NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
562770 | 2lvw | 18591 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H1 GLY 1 9.871 1.368 -19.339 2 H2 GLY 1 H2 GLY 1 9.419 1.351 -17.712 3 H3 GLY 1 H3 GLY 1 9.406 2.804 -18.577 4 HA2 GLY 1 HA3 GLY 1 7.175 1.990 -18.279 5 HA3 GLY 1 HA2 GLY 1 7.634 2.024 -19.978 6 H SER 2 H SER 2 6.770 0.067 -17.284 7 HA SER 2 HA SER 2 6.349 -2.072 -16.862 8 HB2 SER 2 HB2 SER 2 5.181 -3.415 -18.588 9 HB3 SER 2 HB3 SER 2 4.572 -1.761 -18.529 10 HG SER 2 HG SER 2 6.609 -2.353 -20.366 11 H MET 3 H MET 3 7.888 -3.414 -16.209 12 HA MET 3 HA MET 3 10.352 -3.814 -17.572 13 HB2 MET 3 HB2 MET 3 10.809 -5.522 -15.756 14 HB3 MET 3 HB3 MET 3 10.443 -3.901 -15.211 15 HG2 MET 3 HG2 MET 3 8.182 -4.592 -14.567 16 HG3 MET 3 HG3 MET 3 8.489 -6.218 -15.183 17 HE1 MET 3 HE1 MET 3 10.861 -4.442 -11.623 18 HE2 MET 3 HE2 MET 3 9.659 -3.519 -12.525 19 HE3 MET 3 HE3 MET 3 11.165 -4.008 -13.304 20 H GLN 4 H GLN 4 9.992 -4.635 -19.592 21 HA GLN 4 HA GLN 4 8.489 -7.043 -20.076 22 HB2 GLN 4 HB2 GLN 4 10.281 -5.435 -21.962 23 HB3 GLN 4 HB3 GLN 4 9.176 -6.720 -22.448 24 HG2 GLN 4 HG2 GLN 4 7.266 -5.341 -21.593 25 HG3 GLN 4 HG3 GLN 4 8.404 -4.048 -21.227 26 HE21 GLN 4 HE21 GLN 4 9.389 -2.929 -22.969 27 HE22 GLN 4 HE22 GLN 4 8.703 -2.945 -24.553 28 H ASN 5 H ASN 5 11.961 -6.182 -20.487 29 HA ASN 5 HA ASN 5 12.672 -9.036 -20.030 30 HB2 ASN 5 HB2 ASN 5 13.902 -7.076 -22.017 31 HB3 ASN 5 HB3 ASN 5 14.652 -8.610 -21.589 32 HD21 ASN 5 HD21 ASN 5 13.674 -10.549 -22.278 33 HD22 ASN 5 HD22 ASN 5 12.477 -10.585 -23.527 34 H THR 6 H THR 6 12.907 -5.972 -18.773 35 HA THR 6 HA THR 6 15.480 -6.490 -17.402 36 HB THR 6 HB THR 6 15.363 -4.297 -18.510 37 HG1 THR 6 HG1 THR 6 16.577 -3.917 -16.812 38 HG21 THR 6 HG21 THR 6 12.916 -3.926 -18.469 39 HG22 THR 6 HG22 THR 6 13.786 -2.545 -17.801 40 HG23 THR 6 HG23 THR 6 12.983 -3.684 -16.720 41 H THR 7 H THR 7 15.530 -5.903 -15.088 42 HA THR 7 HA THR 7 13.010 -6.472 -13.618 43 HB THR 7 HB THR 7 15.908 -6.872 -12.703 44 HG1 THR 7 HG1 THR 7 14.003 -8.772 -13.670 45 HG21 THR 7 HG21 THR 7 14.951 -8.265 -10.897 46 HG22 THR 7 HG22 THR 7 13.320 -7.881 -11.449 47 HG23 THR 7 HG23 THR 7 14.352 -6.609 -10.794 48 H HIS 8 H HIS 8 15.198 -4.031 -14.455 49 HA HIS 8 HA HIS 8 15.006 -2.546 -11.888 50 HB2 HIS 8 HB2 HIS 8 17.279 -3.290 -13.008 51 HB3 HIS 8 HB3 HIS 8 16.990 -1.970 -14.129 52 HD1 HIS 8 HD1 HIS 8 18.431 -2.730 -10.885 53 HD2 HIS 8 HD2 HIS 8 16.911 0.655 -12.751 54 HE1 HIS 8 HE1 HIS 8 19.318 -0.786 -9.572 55 HE2 HIS 8 HE2 HIS 8 18.422 1.254 -10.746 56 H ASP 9 H ASP 9 12.979 -2.644 -14.178 57 HA ASP 9 HA ASP 9 12.961 -0.102 -15.521 58 HB2 ASP 9 HB2 ASP 9 11.727 -2.230 -16.220 59 HB3 ASP 9 HB3 ASP 9 10.569 -1.892 -14.948 60 H ASN 10 H ASN 10 11.649 -1.332 -12.513 61 HA ASN 10 HA ASN 10 10.184 1.059 -11.832 62 HB2 ASN 10 HB2 ASN 10 9.727 -0.111 -9.672 63 HB3 ASN 10 HB3 ASN 10 9.290 -1.073 -11.077 64 HD21 ASN 10 HD21 ASN 10 9.325 -2.915 -9.747 65 HD22 ASN 10 HD22 ASN 10 10.798 -3.677 -9.290 66 H VAL 11 H VAL 11 10.560 1.950 -9.567 67 HA VAL 11 HA VAL 11 13.377 2.249 -8.816 68 HB VAL 11 HB VAL 11 13.082 4.691 -8.421 69 HG11 VAL 11 HG11 VAL 11 14.087 3.984 -10.553 70 HG12 VAL 11 HG12 VAL 11 13.165 5.472 -10.765 71 HG13 VAL 11 HG13 VAL 11 12.493 3.933 -11.313 72 HG21 VAL 11 HG21 VAL 11 11.157 5.957 -9.314 73 HG22 VAL 11 HG22 VAL 11 10.610 4.779 -8.119 74 HG23 VAL 11 HG23 VAL 11 10.389 4.458 -9.839 75 H ILE 12 H ILE 12 13.663 2.526 -6.606 76 HA ILE 12 HA ILE 12 11.428 1.590 -4.935 77 HB ILE 12 HB ILE 12 14.398 1.770 -4.212 78 HG12 ILE 12 HG12 ILE 12 14.098 0.214 -6.113 79 HG13 ILE 12 HG13 ILE 12 14.569 -0.653 -4.662 80 HG21 ILE 12 HG21 ILE 12 12.138 0.252 -2.849 81 HG22 ILE 12 HG22 ILE 12 12.930 1.707 -2.244 82 HG23 ILE 12 HG23 ILE 12 13.842 0.206 -2.380 83 HD11 ILE 12 HD11 ILE 12 12.919 -1.893 -5.903 84 HD12 ILE 12 HD12 ILE 12 11.801 -0.530 -5.862 85 HD13 ILE 12 HD13 ILE 12 12.229 -1.368 -4.367 86 H LEU 13 H LEU 13 10.285 3.408 -4.456 87 HA LEU 13 HA LEU 13 11.643 5.817 -3.418 88 HB2 LEU 13 HB2 LEU 13 8.717 5.405 -4.133 89 HB3 LEU 13 HB3 LEU 13 9.493 6.934 -3.727 90 HG LEU 13 HG LEU 13 10.010 5.255 -6.203 91 HD11 LEU 13 HD11 LEU 13 7.855 6.429 -6.207 92 HD12 LEU 13 HD12 LEU 13 8.961 7.060 -7.418 93 HD13 LEU 13 HD13 LEU 13 8.688 7.964 -5.928 94 HD21 LEU 13 HD21 LEU 13 12.103 6.335 -5.514 95 HD22 LEU 13 HD22 LEU 13 11.292 7.899 -5.406 96 HD23 LEU 13 HD23 LEU 13 11.470 7.100 -6.969 97 H GLU 14 H GLU 14 12.105 5.364 -1.302 98 HA GLU 14 HA GLU 14 10.020 4.215 0.412 99 HB2 GLU 14 HB2 GLU 14 11.757 4.198 2.164 100 HB3 GLU 14 HB3 GLU 14 12.214 3.310 0.726 101 HG2 GLU 14 HG2 GLU 14 13.802 4.948 0.062 102 HG3 GLU 14 HG3 GLU 14 13.164 6.136 1.203 103 H LEU 15 H LEU 15 9.023 5.287 2.028 104 HA LEU 15 HA LEU 15 9.935 7.862 2.947 105 HB2 LEU 15 HB2 LEU 15 7.441 8.743 2.729 106 HB3 LEU 15 HB3 LEU 15 8.583 8.913 1.414 107 HG LEU 15 HG LEU 15 7.545 6.740 0.455 108 HD11 LEU 15 HD11 LEU 15 5.281 7.450 2.333 109 HD12 LEU 15 HD12 LEU 15 6.283 5.998 2.402 110 HD13 LEU 15 HD13 LEU 15 5.222 6.266 1.024 111 HD21 LEU 15 HD21 LEU 15 5.773 7.981 -0.705 112 HD22 LEU 15 HD22 LEU 15 7.251 8.931 -0.591 113 HD23 LEU 15 HD23 LEU 15 5.892 9.287 0.479 114 H THR 16 H THR 16 9.864 7.835 5.052 115 HA THR 16 HA THR 16 8.271 5.867 6.522 116 HB THR 16 HB THR 16 10.288 7.923 7.570 117 HG1 THR 16 HG1 THR 16 11.734 6.480 7.006 118 HG21 THR 16 HG21 THR 16 10.244 6.583 9.654 119 HG22 THR 16 HG22 THR 16 9.025 5.515 8.958 120 HG23 THR 16 HG23 THR 16 8.626 7.202 9.296 121 H VAL 17 H VAL 17 6.189 6.535 6.556 122 HA VAL 17 HA VAL 17 5.571 9.308 7.362 123 HB VAL 17 HB VAL 17 3.377 9.044 6.538 124 HG11 VAL 17 HG11 VAL 17 3.655 8.358 4.170 125 HG12 VAL 17 HG12 VAL 17 5.189 7.582 4.584 126 HG13 VAL 17 HG13 VAL 17 5.013 9.334 4.740 127 HG21 VAL 17 HG21 VAL 17 2.746 6.870 7.460 128 HG22 VAL 17 HG22 VAL 17 3.810 6.039 6.328 129 HG23 VAL 17 HG23 VAL 17 2.382 6.888 5.732 130 H ARG 18 H ARG 18 4.235 9.681 9.205 131 HA ARG 18 HA ARG 18 3.862 7.359 10.991 132 HB2 ARG 18 HB2 ARG 18 3.480 8.996 12.789 133 HB3 ARG 18 HB3 ARG 18 5.072 9.133 12.061 134 HG2 ARG 18 HG2 ARG 18 4.307 11.139 10.801 135 HG3 ARG 18 HG3 ARG 18 2.719 11.001 11.573 136 HD2 ARG 18 HD2 ARG 18 5.385 11.567 12.919 137 HD3 ARG 18 HD3 ARG 18 3.993 12.647 12.806 138 HE ARG 18 HE ARG 18 3.027 10.429 14.105 139 HH11 ARG 18 HH11 ARG 18 5.640 12.690 14.779 140 HH12 ARG 18 HH12 ARG 18 5.548 12.463 16.495 141 HH21 ARG 18 HH21 ARG 18 2.987 10.054 16.335 142 HH22 ARG 18 HH22 ARG 18 4.036 10.960 17.381 143 H ASN 19 H ASN 19 1.807 7.018 11.940 144 HA ASN 19 HA ASN 19 -0.127 7.032 9.825 145 HB2 ASN 19 HB2 ASN 19 -0.158 5.770 12.596 146 HB3 ASN 19 HB3 ASN 19 -1.472 5.576 11.435 147 HD21 ASN 19 HD21 ASN 19 -1.205 3.343 11.237 148 HD22 ASN 19 HD22 ASN 19 0.154 2.621 10.452 149 H HIS 20 H HIS 20 -0.484 9.382 9.812 150 HA HIS 20 HA HIS 20 -2.577 10.326 11.629 151 HB2 HIS 20 HB2 HIS 20 -1.578 11.574 9.018 152 HB3 HIS 20 HB3 HIS 20 -2.631 12.348 10.192 153 HD1 HIS 20 HD1 HIS 20 0.163 13.463 9.187 154 HD2 HIS 20 HD2 HIS 20 -0.513 11.478 12.777 155 HE1 HIS 20 HE1 HIS 20 2.014 14.198 10.718 156 HE2 HIS 20 HE2 HIS 20 1.481 13.125 12.934 157 HA PRO 21 HA PRO 21 -6.084 8.528 9.500 158 HB2 PRO 21 HB2 PRO 21 -7.167 11.336 9.158 159 HB3 PRO 21 HB3 PRO 21 -7.970 9.885 9.800 160 HG2 PRO 21 HG2 PRO 21 -7.113 11.748 11.461 161 HG3 PRO 21 HG3 PRO 21 -6.891 10.028 11.863 162 HD2 PRO 21 HD2 PRO 21 -4.871 12.013 10.864 163 HD3 PRO 21 HD3 PRO 21 -4.677 10.700 12.046 164 H GLY 22 H GLY 22 -5.255 7.735 7.569 165 HA2 GLY 22 HA2 GLY 22 -5.576 7.364 5.315 166 HA3 GLY 22 HA3 GLY 22 -6.355 8.927 5.185 167 H VAL 23 H VAL 23 -3.068 8.054 6.223 168 HA VAL 23 HA VAL 23 -1.899 9.963 4.354 169 HB VAL 23 HB VAL 23 0.254 9.467 5.441 170 HG11 VAL 23 HG11 VAL 23 -1.190 11.196 6.359 171 HG12 VAL 23 HG12 VAL 23 -0.359 10.369 7.676 172 HG13 VAL 23 HG13 VAL 23 -2.055 10.011 7.343 173 HG21 VAL 23 HG21 VAL 23 -1.287 7.477 7.169 174 HG22 VAL 23 HG22 VAL 23 0.384 7.996 7.427 175 HG23 VAL 23 HG23 VAL 23 -0.042 7.072 5.983 176 H MET 24 H MET 24 -2.272 6.505 4.594 177 HA MET 24 HA MET 24 -0.521 5.672 2.533 178 HB2 MET 24 HB2 MET 24 -3.207 4.462 3.321 179 HB3 MET 24 HB3 MET 24 -1.961 3.658 2.374 180 HG2 MET 24 HG2 MET 24 -1.867 2.790 4.593 181 HG3 MET 24 HG3 MET 24 -0.446 3.816 4.379 182 HE1 MET 24 HE1 MET 24 -1.157 4.476 8.146 183 HE2 MET 24 HE2 MET 24 0.062 4.090 6.933 184 HE3 MET 24 HE3 MET 24 -1.231 2.939 7.283 185 H THR 25 H THR 25 -3.705 7.114 2.531 186 HA THR 25 HA THR 25 -4.453 6.724 -0.167 187 HB THR 25 HB THR 25 -5.324 9.058 1.595 188 HG1 THR 25 HG1 THR 25 -7.036 7.290 2.072 189 HG21 THR 25 HG21 THR 25 -6.819 7.436 -0.515 190 HG22 THR 25 HG22 THR 25 -6.219 9.083 -0.725 191 HG23 THR 25 HG23 THR 25 -7.499 8.755 0.442 192 H HIS 26 H HIS 26 -2.342 9.056 1.394 193 HA HIS 26 HA HIS 26 -2.304 11.094 -0.582 194 HB2 HIS 26 HB2 HIS 26 -0.096 10.335 1.382 195 HB3 HIS 26 HB3 HIS 26 -0.152 11.828 0.448 196 HD1 HIS 26 HD1 HIS 26 -0.070 11.790 3.587 197 HD2 HIS 26 HD2 HIS 26 -3.534 12.150 1.300 198 HE1 HIS 26 HE1 HIS 26 -1.771 12.890 5.080 199 HE2 HIS 26 HE2 HIS 26 -3.802 13.223 3.641 200 H VAL 27 H VAL 27 0.006 8.405 0.028 201 HA VAL 27 HA VAL 27 1.656 8.926 -2.214 202 HB VAL 27 HB VAL 27 2.720 6.753 -1.832 203 HG11 VAL 27 HG11 VAL 27 3.335 8.570 -0.323 204 HG12 VAL 27 HG12 VAL 27 3.392 7.030 0.530 205 HG13 VAL 27 HG13 VAL 27 2.036 8.130 0.791 206 HG21 VAL 27 HG21 VAL 27 1.913 5.128 -0.142 207 HG22 VAL 27 HG22 VAL 27 0.737 5.328 -1.439 208 HG23 VAL 27 HG23 VAL 27 0.463 6.107 0.119 209 H CYS 28 H CYS 28 -1.079 6.701 -1.777 210 HA CYS 28 HA CYS 28 -1.033 5.443 -4.305 211 HB2 CYS 28 HB2 CYS 28 -3.330 5.924 -2.380 212 HB3 CYS 28 HB3 CYS 28 -3.391 4.825 -3.759 213 HG CYS 28 HG CYS 28 -3.070 3.092 -1.770 214 H GLY 29 H GLY 29 -2.446 8.469 -3.185 215 HA2 GLY 29 HA2 GLY 29 -4.108 9.062 -5.429 216 HA3 GLY 29 HA3 GLY 29 -3.549 10.197 -4.212 217 H LEU 30 H LEU 30 -0.756 9.902 -4.595 218 HA LEU 30 HA LEU 30 -0.322 11.767 -6.698 219 HB2 LEU 30 HB2 LEU 30 1.429 10.398 -4.695 220 HB3 LEU 30 HB3 LEU 30 2.240 10.989 -6.130 221 HG LEU 30 HG LEU 30 2.391 12.655 -4.355 222 HD11 LEU 30 HD11 LEU 30 1.546 14.628 -5.529 223 HD12 LEU 30 HD12 LEU 30 0.507 13.615 -6.534 224 HD13 LEU 30 HD13 LEU 30 2.261 13.484 -6.664 225 HD21 LEU 30 HD21 LEU 30 0.383 12.064 -3.061 226 HD22 LEU 30 HD22 LEU 30 -0.649 12.736 -4.326 227 HD23 LEU 30 HD23 LEU 30 0.435 13.790 -3.413 228 H PHE 31 H PHE 31 0.512 8.308 -6.420 229 HA PHE 31 HA PHE 31 1.703 8.180 -9.043 230 HB2 PHE 31 HB2 PHE 31 0.860 5.935 -7.168 231 HB3 PHE 31 HB3 PHE 31 1.805 5.714 -8.645 232 HD1 PHE 31 HD2 PHE 31 3.955 7.366 -8.806 233 HD2 PHE 31 HD1 PHE 31 2.108 6.099 -5.164 234 HE1 PHE 31 HE2 PHE 31 6.018 7.880 -7.574 235 HE2 PHE 31 HE1 PHE 31 4.164 6.629 -3.940 236 HZ PHE 31 HZ PHE 31 6.126 7.518 -5.136 237 H ALA 32 H ALA 32 -1.512 7.659 -7.795 238 HA ALA 32 HA ALA 32 -2.772 6.408 -9.977 239 HB1 ALA 32 HB1 ALA 32 -4.859 7.415 -9.115 240 HB2 ALA 32 HB2 ALA 32 -3.918 8.489 -8.075 241 HB3 ALA 32 HB3 ALA 32 -3.884 6.747 -7.803 242 H ARG 33 H ARG 33 -2.505 9.891 -9.210 243 HA ARG 33 HA ARG 33 -3.687 10.788 -11.695 244 HB2 ARG 33 HB2 ARG 33 -3.408 13.029 -10.793 245 HB3 ARG 33 HB3 ARG 33 -3.986 11.972 -9.509 246 HG2 ARG 33 HG2 ARG 33 -1.585 11.787 -8.701 247 HG3 ARG 33 HG3 ARG 33 -1.164 13.030 -9.881 248 HD2 ARG 33 HD2 ARG 33 -3.107 13.339 -7.565 249 HD3 ARG 33 HD3 ARG 33 -1.478 14.014 -7.662 250 HE ARG 33 HE ARG 33 -2.483 15.171 -9.772 251 HH11 ARG 33 HH11 ARG 33 -4.147 14.695 -6.716 252 HH12 ARG 33 HH12 ARG 33 -5.137 16.106 -6.900 253 HH21 ARG 33 HH21 ARG 33 -3.780 17.011 -9.995 254 HH22 ARG 33 HH22 ARG 33 -4.928 17.420 -8.761 255 H ARG 34 H ARG 34 -0.644 9.664 -10.996 256 HA ARG 34 HA ARG 34 1.036 11.571 -12.246 257 HB2 ARG 34 HB2 ARG 34 1.739 9.952 -10.467 258 HB3 ARG 34 HB3 ARG 34 1.577 8.634 -11.609 259 HG2 ARG 34 HG2 ARG 34 3.449 10.911 -12.256 260 HG3 ARG 34 HG3 ARG 34 3.936 9.714 -11.056 261 HD2 ARG 34 HD2 ARG 34 3.120 9.092 -13.912 262 HD3 ARG 34 HD3 ARG 34 4.775 9.162 -13.300 263 HE ARG 34 HE ARG 34 3.154 7.333 -11.804 264 HH11 ARG 34 HH11 ARG 34 5.001 7.601 -14.768 265 HH12 ARG 34 HH12 ARG 34 5.300 5.898 -14.876 266 HH21 ARG 34 HH21 ARG 34 3.528 5.113 -11.985 267 HH22 ARG 34 HH22 ARG 34 4.467 4.495 -13.303 268 H ALA 35 H ALA 35 0.271 8.230 -13.255 269 HA ALA 35 HA ALA 35 -0.550 8.738 -15.880 270 HB1 ALA 35 HB1 ALA 35 1.747 9.559 -16.282 271 HB2 ALA 35 HB2 ALA 35 1.452 8.084 -17.200 272 HB3 ALA 35 HB3 ALA 35 2.412 8.024 -15.717 273 H PHE 36 H PHE 36 1.625 6.554 -14.142 274 HA PHE 36 HA PHE 36 -0.060 4.219 -14.834 275 HB2 PHE 36 HB2 PHE 36 2.078 4.253 -16.119 276 HB3 PHE 36 HB3 PHE 36 2.989 4.384 -14.624 277 HD1 PHE 36 HD1 PHE 36 0.820 2.111 -16.628 278 HD2 PHE 36 HD2 PHE 36 3.569 2.410 -13.369 279 HE1 PHE 36 HE1 PHE 36 0.992 -0.340 -16.545 280 HE2 PHE 36 HE2 PHE 36 3.735 -0.038 -13.287 281 HZ PHE 36 HZ PHE 36 2.448 -1.421 -14.874 282 H ASN 37 H ASN 37 -0.208 2.631 -13.175 283 HA ASN 37 HA ASN 37 -0.391 3.752 -10.519 284 HB2 ASN 37 HB2 ASN 37 -0.929 0.931 -11.558 285 HB3 ASN 37 HB3 ASN 37 -1.376 1.514 -9.956 286 HD21 ASN 37 HD21 ASN 37 -2.841 0.632 -12.522 287 HD22 ASN 37 HD22 ASN 37 -4.067 1.826 -12.701 288 H VAL 38 H VAL 38 0.266 2.145 -8.630 289 HA VAL 38 HA VAL 38 3.141 1.800 -8.710 290 HB VAL 38 HB VAL 38 1.245 0.912 -6.467 291 HG11 VAL 38 HG11 VAL 38 4.232 1.525 -6.463 292 HG12 VAL 38 HG12 VAL 38 3.492 -0.071 -6.328 293 HG13 VAL 38 HG13 VAL 38 3.273 1.111 -5.038 294 HG21 VAL 38 HG21 VAL 38 0.910 3.312 -6.912 295 HG22 VAL 38 HG22 VAL 38 2.646 3.597 -6.770 296 HG23 VAL 38 HG23 VAL 38 1.719 3.068 -5.363 297 H GLU 39 H GLU 39 4.209 -0.088 -8.956 298 HA GLU 39 HA GLU 39 2.936 -2.458 -9.929 299 HB2 GLU 39 HB2 GLU 39 5.136 -1.694 -10.739 300 HB3 GLU 39 HB3 GLU 39 5.805 -1.833 -9.116 301 HG2 GLU 39 HG2 GLU 39 5.223 -4.337 -9.278 302 HG3 GLU 39 HG3 GLU 39 4.981 -4.048 -11.002 303 H GLY 40 H GLY 40 4.883 -1.668 -7.032 304 HA2 GLY 40 HA2 GLY 40 3.474 -3.728 -5.444 305 HA3 GLY 40 HA3 GLY 40 5.225 -3.819 -5.584 306 H ILE 41 H ILE 41 3.314 -3.272 -3.284 307 HA ILE 41 HA ILE 41 4.550 -0.765 -2.259 308 HB ILE 41 HB ILE 41 1.728 -1.791 -1.616 309 HG12 ILE 41 HG12 ILE 41 2.525 0.700 -3.204 310 HG13 ILE 41 HG13 ILE 41 1.873 -0.779 -3.899 311 HG21 ILE 41 HG21 ILE 41 1.421 0.276 -0.305 312 HG22 ILE 41 HG22 ILE 41 3.082 0.761 -0.649 313 HG23 ILE 41 HG23 ILE 41 2.766 -0.673 0.329 314 HD11 ILE 41 HD11 ILE 41 0.435 1.094 -2.025 315 HD12 ILE 41 HD12 ILE 41 -0.228 -0.409 -2.672 316 HD13 ILE 41 HD13 ILE 41 0.172 0.922 -3.758 317 H LEU 42 H LEU 42 5.506 -0.959 -0.293 318 HA LEU 42 HA LEU 42 4.966 -3.333 1.383 319 HB2 LEU 42 HB2 LEU 42 7.076 -3.694 0.118 320 HB3 LEU 42 HB3 LEU 42 7.718 -2.188 0.759 321 HG LEU 42 HG LEU 42 7.620 -3.136 3.060 322 HD11 LEU 42 HD11 LEU 42 6.767 -5.715 1.712 323 HD12 LEU 42 HD12 LEU 42 5.791 -4.726 2.803 324 HD13 LEU 42 HD13 LEU 42 7.234 -5.536 3.406 325 HD21 LEU 42 HD21 LEU 42 9.700 -3.288 1.784 326 HD22 LEU 42 HD22 LEU 42 9.194 -4.839 1.106 327 HD23 LEU 42 HD23 LEU 42 9.500 -4.685 2.838 328 H CYS 43 H CYS 43 3.659 -2.037 2.664 329 HA CYS 43 HA CYS 43 4.811 0.228 4.121 330 HB2 CYS 43 HB2 CYS 43 2.460 0.327 3.336 331 HB3 CYS 43 HB3 CYS 43 2.071 -1.087 4.305 332 HG CYS 43 HG CYS 43 3.307 1.653 5.861 333 H LEU 44 H LEU 44 6.392 -0.639 5.381 334 HA LEU 44 HA LEU 44 5.995 -3.055 6.983 335 HB2 LEU 44 HB2 LEU 44 8.127 -2.433 5.631 336 HB3 LEU 44 HB3 LEU 44 8.449 -1.260 6.889 337 HG LEU 44 HG LEU 44 8.345 -3.318 8.517 338 HD11 LEU 44 HD11 LEU 44 7.424 -4.951 6.932 339 HD12 LEU 44 HD12 LEU 44 9.002 -5.466 7.521 340 HD13 LEU 44 HD13 LEU 44 8.853 -4.778 5.900 341 HD21 LEU 44 HD21 LEU 44 10.686 -2.996 6.599 342 HD22 LEU 44 HD22 LEU 44 10.742 -3.778 8.181 343 HD23 LEU 44 HD23 LEU 44 10.404 -2.054 8.068 344 HA PRO 45 HA PRO 45 4.538 -0.111 10.179 345 HB2 PRO 45 HB2 PRO 45 3.892 -2.013 12.105 346 HB3 PRO 45 HB3 PRO 45 2.842 -1.595 10.737 347 HG2 PRO 45 HG2 PRO 45 4.719 -3.914 11.030 348 HG3 PRO 45 HG3 PRO 45 3.066 -3.869 10.367 349 HD2 PRO 45 HD2 PRO 45 5.237 -3.906 8.750 350 HD3 PRO 45 HD3 PRO 45 3.762 -3.020 8.314 351 H ILE 46 H ILE 46 6.093 1.042 11.155 352 HA ILE 46 HA ILE 46 8.441 -0.082 12.384 353 HB ILE 46 HB ILE 46 7.353 2.774 12.521 354 HG12 ILE 46 HG12 ILE 46 7.825 2.126 10.181 355 HG13 ILE 46 HG13 ILE 46 9.002 3.310 10.728 356 HG21 ILE 46 HG21 ILE 46 9.657 3.433 13.157 357 HG22 ILE 46 HG22 ILE 46 10.123 1.731 13.215 358 HG23 ILE 46 HG23 ILE 46 8.922 2.358 14.348 359 HD11 ILE 46 HD11 ILE 46 9.463 0.333 10.444 360 HD12 ILE 46 HD12 ILE 46 10.651 1.495 11.038 361 HD13 ILE 46 HD13 ILE 46 10.066 1.603 9.379 362 H GLN 47 H GLN 47 8.065 -1.310 14.120 363 HA GLN 47 HA GLN 47 5.803 -1.211 15.798 364 HB2 GLN 47 HB2 GLN 47 6.884 -2.981 17.079 365 HB3 GLN 47 HB3 GLN 47 7.151 -3.244 15.363 366 HG2 GLN 47 HG2 GLN 47 9.436 -2.391 15.543 367 HG3 GLN 47 HG3 GLN 47 9.184 -2.022 17.248 368 HE21 GLN 47 HE21 GLN 47 11.214 -3.697 16.104 369 HE22 GLN 47 HE22 GLN 47 11.021 -5.274 16.779 370 H ASP 48 H ASP 48 8.681 0.650 15.977 371 HA ASP 48 HA ASP 48 8.978 0.806 18.801 372 HB2 ASP 48 HB2 ASP 48 10.963 1.813 18.290 373 HB3 ASP 48 HB3 ASP 48 10.576 1.519 16.606 374 H SER 49 H