 7.125 -8.800 -7.075 289 HA ALA 33 HA ALA 33 7.301 -9.315 -4.901 290 HB1 ALA 33 HB1 ALA 33 5.228 -10.414 -5.671 291 HB2 ALA 33 HB2 ALA 33 6.096 -11.941 -5.816 292 HB3 ALA 33 HB3 ALA 33 5.926 -11.170 -4.213 293 H SER 34 H SER 34 8.620 -12.146 -6.703 294 HA SER 34 HA SER 34 10.191 -13.154 -4.553 295 HB2 SER 34 HB2 SER 34 10.494 -13.552 -7.552 296 HB3 SER 34 HB3 SER 34 11.259 -14.542 -6.293 297 HG SER 34 HG SER 34 9.299 -15.471 -7.069 298 H ASP 35 H ASP 35 10.812 -10.441 -6.590 299 HA ASP 35 HA ASP 35 13.717 -10.428 -6.187 300 HB2 ASP 35 HB2 ASP 35 11.788 -8.917 -7.732 301 HB3 ASP 35 HB3 ASP 35 12.689 -7.792 -6.741 302 H TRP 36 H TRP 36 11.063 -9.794 -4.075 303 HA TRP 36 HA TRP 36 12.443 -7.727 -2.514 304 HB2 TRP 36 HB2 TRP 36 9.728 -8.963 -2.047 305 HB3 TRP 36 HB3 TRP 36 10.345 -7.444 -1.449 306 HD1 TRP 36 HD1 TRP 36 11.190 -6.962 -4.882 307 HE1 TRP 36 HE1 TRP 36 9.293 -5.852 -6.239 308 HE3 TRP 36 HE3 TRP 36 7.261 -7.812 -1.711 309 HZ2 TRP 36 HZ2 TRP 36 6.632 -5.000 -5.779 310 HZ3 TRP 36 HZ3 TRP 36 5.041 -6.761 -2.176 311 HH2 TRP 36 HH2 TRP 36 4.726 -5.375 -4.193 312 H LYS 37 H LYS 37 12.130 -7.979 -0.109 313 HA LYS 37 HA LYS 37 13.541 -10.377 0.792 314 HB2 LYS 37 HB2 LYS 37 12.680 -7.862 2.270 315 HB3 LYS 37 HB3 LYS 37 13.613 -9.190 2.967 316 HG2 LYS 37 HG2 LYS 37 15.336 -8.865 1.167 317 HG3 LYS 37 HG3 LYS 37 14.506 -7.349 0.747 318 HD2 LYS 37 HD2 LYS 37 15.869 -8.126 3.343 319 HD3 LYS 37 HD3 LYS 37 16.341 -6.852 2.207 320 HE2 LYS 37 HE2 LYS 37 14.186 -5.660 2.765 321 HE3 LYS 37 HE3 LYS 37 13.865 -6.904 3.989 322 HZ1 LYS 37 HZ1 LYS 37 14.994 -4.832 4.884 323 HZ2 LYS 37 HZ2 LYS 37 15.842 -6.206 5.174 324 HZ3 LYS 37 HZ3 LYS 37 16.299 -5.183 3.986 325 H LEU 38 H LEU 38 11.350 -11.466 0.020 326 HA LEU 38 HA LEU 38 9.075 -11.470 1.703 327 HB2 LEU 38 HB2 LEU 38 10.104 -13.719 -0.061 328 HB3 LEU 38 HB3 LEU 38 8.465 -13.565 0.569 329 HG LEU 38 HG LEU 38 9.810 -11.706 -1.420 330 HD11 LEU 38 HD11 LEU 38 9.098 -13.899 -2.328 331 HD12 LEU 38 HD12 LEU 38 7.479 -13.684 -1.622 332 HD13 LEU 38 HD13 LEU 38 8.021 -12.629 -2.931 333 HD21 LEU 38 HD21 LEU 38 7.521 -10.677 -1.640 334 HD22 LEU 38 HD22 LEU 38 7.045 -11.566 -0.174 335 HD23 LEU 38 HD23 LEU 38 8.322 -10.330 -0.107 336 H ASP 39 H ASP 39 12.082 -12.902 2.490 337 HA ASP 39 HA ASP 39 10.804 -14.636 4.571 338 HB2 ASP 39 HB2 ASP 39 12.254 -15.743 2.846 339 HB3 ASP 39 HB3 ASP 39 13.622 -14.831 3.475 340 H GLN 40 H GLN 40 12.117 -11.621 4.226 341 HA GLN 40 HA GLN 40 12.466 -11.304 7.096 342 HB2 GLN 40 HB2 GLN 40 14.680 -10.143 6.884 343 HB3 GLN 40 HB3 GLN 40 14.697 -11.891 6.850 344 HG2 GLN 40 HG2 GLN 40 14.939 -10.157 4.364 345 HG3 GLN 40 HG3 GLN 40 16.303 -10.699 5.310 346 HE21 GLN 40 HE21 GLN 40 15.338 -13.101 2.415 347 HE22 GLN 40 HE22 GLN 40 15.161 -11.353 2.438 348 HA PRO 41 HA PRO 41 10.266 -7.799 4.960 349 HB2 PRO 41 HB2 PRO 41 9.077 -7.813 7.729 350 HB3 PRO 41 HB3 PRO 41 8.273 -7.451 6.182 351 HG2 PRO 41 HG2 PRO 41 7.974 -9.891 7.360 352 HG3 PRO 41 HG3 PRO 41 8.221 -9.783 5.592 353 HD2 PRO 41 HD2 PRO 41 10.234 -10.478 7.735 354 HD3 PRO 41 HD3 PRO 41 10.002 -11.208 6.119 355 H ASP 42 H ASP 42 10.697 -5.638 5.214 356 HA ASP 42 HA ASP 42 12.943 -4.885 6.942 357 HB2 ASP 42 HB2 ASP 42 12.332 -4.095 4.503 358 HB3 ASP 42 HB3 ASP 42 11.267 -2.950 5.322 359 H TRP 43 H TRP 43 9.471 -4.616 6.950 360 HA TRP 43 HA TRP 43 9.459 -4.084 9.825 361 HB2 TRP 43 HB2 TRP 43 9.509 -1.795 9.101 362 HB3 TRP 43 HB3 TRP 43 8.325 -2.085 7.846 363 HD1 TRP 43 HD1 TRP 43 8.604 -1.197 11.494 364 HE1 TRP 43 HE1 TRP 43 6.289 -0.534 12.385 365 HE3 TRP 43 HE3 TRP 43 5.748 -2.903 7.623 366 HZ2 TRP 43 HZ2 TRP 43 3.559 -0.488 11.390 367 HZ3 TRP 43 HZ3 TRP 43 3.302 -2.390 7.549 368 HH2 TRP 43 HH2 TRP 43 2.201 -1.232 9.441 369 H THR 44 H THR 44 7.365 -4.580 10.791 370 HA THR 44 HA THR 44 5.246 -5.616 8.997 371 HB THR 44 HB THR 44 4.739 -7.459 10.585 372 HG1 THR 44 HG1 THR 44 6.420 -8.158 11.940 373 HG21 THR 44 HG21 THR 44 7.507 -7.737 9.374 374 HG22 THR 44 HG22 THR 44 6.331 -9.031 9.713 375 HG23 THR 44 HG23 THR 44 5.986 -7.835 8.456 376 H GLY 45 H GLY 45 3.173 -5.326 9.681 377 HA2 GLY 45 HA2 GLY 45 2.329 -4.783 12.310 378 HA3 GLY 45 HA3 GLY 45 2.665 -3.219 11.566 379 H ARG 46 H ARG 46 0.685 -2.433 11.398 380 HA ARG 46 HA ARG 46 -1.600 -4.086 10.439 381 HB2 ARG 46 HB2 ARG 46 -1.537 -1.483 12.020 382 HB3 ARG 46 HB3 ARG 46 -2.970 -2.431 11.625 383 HG2 ARG 46 HG2 ARG 46 -2.167 -4.292 13.020 384 HG3 ARG 46 HG3 ARG 46 -0.672 -3.419 13.405 385 HD2 ARG 46 HD2 ARG 46 -1.866 -1.695 14.575 386 HD3 ARG 46 HD3 ARG 46 -3.422 -2.246 13.962 387 HE ARG 46 HE ARG 46 -3.102 -4.346 