SER 49 7.183 2.662 16.451 375 HA SER 49 HA SER 49 5.804 4.232 18.502 376 HB2 SER 49 HB2 SER 49 7.394 5.471 16.201 377 HB3 SER 49 HB3 SER 49 6.218 6.361 17.163 378 HG SER 49 HG SER 49 8.492 5.049 18.251 379 H ASP 50 H ASP 50 4.257 5.815 17.061 380 HA ASP 50 HA ASP 50 2.622 4.117 15.348 381 HB2 ASP 50 HB2 ASP 50 1.082 6.113 15.287 382 HB3 ASP 50 HB3 ASP 50 1.411 5.522 16.907 383 H LYS 51 H LYS 51 4.379 3.851 13.824 384 HA LYS 51 HA LYS 51 4.293 5.772 11.618 385 HB2 LYS 51 HB2 LYS 51 6.939 4.708 12.740 386 HB3 LYS 51 HB3 LYS 51 6.765 5.612 11.243 387 HG2 LYS 51 HG2 LYS 51 5.845 7.520 12.731 388 HG3 LYS 51 HG3 LYS 51 6.515 6.611 14.087 389 HD2 LYS 51 HD2 LYS 51 8.062 7.663 11.678 390 HD3 LYS 51 HD3 LYS 51 8.104 8.335 13.305 391 HE2 LYS 51 HE2 LYS 51 9.068 5.563 12.531 392 HE3 LYS 51 HE3 LYS 51 10.100 6.967 12.789 393 HZ1 LYS 51 HZ1 LYS 51 9.378 7.048 15.077 394 HZ2 LYS 51 HZ2 LYS 51 10.023 5.523 14.721 395 HZ3 LYS 51 HZ3 LYS 51 8.355 5.726 14.840 396 H SER 52 H SER 52 5.197 4.826 9.650 397 HA SER 52 HA SER 52 5.832 2.029 9.494 398 HB2 SER 52 HB2 SER 52 3.303 2.090 9.363 399 HB3 SER 52 HB3 SER 52 3.442 3.080 7.905 400 HG SER 52 HG SER 52 3.376 0.531 7.930 401 H HIS 53 H HIS 53 7.232 1.685 7.816 402 HA HIS 53 HA HIS 53 7.981 4.009 6.128 403 HB2 HIS 53 HB2 HIS 53 9.681 2.928 7.693 404 HB3 HIS 53 HB3 HIS 53 9.573 1.461 6.729 405 HD1 HIS 53 HD1 HIS 53 12.267 2.193 6.715 406 HD2 HIS 53 HD2 HIS 53 9.679 4.333 4.273 407 HE1 HIS 53 HE1 HIS 53 13.732 3.407 5.082 408 HE2 HIS 53 HE2 HIS 53 12.162 4.864 3.780 409 H ILE 54 H ILE 54 7.140 3.911 4.101 410 HA ILE 54 HA ILE 54 6.345 1.302 2.981 411 HB ILE 54 HB ILE 54 5.409 4.047 2.005 412 HG12 ILE 54 HG12 ILE 54 3.147 3.323 3.077 413 HG13 ILE 54 HG13 ILE 54 4.084 2.174 4.020 414 HG21 ILE 54 HG21 ILE 54 4.359 1.252 1.413 415 HG22 ILE 54 HG22 ILE 54 5.282 2.278 0.313 416 HG23 ILE 54 HG23 ILE 54 3.664 2.763 0.812 417 HD11 ILE 54 HD11 ILE 54 3.579 4.187 5.265 418 HD12 ILE 54 HD12 ILE 54 4.399 5.170 4.053 419 HD13 ILE 54 HD13 ILE 54 5.319 4.022 5.030 420 H TRP 55 H TRP 55 7.448 0.496 1.270 421 HA TRP 55 HA TRP 55 9.113 2.282 -0.412 422 HB2 TRP 55 HB2 TRP 55 9.118 -0.754 -0.094 423 HB3 TRP 55 HB3 TRP 55 10.097 0.115 -1.278 424 HD1 TRP 55 HD1 TRP 55 12.275 1.378 -0.367 425 HE1 TRP 55 HE1 TRP 55 13.536 1.329 1.869 426 HE3 TRP 55 HE3 TRP 55 8.780 -0.996 2.470 427 HZ2 TRP 55 HZ2 TRP 55 13.118 0.372 4.491 428 HZ3 TRP 55 HZ3 TRP 55 9.298 -1.449 4.813 429 HH2 TRP 55 HH2 TRP 55 11.415 -0.782 5.821 430 H LEU 56 H LEU 56 8.190 2.942 -2.206 431 HA LEU 56 HA LEU 56 5.962 1.504 -3.464 432 HB2 LEU 56 HB2 LEU 56 6.965 4.359 -3.872 433 HB3 LEU 56 HB3 LEU 56 5.655 3.633 -4.784 434 HG LEU 56 HG LEU 56 4.637 5.036 -3.165 435 HD11 LEU 56 HD11 LEU 56 3.484 2.895 -3.442 436 HD12 LEU 56 HD12 LEU 56 3.262 3.527 -1.814 437 HD13 LEU 56 HD13 LEU 56 4.398 2.207 -2.095 438 HD21 LEU 56 HD21 LEU 56 5.055 4.964 -0.742 439 HD22 LEU 56 HD22 LEU 56 6.512 5.387 -1.637 440 HD23 LEU 56 HD23 LEU 56 6.321 3.757 -0.986 441 H LEU 57 H LEU 57 6.656 0.094 -4.895 442 HA LEU 57 HA LEU 57 8.937 0.484 -6.673 443 HB2 LEU 57 HB2 LEU 57 6.930 -1.758 -6.225 444 HB3 LEU 57 HB3 LEU 57 7.971 -1.767 -7.638 445 HG LEU 57 HG LEU 57 9.956 -2.019 -6.280 446 HD11 LEU 57 HD11 LEU 57 9.446 -0.611 -4.359 447 HD12 LEU 57 HD12 LEU 57 9.913 -2.219 -3.819 448 HD13 LEU 57 HD13 LEU 57 8.210 -1.749 -3.803 449 HD21 LEU 57 HD21 LEU 57 9.505 -4.226 -5.271 450 HD22 LEU 57 HD22 LEU 57 8.720 -4.057 -6.839 451 HD23 LEU 57 HD23 LEU 57 7.767 -3.918 -5.358 452 H VAL 58 H VAL 58 8.493 1.993 -8.191 453 HA VAL 58 HA VAL 58 6.160 1.600 -9.950 454 HB VAL 58 HB VAL 58 5.575 3.325 -8.156 455 HG11 VAL 58 HG11 VAL 58 6.525 5.592 -8.289 456 HG12 VAL 58 HG12 VAL 58 7.680 5.043 -9.505 457 HG13 VAL 58 HG13 VAL 58 7.750 4.394 -7.865 458 HG21 VAL 58 HG21 VAL 58 4.351 3.295 -10.274 459 HG22 VAL 58 HG22 VAL 58 5.569 4.325 -11.029 460 HG23 VAL 58 HG23 VAL 58 4.560 4.959 -9.725 461 H ASN 59 H ASN 59 6.580 2.376 -12.100 462 HA ASN 59 HA ASN 59 9.386 2.447 -12.768 463 HB2 ASN 59 HB2 ASN 59 8.656 2.527 -15.107 464 HB3 ASN 59 HB3 ASN 59 7.807 1.267 -14.225 465 HD21 ASN 59 HD21 ASN 59 7.027 2.488 -16.688 466 HD22 ASN 59 HD22 ASN 59 5.472 3.187 -16.443 467 H ASP 60 H ASP 60 10.584 4.168 -13.530 468 HA ASP 60 HA ASP 60 10.027 6.744 -12.482 469 HB2 ASP 60 HB2 ASP 60 12.328 6.049 -12.680 470 HB3 ASP 60 HB3 ASP 60 12.163 5.738 -14.402 471 H ASP 61 H ASP 61 9.653 8.711 -13.557 472 HA ASP 61 HA ASP 61 8.561 8.719 -16.271 473 HB2 ASP 61 HB2 ASP 61 6.732 8.031 -14.698 474 HB3 ASP 61 HB3 ASP 61 6.981 9.493 -13.766 475 H GLN 62 H GLN 62 8.006 11.010 -16.882 476 HA GLN 62 HA GLN 62 10.090 12.846 -16.290 477 HB2 GLN 62 HB2 GLN 62 7.432 13.322 -17.700 478 HB3 GLN 62 HB3 GLN 62 8.815 14.419 -17.739 479 HG2 GLN 62 HG2 GLN 62 10.155 12.727 -18.910 480 HG3 GLN 62 HG3 GLN 62 8.823 11.579 -18.817 481 HE21 GLN 62 HE21 GLN 62 6.766 13.575 -19.467 482 HE22 GLN 62 HE22 GLN 62 6.947 13.908 -21.147 483 H ARG 63 H ARG 63 6.768 12.570 -15.188 484 HA ARG 63 HA ARG 63 6.775 15.030 -13.626 485 HB2 ARG 63 HB2 ARG 63 4.689 12.872 -14.051 486 HB3 ARG 63 HB3 ARG 63 4.475 14.111 -12.820 487 HG2 ARG 63 HG2 ARG 63 3.236 14.729 -14.798 488 HG3 ARG 63 HG3 ARG 63 4.564 15.865 -14.574 489 HD2 ARG 63 HD2 ARG 63 4.251 15.231 -16.947 490 HD3 ARG 63 HD3 ARG 63 5.843 14.776 -16.333 491 HE ARG 63 HE ARG 63 4.434 12.527 -15.940 492 HH11 ARG 63 HH11 ARG 63 4.779 14.487 -18.829 493 HH12 ARG 63 HH12 ARG 63 4.578 13.138 -19.898 494 HH21 ARG 63 HH21 ARG 63 4.252 10.781 -17.324 495 HH22 ARG 63 HH22 ARG 63 4.281 11.030 -19.043 496 H LEU 64 H LEU 64 7.599 11.749 -13.171 497 HA LEU 64 HA LEU 64 6.674 10.869 -10.801 498 HB2 LEU 64 HB2 LEU 64 8.423 9.916 -12.606 499 HB3 LEU 64 HB3 LEU 64 9.581 10.324 -11.365 500 HG LEU 64 HG LEU 64 8.958 7.943 -11.314 501 HD11 LEU 64 HD11 LEU 64 8.469 7.684 -8.963 502 HD12 LEU 64 HD12 LEU 64 7.967 9.373 -8.852 503 HD13 LEU 64 HD13 LEU 64 9.644 8.967 -9.227 504 HD21 LEU 64 HD21 LEU 64 6.726 7.177 -10.662 505 HD22 LEU 64 HD22 LEU 64 6.672 8.071 -12.176 506 HD23 LEU 64 HD23 LEU 64 6.121 8.837 -10.683 507 H GLU 65 H GLU 65 9.848 12.542 -11.010 508 HA GLU 65 HA GLU 65 10.247 12.564 -8.181 509 HB2 GLU 65 HB2 GLU 65 11.738 14.019 -10.382 510 HB3 GLU 65 HB3 GLU 65 12.241 13.997 -8.690 511 HG2 GLU 65 HG2 GLU 65 12.284 11.444 -8.884 512 HG3 GLU 65 HG3 GLU 65 12.137 11.663 -10.627 513 H GLN 66 H GLN 66 8.942 14.924 -10.423 514 HA GLN 66 HA GLN 66 8.824 17.187 -8.712 515 HB2 GLN 66 HB2 GLN 66 8.420 17.327 -11.132 516 HB3 GLN 66 HB3 GLN 66 6.984 16.330 -10.984 517 HG2 GLN 66 HG2 GLN 66 6.308 18.613 -11.294 518 HG3 GLN 66 HG3 GLN 66 5.903 18.134 -9.648 519 HE21 GLN 66 HE21 GLN 66 7.066 19.062 -7.922 520 HE22 GLN 66 HE22 GLN 66 8.033 20.478 -8.125 521 H MET 67 H MET 67 6.703 14.403 -9.149 522 HA MET 67 HA MET 67 4.650 15.316 -7.336 523 HB2 MET 67 HB2 MET 67 5.111 12.620 -8.676 524 HB3 MET 67 HB3 MET 67 3.696 13.008 -7.695 525 HG2 MET 67 HG2 MET 67 3.214 14.898 -9.289 526 HG3 MET 67 HG3 MET 67 4.508 14.274 -10.318 527 HE1 MET 67 HE1 MET 67 1.110 13.340 -12.143 528 HE2 MET 67 HE2 MET 67 2.608 14.261 -12.268 529 HE3 MET 67 HE3 MET 67 1.367 14.750 -11.115 530 H ILE 68 H ILE 68 7.491 13.228 -7.098 531 HA ILE 68 HA ILE 68 7.113 12.265 -4.459 532 HB ILE 68 HB ILE 68 9.747 12.990 -5.831 533 HG12 ILE 68 HG12 ILE 68 8.442 10.235 -5.591 534 HG13 ILE 68 HG13 ILE 68 8.411 11.229 -7.045 535 HG21 ILE 68 HG21 ILE 68 10.832 11.490 -4.173 536 HG22 ILE 68 HG22 ILE 68 9.281 11.261 -3.361 537 HG23 ILE 68 HG23 ILE 68 10.036 12.855 -3.392 538 HD11 ILE 68 HD11 ILE 68 10.106 9.517 -7.198 539 HD12 ILE 68 HD12 ILE 68 10.874 10.101 -5.725 540 HD13 ILE 68 HD13 ILE 68 10.855 11.113 -7.172 541 H SER 69 H SER 69 8.547 15.225 -5.766 542 HA SER 69 HA SER 69 9.433 16.377 -3.346 543 HB2 SER 69 HB2 SER 69 10.174 17.067 -5.667 544 HB3 SER 69 HB3 SER 69 8.616 17.866 -5.880 545 HG SER 69 HG SER 69 9.964 19.426 -5.140 546 H GLN 70 H GLN 70 6.328 16.415 -5.009 547 HA GLN 70 HA GLN 70 5.048 18.415 -3.415 548 HB2 GLN 70 HB2 GLN 70 4.320 17.600 -5.721 549 HB3 GLN 70 HB3 GLN 70 3.701 16.145 -4.960 550 HG2 GLN 70 HG2 GLN 70 2.734 18.937 -4.260 551 HG3 GLN 70 HG3 GLN 70 2.008 17.958 -5.526 552 HE21 GLN 70 HE21 GLN 70 2.215 15.446 -4.006 553 HE22 GLN 70 HE22 GLN 70 1.019 15.543 -2.770 554 H ILE 71 H ILE 71 4.971 14.842 -3.336 555 HA ILE 71 HA ILE 71 3.137 14.665 -1.158 556 HB ILE 71 HB ILE 71 3.549 12.950 -3.027 557 HG12 ILE 71 HG12 ILE 71 2.109 12.578 -0.917 558 HG13 ILE 71 HG13 ILE 71 2.601 11.156 -1.817 559 HG21 ILE 71 HG21 ILE 71 5.159 11.137 -2.634 560 HG22 ILE 71 HG22 ILE 71 5.811 12.009 -1.244 561 HG23 ILE 71 HG23 ILE 71 5.956 12.694 -2.863 562 HD11 ILE 71 HD11 ILE 71 4.313 10.684 -0.146 563 HD12 ILE 71 HD12 ILE 71 2.710 10.786 0.576 564 HD13 ILE 71 HD13 ILE 71 3.842 12.125 0.757 565 H ASP 72 H ASP 72 6.577 14.822 -1.411 566 HA ASP 72 HA ASP 72 7.435 14.027 1.141 567 HB2 ASP 72 HB2 ASP 72 9.274 14.214 -0.214 568 HB3 ASP 72 HB3 ASP 72 8.565 15.475 -1.190 569 H LYS 73 H LYS 73 5.968 17.024 0.076 570 HA LYS 73 HA LYS 73 6.809 18.611 2.337 571 HB2 LYS 73 HB2 LYS 73 4.576 19.208 0.354 572 HB3 LYS 73 HB3 LYS 73 5.327 20.357 1.458 573 HG2 LYS 73 HG2 LYS 73 6.569 19.034 -0.961 574 HG3 LYS 73 HG3 LYS 73 6.226 20.749 -0.720 575 HD2 LYS 73 HD2 LYS 73 7.945 20.875 1.033 576 HD3 LYS 73 HD3 LYS 73 8.249 19.140 0.896 577 HE2 LYS 73 HE2 LYS 73 8.909 19.561 -1.529 578 HE3 LYS 73 HE3 LYS 73 8.852 21.288 -1.158 579 HZ1 LYS 73 HZ1 LYS 73 10.513 20.895 0.578 580 HZ2 LYS 73 HZ2 LYS 73 11.082 20.454 -0.949 581 HZ3 LYS 73 HZ3 LYS 73 10.588 19.260 0.145 582 H LEU 74 H LEU 74 4.317 16.301 1.890 583 HA LEU 74 HA LEU 74 2.453 17.284 3.827 584 HB2 LEU 74 HB2 LEU 74 2.899 14.564 2.561 585 HB3 LEU 74 HB3 LEU 74 1.744 14.771 3.860 586 HG LEU 74 HG LEU 74 0.563 14.810 1.752 587 HD11 LEU 74 HD11 LEU 74 -0.640 16.945 1.916 588 HD12 LEU 74 HD12 LEU 74 0.650 17.606 2.921 589 HD13 LEU 74 HD13 LEU 74 -0.328 16.261 3.511 590 HD21 LEU 74 HD21 LEU 74 2.398 15.510 0.257 591 HD22 LEU 74 HD22 LEU 74 2.314 17.147 0.904 592 HD23 LEU 74 HD23 LEU 74 0.954 16.486 -0.008 593 H GLU 75 H GLU 75 2.369 16.942 5.990 594 HA GLU 75 HA GLU 75 4.957 16.722 7.250 595 HB2 GLU 75 HB2 GLU 75 2.204 17.289 8.409 596 HB3 GLU 75 HB3 GLU 75 3.720 17.476 9.291 597 HG2 GLU 75 HG2 GLU 75 4.430 19.263 7.815 598 HG3 GLU 75 HG3 GLU 75 3.047 18.996 6.753 599 H ASP 76 H ASP 76 2.430 14.502 6.725 600 HA ASP 76 HA ASP 76 2.935 12.672 8.865 601 HB2 ASP 76 HB2 ASP 76 1.895 10.966 7.298 602 HB3 ASP 76 HB3 ASP 76 0.891 12.343 7.724 603 H VAL 77 H VAL 77 4.230 13.028 5.561 604 HA VAL 77 HA VAL 77 6.141 10.949 5.684 605 HB VAL 77 HB VAL 77 6.049 13.527 4.038 606 HG11 VAL 77 HG11 VAL 77 8.076 11.268 3.721 607 HG12 VAL 77 HG12 VAL 77 8.431 12.890 4.314 608 HG13 VAL 77 HG13 VAL 77 7.891 12.665 2.652 609 HG21 VAL 77 HG21 VAL 77 4.360 11.780 3.531 610 HG22 VAL 77 HG22 VAL 77 5.661 10.618 3.231 611 HG23 VAL 77 HG23 VAL 77 5.477 12.033 2.187 612 H VAL 78 H VAL 78 7.172 10.895 7.589 613 HA VAL 78 HA VAL 78 8.516 13.044 8.896 614 HB VAL 78 HB VAL 78 9.148 10.066 9.246 615 HG11 VAL 78 HG11 VAL 78 10.676 11.599 10.413 616 HG12 VAL 78 HG12 VAL 78 9.709 10.677 11.563 617 HG13 VAL 78 HG13 VAL 78 9.309 12.364 11.232 618 HG21 VAL 78 HG21 VAL 78 6.864 11.570 10.589 619 HG22 VAL 78 HG22 VAL 78 7.384 9.927 10.974 620 HG23 VAL 78 HG23 VAL 78 6.708 10.286 9.386 621 H LYS 79 H LYS 79 9.411 10.488 6.630 622 HA LYS 79 HA LYS 79 11.892 11.852 5.847 623 HB2 LYS 79 HB2 LYS 79 11.778 8.891 6.586 624 HB3 LYS 79 HB3 LYS 79 13.145 9.667 5.789 625 HG2 LYS 79 HG2 LYS 79 13.484 11.097 7.777 626 HG3 LYS 79 HG3 LYS 79 12.121 10.304 8.571 627 HD2 LYS 79 HD2 LYS 79 13.338 8.138 8.465 628 HD3 LYS 79 HD3 LYS 79 14.701 8.954 7.690 629 HE2 LYS 79 HE2 LYS 79 14.932 10.398 9.723 630 HE3 LYS 79 HE3 LYS 79 13.652 9.459 10.496 631 HZ1 LYS 79 HZ1 LYS 79 15.040 7.493 10.307 632 HZ2 LYS 79 HZ2 LYS 79 15.849 8.715 11.155 633 HZ3 LYS 79 HZ3 LYS 79 16.252 8.391 9.545 634 H VAL 80 H VAL 80 12.568 11.346 3.707 635 HA VAL 80 HA VAL 80 11.058 9.465 2.062 636 HB VAL 80 HB VAL 80 9.717 11.569 1.856 637 HG11 VAL 80 HG11 VAL 80 12.242 12.847 0.758 638 HG12 VAL 80 HG12 VAL 80 11.471 13.218 2.301 639 HG13 VAL 80 HG13 VAL 80 10.639 13.583 0.792 640 HG21 VAL 80 HG21 VAL 80 9.771 10.030 -0.059 641 HG22 VAL 80 HG22 VAL 80 11.204 10.832 -0.702 642 HG23 VAL 80 HG23 VAL 80 9.667 11.698 -0.627 643 H GLN 81 H GLN 81 12.467 8.508 0.606 644 HA GLN 81 HA GLN 81 14.861 9.921 -0.343 645 HB2 GLN 81 HB2 GLN 81 14.985 7.107 0.839 646 HB3 GLN 81 HB3 GLN 81 16.320 7.952 0.065 647 HG2 GLN 81 HG2 GLN 81 16.305 9.628 1.874 648 HG3 GLN 81 HG3 GLN 81 14.951 8.798 2.637 649 HE21 GLN 81 HE21 GLN 81 16.063 8.399 4.540 650 HE22 GLN 81 HE22 GLN 81 17.363 7.271 4.658 651 H ARG 82 H ARG 82 15.492 9.346 -2.378 652 HA ARG 82 HA ARG 82 13.698 7.580 -3.963 653 HB2 ARG 82 HB2 ARG 82 15.579 9.747 -5.015 654 HB3 ARG 82 HB3 ARG 82 14.278 8.936 -5.886 655 HG2 ARG 82 HG2 ARG 82 12.597 10.086 -4.538 656 HG3 ARG 82 HG3 ARG 82 13.858 10.804 -3.530 657 HD2 ARG 82 HD2 ARG 82 14.748 11.945 -5.601 658 HD3 ARG 82 HD3 ARG 82 13.326 11.353 -6.465 659 HE ARG 82 HE ARG 82 12.470 12.726 -4.167 660 HH11 ARG 82 HH11 ARG 82 14.047 13.446 -7.221 661 HH12 ARG 82 HH12 ARG 82 13.422 15.062 -7.297 662 HH21 ARG 82 HH21 ARG 82 11.670 14.860 -4.269 663 HH22 ARG 82 HH22 ARG 82 12.075 15.865 -5.627 664 H ASN 83 H ASN 83 14.626 5.625 -4.415 665 HA ASN 83 HA ASN 83 17.578 5.451 -4.748 666 HB2 ASN 83 HB2 ASN 83 15.712 3.516 -3.303 667 HB3 ASN 83 HB3 ASN 83 17.385 3.142 -3.712 668 HD21 ASN 83 HD21 ASN 83 18.539 5.697 -3.122 669 HD22 ASN 83 HD22 ASN 83 18.460 5.929 -1.417 670 H GLN 84 H GLN 84 18.084 4.801 -6.765 671 HA GLN 84 HA GLN 84 16.086 3.511 -8.474 672 HB2 GLN 84 HB2 GLN 84 18.939 4.138 -9.313 673 HB3 GLN 84 HB3 GLN 84 17.511 3.991 -10.324 674 HG2 GLN 84 HG2 GLN 84 18.185 6.279 -8.459 675 HG3 GLN 84 HG3 GLN 84 18.298 6.292 -10.213 676 HE21 GLN 84 HE21 GLN 84 16.948 7.996 -10.498 677 HE22 GLN 84 HE22 GLN 84 15.255 7.967 -10.165 678 H SER 85 H SER 85 15.896 1.444 -7.624 679 HA SER 85 HA SER 85 18.195 -0.352 -7.824 680 HB2 SER 85 HB2 SER 85 18.193 0.672 -5.492 681 HB3 SER 85 HB3 SER 85 16.632 -0.100 -5.213 682 HG SER 85 HG SER 85 18.702 -1.210 -4.555 683 H ASP 86 H ASP 86 17.256 -2.638 -6.861 684 HA ASP 86 HA ASP 86 15.191 -3.276 -8.844 685 HB2 ASP 86 HB2 ASP 86 17.141 -5.049 -7.304 686 HB3 ASP 86 HB3 ASP 86 15.998 -5.640 -8.508 687 HA PRO 87 HA PRO 87 11.957 -4.360 -5.894 688 HB2 PRO 87 HB2 PRO 87 10.770 -6.523 -7.130 689 HB3 PRO 87 HB3 PRO 87 10.600 -4.859 -7.726 690 HG2 PRO 87 HG2 PRO 87 12.486 -7.003 -8.660 691 HG3 PRO 87 HG3 PRO 87 11.443 -5.922 -9.618 692 HD2 PRO 87 HD2 PRO 87 14.051 -5.383 -9.296 693 HD3 PRO 87 HD3 PRO 87 12.845 -4.079 -9.330 694 H THR 88 H THR 88 14.583 -6.485 -6.471 695 HA THR 88 HA THR 88 13.959 -8.592 -4.645 696 HB THR 88 HB THR 88 16.445 -8.967 -4.608 697 HG1 THR 88 HG1 THR 88 17.616 -7.261 -5.050 698 HG21 THR 88 HG21 THR 88 15.093 -9.999 -6.407 699 HG22 THR 88 HG22 THR 88 16.688 -9.539 -7.002 700 HG23 THR 88 HG23 THR 88 15.283 -8.544 -7.391 701 H MET 89 H MET 89 15.216 -5.352 -4.289 702 HA MET 89 HA MET 89 16.141 -5.456 -1.616 703 HB2 MET 89 HB2 MET 89 14.947 -3.105 -3.144 704 HB3 MET 89 HB3 MET 89 15.843 -2.979 -1.629 705 HG2 MET 89 HG2 MET 89 16.920 -3.937 -4.289 706 HG3 MET 89 HG3 MET 89 17.282 -2.405 -3.484 707 HE1 MET 89 HE1 MET 89 20.655 -4.479 -3.252 708 HE2 MET 89 HE2 MET 89 19.917 -2.994 -3.849 709 HE3 MET 89 HE3 MET 89 19.487 -4.546 -4.571 710 H PHE 90 H PHE 90 12.978 -4.705 -3.005 711 HA PHE 90 HA PHE 90 11.398 -4.209 -0.788 712 HB2 PHE 90 HB2 PHE 90 10.205 -3.914 -2.749 713 HB3 PHE 90 HB3 PHE 90 10.957 -5.275 -3.551 714 HD1 PHE 90 HD1 PHE 90 8.246 -4.340 -1.169 715 HD2 PHE 90 HD2 PHE 90 9.847 -7.400 -3.694 716 HE1 PHE 90 HE1 PHE 90 6.187 -5.652 -0.894 717 HE2 PHE 90 HE2 PHE 90 7.786 -8.705 -3.411 718 HZ PHE 90 HZ PHE 90 5.953 -7.839 -2.011 719 H ASN 91 H ASN 91 12.333 -7.382 -2.126 720 HA ASN 91 HA ASN 91 10.886 -8.993 -0.259 721 HB2 ASN 91 HB2 ASN 91 11.614 -9.912 -2.411 722 HB3 ASN 91 HB3 ASN 91 13.298 -9.606 -2.016 723 HD21 ASN 91 HD21 ASN 91 10.508 -11.598 -1.271 724 HD22 ASN 91 HD22 ASN 91 11.402 -12.888 -0.551 725 H LYS 92 H LYS 92 14.244 -7.906 -0.453 726 HA LYS 92 HA LYS 92 15.445 -9.312 1.605 727 HB2 LYS 92 HB2 LYS 92 16.685 -8.017 -0.073 728 HB3 LYS 92 HB3 LYS 92 16.055 -6.509 0.582 729 HG2 LYS 92 HG2 LYS 92 17.277 -6.938 2.704 730 HG3 LYS 92 HG3 LYS 92 17.931 -8.426 2.008 731 HD2 LYS 92 HD2 LYS 92 19.040 -7.069 0.223 732 HD3 LYS 92 HD3 LYS 92 18.426 -5.598 0.988 733 HE2 LYS 92 HE2 LYS 92 20.767 -6.016 1.604 734 HE3 LYS 92 HE3 LYS 92 19.719 -6.104 3.020 735 HZ1 LYS 92 HZ1 LYS 92 19.775 -8.510 2.871 736 HZ2 LYS 92 HZ2 LYS 92 21.350 -7.898 2.966 737 HZ3 LYS 92 HZ3 LYS 92 20.740 -8.430 1.486 738 H ILE 93 H ILE 93 13.925 -6.110 1.769 739 HA ILE 93 HA ILE 93 14.496 -5.759 4.594 740 HB ILE 93 HB ILE 93 13.374 -3.558 4.321 741 HG12 ILE 93 HG12 ILE 93 12.566 -4.769 1.666 742 HG13 ILE 93 HG13 ILE 93 11.625 -3.776 2.764 743 HG21 ILE 93 HG21 ILE 93 15.034 -2.589 2.776 744 HG22 ILE 93 HG22 ILE 93 15.396 -4.193 2.139 745 HG23 ILE 93 HG23 ILE 93 15.773 -3.803 3.819 746 HD11 ILE 93 HD11 ILE 93 11.983 -2.589 0.733 747 HD12 ILE 93 HD12 ILE 93 13.721 -2.864 0.807 748 HD13 ILE 93 HD13 ILE 93 12.946 -1.805 1.987 749 H ALA 94 H ALA 94 11.756 -6.789 2.646 750 HA ALA 94 HA ALA 94 9.728 -6.732 4.624 751 HB1 ALA 94 HB1 ALA 94 10.054 -8.633 2.271 752 HB2 ALA 94 HB2 ALA 94 9.233 -7.071 2.246 753 HB3 ALA 94 HB3 ALA 94 8.569 -8.396 3.205 754 H VAL 95 H VAL 95 12.195 -9.160 3.813 755 HA VAL 95 HA VAL 95 11.158 -11.085 5.735 756 HB VAL 95 HB VAL 95 11.993 -11.851 3.516 757 HG11 VAL 95 HG11 VAL 95 14.760 -11.125 4.534 758 HG12 VAL 95 HG12 VAL 95 13.897 -10.359 3.201 759 HG13 VAL 95 HG13 VAL 95 14.414 -12.039 3.062 760 HG21 VAL 95 HG21 VAL 95 11.830 -13.458 5.369 761 HG22 VAL 95 HG22 VAL 95 13.473 -13.070 5.884 762 HG23 VAL 95 HG23 VAL 95 13.198 -13.857 4.328 763 H PHE 96 H PHE 96 13.768 -8.759 5.542 764 HA PHE 96 HA PHE 96 15.185 -9.774 7.873 765 HB2 PHE 96 HB2 PHE 96 16.369 -8.672 5.939 766 HB3 PHE 96 HB3 PHE 96 15.594 -7.151 6.362 767 HD1 PHE 96 HD1 PHE 96 17.986 -9.742 7.623 768 HD2 PHE 96 HD2 PHE 96 16.572 -5.734 8.056 769 HE1 PHE 96 HE1 PHE 96 19.842 -9.251 9.152 770 HE2 PHE 96 HE2 PHE 96 18.439 -5.245 9.583 771 HZ PHE 96 HZ PHE 96 20.080 -7.004 10.132 772 H PHE 97 H PHE 97 12.747 -7.385 7.135 773 HA PHE 97 HA PHE 97 11.468 -5.954 8.306 774 HB2 PHE 97 HB2 PHE 97 12.284 -7.762 10.614 775 HB3 PHE 97 HB3 PHE 97 11.210 -6.394 10.857 776 HD1 PHE 97 HD2 PHE 97 9.005 -6.334 9.573 777 HD2 PHE 97 HD1 PHE 97 11.412 -9.857 9.844 778 HE1 PHE 97 HE2 PHE 97 7.051 -7.710 9.019 779 HE2 PHE 97 HE1 PHE 97 9.452 -11.228 9.290 780 HZ PHE 97 HZ PHE 97 7.267 -10.160 8.879 781 H GLN 98 H GLN 98 12.983 -4.287 7.689 782 HA GLN 98 HA GLN 98 13.932 -2.802 10.007 783 HB2 GLN 98 HB2 GLN 98 15.871 -4.344 9.038 784 HB3 GLN 98 HB3 GLN 98 15.973 -3.137 7.768 785 HG2 GLN 98 HG2 GLN 98 16.273 -2.532 10.732 786 HG3 GLN 98 HG3 GLN 98 17.624 -2.884 9.666 787 HE21 GLN 98 HE21 GLN 98 15.208 -0.531 10.550 788 HE22 GLN 98 HE22 GLN 98 15.884 0.800 9.682 789 H1 GLY 1 H1 GLY 1 -9.560 -6.103 17.664 790 H2 GLY 1 H2 GLY 1 -8.997 -5.765 19.220 791 H3 GLY 1 H3 GLY 1 -7.957 -5.616 17.899 792 HA2 GLY 1 HA3 GLY 1 -9.300 -3.818 17.006 793 HA3 GLY 1 HA2 GLY 1 -10.357 -3.960 18.403 794 H SER 2 H SER 2 -7.975 -4.500 20.191 795 HA SER 2 HA SER 2 -7.084 -1.687 20.482 796 HB2 SER 2 HB2 SER 2 -6.801 -2.278 22.937 797 HB3 SER 2 HB3 SER 2 -8.466 -2.313 22.366 798 HG SER 2 HG SER 2 -6.821 -4.624 22.543 799 H MET 3 H MET 3 -5.271 -1.863 19.177 800 HA MET 3 HA MET 3 -3.335 -3.959 19.364 801 HB2 MET 3 HB2 MET 3 -3.611 -2.768 17.263 802 HB3 MET 3 HB3 MET 3 -3.246 -1.225 18.021 803 HG2 MET 3 HG2 MET 3 -1.376 -2.059 16.662 804 HG3 MET 3 HG3 MET 3 -0.930 -1.897 18.359 805 HE1 MET 3 HE1 MET 3 -2.966 -4.747 16.478 806 HE2 MET 3 HE2 MET 3 -1.676 -5.918 16.207 807 HE3 MET 3 HE3 MET 3 -1.632 -4.355 15.390 808 H GLN 4 H GLN 4 -2.790 -4.072 21.553 809 HA GLN 4 HA GLN 4 -1.276 -1.888 22.803 810 HB2 GLN 4 HB2 GLN 4 -1.836 -4.711 23.837 811 HB3 GLN 4 HB3 GLN 4 -1.210 -3.359 24.778 812 HG2 GLN 4 HG2 GLN 4 -3.332 -2.192 24.618 813 HG3 GLN 4 HG3 GLN 4 -3.961 -3.397 23.496 814 HE21 GLN 4 HE21 GLN 4 -4.562 -5.422 24.288 815 HE22 GLN 4 HE22 GLN 4 -4.824 -5.731 25.967 816 H ASN 5 H ASN 5 -0.586 -5.381 22.690 817 HA ASN 5 HA ASN 5 1.638 -5.067 20.813 818 HB2 ASN 5 HB2 ASN 5 1.971 -6.336 23.575 819 HB3 ASN 5 HB3 ASN 5 3.104 -6.598 22.256 820 HD21 ASN 5 HD21 ASN 5 4.348 -4.797 21.511 821 HD22 ASN 5 HD22 ASN 5 4.648 -3.440 22.537 822 H THR 6 H THR 6 -1.159 -6.234 21.143 823 HA THR 6 HA THR 6 -0.945 -9.080 21.015 824 HB THR 6 HB THR 6 -3.445 -8.695 20.099 825 HG1 THR 6 HG1 THR 6 -4.246 -6.686 20.519 826 HG21 THR 6 HG21 THR 6 -2.923 -9.637 22.322 827 HG22 THR 6 HG22 THR 6 -4.259 -8.489 22.425 828 HG23 THR 6 HG23 THR 6 -2.645 -8.012 22.954 829 H THR 7 H THR 7 -0.014 -10.062 19.366 830 HA THR 7 HA THR 7 0.715 -8.930 16.911 831 HB THR 7 HB THR 7 0.547 -11.898 17.622 832 HG1 THR 7 HG1 THR 7 2.035 -9.925 18.711 833 HG21 THR 7 HG21 THR 7 2.446 -12.176 16.068 834 HG22 THR 7 HG22 THR 7 2.384 -10.460 15.671 835 HG23 THR 7 HG23 THR 7 1.042 -11.515 15.225 836 H HIS 8 H HIS 8 -2.011 -11.024 17.788 837 HA HIS 8 HA HIS 8 -2.979 -11.187 14.995 838 HB2 HIS 8 HB2 HIS 8 -2.649 -13.226 16.626 839 HB3 HIS 8 HB3 HIS 8 -4.135 -12.682 17.380 840 HD1 HIS 8 HD1 HIS 8 -3.088 -15.158 15.226 841 HD2 HIS 8 HD2 HIS 8 -6.212 -12.438 14.967 842 HE1 HIS 8 HE1 HIS 8 -4.779 -16.221 13.720 843 HE2 HIS 8 HE2 HIS 8 -6.749 -14.659 13.765 844 H ASP 9 H ASP 9 -3.195 -8.819 16.988 845 HA ASP 9 HA ASP 9 -6.020 -8.405 17.373 846 HB2 ASP 9 HB2 ASP 9 -4.122 -7.226 18.613 847 HB3 ASP 9 HB3 ASP 9 -3.853 -6.284 17.161 848 H ASN 10 H ASN 10 -3.710 -7.929 14.807 849 HA ASN 10 HA ASN 10 -5.504 -6.495 13.061 850 HB2 ASN 10 HB2 ASN 10 -3.728 -6.771 11.344 851 HB3 ASN 10 HB3 ASN 10 -3.114 -6.072 12.834 852 HD21 ASN 10 HD21 ASN 10 -1.029 -6.664 12.102 853 HD22 ASN 10 HD22 ASN 10 -0.441 -8.270 12.266 854 H VAL 11 H VAL 11 -5.879 -7.393 10.848 855 HA VAL 11 HA VAL 11 -6.434 -10.268 10.733 856 HB VAL 11 HB VAL 11 -8.639 -9.848 9.639 857 HG11 VAL 11 HG11 VAL 11 -8.620 -10.341 12.050 858 HG12 VAL 11 HG12 VAL 11 -9.945 -9.250 11.652 859 HG13 VAL 11 HG13 VAL 11 -8.488 -8.619 12.425 860 HG21 VAL 11 HG21 VAL 11 -9.751 -7.639 9.718 861 HG22 VAL 11 HG22 VAL 11 -8.261 -7.543 8.777 862 HG23 VAL 11 HG23 VAL 11 -8.304 -6.916 10.425 863 H ILE 12 H ILE 12 -6.216 -11.115 8.658 864 HA ILE 12 HA ILE 12 -4.569 -9.496 6.833 865 HB ILE 12 HB ILE 12 -5.057 -12.517 6.792 866 HG12 ILE 12 HG12 ILE 12 -3.959 -11.871 8.917 867 HG13 ILE 12 HG13 ILE 12 -2.868 -12.796 7.902 868 HG21 ILE 12 HG21 ILE 12 -2.915 -10.859 5.403 869 HG22 ILE 12 HG22 ILE 12 -4.298 -11.633 4.628 870 HG23 ILE 12 HG23 ILE 12 -3.041 -12.622 5.367 871 HD11 ILE 12 HD11 ILE 12 -1.699 -11.008 9.007 872 HD12 ILE 12 HD12 ILE 12 -2.813 -9.812 8.348 873 HD13 ILE 12 HD13 ILE 12 -1.733 -10.701 7.271 874 H LEU 13 H LEU 13 -6.014 -8.341 5.642 875 HA LEU 13 HA LEU 13 -8.296 -9.670 4.323 876 HB2 LEU 13 HB2 LEU 13 -7.581 -6.717 4.439 877 HB3 LEU 13 HB3 LEU 13 -9.079 -7.410 3.822 878 HG LEU 13 HG LEU 13 -8.142 -7.428 6.710 879 HD11 LEU 13 HD11 LEU 13 -8.914 -5.238 5.910 880 HD12 LEU 13 HD12 LEU 13 -9.985 -5.921 7.125 881 HD13 LEU 13 HD13 LEU 13 -10.456 -5.957 5.426 882 HD21 LEU 13 HD21 LEU 13 -9.354 -9.506 6.248 883 HD22 LEU 13 HD22 LEU 13 -10.693 -8.601 5.537 884 HD23 LEU 13 HD23 LEU 13 -10.330 -8.442 7.257 885 H GLU 14 H GLU 14 -7.416 -10.727 2.586 886 HA GLU 14 HA GLU 14 -5.586 -9.303 0.797 887 HB2 GLU 14 HB2 GLU 14 -5.467 -11.440 -0.437 888 HB3 GLU 14 HB3 GLU 14 -5.014 -11.586 1.247 889 HG2 GLU 14 HG2 GLU 14 -6.982 -12.765 1.819 890 HG3 GLU 14 HG3 GLU 14 -7.791 -12.309 0.317 891 H LEU 15 H LEU 15 -6.078 -8.652 -1.224 892 HA LEU 15 HA LEU 15 -8.485 -9.504 -2.566 893 HB2 LEU 15 HB2 LEU 15 -8.969 -6.966 -3.166 894 HB3 LEU 15 HB3 LEU 15 -9.625 -7.698 -1.719 895 HG LEU 15 HG LEU 15 -7.598 -6.668 -0.477 896 HD11 LEU 15 HD11 LEU 15 -7.465 -4.920 -2.943 897 HD12 LEU 15 HD12 LEU 15 -6.223 -6.045 -2.387 898 HD13 LEU 15 HD13 LEU 15 -6.629 -4.637 -1.414 899 HD21 LEU 15 HD21 LEU 15 -8.769 -4.536 -0.133 900 HD22 LEU 15 HD22 LEU 15 -9.894 -5.890 -0.154 901 HD23 LEU 15 HD23 LEU 15 -9.761 -4.834 -1.563 902 H THR 16 H THR 16 -7.951 -9.997 -4.545 903 HA THR 16 HA THR 16 -5.457 -9.048 -5.755 904 HB THR 16 HB THR 16 -7.510 -11.049 -6.837 905 HG1 THR 16 HG1 THR 16 -6.526 -12.397 -5.539 906 HG21 THR 16 HG21 THR 16 -5.732 -11.686 -8.438 907 HG22 THR 16 HG22 THR 16 -4.672 -10.441 -7.777 908 HG23 THR 16 HG23 THR 16 -6.144 -9.976 -8.635 909 H VAL 17 H VAL 17 -5.753 -6.990 -6.432 910 HA VAL 17 HA VAL 17 -8.114 -6.330 -8.081 911 HB VAL 17 HB VAL 17 -7.692 -4.035 -7.741 912 HG11 VAL 17 HG11 VAL 17 -7.638 -3.745 -5.277 913 HG12 VAL 17 HG12 VAL 17 -7.052 -5.404 -5.104 914 HG13 VAL 17 HG13 VAL 17 -8.664 -5.100 -5.762 915 HG21 VAL 17 HG21 VAL 17 -5.289 -3.892 -8.163 916 HG22 VAL 17 HG22 VAL 17 -4.936 -4.700 -6.638 917 HG23 VAL 17 HG23 VAL 17 -5.651 -3.087 -6.634 918 H ARG 18 H ARG 18 -7.812 -5.490 -10.211 919 HA ARG 18 HA ARG 18 -5.109 -5.836 -11.344 920 HB2 ARG 18 HB2 ARG 18 -6.191 -5.773 -13.555 921 HB3 ARG 18 HB3 ARG 18 -6.756 -7.097 -12.551 922 HG2 ARG 18 HG2 ARG 18 -8.852 -5.835 -12.089 923 HG3 ARG 18 HG3 ARG 18 -8.277 -4.525 -13.132 924 HD2 ARG 18 HD2 ARG 18 -8.923 -7.382 -13.947 925 HD3 ARG 18 HD3 ARG 18 -9.774 -5.915 -14.438 926 HE ARG 18 HE ARG 18 -7.192 -5.522 -15.291 927 HH11 ARG 18 HH11 ARG 18 -9.602 -8.012 -15.933 928 HH12 ARG 18 HH12 ARG 18 -8.965 -8.386 -17.501 929 HH21 ARG 18 HH21 ARG 18 -6.288 -6.120 -17.282 930 HH22 ARG 18 HH22 ARG 18 -7.085 -7.311 -18.263 931 H ASN 19 H ASN 19 -4.234 -4.145 -12.633 932 HA ASN 19 HA ASN 19 -4.397 -1.742 -11.076 933 HB2 ASN 19 HB2 ASN 19 -2.545 -2.576 -13.342 934 HB3 ASN 19 HB3 ASN 19 -2.406 -1.029 -12.509 935 HD21 ASN 19 HD21 ASN 19 -0.366 -1.453 -11.668 936 HD22 ASN 19 HD22 ASN 19 -0.075 -2.625 -10.431 937 H HIS 20 H HIS 20 -6.602 -1.157 -11.781 938 HA HIS 20 HA HIS 20 -6.749 0.473 -14.207 939 HB2 HIS 20 HB2 HIS 20 -8.711 0.316 -11.862 940 HB3 HIS 20 HB3 HIS 20 -9.013 1.097 -13.408 941 HD1 HIS 20 HD1 HIS 20 -10.776 -1.201 -12.149 942 HD2 HIS 20 HD2 HIS 20 -7.887 -1.709 -15.093 943 HE1 HIS 20 HE1 HIS 20 -11.425 -3.295 -13.368 944 HE2 HIS 20 HE2 HIS 20 -9.772 -3.469 -15.261 945 HA PRO 21 HA PRO 21 -4.940 4.207 -12.539 946 HB2 PRO 21 HB2 PRO 21 -7.528 5.625 -13.220 947 HB3 PRO 21 HB3 PRO 21 -5.853 6.081 -13.605 948 HG2 PRO 21 HG2 PRO 21 -7.388 5.012 -15.475 949 HG3 PRO 21 HG3 PRO 21 -5.679 4.530 -15.339 950 HD2 PRO 21 HD2 PRO 21 -8.141 3.028 -14.504 951 HD3 PRO 21 HD3 PRO 21 -6.620 2.414 -15.191 952 H GLY 22 H GLY 22 -4.774 3.832 -10.334 953 HA2 GLY 22 HA2 GLY 22 -4.889 4.692 -8.197 954 HA3 GLY 22 HA3 GLY 22 -6.284 5.639 -8.671 955 H VAL 23 H VAL 23 -5.756 2.128 -8.657 956 HA VAL 23 HA VAL 23 -8.210 1.694 -7.149 957 HB VAL 23 HB VAL 23 -7.839 -0.708 -7.541 958 HG11 VAL 23 HG11 VAL 23 -9.044 0.607 -9.196 959 HG12 VAL 23 HG12 VAL 23 -8.073 -0.615 -10.017 960 HG13 VAL 23 HG13 VAL 23 -7.536 1.065 -9.992 961 HG21 VAL 23 HG21 VAL 23 -5.272 0.117 -8.973 962 HG22 VAL 23 HG22 VAL 23 -5.985 -1.502 -8.976 963 HG23 VAL 23 HG23 VAL 23 -5.370 -0.811 -7.472 964 H MET 24 H MET 24 -4.783 1.642 -6.533 965 HA MET 24 HA MET 24 -4.756 0.425 -3.979 966 HB2 MET 24 HB2 MET 24 -2.967 2.670 -5.011 967 HB3 MET 24 HB3 MET 24 -2.624 1.643 -3.623 968 HG2 MET 24 HG2 MET 24 -1.294 0.877 -5.448 969 HG3 MET 24 HG3 MET 24 -2.564 -0.322 -5.194 970 HE1 MET 24 HE1 MET 24 -2.199 -0.572 -9.059 971 HE2 MET 24 HE2 MET 24 -2.317 -1.459 -7.541 972 HE3 MET 24 HE3 MET 24 -0.917 -0.430 -7.856 973 H THR 25 H THR 25 -5.626 3.620 -5.097 974 HA THR 25 HA THR 25 -5.747 5.018 -2.641 975 HB THR 25 HB THR 25 -7.448 5.611 -5.103 976 HG1 THR 25 HG1 THR 25 -5.332 6.964 -5.442 977 HG21 THR 25 HG21 THR 25 -6.131 7.451 -3.055 978 HG22 THR 25 HG22 THR 25 -7.858 7.095 -3.151 979 HG23 THR 25 HG23 THR 25 -7.066 7.978 -4.457 980 H HIS 26 H HIS 26 -7.963 2.801 -4.220 981 HA HIS 26 HA HIS 26 -10.385 3.502 -2.912 982 HB2 HIS 26 HB2 HIS 26 -9.577 0.783 -4.034 983 HB3 HIS 26 HB3 HIS 26 -11.216 1.255 -3.590 984 HD1 HIS 26 HD1 HIS 26 -10.466 0.328 -6.485 985 HD2 HIS 26 HD2 HIS 26 -10.709 4.297 -5.243 986 HE1 HIS 26 HE1 HIS 26 -10.832 1.677 -8.571 987 HE2 HIS 26 HE2 HIS 26 -11.213 4.027 -7.760 988 H VAL 27 H VAL 27 -8.061 0.845 -2.245 989 HA VAL 27 HA VAL 27 -9.351 -0.097 0.091 990 HB VAL 27 HB VAL 27 -7.352 -1.432 0.558 991 HG11 VAL 27 HG11 VAL 27 -8.843 -2.239 -1.198 992 HG12 VAL 27 HG12 VAL 27 -7.177 -2.672 -1.573 993 HG13 VAL 27 HG13 VAL 27 -7.949 -1.329 -2.421 994 HG21 VAL 27 HG21 VAL 27 -5.268 -1.262 -0.777 995 HG22 VAL 27 HG22 VAL 27 -5.571 0.225 0.119 996 HG23 VAL 27 HG23 VAL 27 -5.911 0.160 -1.610 997 H CYS 28 H CYS 28 -6.675 2.193 -0.336 998 HA CYS 28 HA CYS 28 -6.063 2.684 2.376 999 HB2 CYS 28 HB2 CYS 28 -5.697 4.429 -0.083 1000 HB3 CYS 28 HB3 CYS 28 -4.956 4.743 1.487 1001 HG CYS 28 HG CYS 28 -2.883 3.738 0.160 1002 H GLY 29 H GLY 29 -8.466 4.049 0.189 1003 HA2 GLY 29 HA2 GLY 29 -9.288 6.290 1.754 1004 HA3 GLY 29 HA3 GLY 29 -10.180 5.551 0.436 1005 H LEU 30 H LEU 30 -10.452 2.939 1.504 1006 HA LEU 30 HA LEU 30 -12.802 3.252 3.071 1007 HB2 LEU 30 HB2 LEU 30 -11.289 0.910 1.981 1008 HB3 LEU 30 HB3 LEU 30 -12.337 0.571 3.342 1009 HG LEU 30 HG LEU 30 -13.521 0.111 1.264 1010 HD11 LEU 30 HD11 LEU 30 -15.554 1.427 1.609 1011 HD12 LEU 30 HD12 LEU 30 -14.660 2.599 2.581 1012 HD13 LEU 30 HD13 LEU 30 -14.856 0.942 3.154 1013 HD21 LEU 30 HD21 LEU 30 -12.306 1.622 -0.248 1014 HD22 LEU 30 HD22 LEU 30 -13.081 3.020 0.502 1015 HD23 LEU 30 HD23 LEU 30 -14.049 1.842 -0.387 1016 H PHE 31 H PHE 31 -9.561 2.048 3.935 1017 HA PHE 31 HA PHE 31 -10.244 1.579 6.695 1018 HB2 PHE 31 HB2 PHE 31 -7.516 1.668 5.345 1019 HB3 PHE 31 HB3 PHE 31 -7.804 1.126 7.003 1020 HD1 PHE 31 HD2 PHE 31 -9.785 -0.726 7.199 1021 HD2 PHE 31 HD1 PHE 31 -7.406 -0.041 3.712 1022 HE1 PHE 31 HE2 PHE 31 -10.329 -2.977 6.377 1023 HE2 PHE 31 HE1 PHE 31 -7.967 -2.282 2.894 1024 HZ PHE 31 HZ PHE 31 -9.426 -3.758 4.219 1025 H ALA 32 H ALA 32 -8.913 4.281 4.927 1026 HA ALA 32 HA ALA 32 -8.039 5.938 7.028 1027 HB1 ALA 32 HB1 ALA 32 -8.454 7.823 5.484 1028 HB2 ALA 32 HB2 ALA 32 -9.386 6.760 4.424 1029 HB3 ALA 32 HB3 ALA 32 -7.660 6.484 4.651 1030 H ARG 33 H ARG 33 -11.222 5.847 5.402 1031 HA ARG 33 HA ARG 33 -12.481 7.704 7.213 1032 HB2 ARG 33 HB2 ARG 33 -14.455 7.425 5.836 1033 HB3 ARG 33 HB3 ARG 33 -13.048 7.522 4.786 1034 HG2 ARG 33 HG2 ARG 33 -13.099 4.989 4.622 1035 HG3 ARG 33 HG3 ARG 33 -14.629 5.031 5.502 1036 HD2 ARG 33 HD2 ARG 33 -14.083 6.348 2.817 1037 HD3 ARG 33 HD3 ARG 33 -15.012 4.871 3.080 1038 HE ARG 33 HE ARG 33 -16.461 6.476 4.542 1039 HH11 ARG 33 HH11 ARG 33 -14.982 7.304 1.467 1040 HH12 ARG 33 HH12 ARG 33 -16.208 8.458 1.056 1041 HH21 ARG 33 HH21 ARG 33 -18.076 7.986 3.979 1042 HH22 ARG 33 HH22 ARG 33 -17.960 8.846 2.476 1043 H ARG 34 H ARG 34 -11.745 4.477 7.566 1044 HA ARG 34 HA ARG 34 -14.136 3.391 8.620 1045 HB2 ARG 34 HB2 ARG 34 -12.280 2.084 7.561 1046 HB3 ARG 34 HB3 ARG 34 -11.263 2.416 8.949 1047 HG2 ARG 34 HG2 ARG 34 -13.906 1.023 9.376 1048 HG3 ARG 34 HG3 ARG 34 -12.559 0.113 8.691 1049 HD2 ARG 34 HD2 ARG 34 -12.494 1.604 11.334 1050 HD3 ARG 34 HD3 ARG 34 -12.699 -0.139 11.136 1051 HE ARG 34 HE ARG 34 -10.328 0.812 9.843 1052 HH11 ARG 34 HH11 ARG 34 -11.577 -0.094 12.993 1053 HH12 ARG 34 HH12 ARG 34 -10.021 -0.523 13.619 1054 HH21 ARG 34 HH21 ARG 34 -8.312 0.278 10.677 1055 HH22 ARG 34 HH22 ARG 34 -8.169 -0.308 12.298 1056 H ALA 35 H ALA 35 -11.052 4.078 10.285 1057 HA ALA 35 HA ALA 35 -12.011 5.611 12.416 1058 HB1 ALA 35 HB1 ALA 35 -13.285 3.605 13.104 1059 HB2 ALA 35 HB2 ALA 35 -12.042 3.985 14.295 1060 HB3 ALA 35 HB3 ALA 35 -11.797 2.657 13.154 1061 H PHE 36 H PHE 36 -9.879 2.831 11.877 1062 HA PHE 36 HA PHE 36 -7.516 4.385 12.755 1063 HB2 PHE 36 HB2 PHE 36 -8.190 2.666 14.431 1064 HB3 PHE 36 HB3 PHE 36 -8.104 1.417 13.203 1065 HD1 PHE 36 HD1 PHE 36 -6.045 3.837 15.169 1066 HD2 PHE 36 HD2 PHE 36 -6.017 0.328 12.725 1067 HE1 PHE 36 HE1 PHE 36 -3.704 3.419 15.791 1068 HE2 PHE 36 HE2 PHE 36 -3.680 -0.084 13.349 1069 HZ PHE 36 HZ PHE 36 -2.514 1.458 14.883 1070 H ASN 37 H ASN 37 -5.593 3.946 11.603 1071 HA ASN 37 HA ASN 37 -5.991 3.537 8.777 1072 HB2 ASN 37 HB2 ASN 37 -3.449 4.036 10.397 1073 HB3 ASN 37 HB3 ASN 37 -3.558 4.121 8.640 1074 HD21 ASN 37 HD21 ASN 37 -3.059 6.103 10.947 1075 HD22 ASN 37 HD22 ASN 37 -4.050 7.448 10.529 1076 H VAL 38 H VAL 38 -4.125 2.246 7.593 1077 HA VAL 38 HA VAL 38 -4.281 -0.526 8.421 1078 HB VAL 38 HB VAL 38 -2.597 0.617 6.127 1079 HG11 VAL 38 HG11 VAL 38 -3.669 -2.190 6.642 1080 HG12 VAL 38 HG12 VAL 38 -1.986 -1.671 6.775 1081 HG13 VAL 38 HG13 VAL 38 -2.781 -1.683 5.200 1082 HG21 VAL 38 HG21 VAL 38 -4.947 1.292 5.825 1083 HG22 VAL 38 HG22 VAL 38 -5.469 -0.383 6.015 1084 HG23 VAL 38 HG23 VAL 38 -4.483 0.083 4.626 1085 H GLU 39 H GLU 39 -2.706 -1.676 9.403 1086 HA GLU 39 HA GLU 39 -0.456 -0.441 10.666 1087 HB2 GLU 39 HB2 GLU 39 -1.733 -2.265 11.718 1088 HB3 GLU 39 HB3 GLU 39 -1.344 -3.343 10.382 1089 HG2 GLU 39 HG2 GLU 39 1.132 -2.972 11.079 1090 HG3 GLU 39 HG3 GLU 39 0.465 -2.335 12.583 1091 H GLY 40 H GLY 40 -0.840 -2.980 8.177 1092 HA2 GLY 40 HA2 GLY 40 1.732 -2.251 6.923 1093 HA3 GLY 40 HA3 GLY 40 1.500 -3.902 7.482 1094 H ILE 41 H ILE 41 1.824 -2.624 4.742 1095 HA ILE 41 HA ILE 41 -0.545 -3.829 3.399 1096 HB ILE 41 HB ILE 41 1.050 -1.394 2.422 1097 HG12 ILE 41 HG12 ILE 41 -1.840 -1.490 3.422 1098 HG13 ILE 41 HG13 ILE 41 -0.479 -0.831 4.321 1099 HG21 ILE 41 HG21 ILE 41 -0.574 -1.239 0.572 1100 HG22 ILE 41 HG22 ILE 41 -1.392 -2.694 1.146 1101 HG23 ILE 41 HG23 ILE 41 0.263 -2.792 0.543 1102 HD11 ILE 41 HD11 ILE 41 -1.596 0.242 1.735 1103 HD12 ILE 41 HD12 ILE 41 -0.198 0.898 2.591 1104 HD13 ILE 41 HD13 ILE 41 -1.792 0.935 3.344 1105 H LEU 42 H LEU 42 -0.060 -5.290 1.836 1106 HA LEU 42 HA LEU 42 2.694 -5.446 0.770 1107 HB2 LEU 42 HB2 LEU 42 2.398 -7.175 2.533 1108 HB3 LEU 42 HB3 LEU 42 1.000 -7.808 1.675 1109 HG LEU 42 HG LEU 42 2.464 -8.409 -0.248 1110 HD11 LEU 42 HD11 LEU 42 4.756 -7.499 1.515 1111 HD12 LEU 42 HD12 LEU 42 4.228 -6.749 0.005 1112 HD13 LEU 42 HD13 LEU 