15.293 388 HH11 ARG 46 HH11 ARG 46 -3.480 -4.780 17.421 389 HH12 ARG 46 HH12 ARG 46 -2.854 -3.724 18.648 390 HH21 ARG 46 HH21 ARG 46 -1.342 -1.549 16.486 391 HH22 ARG 46 HH22 ARG 46 -1.832 -1.862 18.136 392 H LEU 47 H LEU 47 -2.974 -3.399 8.914 393 HA LEU 47 HA LEU 47 -2.158 -1.243 7.031 394 HB2 LEU 47 HB2 LEU 47 -2.764 -3.457 6.082 395 HB3 LEU 47 HB3 LEU 47 -4.294 -3.407 6.961 396 HG LEU 47 HG LEU 47 -4.979 -1.391 5.605 397 HD11 LEU 47 HD11 LEU 47 -2.489 -2.088 3.985 398 HD12 LEU 47 HD12 LEU 47 -3.756 -0.942 3.505 399 HD13 LEU 47 HD13 LEU 47 -2.741 -0.587 4.904 400 HD21 LEU 47 HD21 LEU 47 -5.701 -3.683 5.058 401 HD22 LEU 47 HD22 LEU 47 -5.561 -2.648 3.638 402 HD23 LEU 47 HD23 LEU 47 -4.292 -3.842 3.983 403 H ARG 48 H ARG 48 -3.252 0.672 6.944 404 HA ARG 48 HA ARG 48 -6.088 0.770 7.792 405 HB2 ARG 48 HB2 ARG 48 -4.703 1.443 9.752 406 HB3 ARG 48 HB3 ARG 48 -4.010 2.765 8.823 407 HG2 ARG 48 HG2 ARG 48 -7.015 2.602 8.932 408 HG3 ARG 48 HG3 ARG 48 -6.206 2.950 10.455 409 HD2 ARG 48 HD2 ARG 48 -5.789 4.566 7.906 410 HD3 ARG 48 HD3 ARG 48 -6.957 4.944 9.184 411 HE ARG 48 HE ARG 48 -4.488 4.690 10.497 412 HH11 ARG 48 HH11 ARG 48 -3.545 6.349 11.290 413 HH12 ARG 48 HH12 ARG 48 -3.779 7.985 10.643 414 HH21 ARG 48 HH21 ARG 48 -5.674 6.854 7.982 415 HH22 ARG 48 HH22 ARG 48 -5.036 8.259 8.828 416 H ILE 49 H ILE 49 -6.837 0.983 5.806 417 HA ILE 49 HA ILE 49 -5.817 3.077 3.973 418 HB ILE 49 HB ILE 49 -8.235 1.308 3.534 419 HG12 ILE 49 HG12 ILE 49 -5.336 0.809 2.721 420 HG13 ILE 49 HG13 ILE 49 -6.318 -0.163 3.828 421 HG21 ILE 49 HG21 ILE 49 -7.941 1.956 1.175 422 HG22 ILE 49 HG22 ILE 49 -8.054 3.408 2.158 423 HG23 ILE 49 HG23 ILE 49 -6.471 2.865 1.580 424 HD11 ILE 49 HD11 ILE 49 -7.938 -0.477 1.829 425 HD12 ILE 49 HD12 ILE 49 -6.563 0.050 0.829 426 HD13 ILE 49 HD13 ILE 49 -6.431 -1.386 1.865 427 H THR 50 H THR 50 -6.594 4.989 3.877 428 HA THR 50 HA THR 50 -9.195 5.824 5.087 429 HB THR 50 HB THR 50 -7.615 7.928 5.671 430 HG1 THR 50 HG1 THR 50 -5.726 6.393 5.226 431 HG21 THR 50 HG21 THR 50 -8.096 5.446 7.365 432 HG22 THR 50 HG22 THR 50 -7.766 7.082 8.001 433 HG23 THR 50 HG23 THR 50 -9.252 6.754 7.112 434 H SER 51 H SER 51 -9.970 7.933 4.214 435 HA SER 51 HA SER 51 -8.595 9.105 1.951 436 HB2 SER 51 HB2 SER 51 -9.748 7.039 0.975 437 HB3 SER 51 HB3 SER 51 -11.294 7.801 1.420 438 HG SER 51 HG SER 51 -10.855 8.472 -0.631 439 H LYS 52 H LYS 52 -9.732 11.020 1.139 440 HA LYS 52 HA LYS 52 -11.721 12.095 3.089 441 HB2 LYS 52 HB2 LYS 52 -9.264 13.474 2.023 442 HB3 LYS 52 HB3 LYS 52 -10.498 14.109 3.156 443 HG2 LYS 52 HG2 LYS 52 -9.796 12.489 4.834 444 HG3 LYS 52 HG3 LYS 52 -8.627 11.791 3.736 445 HD2 LYS 52 HD2 LYS 52 -7.467 14.053 3.606 446 HD3 LYS 52 HD3 LYS 52 -8.533 14.617 4.896 447 HE2 LYS 52 HE2 LYS 52 -7.771 12.753 6.346 448 HE3 LYS 52 HE3 LYS 52 -6.733 12.165 5.038 449 HZ1 LYS 52 HZ1 LYS 52 -6.398 14.768 6.424 450 HZ2 LYS 52 HZ2 LYS 52 -5.504 13.410 6.661 451 HZ3 LYS 52 HZ3 LYS 52 -5.437 14.200 5.220 452 H GLY 53 H GLY 53 -10.610 14.266 0.698 453 HA2 GLY 53 HA2 GLY 53 -13.183 14.256 -0.763 454 HA3 GLY 53 HA3 GLY 53 -11.808 15.322 -1.034 455 H LYS 54 H LYS 54 -10.797 14.995 -2.903 456 HA LYS 54 HA LYS 54 -10.973 12.420 -4.359 457 HB2 LYS 54 HB2 LYS 54 -9.813 15.103 -5.200 458 HB3 LYS 54 HB3 LYS 54 -9.964 13.671 -6.232 459 HG2 LYS 54 HG2 LYS 54 -12.415 13.689 -5.957 460 HG3 LYS 54 HG3 LYS 54 -12.299 15.136 -4.938 461 HD2 LYS 54 HD2 LYS 54 -11.248 16.366 -6.843 462 HD3 LYS 54 HD3 LYS 54 -11.499 14.932 -7.870 463 HE2 LYS 54 HE2 LYS 54 -13.934 15.035 -7.413 464 HE3 LYS 54 HE3 LYS 54 -13.687 16.429 -6.354 465 HZ1 LYS 54 HZ1 LYS 54 -13.104 16.386 -9.274 466 HZ2 LYS 54 HZ2 LYS 54 -14.385 17.123 -8.582 467 HZ3 LYS 54 HZ3 LYS 54 -12.878 17.674 -8.294 468 H THR 55 H THR 55 -9.373 12.583 -1.860 469 HA THR 55 HA THR 55 -6.836 11.526 -2.988 470 HB THR 55 HB THR 55 -6.823 13.349 -0.568 471 HG1 THR 55 HG1 THR 55 -5.960 14.901 -1.942 472 HG21 THR 55 HG21 THR 55 -4.390 13.413 -1.042 473 HG22 THR 55 HG22 THR 55 -4.926 11.750 -0.775 474 HG23 THR 55 HG23 THR 55 -4.623 12.326 -2.429 475 H ALA 56 H ALA 56 -6.432 9.606 -2.247 476 HA ALA 56 HA ALA 56 -7.590 8.658 0.318 477 HB1 ALA 56 HB1 ALA 56 -6.554 7.001 -1.986 478 HB2 ALA 56 HB2 ALA 56 -7.314 6.407 -0.500 479 HB3 ALA 56 HB3 ALA 56 -8.266 7.355 -1.653 480 H TYR 57 H TYR 57 -6.231 7.168 1.551 481 HA TYR 57 HA TYR 57 -3.321 7.783 1.549 482 HB2 TYR 57 HB2 TYR 57 -5.194 8.226 3.911 483 HB3 TYR 57 HB3 TYR 57 -3.453 8.461 3.886 484 HD1 TYR 57 HD1 TYR 57 -2.462 10.380 2.607 485 HD2 TYR 57 HD2 TYR 57 -6.726 9.877 3.010 486 HE1 TYR 57 HE1 TYR 57 -2.808 12.767 1.974 