42 4.908 -8.374 -0.013 1113 HD21 LEU 42 HD21 LEU 42 1.966 -10.089 1.454 1114 HD22 LEU 42 HD22 LEU 42 3.373 -9.584 2.395 1115 HD23 LEU 42 HD23 LEU 42 3.586 -10.313 0.801 1116 H CYS 43 H CYS 43 1.966 -4.400 -1.076 1117 HA CYS 43 HA CYS 43 -0.055 -5.664 -2.780 1118 HB2 CYS 43 HB2 CYS 43 0.055 -3.191 -2.618 1119 HB3 CYS 43 HB3 CYS 43 1.701 -3.218 -3.233 1120 HG CYS 43 HG CYS 43 -0.762 -4.540 -5.141 1121 H LEU 44 H LEU 44 0.808 -7.600 -3.370 1122 HA LEU 44 HA LEU 44 3.564 -7.884 -4.312 1123 HB2 LEU 44 HB2 LEU 44 2.303 -9.511 -2.723 1124 HB3 LEU 44 HB3 LEU 44 1.421 -10.035 -4.141 1125 HG LEU 44 HG LEU 44 3.793 -10.567 -5.137 1126 HD11 LEU 44 HD11 LEU 44 5.135 -9.427 -3.427 1127 HD12 LEU 44 HD12 LEU 44 5.509 -11.147 -3.476 1128 HD13 LEU 44 HD13 LEU 44 4.494 -10.509 -2.180 1129 HD21 LEU 44 HD21 LEU 44 2.651 -12.281 -2.894 1130 HD22 LEU 44 HD22 LEU 44 3.762 -12.827 -4.154 1131 HD23 LEU 44 HD23 LEU 44 2.138 -12.300 -4.585 1132 HA PRO 45 HA PRO 45 1.723 -7.030 -8.424 1133 HB2 PRO 45 HB2 PRO 45 4.103 -7.105 -9.863 1134 HB3 PRO 45 HB3 PRO 45 3.551 -5.696 -8.937 1135 HG2 PRO 45 HG2 PRO 45 5.531 -7.803 -8.160 1136 HG3 PRO 45 HG3 PRO 45 5.603 -6.039 -7.930 1137 HD2 PRO 45 HD2 PRO 45 4.911 -7.700 -5.913 1138 HD3 PRO 45 HD3 PRO 45 4.198 -6.083 -6.075 1139 H ILE 46 H ILE 46 0.602 -8.661 -9.296 1140 HA ILE 46 HA ILE 46 1.582 -11.352 -9.601 1141 HB ILE 46 HB ILE 46 -0.939 -10.052 -10.749 1142 HG12 ILE 46 HG12 ILE 46 -0.951 -9.952 -8.281 1143 HG13 ILE 46 HG13 ILE 46 -2.150 -11.110 -8.841 1144 HG21 ILE 46 HG21 ILE 46 -1.808 -12.359 -11.000 1145 HG22 ILE 46 HG22 ILE 46 -0.243 -12.999 -10.491 1146 HG23 ILE 46 HG23 ILE 46 -0.375 -12.077 -11.990 1147 HD11 ILE 46 HD11 ILE 46 0.560 -11.768 -7.669 1148 HD12 ILE 46 HD12 ILE 46 -0.607 -12.951 -8.262 1149 HD13 ILE 46 HD13 ILE 46 -1.004 -11.940 -6.875 1150 H GLN 47 H GLN 47 3.245 -11.546 -10.969 1151 HA GLN 47 HA GLN 47 3.912 -9.838 -13.098 1152 HB2 GLN 47 HB2 GLN 47 5.721 -11.398 -13.576 1153 HB3 GLN 47 HB3 GLN 47 5.534 -11.232 -11.839 1154 HG2 GLN 47 HG2 GLN 47 4.389 -13.393 -11.711 1155 HG3 GLN 47 HG3 GLN 47 4.461 -13.555 -13.465 1156 HE21 GLN 47 HE21 GLN 47 5.534 -15.345 -11.423 1157 HE22 GLN 47 HE22 GLN 47 7.224 -15.489 -11.738 1158 H ASP 48 H ASP 48 1.686 -12.452 -13.104 1159 HA ASP 48 HA ASP 48 2.145 -13.475 -15.715 1160 HB2 ASP 48 HB2 ASP 48 0.737 -15.140 -15.036 1161 HB3 ASP 48 HB3 ASP 48 0.680 -14.342 -13.479 1162 H SER 49 H SER 49 0.154 -10.922 -14.433 1163 HA SER 49 HA SER 49 -0.672 -10.000 -17.085 1164 HB2 SER 49 HB2 SER 49 -2.646 -10.800 -14.888 1165 HB3 SER 49 HB3 SER 49 -3.089 -9.839 -16.298 1166 HG SER 49 HG SER 49 -1.910 -12.422 -16.496 1167 H ASP 50 H ASP 50 -2.253 -7.988 -16.541 1168 HA ASP 50 HA ASP 50 -0.788 -6.124 -14.853 1169 HB2 ASP 50 HB2 ASP 50 -2.442 -4.449 -15.712 1170 HB3 ASP 50 HB3 ASP 50 -1.573 -5.284 -16.990 1171 H LYS 51 H LYS 51 -1.173 -7.441 -12.948 1172 HA LYS 51 HA LYS 51 -3.511 -6.573 -11.416 1173 HB2 LYS 51 HB2 LYS 51 -2.683 -9.519 -11.566 1174 HB3 LYS 51 HB3 LYS 51 -3.879 -8.856 -10.463 1175 HG2 LYS 51 HG2 LYS 51 -5.179 -8.174 -12.596 1176 HG3 LYS 51 HG3 LYS 51 -4.096 -9.273 -13.450 1177 HD2 LYS 51 HD2 LYS 51 -5.962 -9.997 -11.149 1178 HD3 LYS 51 HD3 LYS 51 -6.207 -10.410 -12.846 1179 HE2 LYS 51 HE2 LYS 51 -3.917 -11.398 -11.112 1180 HE3 LYS 51 HE3 LYS 51 -5.366 -12.320 -11.508 1181 HZ1 LYS 51 HZ1 LYS 51 -4.757 -12.245 -13.823 1182 HZ2 LYS 51 HZ2 LYS 51 -3.489 -12.901 -12.916 1183 HZ3 LYS 51 HZ3 LYS 51 -3.389 -11.315 -13.475 1184 H SER 52 H SER 52 -3.227 -7.031 -9.111 1185 HA SER 52 HA SER 52 -0.691 -7.877 -8.065 1186 HB2 SER 52 HB2 SER 52 -0.361 -5.412 -8.540 1187 HB3 SER 52 HB3 SER 52 -1.671 -5.060 -7.406 1188 HG SER 52 HG SER 52 0.783 -5.262 -6.760 1189 H HIS 53 H HIS 53 -0.981 -8.805 -6.082 1190 HA HIS 53 HA HIS 53 -3.725 -8.848 -4.955 1191 HB2 HIS 53 HB2 HIS 53 -2.596 -10.998 -5.743 1192 HB3 HIS 53 HB3 HIS 53 -1.407 -10.790 -4.463 1193 HD1 HIS 53 HD1 HIS 53 -2.577 -13.304 -4.058 1194 HD2 HIS 53 HD2 HIS 53 -4.741 -9.947 -2.910 1195 HE1 HIS 53 HE1 HIS 53 -4.383 -14.151 -2.541 1196 HE2 HIS 53 HE2 HIS 53 -5.800 -12.141 -2.042 1197 H ILE 54 H ILE 54 -3.969 -7.515 -3.227 1198 HA ILE 54 HA ILE 54 -1.601 -6.720 -1.658 1199 HB ILE 54 HB ILE 54 -4.307 -5.289 -1.694 1200 HG12 ILE 54 HG12 ILE 54 -2.987 -3.475 -3.022 1201 HG13 ILE 54 HG13 ILE 54 -1.820 -4.740 -3.379 1202 HG21 ILE 54 HG21 ILE 54 -1.593 -4.411 -0.629 1203 HG22 ILE 54 HG22 ILE 54 -2.986 -4.904 0.335 1204 HG23 ILE 54 HG23 ILE 54 -3.066 -3.432 -0.630 1205 HD11 ILE 54 HD11 ILE 54 -3.369 -4.381 -5.203 1206 HD12 ILE 54 HD12 ILE 54 -4.733 -4.749 -4.149 1207 HD13 ILE 54 HD13 ILE 54 -3.554 -6.004 -4.542 1208 H TRP 55 H TRP 55 -1.411 -7.402 0.416 1209 HA TRP 55 HA TRP 55 -3.788 -8.383 1.891 1210 HB2 TRP 55 HB2 TRP 55 -0.805 -8.769 2.407 1211 HB3 TRP 55 HB3 TRP 55 -2.075 -9.313 3.507 1212 HD1 TRP 55 HD1 TRP 55 -3.438 -11.505 2.808 1213 HE1 TRP 55 HE1 TRP 55 -3.078 -13.306 1.020 1214 HE3 TRP 55 HE3 TRP 55 0.091 -9.152 -0.002 1215 HZ2 TRP 55 HZ2 TRP 55 -1.472 -13.706 -1.262 1216 HZ3 TRP 55 HZ3 TRP 55 0.991 -10.318 -1.948 1217 HH2 TRP 55 HH2 TRP 55 0.235 -12.546 -2.584 1218 H LEU 56 H LEU 56 -4.693 -6.965 3.186 1219 HA LEU 56 HA LEU 56 -3.243 -4.637 4.235 1220 HB2 LEU 56 HB2 LEU 56 -6.238 -5.209 4.080 1221 HB3 LEU 56 HB3 LEU 56 -5.543 -3.784 4.829 1222 HG LEU 56 HG LEU 56 -6.337 -3.093 2.703 1223 HD11 LEU 56 HD11 LEU 56 -4.161 -2.129 3.274 1224 HD12 LEU 56 HD12 LEU 56 -4.348 -2.282 1.530 1225 HD13 LEU 56 HD13 LEU 56 -3.336 -3.430 2.408 1226 HD21 LEU 56 HD21 LEU 56 -5.766 -4.140 0.552 1227 HD22 LEU 56 HD22 LEU 56 -6.622 -5.261 1.607 1228 HD23 LEU 56 HD23 LEU 56 -4.876 -5.411 1.394 1229 H LEU 57 H LEU 57 -2.337 -5.071 6.112 1230 HA LEU 57 HA LEU 57 -3.511 -6.747 8.192 1231 HB2 LEU 57 HB2 LEU 57 -0.924 -5.168 7.919 1232 HB3 LEU 57 HB3 LEU 57 -1.420 -5.795 9.481 1233 HG LEU 57 HG LEU 57 -1.188 -8.084 8.731 1234 HD11 LEU 57 HD11 LEU 57 -2.004 -7.955 6.440 1235 HD12 LEU 57 HD12 LEU 57 -0.417 -8.712 6.473 1236 HD13 LEU 57 HD13 LEU 57 -0.579 -7.034 5.942 1237 HD21 LEU 57 HD21 LEU 57 1.237 -8.142 8.277 1238 HD22 LEU 57 HD22 LEU 57 0.837 -6.957 9.517 1239 HD23 LEU 57 HD23 LEU 57 1.210 -6.421 7.877 1240 H VAL 58 H VAL 58 -5.241 -5.758 9.105 1241 HA VAL 58 HA VAL 58 -4.895 -3.104 10.314 1242 HB VAL 58 HB VAL 58 -6.033 -2.851 8.039 1243 HG11 VAL 58 HG11 VAL 58 -8.392 -3.502 7.777 1244 HG12 VAL 58 HG12 VAL 58 -8.340 -4.342 9.329 1245 HG13 VAL 58 HG13 VAL 58 -7.346 -4.908 7.984 1246 HG21 VAL 58 HG21 VAL 58 -6.297 -1.123 9.751 1247 HG22 VAL 58 HG22 VAL 58 -7.662 -1.991 10.459 1248 HG23 VAL 58 HG23 VAL 58 -7.797 -1.302 8.838 1249 H ASN 59 H ASN 59 -6.187 -2.866 12.222 1250 HA ASN 59 HA ASN 59 -6.883 -5.356 13.482 1251 HB2 ASN 59 HB2 ASN 59 -7.384 -4.008 15.465 1252 HB3 ASN 59 HB3 ASN 59 -5.836 -3.553 14.770 1253 HD21 ASN 59 HD21 ASN 59 -7.414 -2.009 16.561 1254 HD22 ASN 59 HD22 ASN 59 -7.849 -0.542 15.761 1255 H ASP 60 H ASP 60 -8.896 -6.147 13.989 1256 HA ASP 60 HA ASP 60 -11.043 -5.632 12.219 1257 HB2 ASP 60 HB2 ASP 60 -10.795 -7.857 13.112 1258 HB3 ASP 60 HB3 ASP 60 -10.850 -7.282 14.773 1259 H ASP 61 H ASP 61 -13.102 -4.798 12.594 1260 HA ASP 61 HA ASP 61 -13.604 -3.032 14.874 1261 HB2 ASP 61 HB2 ASP 61 -12.296 -1.730 13.156 1262 HB3 ASP 61 HB3 ASP 61 -13.522 -2.092 11.958 1263 H GLN 62 H GLN 62 -15.847 -2.128 14.700 1264 HA GLN 62 HA GLN 62 -17.801 -4.112 14.116 1265 HB2 GLN 62 HB2 GLN 62 -18.166 -1.144 14.711 1266 HB3 GLN 62 HB3 GLN 62 -19.434 -2.369 14.800 1267 HG2 GLN 62 HG2 GLN 62 -18.266 -3.486 16.645 1268 HG3 GLN 62 HG3 GLN 62 -16.929 -2.342 16.521 1269 HE21 GLN 62 HE21 GLN 62 -18.693 -0.010 16.120 1270 HE22 GLN 62 HE22 GLN 62 -19.411 0.309 17.653 1271 H ARG 63 H ARG 63 -16.721 -1.233 12.418 1272 HA ARG 63 HA ARG 63 -18.720 -1.398 10.303 1273 HB2 ARG 63 HB2 ARG 63 -16.417 0.505 10.805 1274 HB3 ARG 63 HB3 ARG 63 -17.280 0.509 9.272 1275 HG2 ARG 63 HG2 ARG 63 -18.156 2.266 10.657 1276 HG3 ARG 63 HG3 ARG 63 -19.394 1.027 10.479 1277 HD2 ARG 63 HD2 ARG 63 -19.271 1.926 12.780 1278 HD3 ARG 63 HD3 ARG 63 -18.937 0.194 12.719 1279 HE ARG 63 HE ARG 63 -16.472 1.256 12.595 1280 HH11 ARG 63 HH11 ARG 63 -19.087 1.873 14.859 1281 HH12 ARG 63 HH12 ARG 63 -18.008 2.239 16.166 1282 HH21 ARG 63 HH21 ARG 63 -15.097 1.623 14.328 1283 HH22 ARG 63 HH22 ARG 63 -15.752 2.094 15.865 1284 H LEU 64 H LEU 64 -15.611 -2.631 10.945 1285 HA LEU 64 HA LEU 64 -14.062 -2.456 8.753 1286 HB2 LEU 64 HB2 LEU 64 -13.855 -3.747 11.100 1287 HB3 LEU 64 HB3 LEU 64 -14.146 -5.149 10.101 1288 HG LEU 64 HG LEU 64 -11.750 -4.803 10.541 1289 HD11 LEU 64 HD11 LEU 64 -10.872 -4.981 8.300 1290 HD12 LEU 64 HD12 LEU 64 -12.380 -4.353 7.628 1291 HD13 LEU 64 HD13 LEU 64 -12.360 -5.906 8.469 1292 HD21 LEU 64 HD21 LEU 64 -10.497 -2.907 9.631 1293 HD22 LEU 64 HD22 LEU 64 -11.704 -2.368 10.792 1294 HD23 LEU 64 HD23 LEU 64 -11.993 -2.157 9.063 1295 H GLU 65 H GLU 65 -16.260 -5.268 9.224 1296 HA GLU 65 HA GLU 65 -15.664 -6.398 6.655 1297 HB2 GLU 65 HB2 GLU 65 -17.831 -7.111 8.654 1298 HB3 GLU 65 HB3 GLU 65 -17.480 -8.039 7.194 1299 HG2 GLU 65 HG2 GLU 65 -15.102 -8.281 8.074 1300 HG3 GLU 65 HG3 GLU 65 -15.690 -7.637 9.606 1301 H GLN 66 H GLN 66 -18.229 -4.321 7.816 1302 HA GLN 66 HA GLN 66 -19.972 -4.438 5.579 1303 HB2 GLN 66 HB2 GLN 66 -20.635 -3.416 7.719 1304 HB3 GLN 66 HB3 GLN 66 -19.414 -2.168 7.533 1305 HG2 GLN 66 HG2 GLN 66 -21.571 -1.229 7.034 1306 HG3 GLN 66 HG3 GLN 66 -20.625 -1.290 5.554 1307 HE21 GLN 66 HE21 GLN 66 -21.261 -2.720 3.899 1308 HE22 GLN 66 HE22 GLN 66 -22.820 -3.462 3.881 1309 H MET 67 H MET 67 -17.060 -2.578 6.263 1310 HA MET 67 HA MET 67 -17.170 -0.977 3.859 1311 HB2 MET 67 HB2 MET 67 -14.972 -1.344 5.936 1312 HB3 MET 67 HB3 MET 67 -14.897 -0.191 4.603 1313 HG2 MET 67 HG2 MET 67 -17.022 0.838 5.503 1314 HG3 MET 67 HG3 MET 67 -16.830 -0.188 6.926 1315 HE1 MET 67 HE1 MET 67 -15.863 3.496 8.076 1316 HE2 MET 67 HE2 MET 67 -17.003 2.171 8.304 1317 HE3 MET 67 HE3 MET 67 -17.022 3.103 6.806 1318 H ILE 68 H ILE 68 -15.579 -3.980 4.841 1319 HA ILE 68 HA ILE 68 -13.988 -4.409 2.535 1320 HB ILE 68 HB ILE 68 -15.432 -6.502 4.232 1321 HG12 ILE 68 HG12 ILE 68 -12.519 -5.593 4.439 1322 HG13 ILE 68 HG13 ILE 68 -13.803 -5.075 5.528 1323 HG21 ILE 68 HG21 ILE 68 -13.790 -8.133 3.324 1324 HG22 ILE 68 HG22 ILE 68 -13.125 -6.881 2.272 1325 HG23 ILE 68 HG23 ILE 68 -14.785 -7.434 2.048 1326 HD11 ILE 68 HD11 ILE 68 -12.478 -6.833 6.520 1327 HD12 ILE 68 HD12 ILE 68 -12.822 -7.902 5.163 1328 HD13 ILE 68 HD13 ILE 68 -14.125 -7.398 6.244 1329 H SER 69 H SER 69 -17.365 -5.138 3.303 1330 HA SER 69 HA SER 69 -18.074 -6.490 0.935 1331 HB2 SER 69 HB2 SER 69 -19.420 -6.553 3.049 1332 HB3 SER 69 HB3 SER 69 -19.900 -4.879 2.771 1333 HG SER 69 HG SER 69 -21.485 -6.311 1.994 1334 H GLN 70 H GLN 70 -17.893 -3.082 1.744 1335 HA GLN 70 HA GLN 70 -19.272 -2.085 -0.563 1336 HB2 GLN 70 HB2 GLN 70 -18.924 -0.851 1.641 1337 HB3 GLN 70 HB3 GLN 70 -17.250 -0.593 1.176 1338 HG2 GLN 70 HG2 GLN 70 -19.613 0.405 -0.448 1339 HG3 GLN 70 HG3 GLN 70 -18.837 1.351 0.815 1340 HE21 GLN 70 HE21 GLN 70 -16.123 0.521 0.143 1341 HE22 GLN 70 HE22 GLN 70 -15.714 1.300 -1.336 1342 H ILE 71 H ILE 71 -15.821 -2.380 0.304 1343 HA ILE 71 HA ILE 71 -14.837 -1.224 -2.109 1344 HB ILE 71 HB ILE 71 -13.706 -1.303 0.197 1345 HG12 ILE 71 HG12 ILE 71 -12.611 -0.511 -2.002 1346 HG13 ILE 71 HG13 ILE 71 -11.545 -0.895 -0.664 1347 HG21 ILE 71 HG21 ILE 71 -12.147 -3.136 0.682 1348 HG22 ILE 71 HG22 ILE 71 -12.766 -4.039 -0.705 1349 HG23 ILE 71 HG23 ILE 71 -13.825 -3.679 0.658 1350 HD11 ILE 71 HD11 ILE 71 -10.978 -3.018 -1.710 1351 HD12 ILE 71 HD12 ILE 71 -10.646 -1.659 -2.782 1352 HD13 ILE 71 HD13 ILE 71 -12.070 -2.662 -3.051 1353 H ASP 72 H ASP 72 -15.618 -4.449 -1.127 1354 HA ASP 72 HA ASP 72 -14.409 -6.022 -3.115 1355 HB2 ASP 72 HB2 ASP 72 -15.220 -7.396 -1.470 1356 HB3 ASP 72 HB3 ASP 72 -16.563 -6.351 -1.090 1357 H LYS 73 H LYS 73 -17.284 -4.019 -3.259 1358 HA LYS 73 HA LYS 73 -18.429 -5.262 -5.601 1359 HB2 LYS 73 HB2 LYS 73 -19.080 -2.536 -4.403 1360 HB3 LYS 73 HB3 LYS 73 -20.054 -3.416 -5.577 1361 HG2 LYS 73 HG2 LYS 73 -19.556 -4.131 -2.680 1362 HG3 LYS 73 HG3 LYS 73 -21.088 -3.679 -3.436 1363 HD2 LYS 73 HD2 LYS 73 -21.091 -5.768 -4.734 1364 HD3 LYS 73 HD3 LYS 73 -19.509 -6.204 -4.083 1365 HE2 LYS 73 HE2 LYS 73 -20.576 -6.165 -1.774 1366 HE3 LYS 73 HE3 LYS 73 -22.137 -6.041 -2.592 1367 HZ1 LYS 73 HZ1 LYS 73 -21.604 -8.127 -3.737 1368 HZ2 LYS 73 HZ2 LYS 73 -21.658 -8.309 -2.068 1369 HZ3 LYS 73 HZ3 LYS 73 -20.167 -8.245 -2.855 1370 H LEU 74 H LEU 74 -15.896 -3.013 -5.140 1371 HA LEU 74 HA LEU 74 -16.080 -1.625 -7.639 1372 HB2 LEU 74 HB2 LEU 74 -13.839 -1.980 -5.627 1373 HB3 LEU 74 HB3 LEU 74 -13.557 -1.181 -7.159 1374 HG LEU 74 HG LEU 74 -13.907 0.500 -5.458 1375 HD11 LEU 74 HD11 LEU 74 -15.737 1.806 -6.434 1376 HD12 LEU 74 HD12 LEU 74 -16.345 0.368 -7.256 1377 HD13 LEU 74 HD13 LEU 74 -14.768 1.032 -7.688 1378 HD21 LEU 74 HD21 LEU 74 -15.198 -0.820 -3.828 1379 HD22 LEU 74 HD22 LEU 74 -16.609 -0.769 -4.882 1380 HD23 LEU 74 HD23 LEU 74 -15.988 0.719 -4.162 1381 H GLU 75 H GLU 75 -15.188 -2.126 -9.586 1382 HA GLU 75 HA GLU 75 -15.150 -4.958 -10.120 1383 HB2 GLU 75 HB2 GLU 75 -14.902 -2.563 -11.985 1384 HB3 GLU 75 HB3 GLU 75 -15.162 -4.227 -12.509 1385 HG2 GLU 75 HG2 GLU 75 -17.341 -4.290 -11.463 1386 HG3 GLU 75 HG3 GLU 75 -17.075 -2.726 -10.695 1387 H ASP 76 H ASP 76 -12.706 -2.617 -9.622 1388 HA ASP 76 HA ASP 76 -10.530 -3.853 -10.988 1389 HB2 ASP 76 HB2 ASP 76 -9.095 -2.615 -9.298 1390 HB3 ASP 76 HB3 ASP 76 -10.153 -1.630 -10.296 1391 H VAL 77 H VAL 77 -11.864 -4.202 -7.707 1392 HA VAL 77 HA VAL 77 -10.170 -6.281 -6.823 1393 HB VAL 77 HB VAL 77 -13.016 -5.492 -6.023 1394 HG11 VAL 77 HG11 VAL 77 -11.294 -7.605 -4.652 1395 HG12 VAL 77 HG12 VAL 77 -12.769 -7.914 -5.567 1396 HG13 VAL 77 HG13 VAL 77 -12.846 -6.989 -4.070 1397 HG21 VAL 77 HG21 VAL 77 -11.191 -3.920 -5.442 1398 HG22 VAL 77 HG22 VAL 77 -10.364 -5.210 -4.555 1399 HG23 VAL 77 HG23 VAL 77 -11.937 -4.620 -4.002 1400 H VAL 78 H VAL 78 -9.831 -7.792 -8.346 1401 HA VAL 78 HA VAL 78 -11.814 -9.196 -9.856 1402 HB VAL 78 HB VAL 78 -8.982 -10.200 -9.239 1403 HG11 VAL 78 HG11 VAL 78 -10.434 -11.823 -10.397 1404 HG12 VAL 78 HG12 VAL 78 -9.113 -11.297 -11.441 1405 HG13 VAL 78 HG13 VAL 78 -10.738 -10.650 -11.685 1406 HG21 VAL 78 HG21 VAL 78 -9.735 -8.214 -11.425 1407 HG22 VAL 78 HG22 VAL 78 -8.153 -8.975 -11.225 1408 HG23 VAL 78 HG23 VAL 78 -8.761 -7.873 -9.990 1409 H LYS 79 H LYS 79 -10.074 -9.701 -6.830 1410 HA LYS 79 HA LYS 79 -11.968 -11.747 -5.901 1411 HB2 LYS 79 HB2 LYS 79 -8.937 -12.124 -5.827 1412 HB3 LYS 79 HB3 LYS 79 -10.094 -13.155 -4.987 1413 HG2 LYS 79 HG2 LYS 79 -11.048 -13.841 -7.168 1414 HG3 LYS 79 HG3 LYS 79 -9.861 -12.825 -7.992 1415 HD2 LYS 79 HD2 LYS 79 -8.030 -14.187 -7.019 1416 HD3 LYS 79 HD3 LYS 79 -9.226 -15.204 -6.207 1417 HE2 LYS 79 HE2 LYS 79 -10.144 -15.838 -8.447 1418 HE3 LYS 79 HE3 LYS 79 -8.854 -14.899 -9.208 1419 HZ1 LYS 79 HZ1 LYS 79 -7.231 -16.344 -8.151 1420 HZ2 LYS 79 HZ2 LYS 79 -8.311 -17.244 -9.091 1421 HZ3 LYS 79 HZ3 LYS 79 -8.468 -17.228 -7.408 1422 H VAL 80 H VAL 80 -12.093 -11.880 -3.611 1423 HA VAL 80 HA VAL 80 -10.419 -10.188 -1.911 1424 HB VAL 80 HB VAL 80 -12.254 -8.628 -2.590 1425 HG11 VAL 80 HG11 VAL 80 -14.159 -10.620 -1.319 1426 HG12 VAL 80 HG12 VAL 80 -14.032 -10.247 -3.038 1427 HG13 VAL 80 HG13 VAL 80 -14.583 -9.014 -1.911 1428 HG21 VAL 80 HG21 VAL 80 -11.232 -8.327 -0.377 1429 HG22 VAL 80 HG22 VAL 80 -12.387 -9.451 0.343 1430 HG23 VAL 80 HG23 VAL 80 -12.946 -7.909 -0.310 1431 H GLN 81 H GLN 81 -10.064 -11.252 0.023 1432 HA GLN 81 HA GLN 81 -12.036 -13.152 1.085 1433 HB2 GLN 81 HB2 GLN 81 -9.087 -13.871 0.753 1434 HB3 GLN 81 HB3 GLN 81 -10.297 -14.858 1.563 1435 HG2 GLN 81 HG2 GLN 81 -11.493 -15.150 -0.575 1436 HG3 GLN 81 HG3 GLN 81 -10.299 -14.137 -1.385 1437 HE21 GLN 81 HE21 GLN 81 -9.691 -15.756 -2.815 1438 HE22 GLN 81 HE22 GLN 81 -8.807 -17.160 -2.338 1439 H ARG 82 H ARG 82 -12.081 -13.275 3.277 1440 HA ARG 82 HA ARG 82 -10.461 -11.327 4.833 1441 HB2 ARG 82 HB2 ARG 82 -13.090 -12.650 5.651 1442 HB3 ARG 82 HB3 ARG 82 -12.306 -11.260 6.398 1443 HG2 ARG 82 HG2 ARG 82 -12.822 -9.867 4.463 1444 HG3 ARG 82 HG3 ARG 82 -13.473 -11.263 3.597 1445 HD2 ARG 82 HD2 ARG 82 -15.194 -11.494 5.429 1446 HD3 ARG 82 HD3 ARG 82 -14.605 -9.965 6.092 1447 HE ARG 82 HE ARG 82 -15.250 -9.584 3.386 1448 HH11 ARG 82 HH11 ARG 82 -16.876 -10.267 6.413 1449 HH12 ARG 82 HH12 ARG 82 -18.351 -9.489 5.937 1450 HH21 ARG 82 HH21 ARG 82 -17.196 -8.559 2.765 1451 HH22 ARG 82 HH22 ARG 82 -18.533 -8.521 3.869 1452 H ASN 83 H ASN 83 -8.851 -12.283 5.998 1453 HA ASN 83 HA ASN 83 -9.228 -15.051 7.019 1454 HB2 ASN 83 HB2 ASN 83 -6.721 -13.819 5.793 1455 HB3 ASN 83 HB3 ASN 83 -6.737 -15.355 6.655 1456 HD21 ASN 83 HD21 ASN 83 -9.235 -16.364 5.622 1457 HD22 ASN 83 HD22 ASN 83 -8.995 -16.712 3.950 1458 H GLN 84 H GLN 84 -9.177 -15.079 9.186 1459 HA GLN 84 HA GLN 84 -8.015 -12.848 10.690 1460 HB2 GLN 84 HB2 GLN 84 -9.279 -15.314 11.946 1461 HB3 GLN 84 HB3 GLN 84 -9.146 -13.696 12.614 1462 HG2 GLN 84 HG2 GLN 84 -11.008 -14.590 10.397 1463 HG3 GLN 84 HG3 GLN 84 -11.453 -14.253 12.064 1464 HE21 GLN 