487 HE2 TYR 57 HE2 TYR 57 -7.071 12.235 2.287 488 HH TYR 57 HH TYR 57 -4.338 14.441 1.609 489 H ILE 58 H ILE 58 -2.600 5.690 1.317 490 HA ILE 58 HA ILE 58 -3.639 3.524 3.098 491 HB ILE 58 HB ILE 58 -1.357 3.475 1.073 492 HG12 ILE 58 HG12 ILE 58 -2.964 1.709 0.003 493 HG13 ILE 58 HG13 ILE 58 -4.238 2.507 0.916 494 HG21 ILE 58 HG21 ILE 58 -2.611 1.226 2.715 495 HG22 ILE 58 HG22 ILE 58 -1.348 1.044 1.475 496 HG23 ILE 58 HG23 ILE 58 -0.985 1.902 2.958 497 HD11 ILE 58 HD11 ILE 58 -4.044 3.272 -1.444 498 HD12 ILE 58 HD12 ILE 58 -3.763 4.612 -0.336 499 HD13 ILE 58 HD13 ILE 58 -2.382 3.806 -1.135 500 H LYS 59 H LYS 59 -3.222 4.050 5.166 501 HA LYS 59 HA LYS 59 -0.403 4.754 5.862 502 HB2 LYS 59 HB2 LYS 59 -2.879 5.060 7.583 503 HB3 LYS 59 HB3 LYS 59 -1.231 5.588 7.947 504 HG2 LYS 59 HG2 LYS 59 -1.498 6.873 5.599 505 HG3 LYS 59 HG3 LYS 59 -3.215 6.710 5.967 506 HD2 LYS 59 HD2 LYS 59 -2.777 7.879 8.167 507 HD3 LYS 59 HD3 LYS 59 -1.100 8.093 7.684 508 HE2 LYS 59 HE2 LYS 59 -1.868 9.319 5.635 509 HE3 LYS 59 HE3 LYS 59 -3.546 9.131 6.181 510 HZ1 LYS 59 HZ1 LYS 59 -3.003 10.427 8.142 511 HZ2 LYS 59 HZ2 LYS 59 -1.419 10.616 7.631 512 HZ3 LYS 59 HZ3 LYS 59 -2.662 11.290 6.813 513 H LEU 60 H LEU 60 0.802 3.640 7.140 514 HA LEU 60 HA LEU 60 -0.031 0.885 7.971 515 HB2 LEU 60 HB2 LEU 60 2.418 2.050 6.693 516 HB3 LEU 60 HB3 LEU 60 2.689 0.859 7.955 517 HG LEU 60 HG LEU 60 1.431 -0.826 6.825 518 HD11 LEU 60 HD11 LEU 60 0.834 1.256 4.674 519 HD12 LEU 60 HD12 LEU 60 0.584 -0.495 4.483 520 HD13 LEU 60 HD13 LEU 60 -0.350 0.394 5.684 521 HD21 LEU 60 HD21 LEU 60 3.246 0.587 4.821 522 HD22 LEU 60 HD22 LEU 60 3.814 -0.370 6.202 523 HD23 LEU 60 HD23 LEU 60 2.888 -1.153 4.914 524 H GLU 61 H GLU 61 0.157 0.285 10.050 525 HA GLU 61 HA GLU 61 1.205 2.297 12.007 526 HB2 GLU 61 HB2 GLU 61 -1.516 0.954 12.006 527 HB3 GLU 61 HB3 GLU 61 -0.848 1.889 13.355 528 HG2 GLU 61 HG2 GLU 61 -0.671 3.886 11.885 529 HG3 GLU 61 HG3 GLU 61 -1.403 2.978 10.559 530 H ASP 62 H ASP 62 1.815 1.532 14.090 531 HA ASP 62 HA ASP 62 3.087 -1.010 13.996 532 HB2 ASP 62 HB2 ASP 62 3.903 0.968 15.253 533 HB3 ASP 62 HB3 ASP 62 2.540 0.747 16.382 534 H LYS 63 H LYS 63 2.786 -2.878 14.985 535 HA LYS 63 HA LYS 63 0.103 -3.676 15.629 536 HB2 LYS 63 HB2 LYS 63 1.392 -5.993 15.985 537 HB3 LYS 63 HB3 LYS 63 1.054 -5.328 14.401 538 HG2 LYS 63 HG2 LYS 63 3.324 -6.218 14.527 539 HG3 LYS 63 HG3 LYS 63 3.288 -4.501 14.150 540 HD2 LYS 63 HD2 LYS 63 3.836 -4.012 16.573 541 HD3 LYS 63 HD3 LYS 63 4.088 -5.750 16.808 542 HE2 LYS 63 HE2 LYS 63 6.006 -5.779 15.473 543 HE3 LYS 63 HE3 LYS 63 5.449 -4.443 14.462 544 HZ1 LYS 63 HZ1 LYS 63 5.912 -2.897 16.235 545 HZ2 LYS 63 HZ2 LYS 63 6.419 -4.098 17.243 546 HZ3 LYS 63 HZ3 LYS 63 7.270 -3.743 15.893 547 H VAL 64 H VAL 64 2.270 -2.321 17.718 548 HA VAL 64 HA VAL 64 0.785 -3.529 20.023 549 HB VAL 64 HB VAL 64 3.545 -2.256 20.110 550 HG11 VAL 64 HG11 VAL 64 2.311 -2.047 22.234 551 HG12 VAL 64 HG12 VAL 64 1.944 -3.787 22.209 552 HG13 VAL 64 HG13 VAL 64 3.618 -3.220 22.393 553 HG21 VAL 64 HG21 VAL 64 4.371 -4.564 20.588 554 HG22 VAL 64 HG22 VAL 64 2.756 -5.202 20.202 555 HG23 VAL 64 HG23 VAL 64 3.735 -4.400 18.952 556 H SER 65 H SER 65 2.337 -0.501 18.839 557 HA SER 65 HA SER 65 0.806 1.020 20.857 558 HB2 SER 65 HB2 SER 65 3.007 1.840 18.938 559 HB3 SER 65 HB3 SER 65 2.292 2.882 20.185 560 HG SER 65 HG SER 65 4.231 1.835 20.875 561 H GLY 66 H GLY 66 0.511 0.411 17.462 562 HA2 GLY 66 HA2 GLY 66 -1.074 1.124 15.926 563 HA3 GLY 66 HA3 GLY 66 -1.851 2.096 17.181 564 H GLU 67 H GLU 67 1.517 2.696 16.822 565 HA GLU 67 HA GLU 67 1.008 5.413 15.925 566 HB2 GLU 67 HB2 GLU 67 3.232 5.868 16.580 567 HB3 GLU 67 HB3 GLU 67 2.504 4.813 17.803 568 HG2 GLU 67 HG2 GLU 67 3.714 2.874 16.880 569 HG3 GLU 67 HG3 GLU 67 4.436 3.894 15.632 570 H LEU 68 H LEU 68 2.049 6.463 14.159 571 HA LEU 68 HA LEU 68 1.669 4.958 11.756 572 HB2 LEU 68 HB2 LEU 68 1.050 7.353 12.118 573 HB3 LEU 68 HB3 LEU 68 2.762 7.766 12.184 574 HG LEU 68 HG LEU 68 2.990 6.920 9.799 575 HD11 LEU 68 HD11 LEU 68 0.929 6.723 8.464 576 HD12 LEU 68 HD12 LEU 68 0.969 5.476 9.703 577 HD13 LEU 68 HD13 LEU 68 -0.063 6.900 9.930 578 HD21 LEU 68 HD21 LEU 68 2.747 9.314 10.308 579 HD22 LEU 68 HD22 LEU 68 1.901 8.907 8.808 580 HD23 LEU 68 HD23 LEU 68 0.977 9.154 10.304 581 H PHE 69 H PHE 69 3.056 3.726 10.682 582 HA PHE 69 HA PHE 69 5.993 3.994 10.981 583 HB2 PHE 69 HB2 PHE 69 5.227 1.745 10.950 584 HB3 PHE 69 HB3 PHE 69 4.169 2.022 9.575 585 HD1 PHE 69 HD1 PHE 69 4.903 1.501 7.374 586 HD2 PHE 69 HD2 PHE 69 7.815 2.059 10.510 587 HE1 PHE 69 HE1 PHE 69 6.718 0.929 5.796 588 HE2 