84 HE21 GLN 84 -12.930 -12.691 11.600 1465 HE22 GLN 84 HE22 GLN 84 -12.531 -11.158 10.922 1466 H SER 85 H SER 85 -5.797 -13.082 10.416 1467 HA SER 85 HA SER 85 -4.489 -15.434 11.561 1468 HB2 SER 85 HB2 SER 85 -4.918 -15.920 9.109 1469 HB3 SER 85 HB3 SER 85 -3.908 -14.534 8.701 1470 HG SER 85 HG SER 85 -3.084 -16.924 9.001 1471 H ASP 86 H ASP 86 -1.940 -15.001 11.094 1472 HA ASP 86 HA ASP 86 -1.446 -12.575 12.666 1473 HB2 ASP 86 HB2 ASP 86 0.292 -15.030 12.118 1474 HB3 ASP 86 HB3 ASP 86 0.742 -13.698 13.184 1475 HA PRO 87 HA PRO 87 0.807 -10.330 9.448 1476 HB2 PRO 87 HB2 PRO 87 2.785 -9.084 10.924 1477 HB3 PRO 87 HB3 PRO 87 1.079 -8.597 10.996 1478 HG2 PRO 87 HG2 PRO 87 2.600 -10.391 12.866 1479 HG3 PRO 87 HG3 PRO 87 1.512 -9.032 13.243 1480 HD2 PRO 87 HD2 PRO 87 0.637 -11.563 13.380 1481 HD3 PRO 87 HD3 PRO 87 -0.420 -10.265 12.786 1482 H THR 88 H THR 88 2.273 -12.908 11.154 1483 HA THR 88 HA THR 88 4.828 -12.989 9.881 1484 HB THR 88 HB THR 88 4.796 -15.418 10.537 1485 HG1 THR 88 HG1 THR 88 2.865 -16.257 10.773 1486 HG21 THR 88 HG21 THR 88 5.581 -13.726 12.167 1487 HG22 THR 88 HG22 THR 88 4.747 -15.050 12.979 1488 HG23 THR 88 HG23 THR 88 3.924 -13.507 12.743 1489 H MET 89 H MET 89 1.602 -13.996 8.959 1490 HA MET 89 HA MET 89 2.197 -15.592 6.696 1491 HB2 MET 89 HB2 MET 89 -0.233 -13.824 7.204 1492 HB3 MET 89 HB3 MET 89 -0.130 -15.074 5.963 1493 HG2 MET 89 HG2 MET 89 -0.009 -15.508 8.955 1494 HG3 MET 89 HG3 MET 89 -1.367 -15.878 7.889 1495 HE1 MET 89 HE1 MET 89 0.101 -19.408 8.991 1496 HE2 MET 89 HE2 MET 89 -1.346 -18.402 8.982 1497 HE3 MET 89 HE3 MET 89 0.048 -17.937 9.962 1498 H PHE 90 H PHE 90 1.642 -12.116 7.068 1499 HA PHE 90 HA PHE 90 1.956 -11.128 4.505 1500 HB2 PHE 90 HB2 PHE 90 1.407 -9.438 5.988 1501 HB3 PHE 90 HB3 PHE 90 2.397 -10.088 7.277 1502 HD1 PHE 90 HD1 PHE 90 2.511 -8.014 4.179 1503 HD2 PHE 90 HD2 PHE 90 4.587 -9.202 7.728 1504 HE1 PHE 90 HE1 PHE 90 4.178 -6.249 3.803 1505 HE2 PHE 90 HE2 PHE 90 6.248 -7.436 7.341 1506 HZ PHE 90 HZ PHE 90 6.052 -5.958 5.379 1507 H ASN 91 H ASN 91 4.523 -12.014 6.818 1508 HA ASN 91 HA ASN 91 6.734 -11.256 5.163 1509 HB2 ASN 91 HB2 ASN 91 7.004 -11.472 7.589 1510 HB3 ASN 91 HB3 ASN 91 6.536 -13.165 7.527 1511 HD21 ASN 91 HD21 ASN 91 9.070 -10.875 6.719 1512 HD22 ASN 91 HD22 ASN 91 10.329 -12.051 6.596 1513 H LYS 92 H LYS 92 5.090 -14.319 5.808 1514 HA LYS 92 HA LYS 92 6.750 -16.152 4.558 1515 HB2 LYS 92 HB2 LYS 92 4.912 -16.774 6.067 1516 HB3 LYS 92 HB3 LYS 92 3.724 -16.202 4.902 1517 HG2 LYS 92 HG2 LYS 92 4.450 -17.988 3.319 1518 HG3 LYS 92 HG3 LYS 92 5.584 -18.578 4.541 1519 HD2 LYS 92 HD2 LYS 92 3.652 -19.001 6.078 1520 HD3 LYS 92 HD3 LYS 92 2.548 -18.480 4.800 1521 HE2 LYS 92 HE2 LYS 92 2.703 -20.939 4.922 1522 HE3 LYS 92 HE3 LYS 92 3.298 -20.336 3.375 1523 HZ1 LYS 92 HZ1 LYS 92 5.555 -20.585 4.174 1524 HZ2 LYS 92 HZ2 LYS 92 4.729 -22.055 4.316 1525 HZ3 LYS 92 HZ3 LYS 92 5.000 -21.104 5.687 1526 H ILE 93 H ILE 93 3.979 -14.416 3.202 1527 HA ILE 93 HA ILE 93 4.181 -15.685 0.599 1528 HB ILE 93 HB ILE 93 2.189 -14.320 0.024 1529 HG12 ILE 93 HG12 ILE 93 2.884 -12.943 2.630 1530 HG13 ILE 93 HG13 ILE 93 2.346 -12.242 1.113 1531 HG21 ILE 93 HG21 ILE 93 0.636 -15.378 1.622 1532 HG22 ILE 93 HG22 ILE 93 1.975 -15.712 2.721 1533 HG23 ILE 93 HG23 ILE 93 1.911 -16.496 1.143 1534 HD11 ILE 93 HD11 ILE 93 0.673 -11.913 2.780 1535 HD12 ILE 93 HD12 ILE 93 0.660 -13.627 3.186 1536 HD13 ILE 93 HD13 ILE 93 0.056 -13.088 1.618 1537 H ALA 94 H ALA 94 5.205 -12.667 2.060 1538 HA ALA 94 HA ALA 94 5.929 -11.225 -0.276 1539 HB1 ALA 94 HB1 ALA 94 7.138 -11.100 2.515 1540 HB2 ALA 94 HB2 ALA 94 5.771 -10.152 1.929 1541 HB3 ALA 94 HB3 ALA 94 7.374 -9.898 1.237 1542 H VAL 95 H VAL 95 7.654 -13.624 1.704 1543 HA VAL 95 HA VAL 95 10.123 -13.330 0.192 1544 HB VAL 95 HB VAL 95 10.197 -13.634 2.661 1545 HG11 VAL 95 HG11 VAL 95 9.272 -16.479 2.139 1546 HG12 VAL 95 HG12 VAL 95 8.370 -15.219 2.983 1547 HG13 VAL 95 HG13 VAL 95 9.858 -15.855 3.684 1548 HG21 VAL 95 HG21 VAL 95 12.195 -14.137 1.317 1549 HG22 VAL 95 HG22 VAL 95 11.667 -15.808 1.112 1550 HG23 VAL 95 HG23 VAL 95 12.104 -15.211 2.714 1551 H PHE 96 H PHE 96 7.413 -15.534 0.302 1552 HA PHE 96 HA PHE 96 8.705 -17.595 -1.310 1553 HB2 PHE 96 HB2 PHE 96 7.035 -18.117 0.507 1554 HB3 PHE 96 HB3 PHE 96 5.782 -17.354 -0.464 1555 HD1 PHE 96 HD1 PHE 96 8.192 -20.218 -0.386 1556 HD2 PHE 96 HD2 PHE 96 4.675 -18.606 -2.207 1557 HE1 PHE 96 HE1 PHE 96 7.777 -22.371 -1.496 1558 HE2 PHE 96 HE2 PHE 96 4.261 -20.764 -3.310 1559 HZ PHE 96 HZ PHE 96 5.809 -22.654 -2.955 1560 H PHE 97 H PHE 97 6.609 -14.850 -1.761 1561 HA PHE 97 HA PHE 97 5.660 -13.769 -3.477 1562 HB2 PHE 97 HB2 PHE 97 7.648 -15.346 -5.159 1563 HB3 PHE 97 HB3 PHE 97 6.587 -14.116 -5.833 1564 HD1 PHE 97 HD2 PHE 97 6.824 -11.718 -5.065 1565 HD2 PHE 97 HD1 PHE 97 9.691 -14.719 -4.034 1566 HE1 PHE 97 HE2 PHE 97 8.463 -9.969 -4.537 1567 HE2 PHE 97 HE1 PHE 97 11.321 -12.962 -3.507 1568 HZ PHE 97 HZ PHE 97 10.715 -10.587 -3.759 1569 H GLN 98 H GLN 98 3.782 -15.018 -2.778 1570 HA GLN 98 HA GLN 98 2.375 -15.999 -5.082 1571 HB2 GLN 98 HB2 GLN 98 3.574 -18.080 -4.227 1572 HB3 GLN 98 HB3 GLN 98 2.660 -17.955 -2.739 1573 HG2 GLN 98 HG2 GLN 98 1.339 -18.286 -5.451 1574 HG3 GLN 98 HG3 GLN 98 1.869 -19.656 -4.490 1575 HE21 GLN 98 HE21 GLN 98 -0.500 -17.143 -4.829 1576 HE22 GLN 98 HE22 GLN 98 -1.582 -17.694 -3.601 Start of MODEL 2 1 H1 GLY 1 H1 GLY 1 8.480 10.310 -21.217 2 H2 GLY 1 H2 GLY 1 9.400 10.739 -19.870 3 H3 GLY 1 H3 GLY 1 7.759 10.382 -19.693 4 HA2 GLY 1 HA3 GLY 1 9.893 8.500 -20.489 5 HA3 GLY 1 HA2 GLY 1 9.106 8.563 -18.918 6 H SER 2 H SER 2 9.240 6.294 -20.550 7 HA SER 2 HA SER 2 6.704 5.809 -21.834 8 HB2 SER 2 HB2 SER 2 8.864 4.698 -22.515 9 HB3 SER 2 HB3 SER 2 8.879 3.843 -20.974 10 HG SER 2 HG SER 2 8.000 2.604 -22.694 11 H MET 3 H MET 3 5.940 3.288 -20.865 12 HA MET 3 HA MET 3 5.742 3.417 -17.938 13 HB2 MET 3 HB2 MET 3 3.322 2.994 -17.947 14 HB3 MET 3 HB3 MET 3 3.695 4.517 -18.725 15 HG2 MET 3 HG2 MET 3 2.034 3.671 -20.101 16 HG3 MET 3 HG3 MET 3 3.482 3.114 -20.942 17 HE1 MET 3 HE1 MET 3 1.991 1.307 -22.281 18 HE2 MET 3 HE2 MET 3 0.550 1.868 -21.431 19 HE3 MET 3 HE3 MET 3 0.932 0.148 -21.478 20 H GLN 4 H GLN 4 6.762 1.616 -17.344 21 HA GLN 4 HA GLN 4 6.122 -0.969 -18.640 22 HB2 GLN 4 HB2 GLN 4 8.955 -0.170 -17.841 23 HB3 GLN 4 HB3 GLN 4 8.465 -1.636 -18.684 24 HG2 GLN 4 HG2 GLN 4 7.877 -0.272 -20.667 25 HG3 GLN 4 HG3 GLN 4 8.361 1.186 -19.806 26 HE21 GLN 4 HE21 GLN 4 10.601 1.514 -19.367 27 HE22 GLN 4 HE22 GLN 4 11.818 0.689 -20.271 28 H ASN 5 H ASN 5 6.994 -2.799 -17.331 29 HA ASN 5 HA ASN 5 7.439 -2.500 -14.521 30 HB2 ASN 5 HB2 ASN 5 5.366 -3.829 -13.840 31 HB3 ASN 5 HB3 ASN 5 5.040 -2.189 -14.374 32 HD21 ASN 5 HD21 ASN 5 4.045 -1.885 -16.442 33 HD22 ASN 5 HD22 ASN 5 3.122 -3.145 -17.178 34 H THR 6 H THR 6 9.135 -3.882 -14.428 35 HA THR 6 HA THR 6 8.880 -6.641 -15.432 36 HB THR 6 HB THR 6 11.285 -6.398 -16.422 37 HG1 THR 6 HG1 THR 6 11.504 -4.081 -17.208 38 HG21 THR 6 HG21 THR 6 10.488 -5.568 -18.608 39 HG22 THR 6 HG22 THR 6 9.019 -4.952 -17.847 40 HG23 THR 6 HG23 THR 6 9.324 -6.690 -17.898 41 H THR 7 H THR 7 11.650 -4.667 -14.235 42 HA THR 7 HA THR 7 11.809 -5.965 -11.678 43 HB THR 7 HB THR 7 14.052 -6.698 -13.641 44 HG1 THR 7 HG1 THR 7 11.811 -8.164 -12.746 45 HG21 THR 7 HG21 THR 7 14.865 -8.155 -11.829 46 HG22 THR 7 HG22 THR 7 13.546 -7.620 -10.788 47 HG23 THR 7 HG23 THR 7 14.799 -6.477 -11.281 48 H HIS 8 H HIS 8 13.786 -4.394 -14.225 49 HA HIS 8 HA HIS 8 14.566 -2.312 -12.259 50 HB2 HIS 8 HB2 HIS 8 16.823 -2.169 -13.278 51 HB3 HIS 8 HB3 HIS 8 16.524 -3.734 -12.547 52 HD1 HIS 8 HD1 HIS 8 16.245 -5.786 -14.227 53 HD2 HIS 8 HD2 HIS 8 17.511 -2.233 -15.968 54 HE1 HIS 8 HE1 HIS 8 17.182 -6.419 -16.462 55 HE2 HIS 8 HE2 HIS 8 17.803 -4.237 -17.547 56 H ASP 9 H ASP 9 12.943 -1.046 -12.947 57 HA ASP 9 HA ASP 9 13.456 0.878 -14.957 58 HB2 ASP 9 HB2 ASP 9 12.507 -0.862 -16.514 59 HB3 ASP 9 HB3 ASP 9 11.029 -0.889 -15.546 60 H ASN 10 H ASN 10 11.189 -0.762 -12.934 61 HA ASN 10 HA ASN 10 9.830 1.540 -11.933 62 HB2 ASN 10 HB2 ASN 10 8.996 -0.022 -10.178 63 HB3 ASN 10 HB3 ASN 10 8.790 -0.703 -11.787 64 HD21 ASN 10 HD21 ASN 10 8.979 -2.048 -9.158 65 HD22 ASN 10 HD22 ASN 10 10.276 -3.178 -9.313 66 H VAL 11 H VAL 11 10.065 2.132 -9.602 67 HA VAL 11 HA VAL 11 12.775 1.891 -8.483 68 HB VAL 11 HB VAL 11 12.632 4.321 -7.723 69 HG11 VAL 11 HG11 VAL 11 12.817 3.878 -10.721 70 HG12 VAL 11 HG12 VAL 11 14.120 3.659 -9.551 71 HG13 VAL 11 HG13 VAL 11 13.461 5.270 -9.841 72 HG21 VAL 11 HG21 VAL 11 10.190 4.662 -8.084 73 HG22 VAL 11 HG22 VAL 11 10.433 4.548 -9.826 74 HG23 VAL 11 HG23 VAL 11 11.147 5.886 -8.925 75 H ILE 12 H ILE 12 12.847 2.185 -6.257 76 HA ILE 12 HA ILE 12 10.393 1.308 -4.884 77 HB ILE 12 HB ILE 12 13.288 1.138 -3.903 78 HG12 ILE 12 HG12 ILE 12 12.999 -0.133 -6.053 79 HG13 ILE 12 HG13 ILE 12 13.439 -1.150 -4.691 80 HG21 ILE 12 HG21 ILE 12 10.821 -0.396 -3.070 81 HG22 ILE 12 HG22 ILE 12 11.594 0.898 -2.156 82 HG23 ILE 12 HG23 ILE 12 12.447 -0.626 -2.419 83 HD11 ILE 12 HD11 ILE 12 10.686 -0.869 -5.892 84 HD12 ILE 12 HD12 ILE 12 11.116 -1.908 -4.531 85 HD13 ILE 12 HD13 ILE 12 11.806 -2.211 -6.124 86 H LEU 13 H LEU 13 9.448 3.358 -4.459 87 HA LEU 13 HA LEU 13 11.092 5.553 -3.462 88 HB2 LEU 13 HB2 LEU 13 8.127 5.427 -4.135 89 HB3 LEU 13 HB3 LEU 13 8.964 6.883 -3.605 90 HG LEU 13 HG LEU 13 9.521 5.352 -6.185 91 HD11 LEU 13 HD11 LEU 13 8.630 7.319 -7.331 92 HD12 LEU 13 HD12 LEU 13 8.236 8.067 -5.779 93 HD13 LEU 13 HD13 LEU 13 7.416 6.585 -6.283 94 HD21 LEU 13 HD21 LEU 13 11.588 6.330 -5.299 95 HD22 LEU 13 HD22 LEU 13 10.805 7.906 -5.146 96 HD23 LEU 13 HD23 LEU 13 11.060 7.192 -6.741 97 H GLU 14 H GLU 14 11.623 5.422 -1.389 98 HA GLU 14 HA GLU 14 9.926 4.047 0.540 99 HB2 GLU 14 HB2 GLU 14 12.357 3.571 0.447 100 HB3 GLU 14 HB3 GLU 14 12.707 5.245 0.856 101 HG2 GLU 14 HG2 GLU 14 11.635 4.952 3.054 102 HG3 GLU 14 HG3 GLU 14 11.213 3.288 2.633 103 H LEU 15 H LEU 15 8.251 5.427 0.824 104 HA LEU 15 HA LEU 15 8.611 8.163 1.763 105 HB2 LEU 15 HB2 LEU 15 6.250 6.455 0.974 106 HB3 LEU 15 HB3 LEU 15 5.962 7.828 2.024 107 HG LEU 15 HG LEU 15 5.535 8.335 -0.369 108 HD11 LEU 15 HD11 LEU 15 6.079 10.133 1.177 109 HD12 LEU 15 HD12 LEU 15 6.699 10.476 -0.434 110 HD13 LEU 15 HD13 LEU 15 7.803 9.935 0.836 111 HD21 LEU 15 HD21 LEU 15 7.267 6.916 -1.404 112 HD22 LEU 15 HD22 LEU 15 8.523 7.987 -0.780 113 HD23 LEU 15 HD23 LEU 15 7.364 8.581 -1.973 114 H THR 16 H THR 16 9.359 8.250 3.746 115 HA THR 16 HA THR 16 8.560 6.420 5.871 116 HB THR 16 HB THR 16 10.436 8.834 5.863 117 HG1 THR 16 HG1 THR 16 11.322 7.073 4.738 118 HG21 THR 16 HG21 THR 16 11.145 8.123 8.110 119 HG22 THR 16 HG22 THR 16 9.981 6.797 8.077 120 HG23 THR 16 HG23 THR 16 9.406 8.469 8.110 121 H VAL 17 H VAL 17 6.408 6.860 6.283 122 HA VAL 17 HA VAL 17 5.681 9.628 7.039 123 HB VAL 17 HB VAL 17 3.519 9.421 6.182 124 HG11 VAL 17 HG11 VAL 17 3.703 8.762 3.813 125 HG12 VAL 17 HG12 VAL 17 5.213 7.914 4.164 126 HG13 VAL 17 HG13 VAL 17 5.122 9.669 4.347 127 HG21 VAL 17 HG21 VAL 17 2.456 7.300 5.375 128 HG22 VAL 17 HG22 VAL 17 2.833 7.287 7.098 129 HG23 VAL 17 HG23 VAL 17 3.869 6.417 5.968 130 H ARG 18 H ARG 18 4.426 9.907 8.893 131 HA ARG 18 HA ARG 18 4.005 7.538 10.621 132 HB2 ARG 18 HB2 ARG 18 3.580 9.196 12.446 133 HB3 ARG 18 HB3 ARG 18 5.201 9.264 11.763 134 HG2 ARG 18 HG2 ARG 18 4.398 11.261 10.381 135 HG3 ARG 18 HG3 ARG 18 2.941 11.248 11.391 136 HD2 ARG 18 HD2 ARG 18 5.804 11.570 12.362 137 HD3 ARG 18 HD3 ARG 18 4.597 12.847 12.244 138 HE ARG 18 HE ARG 18 4.174 10.522 14.035 139 HH11 ARG 18 HH11 ARG 18 4.526 14.006 13.654 140 HH12 ARG 18 HH12 ARG 18 4.061 14.352 15.285 141 HH21 ARG 18 HH21 ARG 18 3.598 10.982 16.166 142 HH22 ARG 18 HH22 ARG 18 3.535 12.624 16.717 143 H ASN 19 H ASN 19 1.992 6.722 10.840 144 HA ASN 19 HA ASN 19 0.272 7.482 8.699 145 HB2 ASN 19 HB2 ASN 19 -0.976 5.408 9.159 146 HB3 ASN 19 HB3 ASN 19 0.746 5.143 8.954 147 HD21 ASN 19 HD21 ASN 19 -1.172 3.406 10.140 148 HD22 ASN 19 HD22 ASN 19 -0.668 3.106 11.760 149 H HIS 20 H HIS 20 -0.497 9.444 9.324 150 HA HIS 20 HA HIS 20 -2.635 9.733 11.250 151 HB2 HIS 20 HB2 HIS 20 -2.064 11.416 8.759 152 HB3 HIS 20 HB3 HIS 20 -3.010 11.903 10.150 153 HD1 HIS 20 HD1 HIS 20 -0.480 13.402 8.977 154 HD2 HIS 20 HD2 HIS 20 -0.502 10.949 12.339 155 HE1 HIS 20 HE1 HIS 20 1.500 14.112 10.347 156 HE2 HIS 20 HE2 HIS 20 1.335 12.768 12.465 157 HA PRO 21 HA PRO 21 -6.241 7.916 9.243 158 HB2 PRO 21 HB2 PRO 21 -7.275 10.674 8.521 159 HB3 PRO 21 HB3 PRO 21 -8.146 9.292 9.231 160 HG2 PRO 21 HG2 PRO 21 -7.382 11.265 10.802 161 HG3 PRO 21 HG3 PRO 21 -7.176 9.582 11.344 162 HD2 PRO 21 HD2 PRO 21 -5.093 11.510 10.355 163 HD3 PRO 21 HD3 PRO 21 -4.964 10.248 11.601 164 H GLY 22 H GLY 22 -5.311 6.884 7.502 165 HA2 GLY 22 HA2 GLY 22 -5.210 6.176 5.348 166 HA3 GLY 22 HA3 GLY 22 -6.451 7.355 4.984 167 H VAL 23 H VAL 23 -3.070 7.799 6.049 168 HA VAL 23 HA VAL 23 -2.514 9.831 4.118 169 HB VAL 23 HB VAL 23 -0.136 9.681 4.873 170 HG11 VAL 23 HG11 VAL 23 -0.590 10.423 7.200 171 HG12 VAL 23 HG12 VAL 23 -2.233 9.793 7.067 172 HG13 VAL 23 HG13 VAL 23 -1.713 11.125 6.033 173 HG21 VAL 23 HG21 VAL 23 0.480 8.175 6.738 174 HG22 VAL 23 HG22 VAL 23 0.002 7.248 5.314 175 HG23 VAL 23 HG23 VAL 23 -1.117 7.416 6.670 176 H MET 24 H MET 24 -2.265 6.385 3.967 177 HA MET 24 HA MET 24 -0.346 6.045 1.955 178 HB2 MET 24 HB2 MET 24 -2.790 4.306 2.432 179 HB3 MET 24 HB3 MET 24 -1.360 3.847 1.517 180 HG2 MET 24 HG2 MET 24 -1.183 2.825 3.659 181 HG3 MET 24 HG3 MET 24 -0.017 4.147 3.626 182 HE1 MET 24 HE1 MET 24 -1.172 4.087 7.381 183 HE2 MET 24 HE2 MET 24 0.207 4.002 6.282 184 HE3 MET 24 HE3 MET 24 -0.974 2.688 6.328 185 H THR 25 H THR 25 -3.682 7.130 1.707 186 HA THR 25 HA THR 25 -4.062 6.849 -1.076 187 HB THR 25 HB THR 25 -5.789 8.609 -0.906 188 HG1 THR 25 HG1 THR 25 -5.635 9.072 1.773 189 HG21 THR 25 HG21 THR 25 -5.820 6.739 1.490 190 HG22 THR 25 HG22 THR 25 -6.400 6.353 -0.134 191 HG23 THR 25 HG23 THR 25 -7.225 7.584 0.828 192 H HIS 26 H HIS 26 -2.305 9.251 0.815 193 HA HIS 26 HA HIS 26 -1.891 11.247 -1.148 194 HB2 HIS 26 HB2 HIS 26 -0.025 10.474 1.148 195 HB3 HIS 26 HB3 HIS 26 0.087 11.962 0.218 196 HD1 HIS 26 HD1 HIS 26 -0.070 12.281 3.134 197 HD2 HIS 26 HD2 HIS 26 -3.503 11.996 0.796 198 HE1 HIS 26 HE1 HIS 26 -1.887 13.379 4.461 199 HE2 HIS 26 HE2 HIS 26 -3.898 13.364 2.949 200 H VAL 27 H VAL 27 0.124 8.464 -0.152 201 HA VAL 27 HA VAL 27 2.253 9.057 -1.948 202 HB VAL 27 HB VAL 27 3.282 6.959 -1.227 203 HG11 VAL 27 HG11 VAL 27 3.445 8.855 0.315 204 HG12 VAL 27 HG12 VAL 27 3.373 7.346 1.223 205 HG13 VAL 27 HG13 VAL 27 1.942 8.379 1.111 206 HG21 VAL 27 HG21 VAL 27 0.660 6.277 0.157 207 HG22 VAL 27 HG22 VAL 27 2.170 5.377 0.325 208 HG23 VAL 27 HG23 VAL 27 1.350 5.444 -1.235 209 H CYS 28 H CYS 28 -0.400 6.673 -2.051 210 HA CYS 28 HA CYS 28 0.259 5.394 -4.477 211 HB2 CYS 28 HB2 CYS 28 -1.337 4.339 -2.993 212 HB3 CYS 28 HB3 CYS 28 -2.409 5.738 -3.049 213 HG CYS 28 HG CYS 28 -1.899 4.641 -6.104 214 H GLY 29 H GLY 29 -1.913 8.105 -3.708 215 HA2 GLY 29 HA2 GLY 29 -2.968 8.495 -6.299 216 HA3 GLY 29 HA3 GLY 29 -3.005 9.647 -4.979 217 H LEU 30 H LEU 30 -0.163 9.887 -4.651 218 HA LEU 30 HA LEU 30 0.232 12.091 -6.371 219 HB2 LEU 30 HB2 LEU 30 1.431 11.090 -3.978 220 HB3 LEU 30 HB3 LEU 30 2.743 11.242 -5.123 221 HG LEU 30 HG LEU 30 2.549 13.254 -3.743 222 HD11 LEU 30 HD11 LEU 30 1.746 13.827 -6.608 223 HD12 LEU 30 HD12 LEU 30 3.386 13.548 -6.012 224 HD13 LEU 30 HD13 LEU 30 2.492 14.970 -5.482 225 HD21 LEU 30 HD21 LEU 30 0.145 13.162 -3.222 226 HD22 LEU 30 HD22 LEU 30 -0.244 13.621 -4.884 227 HD23 LEU 30 HD23 LEU 30 0.618 14.748 -3.830 228 H PHE 31 H PHE 31 1.787 8.861 -6.270 229 HA PHE 31 HA PHE 31 3.450 9.525 -8.584 230 HB2 PHE 31 HB2 PHE 31 3.194 6.881 -7.101 231 HB3 PHE 31 HB3 PHE 31 4.468 7.322 -8.246 232 HD1 PHE 31 HD2 PHE 31 5.260 10.023 -7.517 233 HD2 PHE 31 HD1 PHE 31 4.158 6.796 -4.932 234 HE1 PHE 31 HE2 PHE 31 6.516 11.059 -5.679 235 HE2 PHE 31 HE1 PHE 31 5.408 7.843 -3.102 236 HZ PHE 31 HZ PHE 31 6.592 9.976 -3.467 237 H ALA 32 H ALA 32 0.436 7.824 -8.048 238 HA ALA 32 HA ALA 32 0.263 6.512 -10.587 239 HB1 ALA 32 HB1 ALA 32 -1.057 5.787 -8.640 240 HB2 ALA 32 HB2 ALA 32 -2.102 6.144 -10.018 241 HB3 ALA 32 HB3 ALA 32 -1.969 7.298 -8.684 242 H ARG 33 H ARG 33 -0.713 9.720 -9.419 243 HA ARG 33 HA ARG 33 -2.377 10.373 -11.676 244 HB2 ARG 33 HB2 ARG 33 -2.670 12.547 -10.672 245 HB3 ARG 33 HB3 ARG 33 -2.704 11.348 -9.382 246 HG2 ARG 33 HG2 ARG 33 -0.248 11.919 -8.959 247 HG3 ARG 33 HG3 ARG 33 -0.464 13.290 -10.051 248 HD2 ARG 33 HD2 ARG 33 -2.013 12.782 -7.486 249 HD3 ARG 33 HD3 ARG 33 -0.696 13.943 -7.676 250 HE ARG 33 HE ARG 33 -2.509 14.679 -9.584 251 HH11 ARG 33 HH11 ARG 33 -2.710 14.267 -6.087 252 HH12 ARG 33 HH12 ARG 33 -3.950 15.463 -5.901 253 HH21 ARG 33 HH21 ARG 33 -4.132 16.229 -9.319 254 HH22 ARG 33 HH22 ARG 33 -4.762 16.575 -7.739 255 H ARG 34 H ARG 34 0.967 10.225 -11.354 256 HA ARG 34 HA ARG 34 1.805 12.459 -12.901 257 HB2 ARG 34 HB2 ARG 34 3.277 11.016 -11.415 258 HB3 ARG 34 HB3 ARG 34 3.160 9.742 -12.627 259 HG2 ARG 34 HG2 ARG 34 4.065 11.755 -14.213 260 HG3 ARG 34 HG3 ARG 34 4.728 12.300 -12.670 261 HD2 ARG 34 HD2 ARG 34 6.390 10.960 -13.785 262 HD3 ARG 34 HD3 ARG 34 5.781 10.047 -12.398 263 HE ARG 34 HE ARG 34 4.635 9.575 -15.069 264 HH11 ARG 34 HH11 ARG 34 6.509 8.313 -12.377 265 HH12 ARG 34 HH12 ARG 34 6.445 6.679 -12.949 266 HH21 ARG 34 HH21 ARG 34 4.615 7.460 -15.820 267 HH22 ARG 34 HH22 ARG 34 5.374 6.207 -14.896 268 H ALA 35 H ALA 35 1.358 8.977 -13.723 269 HA ALA 35 HA ALA 35 -0.007 9.381 -16.143 270 HB1 ALA 35 HB1 ALA 35 2.143 10.234 -17.005 271 HB2 ALA 35 HB2 ALA 35 1.688 8.737 -17.819 272 HB3 ALA 35 HB3 ALA 35 2.935 8.719 -16.567 273 H PHE 36 H PHE 36 2.424 7.212 -14.664 274 HA PHE 36 HA PHE 36 0.980 4.820 -15.600 275 HB2 PHE 36 HB2 PHE 36 3.425 4.925 -15.979 276 HB3 PHE 36 HB3 PHE 36 3.701 5.133 -14.257 277 HD1 PHE 36 HD2 PHE 36 1.794 2.687 -16.429 278 HD2 PHE 36 HD1 PHE 36 4.593 3.222 -13.230 279 HE1 PHE 36 HE2 PHE 36 2.014 0.248 -16.198 280 HE2 PHE 36 HE1 PHE 36 4.804 0.786 -13.012 281 HZ PHE 36 HZ PHE 36 3.519 -0.706 -14.495 282 H ASN 37 H ASN 37 0.059 3.351 -14.225 283 HA ASN 37 HA ASN 37 -0.777 4.156 -11.597 284 HB2 ASN 37 HB2 ASN 37 -1.049 1.381 -12.853 285 HB3 ASN 37 HB3 ASN 37 -2.007 2.041 -11.529 286 HD21 ASN 37 HD21 ASN 37 -3.066 0.923 -13.877 287 HD22 ASN 37 HD22 ASN 37 -3.905 2.165 -14.737 288 H VAL 38 H VAL 38 -0.265 3.072 -9.609 289 HA VAL 38 HA VAL 38 2.450 2.403 -9.195 290 HB VAL 38 HB VAL 38 0.053 1.866 -7.377 291 HG11 VAL 38 HG11 VAL 38 1.710 1.692 -5.535 292 HG12 VAL 38 HG12 VAL 38 3.023 1.828 -6.708 293 HG13 VAL 38 HG13 VAL 38 1.943 0.430 -6.751 294 HG21 VAL 38 HG21 VAL 38 0.710 3.921 -6.181 295 HG22 VAL 38 HG22 VAL 38 0.346 4.281 -7.871 296 HG23 VAL 38 HG23 VAL 38 2.028 4.192 -7.328 297 H GLU 39 H GLU 39 3.473 0.532 -9.538 298 HA GLU 39 HA GLU 39 2.227 -1.903 -10.395 299 HB2 GLU 39 HB2 GLU 39 4.435 -1.216 -11.244 300 HB3 GLU 39 HB3 GLU 39 5.105 -1.237 -9.617 301 HG2 GLU 39 HG2 GLU 39 4.531 -3.760 -9.610 302 HG3 GLU 39 HG3 GLU 39 4.298 -3.588 -11.350 303 H GLY 40 H GLY 40 4.014 -0.913 -7.438 304 HA2 GLY 40 HA2 GLY 40 2.770 -3.093 -5.872 305 HA3 GLY 40 HA3 GLY 40 4.523 -3.094 -6.035 306 H ILE 41 H ILE 41 2.959 -2.847 -3.612 307 HA ILE 41 HA ILE 41 4.143 -0.364 -2.533 308 HB ILE 41 HB ILE 41 1.326 -1.362 -1.873 309 HG12 ILE 41 HG12 ILE 41 2.263 1.191 -3.242 310 HG13 ILE 41 HG13 ILE 41 1.300 -0.098 -3.953 311 HG21 ILE 41 HG21 ILE 41 2.804 0.961 -0.610 312 HG22 ILE 41 HG22 ILE 41 2.435 -0.576 0.170 313 HG23 ILE 41 HG23 ILE 41 1.126 0.511 -0.291 314 HD11 ILE 41 HD11 ILE 41 0.426 1.847 -1.817 315 HD12 ILE 41 HD12 ILE 41 -0.541 0.493 -2.411 316 HD13 ILE 41 HD13 ILE 41 -0.086 1.798 -3.505 317 H LEU 42 H LEU 42 4.995 -0.612 -0.464 318 HA LEU 42 HA LEU 42 4.316 -2.991 1.118 319 HB2 LEU 42 HB2 LEU 42 6.363 -3.603 -0.097 320 HB3 LEU 42 HB3 LEU 42 7.161 -2.141 0.453 321 HG LEU 42 HG LEU 42 7.297 -2.972 2.739 322 HD11 LEU 42 HD11 LEU 42 6.416 -5.155 3.428 323 HD12 LEU 42 HD12 LEU 42 5.657 -5.356 1.845 324 HD13 LEU 42 HD13 LEU 42 5.132 -4.060 2.924 325 HD21 LEU 42 HD21 LEU 42 8.709 -4.965 2.432 326 HD22 LEU 42 HD22 LEU 42 9.043 -3.743 1.206 327 HD23 LEU 42 HD23 LEU 42 8.080 -5.165 0.790 328 H CYS 43 H CYS 43 3.219 -1.783 2.613 329 HA CYS 43 HA CYS 43 4.532 0.462 3.986 330 HB2 CYS 43 HB2 CYS 43 2.198 0.796 3.325 331 HB3 CYS 43 HB3 CYS 43 1.714 -0.652 4.187 332 HG CYS 43 HG CYS 43 3.016 2.079 5.758 333 H LEU 44 H LEU 44 6.050 -0.406 5.280 334 HA LEU 44 HA LEU 44 5.493 -2.707 7.031 335 HB2 LEU 44 HB2 LEU 44 7.590 -2.522 5.571 336 HB3 LEU 44 HB3 LEU 44 8.105 -1.211 6.610 337 HG LEU 44 HG LEU 44 8.002 -2.936 8.560 338 HD11 LEU 44 HD11 LEU 44 7.980 -4.880 6.233 339 HD12 LEU 44 HD12 LEU 44 6.671 -4.645 7.401 340 HD13 LEU 44 HD13 LEU 44 8.222 -5.290 7.936 341 HD21 LEU 44 HD21 LEU 44 10.064 -3.357 6.370 342 HD22 LEU 44 HD22 LEU 44 10.240 -3.787 8.076 343 HD23 LEU 44 HD23 LEU 44 10.110 -2.094 7.606 344 HA PRO 45 HA PRO 45 4.734 0.655 10.115 345 HB2 PRO 45 HB2 PRO 45 3.668 -0.990 12.076 346 HB3 PRO 45 HB3 PRO 45 2.725 -0.365 10.705 347 HG2 PRO 45 HG2 PRO 45 4.002 -3.068 11.031 348 HG3 PRO 45 HG3 PRO 45 2.394 -2.655 10.393 349 HD2 PRO 45 HD2 PRO 45 4.482 -3.236 8.756 350 HD3 PRO 45 HD3 PRO 45 3.227 -2.064 8.293 351 H ILE 46 H ILE 46 6.438 1.387 11.185 352 HA ILE 46 HA ILE 46 8.681 -0.196 11.939 353 HB ILE 46 HB ILE 46 8.057 2.715 12.631 354 HG12 ILE 46 HG12 ILE 46 8.086 2.391 10.195 355 HG13 ILE 46 HG13 ILE 46 9.529 3.270 10.680 356 HG21 ILE 46 HG21 ILE 46 10.709 1.222 12.734 357 HG22 ILE 46 HG22 ILE 46 9.791 1.823 14.118 358 HG23 ILE 46 HG23 ILE 46 10.509 2.962 12.976 359 HD11 ILE 46 HD11 ILE 46 10.834 1.189 10.488 360 HD12 ILE 46 HD12 ILE 46 10.040 1.643 8.982 361 HD13 ILE 46 HD13 ILE 46 9.374 0.342 9.964 362 H GLN 47 H GLN 47 9.041 -1.249 13.800 363 HA GLN 47 HA GLN 47 7.071 -1.348 15.892 364 HB2 GLN 47 HB2 GLN 47 8.459 -3.073 16.881 365 HB3 GLN 47 HB3 GLN 47 8.427 -3.308 15.139 366 HG2 GLN 47 HG2 GLN 47 10.667 -2.150 15.008 367 HG3 GLN 47 HG3 GLN 47 10.699 -2.139 16.771 368 HE21 GLN 47 HE21 GLN 47 11.008 -4.071 13.909 369 HE22 GLN 47 HE22 GLN 47 11.586 -5.502 14.688 370 H ASP 48 H ASP 48 9.974 0.444 15.382 371 HA ASP 48 HA ASP 48 10.837 0.866 18.037 372 HB2 ASP 48 HB2 ASP 48 12.396 1.129 16.208 373 HB3 ASP 48 HB3 ASP 48 11.389 2.347 15.437 374 H SER 49 H SER 49 8.662 2.688 15.921 375 HA SER 49 HA SER 49 7.581 4.302 18.047 376 HB2 SER 49 HB2 SER 49 8.309 6.505 16.918 377 HB3 SER 49 HB3 SER 49 9.579 5.627 17.773 378 HG SER 49 HG SER 49 10.388 4.914 15.847 379 H ASP 50 H ASP 50 6.123 6.128 16.942 380 HA ASP 50 HA ASP 50 4.291 4.734 15.216 381 HB2 ASP 50 HB2 ASP 50 2.850 6.727 15.407 382 HB3 ASP 50 HB3 ASP 50 3.424 6.209 16.985 383 H LYS 51 H LYS 51 5.748 4.370 13.462 384 HA LYS 51 HA LYS 51 5.421 6.326 11.332 385 HB2 LYS 51 HB2 LYS 51 8.147 5.385 12.303 386 HB3 LYS 51 HB3 LYS 51 7.913 5.704 10.589 387 HG2 LYS 51 HG2 LYS 51 7.239 8.040 11.131 388 HG3 LYS 51 HG3 LYS 51 7.549 7.719 12.839 389 HD2 LYS 51 HD2 LYS 51 9.629 7.544 10.620 390 HD3 LYS 51 HD3 LYS 51 9.418 8.927 11.699 391 HE2 LYS 51 HE2 LYS 51 10.176 6.112 12.587 392 HE3 LYS 51 HE3 LYS 51 11.292 7.465 12.401 393 HZ1 LYS 51 HZ1 LYS 51 10.055 8.654 14.121 394 HZ2 LYS 51 HZ2 LYS 51 10.663 7.187 14.692 395 HZ3 LYS 51 HZ3 LYS 51 9.028 7.329 14.315 396 H SER 52 H SER 52 6.085 5.304 9.255 397 HA SER 52 HA SER 52 6.249 2.449 9.020 398 HB2 SER 52 HB2 SER 52 3.764 2.827 9.295 399 HB3 SER 52 HB3 SER 52 3.801 3.890 7.885 400 HG SER 52 HG SER 52 3.332 1.430 7.765 401 H HIS 53 H HIS 53 7.218 1.948 7.065 402 HA HIS 53 HA HIS 53 7.843 4.201 5.226 403 HB2 HIS 53 HB2 HIS 53 9.339 1.604 5.757 404 HB3 HIS 53 HB3 HIS 53 9.742 2.706 4.444 405 HD1 HIS 53 HD1 HIS 53 12.039 3.326 5.309 406 HD2 HIS 53 HD2 HIS 53 9.057 4.014 8.104 407 HE1 HIS 53 HE1 HIS 53 13.141 4.563 7.177 408 HE2 HIS 53 HE2 HIS 53 11.357 4.833 8.922 409 H ILE 54 H ILE 54 6.678 4.184 3.447 410 HA ILE 54 HA ILE 54 5.458 1.713 2.415 411 HB ILE 54 HB ILE 54 4.723 4.623 1.797 412 HG12 ILE 54 HG12 ILE 54 2.501 4.025 2.925 413 HG13 ILE 54 HG13 ILE 54 3.257 2.544 3.489 414 HG21 ILE 54 HG21 ILE 54 3.400 2.046 0.882 415 HG22 ILE 54 HG22 ILE 54 4.338 3.148 -0.127 416 HG23 ILE 54 HG23 ILE 54 2.802 3.677 0.558 417 HD11 ILE 54 HD11 ILE 54 4.116 5.329 4.215 418 HD12 ILE 54 HD12 ILE 54 4.798 3.825 4.839 419 HD13 ILE 54 HD13 ILE 54 3.128 4.256 5.202 420 H TRP 55 H TRP 55 6.850 0.824 0.963 421 HA TRP 55 HA TRP 55 8.504 2.454 -0.805 422 HB2 TRP 55 HB2 TRP 55 8.274 -0.565 -0.401 423 HB3 TRP 55 HB3 TRP 55 9.348 0.177 -1.583 424 HD1 TRP 55 HD1 TRP 55 11.537 1.449 -0.624 425 HE1 TRP 55 HE1 TRP 55 12.778 1.278 1.608 426 HE3 TRP 55 HE3 TRP 55 7.968 -0.886 2.103 427 HZ2 TRP 55 HZ2 TRP 55 12.290 0.315 4.226 428 HZ3 TRP 55 HZ3 TRP 55 8.404 -1.379 4.444 429 HH2 TRP 55 HH2 TRP 55 10.526 -0.795 5.507 430 H LEU 56 H LEU 56 7.407 3.341 -2.476 431 HA LEU 56 HA LEU 56 5.220 1.959 -3.841 432 HB2 LEU 56 HB2 LEU 56 6.380 4.745 -4.266 433 HB3 LEU 56 HB3 LEU 56 5.049 4.081 -5.194 434 HG LEU 56 HG LEU 56 4.089 5.565 -3.611 435 HD11 LEU 56 HD11 LEU 56 2.616 4.168 -2.278 436 HD12 LEU 56 HD12 LEU 56 3.664 2.771 -2.540 437 HD13 LEU 56 HD13 LEU 56 2.824 3.518 -3.903 438 HD21 LEU 56 HD21 LEU 56 4.464 5.475 -1.185 439 HD22 LEU 56 HD22 LEU 56 5.942 5.826 -2.076 440 HD23 LEU 56 HD23 LEU 56 5.676 4.210 -1.417 441 H LEU 57 H LEU 57 5.769 0.595 -5.373 442 HA LEU 57 HA LEU 57 8.125 0.851 -7.042 443 HB2 LEU 57 HB2 LEU 57 5.956 -1.262 -6.799 444 HB3 LEU 57 HB3 LEU 57 7.136 -1.293 -8.097 445 HG LEU 57 HG LEU 57 8.964 -1.570 -6.465 446 HD11 LEU 57 HD11 LEU 57 8.071 -0.400 -4.538 447 HD12 LEU 57 HD12 LEU 57 8.555 -2.037 -4.099 448 HD13 LEU 57 HD13 LEU 57 6.841 -1.649 -4.313 449 HD21 LEU 57 HD21 LEU 57 6.752 -3.608 -6.126 450 HD22 LEU 57 HD22 LEU 57 8.466 -3.875 -5.786 451 HD23 LEU 57 HD23 LEU 57 7.936 -3.550 -7.436 452 H VAL 58 H VAL 58 7.938 2.344 -8.559 453 HA VAL 58 HA VAL 58 5.834 2.161 -10.614 454 HB VAL 58 HB VAL 58 5.039 3.897 -8.941 455 HG11 VAL 58 HG11 VAL 58 6.137 6.090 -8.770 456 HG12 VAL 58 HG12 VAL 58 7.467 5.503 -9.772 457 HG13 VAL 58 HG13 VAL 58 7.182 4.793 -8.180 458 HG21 VAL 58 HG21 VAL 58 4.266 4.027 -11.275 459 HG22 VAL 58 HG22 VAL 58 5.666 5.016 -11.697 460 HG23 VAL 58 HG23 VAL 58 4.443 5.646 -10.590 461 H ASN 59 H ASN 59 6.644 3.062 -12.679 462 HA ASN 59 HA ASN 59 9.482 2.910 -12.967 463 HB2 ASN 59 HB2 ASN 59 9.148 3.457 -15.320 464 HB3 ASN 59 HB3 ASN 59 7.974 2.256 -14.796 465 HD21 ASN 59 HD21 ASN 59 7.776 3.994 -17.067 466 HD22 ASN 59 HD22 ASN 59 6.365 4.963 -16.848 467 H ASP 60 H ASP 60 11.008 4.493 -13.218 468 HA ASP 60 HA ASP 60 10.508 7.026 -12.004 469 HB2 ASP 60 HB2 ASP 60 12.626 5.815 -11.634 470 HB3 ASP 60 HB3 ASP 60 13.035 5.985 -13.334 471 H ASP 61 H ASP 61 10.472 9.030 -12.893 472 HA ASP 61 HA ASP 61 10.721 9.410 -15.781 473 HB2 ASP 61 HB2 ASP 61 8.347 8.769 -15.432 474 HB3 ASP 61 HB3 ASP 61 8.169 10.025 -14.208 475 H GLN 62 H GLN 62 10.669 11.722 -16.343 476 HA GLN 62 HA GLN 62 12.351 13.287 -14.670 477 HB2 GLN 62 HB2 GLN 62 10.745 14.147 -17.124 478 HB3 GLN 62 HB3 GLN 62 12.117 15.016 -16.430 479 HG2 GLN 62 HG2 GLN 62 13.593 13.108 -16.976 480 HG3 GLN 62 HG3 GLN 62 12.226 12.244 -17.675 481 HE21 GLN 62 HE21 GLN 62 11.325 13.019 -19.646 482 HE22 GLN 62 HE22 GLN 62 12.231 14.039 -20.707 483 H ARG 63 H ARG 63 8.875 13.230 -15.237 484 HA ARG 63 HA ARG 63 8.294 15.625 -13.696 485 HB2 ARG 63 HB2 ARG 63 6.843 15.037 -15.588 486 HB3 ARG 63 HB3 ARG 63 6.484 13.473 -14.869 487 HG2 ARG 63 HG2 ARG 63 5.328 14.644 -12.993 488 HG3 ARG 63 HG3 ARG 63 5.634 16.184 -13.798 489 HD2 ARG 63 HD2 ARG 63 4.200 15.592 -15.634 490 HD3 ARG 63 HD3 ARG 63 4.079 13.917 -15.080 491 HE ARG 63 HE ARG 63 3.137 15.715 -13.085 492 HH11 ARG 63 HH11 ARG 63 2.143 14.285 -16.129 493 HH12 ARG 63 HH12 ARG 63 0.452 14.404 -15.776 494 HH21 ARG 63 HH21 ARG 63 0.915 15.828 -12.624 495 HH22 ARG 63 HH22 ARG 63 -0.244 15.278 -13.787 496 H LEU 64 H LEU 64 8.494 12.148 -13.163 497 HA LEU 64 HA LEU 64 6.978 11.785 -10.852 498 HB2 LEU 64 HB2 LEU 64 8.121 9.961 -12.173 499 HB3 LEU 64 HB3 LEU 64 9.643 10.436 -11.439 500 HG LEU 64 HG LEU 64 8.534 9.907 -9.150 501 HD11 LEU 64 HD11 LEU 64 6.197 9.875 -9.920 502 HD12 LEU 64 HD12 LEU 64 6.659 8.372 -9.121 503 HD13 LEU 64 HD13 LEU 64 6.543 8.429 -10.884 504 HD21 LEU 64 HD21 LEU 64 9.009 7.528 -9.287 505 HD22 LEU 64 HD22 LEU 64 10.230 8.454 -10.160 506 HD23 LEU 64 HD23 LEU 64 8.968 7.596 -11.053 507 H GLU 65 H GLU 65 10.251 13.011 -11.242 508 HA GLU 65 HA GLU 65 11.145 13.090 -8.586 509 HB2 GLU 65 HB2 GLU 65 11.848 15.076 -10.792 510 HB3 GLU 65 HB3 GLU 65 12.825 14.664 -9.380 511 HG2 GLU 65 HG2 GLU 65 13.061 12.349 -10.269 512 HG3 GLU 65 HG3 GLU 65 12.151 12.831 -11.700 513 H GLN 66 H GLN 66 9.282 15.444 -10.480 514 HA GLN 66 HA GLN 66 9.214 17.552 -8.575 515 HB2 GLN 66 HB2 GLN 66 7.246 16.933 -10.827 516 HB3 GLN 66 HB3 GLN 66 7.360 18.465 -9.963 517 HG2 GLN 66 HG2 GLN 66 9.567 17.265 -11.670 518 HG3 GLN 66 HG3 GLN 66 8.445 18.515 -12.202 519 HE21 GLN 66 HE21 GLN 66 11.380 18.620 -12.023 520 HE22 GLN 66 HE22 GLN 66 11.755 19.948 -10.988 521 H MET 67 H MET 67 7.026 14.813 -9.249 522 HA MET 67 HA MET 67 5.028 15.359 -7.327 523 HB2 MET 67 HB2 MET 67 5.933 12.806 -8.692 524 HB3 MET 67 HB3 MET 67 4.726 12.736 -7.420 525 HG2 MET 67 HG2 MET 67 3.583 12.714 -9.511 526 HG3 MET 67 HG3 MET 67 3.287 14.277 -8.759 527 HE1 MET 67 HE1 MET 67 4.662 16.808 -11.236 528 HE2 MET 67 HE2 MET 67 5.011 16.486 -9.539 529 HE3 MET 67 HE3 MET 67 3.349 16.417 -10.125 530 H ILE 68 H ILE 68 8.068 13.586 -7.112 531 HA ILE 68 HA ILE 68 7.875 12.579 -4.480 532 HB ILE 68 HB ILE 68 10.249 13.169 -6.305 533 HG12 ILE 68 HG12 ILE 68 9.064 10.474 -5.491 534 HG13 ILE 68 HG13 ILE 68 8.588 11.345 -6.942 535 HG21 ILE 68 HG21 ILE 68 10.384 11.708 -3.652 536 HG22 ILE 68 HG22 ILE 68 11.111 13.273 -4.011 537 HG23 ILE 68 HG23 ILE 68 11.696 11.823 -4.826 538 HD11 ILE 68 HD11 ILE 68 11.328 10.246 -6.340 539 HD12 ILE 68 HD12 ILE 68 10.897 11.183 -7.773 540 HD13 ILE 68 HD13 ILE 68 10.150 9.611 -7.490 541 H SER 69 H SER 69 9.144 15.596 -5.812 542 HA SER 69 HA SER 69 10.204 16.670 -3.381 543 HB2 SER 69 HB2 SER 69 11.029 17.338 -5.646 544 HB3 SER 69 HB3 SER 69 9.479 18.107 -5.975 545 HG SER 69 HG SER 69 10.567 18.967 -3.626 546 H GLN 70 H GLN 70 7.048 16.718 -4.934 547 HA GLN 70 HA GLN 70 6.003 18.969 -3.461 548 HB2 GLN 70 HB2 GLN 70 5.256 18.275 -5.789 549 HB3 GLN 70 HB3 GLN 70 4.483 16.870 -5.072 550 HG2 GLN 70 HG2 GLN 70 3.752 19.698 -4.253 551 HG3 GLN 70 HG3 GLN 70 3.010 18.912 -5.639 552 HE21 GLN 70 HE21 GLN 70 2.844 16.271 -4.401 553 HE22 GLN 70 HE22 GLN 70 1.602 16.372 -3.208 554 H ILE 71 H ILE 71 5.616 15.418 -3.376 555 HA ILE 71 HA ILE 71 3.751 15.350 -1.249 556 HB ILE 71 HB ILE 71 4.073 13.458 -2.883 557 HG12 ILE 71 HG12 ILE 71 4.167 12.842 0.103 558 HG13 ILE 71 HG13 ILE 71 2.735 13.068 -0.894 559 HG21 ILE 71 HG21 ILE 71 6.549 13.381 -2.887 560 HG22 ILE 71 HG22 ILE 71 5.839 11.801 -2.560 561 HG23 ILE 71 HG23 ILE 71 6.528 12.747 -1.238 562 HD11 ILE 71 HD11 ILE 71 3.031 10.770 -0.339 563 HD12 ILE 71 HD12 ILE 71 4.668 10.773 -0.998 564 HD13 ILE 71 HD13 ILE 71 3.279 10.983 -2.073 565 H ASP 72 H ASP 72 7.247 15.420 -1.382 566 HA ASP 72 HA ASP 72 8.094 14.687 1.119 567 HB2 ASP 72 HB2 ASP 72 9.632 15.316 -0.657 568 HB3 ASP 72 HB3 ASP 72 9.022 16.967 -0.687 569 H LYS 73 H LYS 73 6.332 17.584 0.219 570 HA LYS 73 HA LYS 73 6.983 19.093 2.608 571 HB2 LYS 73 HB2 LYS 73 4.963 19.800 0.437 572 HB3 LYS 73 HB3 LYS 73 5.719 20.897 1.594 573 HG2 LYS 73 HG2 LYS 73 7.066 19.463 -0.725 574 HG3 LYS 73 HG3 LYS 73 6.747 21.196 -0.578 575 HD2 LYS 73 HD2 LYS 73 8.359 21.367 1.275 576 HD3 LYS 73 HD3 LYS 73 8.612 19.618 1.248 577 HE2 LYS 73 HE2 LYS 73 9.476 19.859 -1.108 578 HE3 LYS 73 HE3 LYS 73 9.383 21.612 -0.903 579 HZ1 LYS 73 HZ1 LYS 73 10.973 19.786 0.818 580 HZ2 LYS 73 HZ2 LYS 73 10.963 21.479 0.883 581 HZ3 LYS 73 HZ3 LYS 73 11.600 20.686 -0.469 582 H LEU 74 H LEU 74 4.775 16.658 2.017 583 HA LEU 74 HA LEU 74 2.578 17.568 3.644 584 HB2 LEU 74 HB2 LEU 74 3.351 14.914 2.413 585 HB3 LEU 74 HB3 LEU 74 2.136 14.931 3.672 586 HG LEU 74 HG LEU 74 1.074 14.897 1.468 587 HD11 LEU 74 HD11 LEU 74 -0.113 16.023 3.274 588 HD12 LEU 74 HD12 LEU 74 -0.460 16.785 1.725 589 HD13 LEU 74 HD13 LEU 74 0.654 17.560 2.856 590 HD21 LEU 74 HD21 LEU 74 2.814 15.985 0.137 591 HD22 LEU 74 HD22 LEU 74 2.466 17.535 0.902 592 HD23 LEU 74 HD23 LEU 74 1.253 16.758 -0.122 593 H GLU 75 H GLU 75 2.125 17.050 5.761 594 HA GLU 75 HA GLU 75 4.317 17.060 7.561 595 HB2 GLU 75 HB2 GLU 75 1.342 16.718 8.109 596 HB3 GLU 75 HB3 GLU 75 2.561 17.078 9.335 597 HG2 GLU 75 HG2 GLU 75 3.039 19.238 8.262 598 HG3 GLU 75 HG3 GLU 75 1.887 18.876 6.975 599 H ASP 76 H ASP 76 2.048 14.532 6.559 600 HA ASP 76 HA ASP 76 2.780 12.558 8.448 601 HB2 ASP 76 HB2 ASP 76 1.851 10.901 6.806 602 HB3 ASP 76 HB3 ASP 76 0.758 12.211 7.201 603 H VAL 77 H VAL 77 3.972 13.274 5.167 604 HA VAL 77 HA VAL 77 5.980 11.276 5.070 605 HB VAL 77 HB VAL 77 5.727 13.890 3.510 606 HG11 VAL 77 HG11 VAL 77 7.503 11.489 2.901 607 HG12 VAL 77 HG12 VAL 77 8.057 13.092 3.395 608 HG13 VAL 77 HG13 VAL 77 7.254 12.879 1.839 609 HG21 VAL 77 HG21 VAL 77 3.815 12.343 3.198 610 HG22 VAL 77 HG22 VAL 77 4.937 11.061 2.719 611 HG23 VAL 77 HG23 VAL 77 4.772 12.509 1.723 612 H VAL 78 H VAL 78 7.033 11.383 7.018 613 HA VAL 78 HA VAL 78 8.418 13.522 8.196 614 HB VAL 78 HB VAL 78 9.210 10.562 8.285 615 HG11 VAL 78 HG11 VAL 78 9.754 12.778 10.301 616 HG12 VAL 78 HG12 VAL 78 10.944 12.027 9.232 617 HG13 VAL 78 HG13 VAL 78 10.179 11.074 10.505 618 HG21 VAL 78 HG21 VAL 78 7.782 10.347 10.294 619 HG22 VAL 78 HG22 VAL 78 6.837 10.778 8.866 620 HG23 VAL 78 HG23 VAL 78 7.220 12.009 10.075 621 H LYS 79 H LYS 79 9.423 11.050 5.844 622 HA LYS 79 HA LYS 79 11.391 12.851 4.633 623 HB2 LYS 79 HB2 LYS 79 12.088 10.022 5.572 624 HB3 LYS 79 HB3 LYS 79 13.084 10.971 4.470 625 HG2 LYS 79 HG2 LYS 79 13.502 12.626 6.239 626 HG3 LYS 79 HG3 LYS 79 12.456 11.729 7.341 627 HD2 LYS 79 HD2 LYS 79 15.068 10.724 6.135 628 HD3 LYS 79 HD3 LYS 79 14.842 11.274 7.795 629 HE2 LYS 79 HE2 LYS 79 13.294 9.395 8.212 630 HE3 LYS 79 HE3 LYS 79 13.482 8.857 6.541 631 HZ1 LYS 79 HZ1 LYS 79 15.829 8.488 6.973 632 HZ2 LYS 79 HZ2 LYS 79 14.865 7.579 8.015 