PHE 69 HE2 PHE 69 9.622 1.399 8.941 589 HZ PHE 69 HZ PHE 69 9.074 0.843 6.572 590 H ALA 70 H ALA 70 3.587 4.053 8.313 591 HA ALA 70 HA ALA 70 4.960 6.247 6.956 592 HB1 ALA 70 HB1 ALA 70 4.765 3.494 5.641 593 HB2 ALA 70 HB2 ALA 70 5.380 4.988 4.899 594 HB3 ALA 70 HB3 ALA 70 6.268 4.243 6.232 595 H GLN 71 H GLN 71 3.780 6.936 5.005 596 HA GLN 71 HA GLN 71 0.962 6.052 4.775 597 HB2 GLN 71 HB2 GLN 71 0.277 8.493 4.824 598 HB3 GLN 71 HB3 GLN 71 0.698 7.764 6.376 599 HG2 GLN 71 HG2 GLN 71 2.725 8.951 6.566 600 HG3 GLN 71 HG3 GLN 71 2.805 9.286 4.850 601 HE21 GLN 71 HE21 GLN 71 1.665 12.520 5.472 602 HE22 GLN 71 HE22 GLN 71 2.877 11.447 4.748 603 H ALA 72 H ALA 72 0.302 5.973 2.711 604 HA ALA 72 HA ALA 72 1.811 7.510 0.622 605 HB1 ALA 72 HB1 ALA 72 0.439 4.814 0.484 606 HB2 ALA 72 HB2 ALA 72 1.109 5.697 -0.905 607 HB3 ALA 72 HB3 ALA 72 2.181 5.159 0.397 608 HA PRO 73 HA PRO 73 -2.209 9.637 0.120 609 HB2 PRO 73 HB2 PRO 73 -0.214 11.423 -1.253 610 HB3 PRO 73 HB3 PRO 73 -1.633 11.866 -0.257 611 HG2 PRO 73 HG2 PRO 73 0.891 11.995 0.737 612 HG3 PRO 73 HG3 PRO 73 -0.465 11.393 1.748 613 HD2 PRO 73 HD2 PRO 73 1.639 9.789 0.288 614 HD3 PRO 73 HD3 PRO 73 0.966 9.558 1.925 615 H VAL 74 H VAL 74 -3.403 9.329 -1.642 616 HA VAL 74 HA VAL 74 -2.196 8.688 -4.299 617 HB VAL 74 HB VAL 74 -4.636 7.346 -3.051 618 HG11 VAL 74 HG11 VAL 74 -3.085 6.676 -5.581 619 HG12 VAL 74 HG12 VAL 74 -4.399 5.703 -4.890 620 HG13 VAL 74 HG13 VAL 74 -4.741 7.327 -5.475 621 HG21 VAL 74 HG21 VAL 74 -2.766 6.523 -1.797 622 HG22 VAL 74 HG22 VAL 74 -3.308 5.277 -2.914 623 HG23 VAL 74 HG23 VAL 74 -1.837 6.205 -3.276 624 H GLU 75 H GLU 75 -2.971 10.094 -5.852 625 HA GLU 75 HA GLU 75 -5.307 11.786 -5.198 626 HB2 GLU 75 HB2 GLU 75 -3.826 12.030 -7.795 627 HB3 GLU 75 HB3 GLU 75 -4.554 13.250 -6.776 628 HG2 GLU 75 HG2 GLU 75 -2.376 13.755 -6.444 629 HG3 GLU 75 HG3 GLU 75 -2.564 12.628 -5.111 630 H GLN 76 H GLN 76 -4.672 9.008 -7.050 631 HA GLN 76 HA GLN 76 -7.370 8.653 -7.999 632 HB2 GLN 76 HB2 GLN 76 -6.954 8.618 -10.351 633 HB3 GLN 76 HB3 GLN 76 -6.479 10.194 -9.763 634 HG2 GLN 76 HG2 GLN 76 -4.603 7.924 -10.561 635 HG3 GLN 76 HG3 GLN 76 -4.966 9.356 -11.495 636 HE21 GLN 76 HE21 GLN 76 -2.311 9.662 -8.357 637 HE22 GLN 76 HE22 GLN 76 -3.276 8.192 -8.583 638 H TYR 77 H TYR 77 -7.749 6.439 -8.403 639 HA TYR 77 HA TYR 77 -5.399 4.644 -8.564 640 HB2 TYR 77 HB2 TYR 77 -6.133 4.692 -6.227 641 HB3 TYR 77 HB3 TYR 77 -7.749 4.196 -6.738 642 HD1 TYR 77 HD1 TYR 77 -8.234 1.939 -6.423 643 HD2 TYR 77 HD2 TYR 77 -4.192 3.106 -7.348 644 HE1 TYR 77 HE1 TYR 77 -7.543 -0.454 -6.405 645 HE2 TYR 77 HE2 TYR 77 -3.523 0.714 -7.424 646 HH TYR 77 HH TYR 77 -5.853 -1.941 -6.854 647 HA PRO 78 HA PRO 78 -4.754 2.762 -9.756 648 HB2 PRO 78 HB2 PRO 78 -4.936 2.797 -12.752 649 HB3 PRO 78 HB3 PRO 78 -4.132 1.615 -11.668 650 HG2 PRO 78 HG2 PRO 78 -6.527 1.015 -12.774 651 HG3 PRO 78 HG3 PRO 78 -6.236 0.653 -11.038 652 HD2 PRO 78 HD2 PRO 78 -7.650 3.061 -12.238 653 HD3 PRO 78 HD3 PRO 78 -8.191 1.988 -10.912 654 H GLY 79 H GLY 79 -2.793 3.831 -10.056 655 HA2 GLY 79 HA2 GLY 79 -2.368 6.235 -11.596 656 HA3 GLY 79 HA3 GLY 79 -2.714 6.588 -9.899 657 H ILE 80 H ILE 80 -0.509 7.468 -9.795 658 HA ILE 80 HA ILE 80 1.753 5.682 -10.240 659 HB ILE 80 HB ILE 80 1.972 7.995 -10.804 660 HG12 ILE 80 HG12 ILE 80 3.758 7.377 -8.409 661 HG13 ILE 80 HG13 ILE 80 3.940 6.640 -10.003 662 HG21 ILE 80 HG21 ILE 80 1.702 8.718 -7.845 663 HG22 ILE 80 HG22 ILE 80 1.979 9.826 -9.200 664 HG23 ILE 80 HG23 ILE 80 0.443 8.988 -9.067 665 HD11 ILE 80 HD11 ILE 80 4.398 8.866 -10.980 666 HD12 ILE 80 HD12 ILE 80 4.247 9.598 -9.364 667 HD13 ILE 80 HD13 ILE 80 5.540 8.433 -9.686 668 H ALA 81 H ALA 81 0.055 6.792 -7.314 669 HA ALA 81 HA ALA 81 2.217 5.964 -5.532 670 HB1 ALA 81 HB1 ALA 81 -0.582 7.021 -5.017 671 HB2 ALA 81 HB2 ALA 81 0.710 6.858 -3.806 672 HB3 ALA 81 HB3 ALA 81 0.898 7.991 -5.154 673 H VAL 82 H VAL 82 0.310 3.950 -7.117 674 HA VAL 82 HA VAL 82 0.508 1.842 -5.109 675 HB VAL 82 HB VAL 82 -2.183 2.473 -6.326 676 HG11 VAL 82 HG11 VAL 82 -1.349 0.407 -4.220 677 HG12 VAL 82 HG12 VAL 82 -3.012 0.697 -4.763 678 HG13 VAL 82 HG13 VAL 82 -1.823 0.044 -5.889 679 HG21 VAL 82 HG21 VAL 82 -1.893 4.131 -4.636 680 HG22 VAL 82 HG22 VAL 82 -3.012 2.918 -4.043 681 HG23 VAL 82 HG23 VAL 82 -1.346 2.922 -3.450 682 H GLU 83 H GLU 83 1.149 0.052 -6.148 683 HA GLU 83 HA GLU 83 0.242 -0.587 -8.907 684 HB2 GLU 83 HB2 GLU 83 3.129 -0.207 -8.029 685 HB3 GLU 83 HB3 GLU 83 2.717 -1.402 -9.256 686 HG2 GLU 83 HG2 GLU 83 1.491 0.415 -10.520 687 HG3 GLU 83 HG3 GLU 83 2.233 1.583 -9.409 688 H THR 84 H THR 84 0.619 -2.799 -9.529 689 HA THR 84 HA THR 84 0.545 -4.757 -7.269 690 HB THR 84 HB THR 84 -0.446 -6.263 -8.963 691 HG1 THR 84 HG1 THR 84 -1.089 -5.385 -10.936 692 HG21 THR 84 HG21 THR 84 -2.633 -5.173 -9.127 693 HG22 THR 84 HG22 THR 84 -1.913 -4.849 -7.544 694 HG23 THR 84 HG23 THR 84 -1.907 -3.583 -8.787 695 H VAL 85 H VAL 85 1.679 -6.779 -7.521 696 HA VAL 85 HA VAL 85 4.147 -6.729 -9.131 697 HB VAL 85 HB VAL 85 4.645 -8.855 -8.153 698 HG11 VAL 85 HG11 VAL 85 3.617 -6.956 -6.002 699 HG12 VAL 85 HG12 VAL 85 4.887 -8.173 -5.824 700 HG13 VAL 85 HG13 VAL 85 5.146 -6.779 -6.878 701 HG21 VAL 85 HG21 VAL 85 2.352 -9.817 -8.044 702 HG22 VAL 85 HG22 VAL 85 3.217 -9.942 -6.522 703 HG23 VAL 85 HG23 VAL 85 1.960 -8.706 -6.724 704 H THR 86 H THR 86 4.526 -8.706 -10.560 705 HA THR 86 HA THR 86 2.203 -9.230 -12.304 706 HB THR 86 HB THR 86 3.877 -9.978 -13.906 707 HG1 THR 86 HG1 THR 86 6.052 -9.935 -13.342 708 HG21 THR 86 HG21 THR 86 3.485 -7.513 -13.648 709 HG22 THR 86 HG22 THR 86 4.836 -7.444 -12.505 710 HG23 THR 86 HG23 THR 86 5.136 -7.891 -14.193 711 H ASP 87 H ASP 87 4.196 -10.996 -10.046 712 HA ASP 87 HA ASP 87 3.549 -13.589 -11.275 713 HB2 ASP 87 HB2 ASP 87 5.868 -12.907 -10.668 714 HB3 ASP 87 HB3 ASP 87 5.388 -12.928 -8.967 715 H SER 88 H SER 88 3.022 -12.002 -8.104 716 HA SER 88 HA SER 88 1.115 -14.224 -7.389 717 HB2 SER 88 HB2 SER 88 3.278 -14.622 -6.323 718 HB3 SER 88 HB3 SER 88 3.187 -13.039 -5.527 719 HG SER 88 HG SER 88 2.380 -14.984 -4.336 720 H SER 89 H SER 89 -0.842 -13.471 -7.126 721 HA SER 89 HA SER 89 -1.405 -10.722 -7.108 722 HB2 SER 89 HB2 SER 89 -3.362 -12.987 -6.658 723 HB3 SER 89 HB3 SER 89 -3.701 -11.381 -7.335 724 HG SER 89 HG SER 89 -3.466 -12.951 -8.984 725 H ARG 90 H ARG 90 -0.146 -11.513 -4.554 726 HA ARG 90 HA ARG 90 -2.049 -10.268 -2.651 727 HB2 ARG 90 HB2 ARG 90 -1.250 -11.792 -0.838 728 HB3 ARG 90 HB3 ARG 90 -2.263 -12.506 -2.082 729 HG2 ARG 90 HG2 ARG 90 -0.360 -13.486 -3.201 730 HG3 ARG 90 HG3 ARG 90 0.758 -12.715 -2.065 731 HD2 ARG 90 HD2 ARG 90 -1.397 -14.648 -1.142 732 HD3 ARG 90 HD3 ARG 90 0.142 -15.213 -1.801 733 HE ARG 90 HE ARG 90 0.226 -13.264 0.456 734 HH11 ARG 90 HH11 ARG 90 1.464 -13.715 2.117 735 HH12 ARG 90 HH12 ARG 90 2.179 -15.303 2.345 736 HH21 ARG 90 HH21 ARG 90 0.753 -16.609 -0.506 737 HH22 ARG 90 HH22 ARG 90 1.759 -16.916 0.881 738 H TYR 91 H TYR 91 0.191 -9.172 -4.227 739 HA TYR 91 HA TYR 91 1.649 -7.828 -2.022 740 HB2 TYR 91 HB2 TYR 91 2.866 -9.099 -4.490 741 HB3 TYR 91 HB3 TYR 91 3.721 -8.033 -3.410 742 HD1 TYR 91 HD1 TYR 91 2.526 -11.434 -3.974 743 HD2 TYR 91 HD2 TYR 91 4.254 -8.758 -1.073 744 HE1 TYR 91 HE1 TYR 91 3.204 -13.381 -2.592 745 HE2 TYR 91 HE2 TYR 91 4.897 -10.719 0.338 746 HH TYR 91 HH TYR 91 4.220 -14.088 -0.660 747 H PHE 92 H PHE 92 2.204 -5.692 -2.417 748 HA PHE 92 HA PHE 92 1.571 -4.446 -5.046 749 HB2 PHE 92 HB2 PHE 92 0.544 -3.414 -2.371 750 HB3 PHE 92 HB3 PHE 92 0.296 -2.663 -3.932 751 HD1 PHE 92 HD1 PHE 92 -0.681 -5.380 -1.695 752 HD2 PHE 92 HD2 PHE 92 -1.328 -3.596 -5.555 753 HE1 PHE 92 HE1 PHE 92 -2.761 -6.673 -1.927 754 HE2 PHE 92 HE2 PHE 92 -3.401 -4.961 -5.829 755 HZ PHE 92 HZ PHE 92 -4.125 -6.499 -4.021 756 H VAL 93 H VAL 93 2.422 -2.262 -5.222 757 HA VAL 93 HA VAL 93 4.503 -1.516 -3.208 758 HB VAL 93 HB VAL 93 4.543 -0.980 -6.197 759 HG11 VAL 93 HG11 VAL 93 6.700 0.114 -5.823 760 HG12 VAL 93 HG12 VAL 93 5.426 0.966 -4.957 761 HG13 VAL 93 HG13 VAL 93 6.538 -0.096 -4.070 762 HG21 VAL 93 HG21 VAL 93 6.212 -2.719 -4.339 763 HG22 VAL 93 HG22 VAL 93 5.256 -3.213 -5.756 764 HG23 VAL 93 HG23 VAL 93 6.737 -2.274 -5.966 765 H ILE 94 H ILE 94 4.349 0.567 -2.362 766 HA ILE 94 HA ILE 94 2.406 2.382 -3.662 767 HB ILE 94 HB ILE 94 1.438 3.160 -1.686 768 HG12 ILE 94 HG12 ILE 94 3.241 2.546 -0.029 769 HG13 ILE 94 HG13 ILE 94 1.587 2.302 0.489 770 HG21 ILE 94 HG21 ILE 94 -0.106 1.321 -1.209 771 HG22 ILE 94 HG22 ILE 94 0.281 1.446 -2.931 772 HG23 ILE 94 HG23 ILE 94 1.011 0.163 -1.969 773 HD11 ILE 94 HD11 ILE 94 3.443 0.059 -0.420 774 HD12 ILE 94 HD12 ILE 94 3.050 0.492 1.250 775 HD13 ILE 94 HD13 ILE 94 1.786 -0.127 0.184 776 H ARG 95 H ARG 95 2.730 4.559 -3.427 777 HA ARG 95 HA ARG 95 5.561 5.289 -2.848 778 HB2 ARG 95 HB2 ARG 95 4.473 5.948 -5.019 779 HB3 ARG 95 HB3 ARG 95 3.451 7.067 -4.099 780 HG2 ARG 95 HG2 ARG 95 5.537 8.158 -3.207 781 HG3 ARG 95 HG3 ARG 95 6.501 7.076 -4.230 782 HD2 ARG 95 HD2 ARG 95 5.336 8.004 -6.236 783 HD3 ARG 95 HD3 ARG 95 4.434 9.108 -5.178 784 HE ARG 95 HE ARG 95 7.210 9.461 -4.643 785 HH11 ARG 95 HH11 ARG 95 8.357 11.096 -5.362 786 HH12 ARG 95 HH12 ARG 95 7.907 11.979 -6.808 787 HH21 ARG 95 HH21 