633 HZ3 LYS 79 HZ3 LYS 79 15.636 8.971 8.581 634 H VAL 80 H VAL 80 11.603 12.431 2.411 635 HA VAL 80 HA VAL 80 10.247 10.012 1.317 636 HB VAL 80 HB VAL 80 9.274 12.162 0.462 637 HG11 VAL 80 HG11 VAL 80 11.253 13.606 0.510 638 HG12 VAL 80 HG12 VAL 80 10.534 13.592 -1.101 639 HG13 VAL 80 HG13 VAL 80 11.999 12.661 -0.781 640 HG21 VAL 80 HG21 VAL 80 9.151 10.139 -0.925 641 HG22 VAL 80 HG22 VAL 80 10.705 10.523 -1.664 642 HG23 VAL 80 HG23 VAL 80 9.312 11.572 -1.943 643 H GLN 81 H GLN 81 11.487 8.672 0.025 644 HA GLN 81 HA GLN 81 14.317 9.355 -0.513 645 HB2 GLN 81 HB2 GLN 81 13.262 6.838 0.848 646 HB3 GLN 81 HB3 GLN 81 14.889 6.965 0.183 647 HG2 GLN 81 HG2 GLN 81 15.539 8.589 1.802 648 HG3 GLN 81 HG3 GLN 81 13.873 8.883 2.294 649 HE21 GLN 81 HE21 GLN 81 16.534 6.582 2.441 650 HE22 GLN 81 HE22 GLN 81 15.945 5.707 3.808 651 H ARG 82 H ARG 82 15.139 8.463 -2.363 652 HA ARG 82 HA ARG 82 13.280 7.028 -4.178 653 HB2 ARG 82 HB2 ARG 82 15.657 8.788 -4.951 654 HB3 ARG 82 HB3 ARG 82 14.481 8.059 -6.044 655 HG2 ARG 82 HG2 ARG 82 12.718 9.510 -5.128 656 HG3 ARG 82 HG3 ARG 82 13.875 10.222 -3.998 657 HD2 ARG 82 HD2 ARG 82 13.551 11.709 -5.911 658 HD3 ARG 82 HD3 ARG 82 15.198 11.070 -5.921 659 HE ARG 82 HE ARG 82 13.423 9.477 -7.501 660 HH11 ARG 82 HH11 ARG 82 15.318 12.436 -7.617 661 HH12 ARG 82 HH12 ARG 82 15.448 12.423 -9.343 662 HH21 ARG 82 HH21 ARG 82 13.591 9.491 -9.769 663 HH22 ARG 82 HH22 ARG 82 14.470 10.760 -10.561 664 H ASN 83 H ASN 83 13.863 4.923 -3.685 665 HA ASN 83 HA ASN 83 16.717 4.145 -3.653 666 HB2 ASN 83 HB2 ASN 83 14.283 2.419 -2.983 667 HB3 ASN 83 HB3 ASN 83 15.970 2.006 -2.705 668 HD21 ASN 83 HD21 ASN 83 15.561 1.648 -0.506 669 HD22 ASN 83 HD22 ASN 83 15.259 2.934 0.608 670 H GLN 84 H GLN 84 17.441 2.418 -4.987 671 HA GLN 84 HA GLN 84 16.194 2.339 -7.629 672 HB2 GLN 84 HB2 GLN 84 18.652 2.703 -7.400 673 HB3 GLN 84 HB3 GLN 84 18.815 1.137 -6.617 674 HG2 GLN 84 HG2 GLN 84 18.091 0.013 -8.686 675 HG3 GLN 84 HG3 GLN 84 17.862 1.577 -9.464 676 HE21 GLN 84 HE21 GLN 84 20.594 0.783 -7.366 677 HE22 GLN 84 HE22 GLN 84 21.783 0.853 -8.614 678 H SER 85 H SER 85 15.399 0.451 -8.577 679 HA SER 85 HA SER 85 14.276 -1.439 -6.738 680 HB2 SER 85 HB2 SER 85 12.896 -0.559 -8.545 681 HB3 SER 85 HB3 SER 85 13.969 -1.264 -9.736 682 HG SER 85 HG SER 85 12.603 -2.865 -9.581 683 H ASP 86 H ASP 86 15.027 -3.248 -6.193 684 HA ASP 86 HA ASP 86 16.608 -4.981 -7.919 685 HB2 ASP 86 HB2 ASP 86 18.171 -3.589 -6.424 686 HB3 ASP 86 HB3 ASP 86 17.421 -4.354 -5.032 687 HA PRO 87 HA PRO 87 13.378 -7.744 -6.465 688 HB2 PRO 87 HB2 PRO 87 14.844 -10.164 -6.626 689 HB3 PRO 87 HB3 PRO 87 13.972 -9.396 -7.965 690 HG2 PRO 87 HG2 PRO 87 16.888 -9.214 -7.269 691 HG3 PRO 87 HG3 PRO 87 16.118 -9.397 -8.863 692 HD2 PRO 87 HD2 PRO 87 17.027 -7.017 -8.124 693 HD3 PRO 87 HD3 PRO 87 15.457 -7.133 -8.958 694 H THR 88 H THR 88 16.588 -7.900 -4.961 695 HA THR 88 HA THR 88 15.669 -9.476 -2.711 696 HB THR 88 HB THR 88 17.904 -9.325 -1.810 697 HG1 THR 88 HG1 THR 88 18.942 -7.806 -3.905 698 HG21 THR 88 HG21 THR 88 17.580 -10.928 -3.666 699 HG22 THR 88 HG22 THR 88 19.227 -10.292 -3.650 700 HG23 THR 88 HG23 THR 88 18.056 -9.681 -4.822 701 H MET 89 H MET 89 16.149 -6.048 -3.410 702 HA MET 89 HA MET 89 16.357 -4.947 -0.858 703 HB2 MET 89 HB2 MET 89 16.661 -3.526 -2.783 704 HB3 MET 89 HB3 MET 89 15.040 -3.857 -3.384 705 HG2 MET 89 HG2 MET 89 15.255 -1.581 -2.412 706 HG3 MET 89 HG3 MET 89 14.056 -2.561 -1.566 707 HE1 MET 89 HE1 MET 89 13.926 -1.144 0.565 708 HE2 MET 89 HE2 MET 89 15.013 0.067 -0.124 709 HE3 MET 89 HE3 MET 89 15.313 -0.574 1.492 710 H PHE 90 H PHE 90 13.396 -5.516 -2.752 711 HA PHE 90 HA PHE 90 11.462 -4.655 -0.943 712 HB2 PHE 90 HB2 PHE 90 11.159 -5.177 -3.407 713 HB3 PHE 90 HB3 PHE 90 11.214 -6.887 -3.022 714 HD1 PHE 90 HD1 PHE 90 9.183 -3.805 -2.870 715 HD2 PHE 90 HD2 PHE 90 9.270 -7.995 -1.954 716 HE1 PHE 90 HE1 PHE 90 6.742 -3.799 -2.558 717 HE2 PHE 90 HE2 PHE 90 6.830 -7.969 -1.639 718 HZ PHE 90 HZ PHE 90 5.567 -5.875 -1.947 719 H ASN 91 H ASN 91 12.943 -7.863 -1.383 720 HA ASN 91 HA ASN 91 11.277 -9.225 0.521 721 HB2 ASN 91 HB2 ASN 91 12.285 -10.436 -1.380 722 HB3 ASN 91 HB3 ASN 91 13.903 -10.052 -0.797 723 HD21 ASN 91 HD21 ASN 91 10.974 -11.875 -0.080 724 HD22 ASN 91 HD22 ASN 91 11.724 -13.018 0.979 725 H LYS 92 H LYS 92 14.266 -7.428 0.655 726 HA LYS 92 HA LYS 92 15.441 -8.663 2.916 727 HB2 LYS 92 HB2 LYS 92 16.742 -7.327 1.241 728 HB3 LYS 92 HB3 LYS 92 15.973 -5.859 1.839 729 HG2 LYS 92 HG2 LYS 92 18.194 -6.058 2.811 730 HG3 LYS 92 HG3 LYS 92 16.974 -6.254 4.077 731 HD2 LYS 92 HD2 LYS 92 17.251 -8.771 3.834 732 HD3 LYS 92 HD3 LYS 92 18.599 -8.457 2.735 733 HE2 LYS 92 HE2 LYS 92 18.426 -7.629 5.653 734 HE3 LYS 92 HE3 LYS 92 19.413 -8.934 4.998 735 HZ1 LYS 92 HZ1 LYS 92 20.647 -7.277 3.720 736 HZ2 LYS 92 HZ2 LYS 92 20.738 -6.984 5.380 737 HZ3 LYS 92 HZ3 LYS 92 19.727 -6.040 4.411 738 H ILE 93 H ILE 93 13.604 -5.546 2.589 739 HA ILE 93 HA ILE 93 13.681 -5.161 5.463 740 HB ILE 93 HB ILE 93 12.162 -3.281 5.220 741 HG12 ILE 93 HG12 ILE 93 10.821 -4.421 3.238 742 HG13 ILE 93 HG13 ILE 93 10.931 -2.680 3.330 743 HG21 ILE 93 HG21 ILE 93 13.552 -1.826 3.769 744 HG22 ILE 93 HG22 ILE 93 14.339 -3.260 3.104 745 HG23 ILE 93 HG23 ILE 93 14.527 -2.866 4.814 746 HD11 ILE 93 HD11 ILE 93 12.563 -4.436 1.541 747 HD12 ILE 93 HD12 ILE 93 12.639 -2.672 1.615 748 HD13 ILE 93 HD13 ILE 93 11.161 -3.474 1.084 749 H ALA 94 H ALA 94 11.433 -6.672 3.181 750 HA ALA 94 HA ALA 94 9.202 -6.968 4.896 751 HB1 ALA 94 HB1 ALA 94 8.502 -8.766 3.361 752 HB2 ALA 94 HB2 ALA 94 10.122 -8.803 2.656 753 HB3 ALA 94 HB3 ALA 94 9.114 -7.368 2.470 754 H VAL 95 H VAL 95 12.169 -8.925 4.599 755 HA VAL 95 HA VAL 95 11.232 -10.863 6.574 756 HB VAL 95 HB VAL 95 12.553 -11.607 4.563 757 HG11 VAL 95 HG11 VAL 95 14.933 -10.333 5.952 758 HG12 VAL 95 HG12 VAL 95 14.201 -9.795 4.439 759 HG13 VAL 95 HG13 VAL 95 14.997 -11.368 4.521 760 HG21 VAL 95 HG21 VAL 95 13.922 -13.279 5.766 761 HG22 VAL 95 HG22 VAL 95 12.339 -13.072 6.521 762 HG23 VAL 95 HG23 VAL 95 13.769 -12.338 7.254 763 H PHE 96 H PHE 96 13.134 -7.946 6.531 764 HA PHE 96 HA PHE 96 14.686 -8.513 8.916 765 HB2 PHE 96 HB2 PHE 96 15.548 -7.072 7.048 766 HB3 PHE 96 HB3 PHE 96 14.297 -5.890 7.402 767 HD1 PHE 96 HD1 PHE 96 17.267 -7.596 8.905 768 HD2 PHE 96 HD2 PHE 96 14.720 -4.155 8.998 769 HE1 PHE 96 HE1 PHE 96 18.795 -6.497 10.499 770 HE2 PHE 96 HE2 PHE 96 16.249 -3.077 10.588 771 HZ PHE 96 HZ PHE 96 18.281 -4.240 11.344 772 H PHE 97 H PHE 97 11.660 -6.943 8.116 773 HA PHE 97 HA PHE 97 10.277 -5.492 9.156 774 HB2 PHE 97 HB2 PHE 97 9.216 -6.481 11.250 775 HB3 PHE 97 HB3 PHE 97 9.235 -7.508 9.835 776 HD1 PHE 97 HD1 PHE 97 10.638 -7.062 13.256 777 HD2 PHE 97 HD2 PHE 97 10.485 -9.628 9.822 778 HE1 PHE 97 HE1 PHE 97 11.613 -8.895 14.572 779 HE2 PHE 97 HE2 PHE 97 11.466 -11.448 11.159 780 HZ PHE 97 HZ PHE 97 12.025 -11.089 13.529 781 H GLN 98 H GLN 98 11.988 -3.868 9.261 782 HA GLN 98 HA GLN 98 13.499 -3.305 11.557 783 HB2 GLN 98 HB2 GLN 98 13.829 -1.030 10.563 784 HB3 GLN 98 HB3 GLN 98 14.120 -2.345 9.432 785 HG2 GLN 98 HG2 GLN 98 11.937 -1.967 8.394 786 HG3 GLN 98 HG3 GLN 98 11.593 -0.684 9.546 787 HE21 GLN 98 HE21 GLN 98 12.745 1.280 9.381 788 HE22 GLN 98 HE22 GLN 98 13.533 1.743 7.911 789 H1 GLY 1 H1 GLY 1 -12.941 -4.842 17.504 790 H2 GLY 1 H2 GLY 1 -11.634 -3.883 17.033 791 H3 GLY 1 H3 GLY 1 -12.957 -4.071 16.000 792 HA2 GLY 1 HA3 GLY 1 -14.379 -2.939 17.597 793 HA3 GLY 1 HA2 GLY 1 -12.967 -2.713 18.627 794 H SER 2 H SER 2 -13.662 -0.429 18.389 795 HA SER 2 HA SER 2 -13.658 0.955 15.935 796 HB2 SER 2 HB2 SER 2 -14.775 1.783 18.018 797 HB3 SER 2 HB3 SER 2 -13.190 2.111 18.721 798 HG SER 2 HG SER 2 -14.364 3.329 16.443 799 H MET 3 H MET 3 -11.140 1.177 18.558 800 HA MET 3 HA MET 3 -9.075 0.886 16.539 801 HB2 MET 3 HB2 MET 3 -7.926 2.979 16.906 802 HB3 MET 3 HB3 MET 3 -9.578 3.326 16.441 803 HG2 MET 3 HG2 MET 3 -9.214 4.904 18.102 804 HG3 MET 3 HG3 MET 3 -9.944 3.599 19.043 805 HE1 MET 3 HE1 MET 3 -8.291 5.947 20.418 806 HE2 MET 3 HE2 MET 3 -7.262 5.059 21.542 807 HE3 MET 3 HE3 MET 3 -8.954 4.600 21.347 808 H GLN 4 H GLN 4 -8.116 -0.768 17.414 809 HA GLN 4 HA GLN 4 -6.352 -0.279 19.681 810 HB2 GLN 4 HB2 GLN 4 -8.121 -2.778 19.511 811 HB3 GLN 4 HB3 GLN 4 -6.670 -2.700 20.506 812 HG2 GLN 4 HG2 GLN 4 -7.684 -0.896 21.848 813 HG3 GLN 4 HG3 GLN 4 -9.124 -0.945 20.841 814 HE21 GLN 4 HE21 GLN 4 -10.614 -2.611 21.129 815 HE22 GLN 4 HE22 GLN 4 -10.546 -3.697 22.469 816 H ASN 5 H ASN 5 -4.563 -2.040 19.605 817 HA ASN 5 HA ASN 5 -4.154 -3.292 17.018 818 HB2 ASN 5 HB2 ASN 5 -3.441 -0.917 16.615 819 HB3 ASN 5 HB3 ASN 5 -2.295 -1.041 17.939 820 HD21 ASN 5 HD21 ASN 5 -1.996 -0.529 14.992 821 HD22 ASN 5 HD22 ASN 5 -0.824 -1.674 14.442 822 H THR 6 H THR 6 -3.467 -5.212 17.585 823 HA THR 6 HA THR 6 -0.819 -5.454 18.736 824 HB THR 6 HB THR 6 -1.629 -7.692 19.928 825 HG1 THR 6 HG1 THR 6 -4.016 -6.140 19.969 826 HG21 THR 6 HG21 THR 6 -0.642 -5.833 21.196 827 HG22 THR 6 HG22 THR 6 -2.006 -6.525 22.073 828 HG23 THR 6 HG23 THR 6 -2.203 -4.997 21.213 829 H THR 7 H THR 7 -0.122 -7.907 18.345 830 HA THR 7 HA THR 7 0.084 -7.929 15.512 831 HB THR 7 HB THR 7 1.117 -10.028 17.464 832 HG1 THR 7 HG1 THR 7 1.959 -7.398 16.879 833 HG21 THR 7 HG21 THR 7 2.990 -10.272 15.843 834 HG22 THR 7 HG22 THR 7 2.204 -9.118 14.764 835 HG23 THR 7 HG23 THR 7 1.442 -10.676 15.093 836 H HIS 8 H HIS 8 -2.188 -9.550 17.539 837 HA HIS 8 HA HIS 8 -3.094 -11.193 15.234 838 HB2 HIS 8 HB2 HIS 8 -3.399 -12.000 18.166 839 HB3 HIS 8 HB3 HIS 8 -3.904 -12.939 16.762 840 HD1 HIS 8 HD1 HIS 8 -2.002 -14.081 15.348 841 HD2 HIS 8 HD2 HIS 8 -0.700 -12.221 18.833 842 HE1 HIS 8 HE1 HIS 8 0.345 -14.897 15.726 843 HE2 HIS 8 HE2 HIS 8 1.157 -13.625 17.738 844 H ASP 9 H ASP 9 -3.755 -8.486 16.845 845 HA ASP 9 HA ASP 9 -6.676 -8.760 17.005 846 HB2 ASP 9 HB2 ASP 9 -5.378 -7.433 18.727 847 HB3 ASP 9 HB3 ASP 9 -4.969 -6.275 17.464 848 H ASN 10 H ASN 10 -4.170 -7.479 14.957 849 HA ASN 10 HA ASN 10 -5.911 -6.168 13.070 850 HB2 ASN 10 HB2 ASN 10 -3.881 -5.982 11.651 851 HB3 ASN 10 HB3 ASN 10 -3.545 -5.446 13.293 852 HD21 ASN 10 HD21 ASN 10 -1.675 -6.412 11.236 853 HD22 ASN 10 HD22 ASN 10 -0.854 -7.749 11.953 854 H VAL 11 H VAL 11 -5.953 -6.939 10.766 855 HA VAL 11 HA VAL 11 -5.931 -9.861 10.393 856 HB VAL 11 HB VAL 11 -8.052 -9.667 8.987 857 HG11 VAL 11 HG11 VAL 11 -8.375 -9.111 11.956 858 HG12 VAL 11 HG12 VAL 11 -8.107 -10.690 11.214 859 HG13 VAL 11 HG13 VAL 11 -9.605 -9.811 10.896 860 HG21 VAL 11 HG21 VAL 11 -8.034 -7.193 8.687 861 HG22 VAL 11 HG22 VAL 11 -8.385 -6.985 10.402 862 HG23 VAL 11 HG23 VAL 11 -9.573 -7.755 9.349 863 H ILE 12 H ILE 12 -5.703 -10.487 8.230 864 HA ILE 12 HA ILE 12 -4.133 -8.572 6.636 865 HB ILE 12 HB ILE 12 -4.211 -11.624 6.409 866 HG12 ILE 12 HG12 ILE 12 -3.450 -10.908 8.697 867 HG13 ILE 12 HG13 ILE 12 -2.229 -11.790 7.797 868 HG21 ILE 12 HG21 ILE 12 -2.146 -9.621 5.479 869 HG22 ILE 12 HG22 ILE 12 -3.301 -10.470 4.454 870 HG23 ILE 12 HG23 ILE 12 -2.040 -11.376 5.294 871 HD11 ILE 12 HD11 ILE 12 -2.329 -8.804 8.220 872 HD12 ILE 12 HD12 ILE 12 -1.084 -9.676 7.320 873 HD13 ILE 12 HD13 ILE 12 -1.279 -9.953 9.049 874 H LEU 13 H LEU 13 -5.823 -7.561 5.451 875 HA LEU 13 HA LEU 13 -7.973 -9.172 4.304 876 HB2 LEU 13 HB2 LEU 13 -7.511 -6.162 4.295 877 HB3 LEU 13 HB3 LEU 13 -8.920 -6.952 3.594 878 HG LEU 13 HG LEU 13 -8.158 -6.969 6.549 879 HD11 LEU 13 HD11 LEU 13 -10.163 -5.612 6.889 880 HD12 LEU 13 HD12 LEU 13 -10.448 -5.562 5.147 881 HD13 LEU 13 HD13 LEU 13 -9.012 -4.795 5.832 882 HD21 LEU 13 HD21 LEU 13 -9.228 -9.083 5.918 883 HD22 LEU 13 HD22 LEU 13 -10.570 -8.209 5.172 884 HD23 LEU 13 HD23 LEU 13 -10.307 -8.113 6.916 885 H GLU 14 H GLU 14 -7.435 -10.253 2.520 886 HA GLU 14 HA GLU 14 -5.384 -9.269 0.695 887 HB2 GLU 14 HB2 GLU 14 -5.361 -11.633 1.454 888 HB3 GLU 14 HB3 GLU 14 -6.929 -11.897 0.706 889 HG2 GLU 14 HG2 GLU 14 -5.954 -11.492 -1.523 890 HG3 GLU 14 HG3 GLU 14 -4.386 -11.158 -0.782 891 H LEU 15 H LEU 15 -6.370 -7.579 -0.317 892 HA LEU 15 HA LEU 15 -8.827 -7.894 -1.853 893 HB2 LEU 15 HB2 LEU 15 -6.986 -5.598 -1.188 894 HB3 LEU 15 HB3 LEU 15 -8.002 -5.454 -2.608 895 HG LEU 15 HG LEU 15 -8.983 -4.366 -0.605 896 HD11 LEU 15 HD11 LEU 15 -10.431 -5.110 -2.412 897 HD12 LEU 15 HD12 LEU 15 -11.242 -5.247 -0.856 898 HD13 LEU 15 HD13 LEU 15 -10.610 -6.693 -1.648 899 HD21 LEU 15 HD21 LEU 15 -8.160 -5.896 1.146 900 HD22 LEU 15 HD22 LEU 15 -9.245 -7.159 0.561 901 HD23 LEU 15 HD23 LEU 15 -9.905 -5.670 1.247 902 H THR 16 H THR 16 -8.565 -9.123 -3.563 903 HA THR 16 HA THR 16 -6.178 -9.097 -5.237 904 HB THR 16 HB THR 16 -8.804 -10.644 -5.459 905 HG1 THR 16 HG1 THR 16 -7.550 -11.382 -3.725 906 HG21 THR 16 HG21 THR 16 -7.707 -11.992 -7.201 907 HG22 THR 16 HG22 THR 16 -6.253 -11.002 -7.076 908 HG23 THR 16 HG23 THR 16 -7.749 -10.290 -7.692 909 H VAL 17 H VAL 17 -6.143 -7.096 -6.233 910 HA VAL 17 HA VAL 17 -8.496 -6.314 -7.851 911 HB VAL 17 HB VAL 17 -8.142 -4.035 -7.483 912 HG11 VAL 17 HG11 VAL 17 -8.103 -3.658 -5.048 913 HG12 VAL 17 HG12 VAL 17 -7.458 -5.286 -4.802 914 HG13 VAL 17 HG13 VAL 17 -9.079 -5.069 -5.470 915 HG21 VAL 17 HG21 VAL 17 -6.127 -3.020 -6.395 916 HG22 VAL 17 HG22 VAL 17 -5.769 -3.834 -7.919 917 HG23 VAL 17 HG23 VAL 17 -5.375 -4.620 -6.390 918 H ARG 18 H ARG 18 -8.116 -5.566 -9.944 919 HA ARG 18 HA ARG 18 -5.370 -5.859 -11.015 920 HB2 ARG 18 HB2 ARG 18 -6.455 -5.757 -13.269 921 HB3 ARG 18 HB3 ARG 18 -6.954 -7.126 -12.283 922 HG2 ARG 18 HG2 ARG 18 -9.057 -5.787 -11.714 923 HG3 ARG 18 HG3 ARG 18 -8.562 -4.652 -12.981 924 HD2 ARG 18 HD2 ARG 18 -9.117 -7.621 -13.340 925 HD3 ARG 18 HD3 ARG 18 -10.170 -6.301 -13.842 926 HE ARG 18 HE ARG 18 -7.446 -6.595 -14.987 927 HH11 ARG 18 HH11 ARG 18 -10.932 -6.461 -15.503 928 HH12 ARG 18 HH12 ARG 18 -10.790 -6.395 -17.230 929 HH21 ARG 18 HH21 ARG 18 -7.275 -6.547 -17.232 930 HH22 ARG 18 HH22 ARG 18 -8.702 -6.446 -18.215 931 H ASN 19 H ASN 19 -4.202 -4.065 -11.470 932 HA ASN 19 HA ASN 19 -5.142 -1.782 -10.040 933 HB2 ASN 19 HB2 ASN 19 -2.832 -0.923 -10.199 934 HB3 ASN 19 HB3 ASN 19 -2.920 -2.548 -9.544 935 HD21 ASN 19 HD21 ASN 19 -0.657 -1.202 -10.654 936 HD22 ASN 19 HD22 ASN 19 -0.087 -2.155 -11.967 937 H HIS 20 H HIS 20 -6.746 -0.999 -11.330 938 HA HIS 20 HA HIS 20 -6.219 0.582 -13.692 939 HB2 HIS 20 HB2 HIS 20 -8.508 0.855 -11.680 940 HB3 HIS 20 HB3 HIS 20 -8.496 1.442 -13.332 941 HD1 HIS 20 HD1 HIS 20 -10.627 -0.527 -12.076 942 HD2 HIS 20 HD2 HIS 20 -7.456 -1.634 -14.530 943 HE1 HIS 20 HE1 HIS 20 -11.291 -2.726 -13.088 944 HE2 HIS 20 HE2 HIS 20 -9.478 -3.222 -14.759 945 HA PRO 21 HA PRO 21 -4.369 4.392 -12.144 946 HB2 PRO 21 HB2 PRO 21 -7.015 5.846 -12.446 947 HB3 PRO 21 HB3 PRO 21 -5.383 6.358 -12.938 948 HG2 PRO 21 HG2 PRO 21 -7.030 5.404 -14.765 949 HG3 PRO 21 HG3 PRO 21 -5.322 4.907 -14.776 950 HD2 PRO 21 HD2 PRO 21 -7.732 3.343 -13.894 951 HD3 PRO 21 HD3 PRO 21 -6.246 2.776 -14.691 952 H GLY 22 H GLY 22 -3.946 3.832 -10.037 953 HA2 GLY 22 HA2 GLY 22 -3.789 4.205 -7.806 954 HA3 GLY 22 HA3 GLY 22 -4.779 5.623 -8.055 955 H VAL 23 H VAL 23 -5.534 2.158 -8.410 956 HA VAL 23 HA VAL 23 -8.026 2.336 -7.027 957 HB VAL 23 HB VAL 23 -8.097 -0.159 -7.158 958 HG11 VAL 23 HG11 VAL 23 -8.172 -0.258 -9.640 959 HG12 VAL 23 HG12 VAL 23 -7.330 1.292 -9.714 960 HG13 VAL 23 HG13 VAL 23 -8.939 1.197 -8.995 961 HG21 VAL 23 HG21 VAL 23 -6.314 -1.389 -8.351 962 HG22 VAL 23 HG22 VAL 23 -5.686 -0.653 -6.876 963 HG23 VAL 23 HG23 VAL 23 -5.336 0.083 -8.444 964 H MET 24 H MET 24 -4.804 1.792 -5.899 965 HA MET 24 HA MET 24 -5.273 0.437 -3.489 966 HB2 MET 24 HB2 MET 24 -3.087 2.474 -4.039 967 HB3 MET 24 HB3 MET 24 -3.099 1.307 -2.723 968 HG2 MET 24 HG2 MET 24 -1.649 0.456 -4.408 969 HG3 MET 24 HG3 MET 24 -3.113 -0.523 -4.458 970 HE1 MET 24 HE1 MET 24 -1.964 -0.425 -8.221 971 HE2 MET 24 HE2 MET 24 -2.374 -1.465 -6.855 972 HE3 MET 24 HE3 MET 24 -0.913 -0.471 -6.807 973 H THR 25 H THR 25 -5.819 3.817 -4.311 974 HA THR 25 HA THR 25 -6.140 4.879 -1.712 975 HB THR 25 HB THR 25 -7.495 6.678 -2.730 976 HG1 THR 25 HG1 THR 25 -7.321 5.856 -5.331 977 HG21 THR 25 HG21 THR 25 -5.134 5.890 -4.475 978 HG22 THR 25 HG22 THR 25 -5.050 6.821 -2.975 979 HG23 THR 25 HG23 THR 25 -5.858 7.498 -4.393 980 H HIS 26 H HIS 26 -8.286 2.942 -3.733 981 HA HIS 26 HA HIS 26 -10.723 3.255 -2.325 982 HB2 HIS 26 HB2 HIS 26 -9.758 0.780 -3.850 983 HB3 HIS 26 HB3 HIS 26 -11.420 1.081 -3.360 984 HD1 HIS 26 HD1 HIS 26 -11.009 0.493 -6.213 985 HD2 HIS 26 HD2 HIS 26 -10.688 4.367 -4.731 986 HE1 HIS 26 HE1 HIS 26 -11.442 2.002 -8.163 987 HE2 HIS 26 HE2 HIS 26 -11.448 4.323 -7.191 988 H VAL 27 H VAL 27 -8.141 0.794 -2.084 989 HA VAL 27 HA VAL 27 -9.464 -0.733 -0.069 990 HB VAL 27 HB VAL 27 -7.470 -2.133 0.018 991 HG11 VAL 27 HG11 VAL 27 -8.963 -2.484 -1.889 992 HG12 VAL 27 HG12 VAL 27 -7.295 -2.810 -2.358 993 HG13 VAL 27 HG13 VAL 27 -8.071 -1.298 -2.847 994 HG21 VAL 27 HG21 VAL 27 -6.059 -0.037 -1.674 995 HG22 VAL 27 HG22 VAL 27 -5.409 -1.628 -1.262 996 HG23 VAL 27 HG23 VAL 27 -5.700 -0.437 0.006 997 H CYS 28 H CYS 28 -6.829 1.669 0.035 998 HA CYS 28 HA CYS 28 -6.258 1.471 2.806 999 HB2 CYS 28 HB2 CYS 28 -4.625 2.527 1.365 1000 HB3 CYS 28 HB3 CYS 28 -5.798 3.717 