ARG 95 5.018 10.159 -7.288 788 HH22 ARG 95 HH22 ARG 95 6.026 11.456 -7.874 789 H ILE 96 H ILE 96 5.670 5.300 -0.666 790 HA ILE 96 HA ILE 96 3.790 6.860 0.936 791 HB ILE 96 HB ILE 96 5.018 6.344 2.880 792 HG12 ILE 96 HG12 ILE 96 6.923 4.427 2.394 793 HG13 ILE 96 HG13 ILE 96 7.213 5.488 1.027 794 HG21 ILE 96 HG21 ILE 96 4.602 3.914 1.137 795 HG22 ILE 96 HG22 ILE 96 4.733 3.912 2.902 796 HG23 ILE 96 HG23 ILE 96 3.393 4.751 2.148 797 HD11 ILE 96 HD11 ILE 96 7.221 6.251 3.980 798 HD12 ILE 96 HD12 ILE 96 8.636 6.075 2.928 799 HD13 ILE 96 HD13 ILE 96 7.491 7.402 2.642 800 H GLN 97 H GLN 97 4.086 8.815 1.936 801 HA GLN 97 HA GLN 97 6.303 10.573 0.971 802 HB2 GLN 97 HB2 GLN 97 3.331 11.097 0.693 803 HB3 GLN 97 HB3 GLN 97 4.563 12.332 0.504 804 HG2 GLN 97 HG2 GLN 97 5.231 11.622 -1.554 805 HG3 GLN 97 HG3 GLN 97 4.914 9.919 -1.232 806 HE21 GLN 97 HE21 GLN 97 1.651 9.947 -2.564 807 HE22 GLN 97 HE22 GLN 97 2.959 9.021 -1.841 808 H ASP 98 H ASP 98 6.805 12.246 2.240 809 HA ASP 98 HA ASP 98 5.816 12.170 5.037 810 HB2 ASP 98 HB2 ASP 98 8.273 12.168 4.342 811 HB3 ASP 98 HB3 ASP 98 8.032 13.862 3.900 812 H GLY 99 H GLY 99 4.741 13.737 2.374 813 HA2 GLY 99 HA2 GLY 99 3.065 15.339 2.189 814 HA3 GLY 99 HA3 GLY 99 3.244 15.743 3.897 815 H THR 100 H THR 100 6.193 15.827 2.198 816 HA THR 100 HA THR 100 6.098 18.771 1.711 817 HB THR 100 HB THR 100 6.820 18.272 4.020 818 HG1 THR 100 HG1 THR 100 8.768 19.377 2.302 819 HG21 THR 100 HG21 THR 100 9.284 16.997 2.766 820 HG22 THR 100 HG22 THR 100 9.005 17.322 4.488 821 HG23 THR 100 HG23 THR 100 8.002 16.134 3.644 822 H GLY 101 H GLY 101 6.357 16.235 -0.046 823 HA2 GLY 101 HA2 GLY 101 7.248 16.078 -2.207 824 HA3 GLY 101 HA3 GLY 101 8.460 17.298 -1.830 825 H ARG 102 H ARG 102 8.665 15.179 0.684 826 HA ARG 102 HA ARG 102 10.832 13.476 -0.367 827 HB2 ARG 102 HB2 ARG 102 9.354 13.486 2.292 828 HB3 ARG 102 HB3 ARG 102 10.742 12.468 1.917 829 HG2 ARG 102 HG2 ARG 102 12.198 14.357 1.764 830 HG3 ARG 102 HG3 ARG 102 10.834 15.497 1.878 831 HD2 ARG 102 HD2 ARG 102 10.299 14.643 4.134 832 HD3 ARG 102 HD3 ARG 102 11.706 13.567 4.073 833 HE ARG 102 HE ARG 102 12.948 15.880 3.662 834 HH11 ARG 102 HH11 ARG 102 13.666 17.409 5.076 835 HH12 ARG 102 HH12 ARG 102 12.820 17.692 6.569 836 HH21 ARG 102 HH21 ARG 102 10.359 15.350 6.051 837 HH22 ARG 102 HH22 ARG 102 11.039 16.559 7.101 838 H SER 103 H SER 103 10.509 11.505 -1.076 839 HA SER 103 HA SER 103 8.248 9.954 -0.157 840 HB2 SER 103 HB2 SER 103 7.281 9.393 -2.322 841 HB3 SER 103 HB3 SER 103 7.289 11.149 -2.115 842 HG SER 103 HG SER 103 9.354 11.078 -3.308 843 H ALA 104 H ALA 104 8.216 7.704 -0.766 844 HA ALA 104 HA ALA 104 10.541 6.560 -2.163 845 HB1 ALA 104 HB1 ALA 104 11.263 6.585 0.209 846 HB2 ALA 104 HB2 ALA 104 9.774 5.730 0.673 847 HB3 ALA 104 HB3 ALA 104 10.977 4.928 -0.357 848 H PHE 105 H PHE 105 10.116 4.525 -3.063 849 HA PHE 105 HA PHE 105 7.271 3.606 -3.043 850 HB2 PHE 105 HB2 PHE 105 9.584 3.102 -4.928 851 HB3 PHE 105 HB3 PHE 105 8.145 2.104 -4.907 852 HD1 PHE 105 HD1 PHE 105 6.004 2.887 -5.740 853 HD2 PHE 105 HD2 PHE 105 9.427 5.507 -5.723 854 HE1 PHE 105 HE1 PHE 105 4.852 4.376 -7.320 855 HE2 PHE 105 HE2 PHE 105 8.261 7.020 -7.302 856 HZ PHE 105 HZ PHE 105 5.988 6.449 -8.130 857 H ILE 106 H ILE 106 6.794 2.113 -1.588 858 HA ILE 106 HA ILE 106 8.865 0.091 -0.795 859 HB ILE 106 HB ILE 106 7.987 -0.091 1.368 860 HG12 ILE 106 HG12 ILE 106 5.835 1.954 0.682 861 HG13 ILE 106 HG13 ILE 106 5.578 0.227 0.938 862 HG21 ILE 106 HG21 ILE 106 8.213 2.883 0.802 863 HG22 ILE 106 HG22 ILE 106 8.646 2.026 2.303 864 HG23 ILE 106 HG23 ILE 106 9.596 1.766 0.834 865 HD11 ILE 106 HD11 ILE 106 6.483 2.192 3.066 866 HD12 ILE 106 HD12 ILE 106 4.920 1.372 2.934 867 HD13 ILE 106 HD13 ILE 106 6.383 0.432 3.274 868 H GLY 107 H GLY 107 8.205 -2.048 -0.452 869 HA2 GLY 107 HA2 GLY 107 5.812 -2.879 -2.015 870 HA3 GLY 107 HA3 GLY 107 7.117 -3.926 -1.471 871 H ILE 108 H ILE 108 4.130 -4.003 -1.042 872 HA ILE 108 HA ILE 108 4.375 -4.772 1.782 873 HB ILE 108 HB ILE 108 2.026 -4.308 2.243 874 HG12 ILE 108 HG12 ILE 108 1.996 -2.546 -0.238 875 HG13 ILE 108 HG13 ILE 108 1.206 -4.118 -0.118 876 HG21 ILE 108 HG21 ILE 108 3.720 -1.868 1.613 877 HG22 ILE 108 HG22 ILE 108 2.372 -1.938 2.769 878 HG23 ILE 108 HG23 ILE 108 3.823 -2.898 3.054 879 HD11 ILE 108 HD11 ILE 108 0.507 -1.671 1.564 880 HD12 ILE 108 HD12 ILE 108 -0.444 -2.393 0.262 881 HD13 ILE 108 HD13 ILE 108 -0.196 -3.287 1.771 882 H GLY 109 H GLY 109 3.445 -6.667 2.367 883 HA2 GLY 109 HA2 GLY 109 2.129 -8.322 0.238 884 HA3 GLY 109 HA3 GLY 109 3.369 -8.966 1.307 885 H PHE 110 H PHE 110 0.577 -9.686 0.797 886 HA PHE 110 HA PHE 110 -0.634 -9.507 3.523 887 HB2 PHE 110 HB2 PHE 110 -1.805 -10.015 0.763 888 HB3 PHE 110 HB3 PHE 110 -2.709 -10.257 2.247 889 HD1 PHE 110 HD1 PHE 110 -3.456 -8.430 3.635 890 HD2 PHE 110 HD2 PHE 110 -1.113 -7.682 0.089 891 HE1 PHE 110 HE1 PHE 110 -3.989 -6.024 3.789 892 HE2 PHE 110 HE2 PHE 110 -1.659 -5.252 0.263 893 HZ PHE 110 HZ PHE 110 -3.098 -4.435 2.080 894 H THR 111 H THR 111 -1.823 -11.443 4.240 895 HA THR 111 HA THR 111 -0.188 -13.841 4.087 896 HB THR 111 HB THR 111 -1.330 -13.014 6.124 897 HG1 THR 111 HG1 THR 111 -1.857 -15.060 6.827 898 HG21 THR 111 HG21 THR 111 -3.661 -13.511 6.560 899 HG22 THR 111 HG22 THR 111 -3.565 -12.436 5.161 900 HG23 THR 111 HG23 THR 111 -3.884 -14.169 4.928 901 H ASP 112 H ASP 112 -3.020 -12.724 2.363 902 HA ASP 112 HA ASP 112 -3.094 -15.131 0.718 903 HB2 ASP 112 HB2 ASP 112 -4.492 -15.712 2.732 904 HB3 ASP 112 HB3 ASP 112 -5.522 -14.324 2.381 905 H ARG 113 H ARG 113 -4.386 -14.887 -1.191 906 HA ARG 113 HA ARG 113 -4.437 -12.304 -2.409 907 HB2 ARG 113 HB2 ARG 113 -4.307 -14.453 -3.635 908 HB3 ARG 113 HB3 ARG 113 -5.965 -14.838 -3.139 909 HG2 ARG 113 HG2 ARG 113 -6.786 -12.823 -4.350 910 HG3 ARG 113 HG3 ARG 113 -5.123 -12.443 -4.838 911 HD2 ARG 113 HD2 ARG 113 -5.010 -14.508 -6.144 912 HD3 ARG 113 HD3 ARG 113 -6.587 -15.028 -5.519 913 HE ARG 113 HE ARG 113 -7.016 -12.519 -6.704 914 HH11 ARG 113 HH11 ARG 113 -8.011 -12.313 -8.670 915 HH12 ARG 113 HH12 ARG 113 -7.875 -13.577 -9.857 916 HH21 ARG 113 HH21 ARG 113 -6.043 -15.682 -7.862 917 HH22 ARG 113 HH22 ARG 113 -6.804 -15.448 -9.410 918 H GLY 114 H GLY 114 -7.017 -14.002 -0.588 919 HA2 GLY 114 HA2 GLY 114 -9.190 -12.344 -1.400 920 HA3 GLY 114 HA3 GLY 114 -9.076 -13.255 0.112 921 H ASP 115 H ASP 115 -6.744 -11.855 1.163 922 HA ASP 115 HA ASP 115 -8.086 -9.438 2.190 923 HB2 ASP 115 HB2 ASP 115 -5.488 -10.847 2.877 924 HB3 ASP 115 HB3 ASP 115 -5.931 -9.279 3.553 925 H ALA 116 H ALA 116 -5.274 -10.155 0.067 926 HA ALA 116 HA ALA 116 -4.530 -7.434 -0.415 927 HB1 ALA 116 HB1 ALA 116 -3.101 -9.224 -1.020 928 HB2 ALA 116 HB2 ALA 116 -4.362 -10.039 -1.978 929 HB3 ALA 116 HB3 ALA 116 -3.656 -8.540 -2.566 930 H PHE 117 H PHE 117 -6.988 -9.520 -2.036 931 HA PHE 117 HA PHE 117 -7.797 -7.470 -3.897 932 HB2 PHE 117 HB2 PHE 117 -8.862 -10.144 -3.081 933 HB3 PHE 117 HB3 PHE 117 -9.978 -9.010 -3.817 934 HD1 PHE 117 HD1 PHE 117 -6.357 -9.962 -4.453 935 HD2 PHE 117 HD2 PHE 117 -10.287 -9.275 -6.102 936 HE1 PHE 117 HE1 PHE 117 -5.460 -10.282 -6.728 937 HE2 PHE 117 HE2 PHE 117 -9.386 -9.642 -8.384 938 HZ PHE 117 HZ PHE 117 -6.961 -10.118 -8.708 939 H ASP 118 H ASP 118 -8.903 -8.204 -0.570 940 HA ASP 118 HA ASP 118 -11.019 -6.270 -0.599 941 HB2 ASP 118 HB2 ASP 118 -10.646 -8.189 1.015 942 HB3 ASP 118 HB3 ASP 118 -9.384 -7.223 1.779 943 H PHE 119 H PHE 119 -7.544 -5.960 0.167 944 HA PHE 119 HA PHE 119 -7.441 -3.167 0.903 945 HB2 PHE 119 HB2 PHE 119 -5.547 -4.418 1.356 946 HB3 PHE 119 HB3 PHE 119 -5.533 -5.219 -0.190 947 HD1 PHE 119 HD1 PHE 119 -4.669 -4.104 -2.241 948 HD2 PHE 119 HD2 PHE 119 -4.440 -2.254 1.637 949 HE1 PHE 119 HE1 PHE 119 -3.118 -2.403 -3.148 950 HE2 PHE 119 HE2 PHE 119 -2.935 -0.538 0.737 951 HZ PHE 119 HZ PHE 119 -2.242 -0.596 -1.666 952 H ASN 120 H ASN 120 -7.237 -4.777 -2.261 953 HA ASN 120 HA ASN 120 -6.909 -2.344 -3.764 954 HB2 ASN 120 HB2 ASN 120 -5.950 -4.337 -4.610 955 HB3 ASN 120 HB3 ASN 120 -7.395 -5.283 -4.300 956 HD21 ASN 120 HD21 ASN 120 -8.453 -5.051 -7.579 957 HD22 ASN 120 HD22 ASN 120 -8.470 -5.900 -6.042 958 H VAL 121 H VAL 121 -9.812 -4.343 -3.096 959 HA VAL 121 HA VAL 121 -11.495 -2.769 -4.865 960 HB VAL 121 HB VAL 121 -12.110 -4.922 -2.827 961 HG11 VAL 121 HG11 VAL 121 -14.114 -3.517 -2.920 962 HG12 VAL 121 HG12 VAL 121 -14.049 -3.488 -4.697 963 HG13 VAL 121 HG13 VAL 121 -14.393 -5.001 -3.830 964 HG21 VAL 121 HG21 VAL 121 -12.286 -4.841 -5.882 965 HG22 VAL 121 HG22 VAL 121 -10.968 -5.593 -4.969 966 HG23 VAL 121 HG23 VAL 121 -12.603 -6.247 -4.840 967 H SER 122 H SER 122 -10.958 -2.741 -1.298 968 HA SER 122 HA SER 122 -12.997 -0.791 -0.776 969 HB2 SER 122 HB2 SER 122 -11.834 -0.414 1.355 970 HB3 SER 122 HB3 SER 122 -12.070 -2.138 1.011 971 HG SER 122 HG SER 122 -9.986 -2.386 0.568 972 H LEU 123 H LEU 123 -9.612 -0.366 -1.856 973 HA LEU 123 HA LEU 123 -9.573 2.477 -1.541 974 HB2 LEU 123 HB2 LEU 123 -7.588 0.982 -1.561 975 HB3 LEU 123 HB3 LEU 123 -7.924 0.567 -3.245 976 HG LEU 123 HG LEU 123 -7.602 2.959 -3.843 977 HD11 LEU 123 HD11 LEU 123 -6.642 3.218 -0.966 978 HD12 LEU 123 HD12 LEU 123 -6.360 4.416 -2.244 979 HD13 LEU 123 HD13 LEU 123 -8.010 4.083 -1.705 980 HD21 LEU 123 HD21 LEU 123 -5.812 1.303 -4.102 981 HD22 LEU 123 HD22 LEU 123 -5.172 2.895 -3.681 982 HD23 LEU 123 HD23 LEU 123 -5.272 1.610 -2.443 983 H GLN 124 H GLN 124 -10.147 0.368 -4.445 984 HA GLN 124 HA GLN 124 -10.599 2.640 -6.157 985 HB2 GLN 124 HB2 GLN 124 -10.988 1.132 -7.881 986 HB3 GLN 124 HB3 GLN 124 -9.843 0.308 -6.823 987 HG2 GLN 124 HG2 GLN 124 -11.846 -0.884 -5.796 988 HG3 GLN 124 HG3 GLN 124 -12.818 -0.239 -7.119 989 HE21 GLN 124 HE21 GLN 124 -9.934 -3.083 -7.946 990 HE22 GLN 124 HE22 GLN 124 -9.776 -2.098 -6.496 991 H ASP 125 H ASP 125 -12.774 0.956 -3.987 992 HA ASP 125 HA ASP 125 -15.189 2.018 -5.222 993 HB2 ASP 125 HB2 ASP 125 -15.113 -0.173 -4.051 994 HB3 ASP 125 HB3 ASP 125 -14.772 0.665 -2.531 995 H HIS 126 H HIS 126 -12.754 3.496 -3.424 996 HA HIS 126 HA HIS 126 -14.629 5.660 -2.636 997 HB2 HIS 126 HB2 HIS 126 -12.712 5.185 -1.144 998 HB3 HIS 126 HB3 HIS 126 -11.599 5.627 -2.449 999 HD2 HIS 126 HD2 HIS 126 -11.518 8.263 -3.167 1000 HE1 HIS 126 HE1 HIS 126 -13.875 9.769 0.052 1001 HE2 HIS 126 HE2 HIS 126 -12.351 10.414 -1.874 1002 H PHE 127 H PHE 127 -12.289 4.852 -5.186 1003 HA PHE 127 HA PHE 127 -12.479 7.550 -6.318 1004 HB2 PHE 127 HB2 PHE 127 -10.861 5.091 -7.021 1005 HB3 PHE 127 HB3 PHE 127 -10.840 6.549 -7.996 1006 HD1 PHE 127 HD1 PHE 127 -10.437 8.831 -6.700 1007 HD2 PHE 127 HD2 PHE 127 -9.268 4.941 -5.261 1008 HE1 PHE 127 HE1 PHE 127 -8.599 9.868 -5.387 1009 HE2 PHE 127 HE2 PHE 127 -7.426 5.972 -3.965 1010 HZ PHE 127 HZ PHE 127 -7.089 8.435 -4.032 1011 H LYS 128 H LYS 128 -14.429 4.800 -6.850 1012 HA LYS 128 HA LYS 128 -14.714 4.756 -9.569 1013 HB2 LYS 128 HB2 LYS 128 -16.737 3.652 -9.406 1014 HB3 LYS 128 HB3 LYS 128 -15.776 3.163 -8.024 1015 HG2 LYS 128 HG2 LYS 128 -18.037 5.231 -7.930 1016 HG3 LYS 128 HG3 LYS 128 -18.210 3.509 -7.585 1017 HD2 LYS 128 HD2 LYS 128 -16.495 3.752 -5.765 1018 HD3 LYS 128 HD3 LYS 128 -16.505 5.500 -6.038 1019 HE2 LYS 128 HE2 LYS 128 -17.919 5.133 -4.210 1020 HE3 LYS 128 HE3 LYS 128 -18.963 5.516 -5.591 1021 HZ1 LYS 128 HZ1 LYS 128 -19.746 3.589 -4.240 1022 HZ2 LYS 128 HZ2 LYS 128 -19.463 3.146 -5.785 1023 HZ3 LYS 128 HZ3 LYS 128 -18.392 2.747 -4.616 1024 H TRP 129 H TRP 129 -15.997 7.352 -7.636 1025 HA TRP 129 HA TRP 129 -17.560 8.498 -9.867 1026 HB2 TRP 129 HB2 TRP 129 -18.151 10.234 -8.320 1027 HB3 TRP 129 HB3 TRP 129 -18.363 8.671 -7.549 1028 HD1 TRP 129 HD1 TRP 129 -16.366 7.954 -5.768 1029 HE1 TRP 129 HE1 TRP 129 -14.840 9.321 -4.289 1030 HE3 TRP 129 HE3 TRP 129 -17.190 12.575 -7.834 1031 HZ2 TRP 129 HZ2 TRP 129 -14.307 12.142 -3.787 1032 HZ3 TRP 129 HZ3 TRP 129 -16.229 14.601 -6.765 1033 HH2 TRP 129 HH2 TRP 129 -14.795 14.400 -4.743 1034 H VAL 130 H VAL 130 -14.308 8.751 -8.669 1035 HA VAL 130 HA VAL 130 -13.701 11.312 -10.014 1036 HB VAL 130 HB VAL 130 -11.798 9.391 -8.620 1037 HG11 VAL 130 HG11 VAL 130 -10.385 11.408 -8.348 1038 HG12 VAL 130 HG12 VAL 130 -10.653 11.042 -10.050 1039 HG13 VAL 130 HG13 VAL 130 -11.563 12.360 -9.278 1040 HG21 VAL 130 HG21 VAL 130 -13.439 10.058 -6.960 1041 HG22 VAL 130 HG22 VAL 130 -11.954 10.956 -6.667 1042 HG23 VAL 130 HG23 VAL 130 -13.325 11.760 -7.463 1043 H LYS 131 H LYS 131 -13.264 7.841 -10.494 1044 HA LYS 131 HA LYS 131 -11.551 8.184 -12.865 1045 HB2 LYS 131 HB2 LYS 131 -12.142 6.000 -10.909 1046 HB3 LYS 131 HB3 LYS 131 -11.828 5.451 -12.541 1047 HG2 LYS 131 HG2 LYS 131 -9.974 7.422 -11.160 1048 HG3 LYS 131 HG3 LYS 131 -9.807 5.671 -10.982 1049 HD2 LYS 131 HD2 LYS 131 -9.432 5.334 -13.324 1050 HD3 LYS 131 HD3 LYS 131 -9.920 6.985 -13.721 1051 HE2 LYS 131 HE2 LYS 131 -7.974 7.862 -12.448 1052 HE3 LYS 131 HE3 LYS 131 -7.426 6.199 -12.156 1053 HZ1 LYS 131 HZ1 LYS 131 -7.219 5.909 -14.551 1054 HZ2 LYS 131 HZ2 LYS 131 -7.857 7.382 -14.857 1055 HZ3 LYS 131 HZ3 LYS 131 -6.380 7.251 -14.139 1056 H GLN 132 H GLN 132 -14.149 9.187 -13.078 1057 HA GLN 132 HA GLN 132 -15.559 7.411 -14.943 1058 HB2 GLN 132 HB2 GLN 132 -16.124 10.232 -13.983 1059 HB3 GLN 132 HB3 GLN 132 -17.066 9.401 -15.228 1060 HG2 GLN 132 HG2 GLN 132 -16.686 8.380 -12.379 1061 HG3 GLN 132 HG3 GLN 132 -18.091 9.277 -12.938 1062 HE21 GLN 132 HE21 GLN 132 -18.282 5.353 -13.322 1063 HE22 GLN 132 HE22 GLN 132 -17.294 6.224 -12.145 1064 H GLU 133 H GLU 133 -14.179 7.103 -16.545 1065 HA GLU 133 HA GLU 133 -13.387 9.353 -18.364 1066 HB2 GLU 133 HB2 GLU 133 -11.640 7.003 -17.522 1067 HB3 GLU 133 HB3 GLU 133 -11.278 8.144 -18.820 1068 HG2 GLU 133 HG2 GLU 133 -11.376 10.014 -17.107 1069 HG3 GLU 133 HG3 GLU 133 -11.497 8.782 -15.848
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