0.804 1001 HG CYS 28 HG CYS 28 -5.546 3.875 4.082 1002 H GLY 29 H GLY 29 -8.333 3.633 0.889 1003 HA2 GLY 29 HA2 GLY 29 -9.125 5.358 2.980 1004 HA3 GLY 29 HA3 GLY 29 -9.927 5.166 1.435 1005 H LEU 30 H LEU 30 -10.547 2.376 1.715 1006 HA LEU 30 HA LEU 30 -13.125 2.679 2.814 1007 HB2 LEU 30 HB2 LEU 30 -11.793 0.788 1.136 1008 HB3 LEU 30 HB3 LEU 30 -12.441 -0.149 2.462 1009 HG LEU 30 HG LEU 30 -13.993 -0.117 0.566 1010 HD11 LEU 30 HD11 LEU 30 -15.104 1.473 2.899 1011 HD12 LEU 30 HD12 LEU 30 -14.976 -0.285 2.792 1012 HD13 LEU 30 HD13 LEU 30 -16.048 0.582 1.697 1013 HD21 LEU 30 HD21 LEU 30 -13.359 2.038 -0.436 1014 HD22 LEU 30 HD22 LEU 30 -14.135 2.900 0.899 1015 HD23 LEU 30 HD23 LEU 30 -15.102 1.914 -0.205 1016 H PHE 31 H PHE 31 -10.292 0.865 3.991 1017 HA PHE 31 HA PHE 31 -11.734 -0.089 6.331 1018 HB2 PHE 31 HB2 PHE 31 -8.814 -0.485 5.577 1019 HB3 PHE 31 HB3 PHE 31 -9.703 -1.376 6.817 1020 HD1 PHE 31 HD2 PHE 31 -12.257 -2.046 5.574 1021 HD2 PHE 31 HD1 PHE 31 -8.366 -1.996 3.796 1022 HE1 PHE 31 HE2 PHE 31 -13.015 -3.627 3.855 1023 HE2 PHE 31 HE1 PHE 31 -9.136 -3.571 2.082 1024 HZ PHE 31 HZ PHE 31 -11.460 -4.392 2.103 1025 H ALA 32 H ALA 32 -9.471 2.478 5.582 1026 HA ALA 32 HA ALA 32 -8.770 3.186 8.267 1027 HB1 ALA 32 HB1 ALA 32 -7.394 3.849 6.334 1028 HB2 ALA 32 HB2 ALA 32 -7.879 5.258 7.282 1029 HB3 ALA 32 HB3 ALA 32 -8.696 4.893 5.755 1030 H ARG 33 H ARG 33 -11.403 4.127 6.082 1031 HA ARG 33 HA ARG 33 -12.274 6.397 7.628 1032 HB2 ARG 33 HB2 ARG 33 -14.069 6.641 6.040 1033 HB3 ARG 33 HB3 ARG 33 -12.617 6.203 5.144 1034 HG2 ARG 33 HG2 ARG 33 -13.489 3.792 5.175 1035 HG3 ARG 33 HG3 ARG 33 -15.018 4.447 5.770 1036 HD2 ARG 33 HD2 ARG 33 -13.656 5.180 3.153 1037 HD3 ARG 33 HD3 ARG 33 -15.039 4.094 3.323 1038 HE ARG 33 HE ARG 33 -15.873 6.419 4.485 1039 HH11 ARG 33 HH11 ARG 33 -14.597 5.660 1.282 1040 HH12 ARG 33 HH12 ARG 33 -15.489 6.932 0.508 1041 HH21 ARG 33 HH21 ARG 33 -17.028 8.054 3.449 1042 HH22 ARG 33 HH22 ARG 33 -16.864 8.285 1.737 1043 H ARG 34 H ARG 34 -12.624 3.087 8.123 1044 HA ARG 34 HA ARG 34 -15.265 2.921 9.164 1045 HB2 ARG 34 HB2 ARG 34 -13.758 0.979 8.500 1046 HB3 ARG 34 HB3 ARG 34 -12.825 1.280 9.965 1047 HG2 ARG 34 HG2 ARG 34 -15.291 1.018 11.080 1048 HG3 ARG 34 HG3 ARG 34 -15.538 0.039 9.632 1049 HD2 ARG 34 HD2 ARG 34 -14.811 -1.401 11.420 1050 HD3 ARG 34 HD3 ARG 34 -13.504 -1.269 10.236 1051 HE ARG 34 HE ARG 34 -13.497 0.482 12.598 1052 HH11 ARG 34 HH11 ARG 34 -11.985 -2.173 10.862 1053 HH12 ARG 34 HH12 ARG 34 -10.548 -2.135 11.824 1054 HH21 ARG 34 HH21 ARG 34 -11.632 0.492 13.845 1055 HH22 ARG 34 HH22 ARG 34 -10.361 -0.624 13.507 1056 H ALA 35 H ALA 35 -12.054 3.186 10.793 1057 HA ALA 35 HA ALA 35 -12.789 5.189 12.632 1058 HB1 ALA 35 HB1 ALA 35 -14.187 3.441 13.670 1059 HB2 ALA 35 HB2 ALA 35 -12.882 3.925 14.754 1060 HB3 ALA 35 HB3 ALA 35 -12.773 2.401 13.864 1061 H PHE 36 H PHE 36 -10.760 2.251 12.341 1062 HA PHE 36 HA PHE 36 -8.460 3.632 13.563 1063 HB2 PHE 36 HB2 PHE 36 -9.061 1.397 14.438 1064 HB3 PHE 36 HB3 PHE 36 -8.888 0.702 12.835 1065 HD1 PHE 36 HD2 PHE 36 -6.759 2.842 15.120 1066 HD2 PHE 36 HD1 PHE 36 -6.962 -0.614 12.595 1067 HE1 PHE 36 HE2 PHE 36 -4.406 2.321 15.621 1068 HE2 PHE 36 HE1 PHE 36 -4.615 -1.124 13.109 1069 HZ PHE 36 HZ PHE 36 -3.334 0.339 14.620 1070 H ASN 37 H ASN 37 -6.567 4.002 12.467 1071 HA ASN 37 HA ASN 37 -6.577 4.202 9.601 1072 HB2 ASN 37 HB2 ASN 37 -4.176 4.511 11.471 1073 HB3 ASN 37 HB3 ASN 37 -4.321 5.138 9.830 1074 HD21 ASN 37 HD21 ASN 37 -3.634 6.683 12.070 1075 HD22 ASN 37 HD22 ASN 37 -4.887 7.844 12.335 1076 H VAL 38 H VAL 38 -5.152 3.086 8.146 1077 HA VAL 38 HA VAL 38 -4.862 0.305 8.555 1078 HB VAL 38 HB VAL 38 -3.514 2.075 6.457 1079 HG11 VAL 38 HG11 VAL 38 -3.191 -0.014 5.157 1080 HG12 VAL 38 HG12 VAL 38 -3.820 -0.952 6.513 1081 HG13 VAL 38 HG13 VAL 38 -2.310 -0.050 6.690 1082 HG21 VAL 38 HG21 VAL 38 -5.308 1.346 4.928 1083 HG22 VAL 38 HG22 VAL 38 -5.993 2.172 6.331 1084 HG23 VAL 38 HG23 VAL 38 -6.060 0.407 6.225 1085 H GLU 39 H GLU 39 -3.307 -0.793 9.579 1086 HA GLU 39 HA GLU 39 -0.980 0.392 10.775 1087 HB2 GLU 39 HB2 GLU 39 -2.197 -1.416 11.906 1088 HB3 GLU 39 HB3 GLU 39 -1.922 -2.501 10.545 1089 HG2 GLU 39 HG2 GLU 39 0.595 -2.223 11.051 1090 HG3 GLU 39 HG3 GLU 39 0.089 -1.489 12.577 1091 H GLY 40 H GLY 40 -1.532 -1.952 8.111 1092 HA2 GLY 40 HA2 GLY 40 1.143 -1.426 6.985 1093 HA3 GLY 40 HA3 GLY 40 0.812 -3.064 7.546 1094 H ILE 41 H ILE 41 1.399 -2.174 4.853 1095 HA ILE 41 HA ILE 41 -0.919 -3.349 3.448 1096 HB ILE 41 HB ILE 41 0.654 -0.913 2.464 1097 HG12 ILE 41 HG12 ILE 41 -2.270 -1.200 3.268 1098 HG13 ILE 41 HG13 ILE 41 -1.045 -0.225 4.069 1099 HG21 ILE 41 HG21 ILE 41 -1.522 -2.426 0.996 1100 HG22 ILE 41 HG22 ILE 41 0.193 -2.435 0.590 1101 HG23 ILE 41 HG23 ILE 41 -0.738 -0.945 0.437 1102 HD11 ILE 41 HD11 ILE 41 -2.254 0.263 1.348 1103 HD12 ILE 41 HD12 ILE 41 -0.935 1.206 2.049 1104 HD13 ILE 41 HD13 ILE 41 -2.517 1.191 2.825 1105 H LEU 42 H LEU 42 -0.329 -4.699 1.737 1106 HA LEU 42 HA LEU 42 2.432 -4.743 0.773 1107 HB2 LEU 42 HB2 LEU 42 2.378 -6.444 2.552 1108 HB3 LEU 42 HB3 LEU 42 0.972 -7.200 1.822 1109 HG LEU 42 HG LEU 42 2.283 -8.023 -0.058 1110 HD11 LEU 42 HD11 LEU 42 4.683 -7.584 -0.312 1111 HD12 LEU 42 HD12 LEU 42 4.627 -6.461 1.051 1112 HD13 LEU 42 HD13 LEU 42 3.730 -6.107 -0.428 1113 HD21 LEU 42 HD21 LEU 42 3.881 -9.501 1.089 1114 HD22 LEU 42 HD22 LEU 42 2.367 -9.372 1.981 1115 HD23 LEU 42 HD23 LEU 42 3.792 -8.487 2.536 1116 H CYS 43 H CYS 43 1.786 -3.954 -1.192 1117 HA CYS 43 HA CYS 43 -0.255 -5.354 -2.780 1118 HB2 CYS 43 HB2 CYS 43 -0.344 -2.905 -2.771 1119 HB3 CYS 43 HB3 CYS 43 1.322 -2.812 -3.308 1120 HG CYS 43 HG CYS 43 -1.146 -4.193 -5.207 1121 H LEU 44 H LEU 44 0.631 -7.232 -3.422 1122 HA LEU 44 HA LEU 44 3.340 -7.390 -4.564 1123 HB2 LEU 44 HB2 LEU 44 2.461 -9.001 -2.775 1124 HB3 LEU 44 HB3 LEU 44 1.371 -9.631 -3.990 1125 HG LEU 44 HG LEU 44 3.497 -10.222 -5.365 1126 HD11 LEU 44 HD11 LEU 44 4.818 -9.778 -2.673 1127 HD12 LEU 44 HD12 LEU 44 5.082 -8.811 -4.130 1128 HD13 LEU 44 HD13 LEU 44 5.571 -10.504 -4.099 1129 HD21 LEU 44 HD21 LEU 44 3.041 -11.662 -2.731 1130 HD22 LEU 44 HD22 LEU 44 3.827 -12.327 -4.169 1131 HD23 LEU 44 HD23 LEU 44 2.118 -11.905 -4.217 1132 HA PRO 45 HA PRO 45 0.967 -7.100 -8.527 1133 HB2 PRO 45 HB2 PRO 45 3.179 -6.738 -10.157 1134 HB3 PRO 45 HB3 PRO 45 2.419 -5.422 -9.237 1135 HG2 PRO 45 HG2 PRO 45 4.869 -7.026 -8.548 1136 HG3 PRO 45 HG3 PRO 45 4.597 -5.274 -8.407 1137 HD2 PRO 45 HD2 PRO 45 4.420 -6.930 -6.264 1138 HD3 PRO 45 HD3 PRO 45 3.401 -5.480 -6.414 1139 H ILE 46 H ILE 46 0.229 -8.968 -9.298 1140 HA ILE 46 HA ILE 46 1.572 -11.460 -9.107 1141 HB ILE 46 HB ILE 46 -0.964 -10.754 -10.655 1142 HG12 ILE 46 HG12 ILE 46 -1.222 -10.204 -8.275 1143 HG13 ILE 46 HG13 ILE 46 -2.179 -11.630 -8.647 1144 HG21 ILE 46 HG21 ILE 46 0.063 -13.481 -9.780 1145 HG22 ILE 46 HG22 ILE 46 -0.047 -12.888 -11.440 1146 HG23 ILE 46 HG23 ILE 46 -1.518 -13.170 -10.507 1147 HD11 ILE 46 HD11 ILE 46 -0.444 -13.044 -7.618 1148 HD12 ILE 46 HD12 ILE 46 -1.096 -11.845 -6.505 1149 HD13 ILE 46 HD13 ILE 46 0.489 -11.591 -7.230 1150 H GLN 47 H GLN 47 2.941 -12.418 -10.502 1151 HA GLN 47 HA GLN 47 3.862 -11.086 -12.881 1152 HB2 GLN 47 HB2 GLN 47 5.523 -12.857 -13.015 1153 HB3 GLN 47 HB3 GLN 47 5.342 -12.379 -11.332 1154 HG2 GLN 47 HG2 GLN 47 3.813 -14.360 -11.001 1155 HG3 GLN 47 HG3 GLN 47 4.228 -14.877 -12.637 1156 HE21 GLN 47 HE21 GLN 47 5.318 -14.546 -9.373 1157 HE22 GLN 47 HE22 GLN 47 6.770 -15.468 -9.546 1158 H ASP 48 H ASP 48 1.524 -13.520 -12.217 1159 HA ASP 48 HA ASP 48 1.617 -15.040 -14.607 1160 HB2 ASP 48 HB2 ASP 48 0.678 -16.015 -12.602 1161 HB3 ASP 48 HB3 ASP 48 -0.495 -14.718 -12.434 1162 H SER 49 H SER 49 -0.265 -12.207 -13.617 1163 HA SER 49 HA SER 49 -1.121 -11.554 -16.290 1164 HB2 SER 49 HB2 SER 49 -3.616 -11.740 -15.676 1165 HB3 SER 49 HB3 SER 49 -2.779 -13.272 -15.933 1166 HG SER 49 HG SER 49 -2.709 -13.611 -13.757 1167 H ASP 50 H ASP 50 -2.876 -9.674 -16.090 1168 HA ASP 50 HA ASP 50 -1.652 -7.613 -14.508 1169 HB2 ASP 50 HB2 ASP 50 -3.288 -6.075 -15.534 1170 HB3 ASP 50 HB3 ASP 50 -2.528 -7.088 -16.752 1171 H LYS 51 H LYS 51 -1.943 -8.580 -12.425 1172 HA LYS 51 HA LYS 51 -4.271 -7.518 -11.032 1173 HB2 LYS 51 HB2 LYS 51 -3.586 -10.480 -11.081 1174 HB3 LYS 51 HB3 LYS 51 -4.250 -9.786 -9.607 1175 HG2 LYS 51 HG2 LYS 51 -6.254 -9.039 -10.891 1176 HG3 LYS 51 HG3 LYS 51 -5.596 -9.815 -12.334 1177 HD2 LYS 51 HD2 LYS 51 -6.298 -11.250 -9.740 1178 HD3 LYS 51 HD3 LYS 51 -7.330 -11.186 -11.169 1179 HE2 LYS 51 HE2 LYS 51 -4.551 -12.431 -11.095 1180 HE3 LYS 51 HE3 LYS 51 -6.070 -13.319 -10.990 1181 HZ1 LYS 51 HZ1 LYS 51 -6.653 -12.466 -13.193 1182 HZ2 LYS 51 HZ2 LYS 51 -5.234 -13.379 -13.217 1183 HZ3 LYS 51 HZ3 LYS 51 -5.151 -11.699 -13.293 1184 H SER 52 H SER 52 -3.893 -7.726 -8.655 1185 HA SER 52 HA SER 52 -1.238 -8.081 -7.631 1186 HB2 SER 52 HB2 SER 52 -1.119 -5.735 -8.561 1187 HB3 SER 52 HB3 SER 52 -2.491 -5.288 -7.542 1188 HG SER 52 HG SER 52 -0.020 -5.142 -6.874 1189 H HIS 53 H HIS 53 -1.391 -8.588 -5.457 1190 HA HIS 53 HA HIS 53 -4.084 -8.456 -4.202 1191 HB2 HIS 53 HB2 HIS 53 -1.724 -10.298 -3.656 1192 HB3 HIS 53 HB3 HIS 53 -3.158 -10.229 -2.637 1193 HD1 HIS 53 HD1 HIS 53 -3.931 -12.592 -3.105 1194 HD2 HIS 53 HD2 HIS 53 -3.407 -10.384 -6.571 1195 HE1 HIS 53 HE1 HIS 53 -4.884 -13.982 -4.942 1196 HE2 HIS 53 HE2 HIS 53 -4.345 -12.731 -7.039 1197 H ILE 54 H ILE 54 -4.299 -6.883 -2.784 1198 HA ILE 54 HA ILE 54 -1.972 -5.693 -1.432 1199 HB ILE 54 HB ILE 54 -4.783 -4.530 -1.801 1200 HG12 ILE 54 HG12 ILE 54 -3.575 -2.753 -3.200 1201 HG13 ILE 54 HG13 ILE 54 -2.152 -3.779 -3.160 1202 HG21 ILE 54 HG21 ILE 54 -2.306 -3.289 -0.553 1203 HG22 ILE 54 HG22 ILE 54 -3.757 -3.808 0.307 1204 HG23 ILE 54 HG23 ILE 54 -3.843 -2.459 -0.825 1205 HD11 ILE 54 HD11 ILE 54 -4.792 -4.506 -4.393 1206 HD12 ILE 54 HD12 ILE 54 -3.318 -5.478 -4.421 1207 HD13 ILE 54 HD13 ILE 54 -3.368 -3.925 -5.253 1208 H TRP 55 H TRP 55 -1.694 -6.731 0.489 1209 HA TRP 55 HA TRP 55 -3.950 -7.708 2.066 1210 HB2 TRP 55 HB2 TRP 55 -0.926 -7.892 2.448 1211 HB3 TRP 55 HB3 TRP 55 -2.088 -8.542 3.602 1212 HD1 TRP 55 HD1 TRP 55 -3.453 -10.760 2.852 1213 HE1 TRP 55 HE1 TRP 55 -2.971 -12.551 1.085 1214 HE3 TRP 55 HE3 TRP 55 0.026 -8.287 0.130 1215 HZ2 TRP 55 HZ2 TRP 55 -1.343 -12.863 -1.213 1216 HZ3 TRP 55 HZ3 TRP 55 0.981 -9.365 -1.831 1217 HH2 TRP 55 HH2 TRP 55 0.318 -11.617 -2.506 1218 H LEU 56 H LEU 56 -5.020 -6.113 3.140 1219 HA LEU 56 HA LEU 56 -3.647 -3.804 4.299 1220 HB2 LEU 56 HB2 LEU 56 -6.610 -4.516 4.211 1221 HB3 LEU 56 HB3 LEU 56 -5.969 -3.064 4.956 1222 HG LEU 56 HG LEU 56 -6.856 -2.408 2.855 1223 HD11 LEU 56 HD11 LEU 56 -4.959 -1.487 1.653 1224 HD12 LEU 56 HD12 LEU 56 -3.858 -2.567 2.511 1225 HD13 LEU 56 HD13 LEU 56 -4.755 -1.329 3.397 1226 HD21 LEU 56 HD21 LEU 56 -6.260 -3.414 0.695 1227 HD22 LEU 56 HD22 LEU 56 -7.052 -4.562 1.768 1228 HD23 LEU 56 HD23 LEU 56 -5.306 -4.645 1.529 1229 H LEU 57 H LEU 57 -2.794 -4.063 6.232 1230 HA LEU 57 HA LEU 57 -3.829 -5.861 8.258 1231 HB2 LEU 57 HB2 LEU 57 -1.391 -4.052 8.112 1232 HB3 LEU 57 HB3 LEU 57 -1.865 -4.849 9.602 1233 HG LEU 57 HG LEU 57 -1.516 -7.060 8.566 1234 HD11 LEU 57 HD11 LEU 57 -2.031 -6.593 6.241 1235 HD12 LEU 57 HD12 LEU 57 -0.442 -7.340 6.387 1236 HD13 LEU 57 HD13 LEU 57 -0.576 -5.601 6.088 1237 HD21 LEU 57 HD21 LEU 57 0.888 -5.238 8.295 1238 HD22 LEU 57 HD22 LEU 57 0.934 -7.000 8.436 1239 HD23 LEU 57 HD23 LEU 57 0.326 -6.026 9.774 1240 H VAL 58 H VAL 58 -5.591 -5.124 9.244 1241 HA VAL 58 HA VAL 58 -5.551 -2.588 10.727 1242 HB VAL 58 HB VAL 58 -6.684 -2.097 8.510 1243 HG11 VAL 58 HG11 VAL 58 -8.924 -2.974 8.007 1244 HG12 VAL 58 HG12 VAL 58 -8.820 -4.045 9.407 1245 HG13 VAL 58 HG13 VAL 58 -7.713 -4.261 8.047 1246 HG21 VAL 58 HG21 VAL 58 -7.232 -0.724 10.478 1247 HG22 VAL 58 HG22 VAL 58 -8.515 -1.852 10.925 1248 HG23 VAL 58 HG23 VAL 58 -8.649 -0.908 9.437 1249 H ASN 59 H ASN 59 -7.032 -2.717 12.600 1250 HA ASN 59 HA ASN 59 -7.409 -5.369 13.578 1251 HB2 ASN 59 HB2 ASN 59 -8.455 -4.362 15.538 1252 HB3 ASN 59 HB3 ASN 59 -6.991 -3.490 15.107 1253 HD21 ASN 59 HD21 ASN 59 -9.140 -2.537 16.718 1254 HD22 ASN 59 HD22 ASN 59 -9.827 -1.160 15.929 1255 H ASP 60 H ASP 60 -9.235 -6.631 13.724 1256 HA ASP 60 HA ASP 60 -11.286 -6.234 11.791 1257 HB2 ASP 60 HB2 ASP 60 -10.410 -8.482 12.267 1258 HB3 ASP 60 HB3 ASP 60 -11.033 -8.398 13.913 1259 H ASP 61 H ASP 61 -13.416 -5.718 12.048 1260 HA ASP 61 HA ASP 61 -14.518 -5.183 14.706 1261 HB2 ASP 61 HB2 ASP 61 -13.415 -3.067 14.034 1262 HB3 ASP 61 HB3 ASP 61 -14.285 -3.075 12.503 1263 H GLN 62 H GLN 62 -16.844 -4.784 14.607 1264 HA GLN 62 HA GLN 62 -18.235 -6.655 12.991 1265 HB2 GLN 62 HB2 GLN 62 -19.358 -4.365 14.674 1266 HB3 GLN 62 HB3 GLN 62 -20.262 -5.770 14.110 1267 HG2 GLN 62 HG2 GLN 62 -18.859 -7.240 15.511 1268 HG3 GLN 62 HG3 GLN 62 -17.930 -5.847 16.059 1269 HE21 GLN 62 HE21 GLN 62 -18.904 -4.381 17.539 1270 HE22 GLN 62 HE22 GLN 62 -20.314 -4.806 18.443 1271 H ARG 63 H ARG 63 -17.740 -3.165 12.758 1272 HA ARG 63 HA ARG 63 -19.561 -2.786 10.524 1273 HB2 ARG 63 HB2 ARG 63 -19.220 -0.957 12.126 1274 HB3 ARG 63 HB3 ARG 63 -17.494 -0.943 11.786 1275 HG2 ARG 63 HG2 ARG 63 -18.008 -0.233 9.441 1276 HG3 ARG 63 HG3 ARG 63 -19.717 -0.153 9.873 1277 HD2 ARG 63 HD2 ARG 63 -19.314 1.655 11.405 1278 HD3 ARG 63 HD3 ARG 63 -17.562 1.451 11.282 1279 HE ARG 63 HE ARG 63 -18.711 2.007 8.733 1280 HH11 ARG 63 HH11 ARG 63 -17.822 3.601 11.726 1281 HH12 ARG 63 HH12 ARG 63 -17.573 5.144 10.976 1282 HH21 ARG 63 HH21 ARG 63 -18.342 4.027 7.741 1283 HH22 ARG 63 HH22 ARG 63 -17.866 5.386 8.710 1284 H LEU 64 H LEU 64 -16.141 -3.464 11.015 1285 HA LEU 64 HA LEU 64 -14.998 -2.646 8.607 1286 HB2 LEU 64 HB2 LEU 64 -13.751 -3.579 10.596 1287 HB3 LEU 64 HB3 LEU 64 -14.286 -5.185 10.129 1288 HG LEU 64 HG LEU 64 -13.054 -4.780 7.879 1289 HD11 LEU 64 HD11 LEU 64 -12.806 -2.338 8.069 1290 HD12 LEU 64 HD12 LEU 64 -11.261 -3.153 7.834 1291 HD13 LEU 64 HD13 LEU 64 -11.706 -2.565 9.440 1292 HD21 LEU 64 HD21 LEU 64 -10.892 -5.446 8.762 1293 HD22 LEU 64 HD22 LEU 64 -12.192 -6.290 9.604 1294 HD23 LEU 64 HD23 LEU 64 -11.369 -4.934 10.386 1295 H GLU 65 H GLU 65 -16.811 -5.568 9.382 1296 HA GLU 65 HA GLU 65 -16.404 -7.109 7.075 1297 HB2 GLU 65 HB2 GLU 65 -18.945 -7.024 8.762 1298 HB3 GLU 65 HB3 GLU 65 -18.369 -8.371 7.774 1299 HG2 GLU 65 HG2 GLU 65 -16.403 -8.593 9.290 1300 HG3 GLU 65 HG3 GLU 65 -17.053 -7.293 10.289 1301 H GLN 66 H GLN 66 -18.767 -4.564 7.783 1302 HA GLN 66 HA GLN 66 -20.340 -4.811 5.421 1303 HB2 GLN 66 HB2 GLN 66 -19.977 -2.388 7.245 1304 HB3 GLN 66 HB3 GLN 66 -21.241 -2.566 6.030 1305 HG2 GLN 66 HG2 GLN 66 -20.901 -4.348 8.467 1306 HG3 GLN 66 HG3 GLN 66 -22.043 -3.011 8.341 1307 HE21 GLN 66 HE21 GLN 66 -22.603 -5.839 8.833 1308 HE22 GLN 66 HE22 GLN 66 -23.657 -6.355 7.565 1309 H MET 67 H MET 67 -17.513 -2.828 6.303 1310 HA MET 67 HA MET 67 -17.255 -1.345 3.907 1311 HB2 MET 67 HB2 MET 67 -15.280 -2.117 6.078 1312 HB3 MET 67 HB3 MET 67 -14.712 -1.305 4.629 1313 HG2 MET 67 HG2 MET 67 -14.983 0.345 6.326 1314 HG3 MET 67 HG3 MET 67 -16.258 0.589 5.140 1315 HE1 MET 67 HE1 MET 67 -19.483 0.184 7.110 1316 HE2 MET 67 HE2 MET 67 -18.843 -0.638 5.688 1317 HE3 MET 67 HE3 MET 67 -18.638 1.105 5.866 1318 H ILE 68 H ILE 68 -16.021 -4.498 4.874 1319 HA ILE 68 HA ILE 68 -14.399 -5.104 2.639 1320 HB ILE 68 HB ILE 68 -15.784 -6.841 4.732 1321 HG12 ILE 68 HG12 ILE 68 -12.816 -6.189 4.426 1322 HG13 ILE 68 HG13 ILE 68 -13.915 -5.263 5.440 1323 HG21 ILE 68 HG21 ILE 68 -13.780 -7.813 2.673 1324 HG22 ILE 68 HG22 ILE 68 -15.484 -8.258 2.750 1325 HG23 ILE 68 HG23 ILE 68 -14.385 -8.753 4.037 1326 HD11 ILE 68 HD11 ILE 68 -13.173 -8.160 5.796 1327 HD12 ILE 68 HD12 ILE 68 -14.337 -7.276 6.787 1328 HD13 ILE 68 HD13 ILE 68 -12.640 -6.792 6.774 1329 H SER 69 H SER 69 -17.817 -5.677 3.366 1330 HA SER 69 HA SER 69 -18.439 -7.207 1.032 1331 HB2 SER 69 HB2 SER 69 -19.751 -7.324 3.173 1332 HB3 SER 69 HB3 SER 69 -20.328 -5.685 2.886 1333 HG SER 69 HG SER 69 -20.796 -7.152 0.698 1334 H GLN 70 H GLN 70 -18.342 -3.759 1.758 1335 HA GLN 70 HA GLN 70 -19.967 -2.918 -0.472 1336 HB2 GLN 70 HB2 GLN 70 -19.725 -1.651 1.718 1337 HB3 GLN 70 HB3 GLN 70 -18.081 -1.246 1.251 1338 HG2 GLN 70 HG2 GLN 70 -20.471 -0.479 -0.448 1339 HG3 GLN 70 HG3 GLN 70 -19.924 0.528 0.887 1340 HE21 GLN 70 HE21 GLN 70 -17.074 0.107 0.412 1341 HE22 GLN 70 HE22 GLN 70 -16.688 0.982 -1.025 1342 H ILE 71 H ILE 71 -16.483 -2.936 0.313 1343 HA ILE 71 HA ILE 71 -15.603 -1.702 -2.080 1344 HB ILE 71 HB ILE 71 -14.238 -1.781 0.033 1345 HG12 ILE 71 HG12 ILE 71 -12.952 -2.708 -2.573 1346 HG13 ILE 71 HG13 ILE 71 -13.171 -1.053 -2.020 1347 HG21 ILE 71 HG21 ILE 71 -14.579 -4.163 0.621 1348 HG22 ILE 71 HG22 ILE 71 -12.870 -3.735 0.583 1349 HG23 ILE 71 HG23 ILE 71 -13.580 -4.644 -0.754 1350 HD11 ILE 71 HD11 ILE 71 -10.886 -1.712 -1.852 1351 HD12 ILE 71 HD12 ILE 71 -11.314 -3.110 -0.865 1352 HD13 ILE 71 HD13 ILE 71 -11.545 -1.474 -0.232 1353 H ASP 72 H ASP 72 -16.303 -4.993 -1.197 1354 HA ASP 72 HA ASP 72 -15.130 -6.539 -3.133 1355 HB2 ASP 72 HB2 ASP 72 -16.376 -7.509 -1.297 1356 HB3 ASP 72 HB3 ASP 72 -17.869 -6.735 -1.811 1357 H LYS 73 H LYS 73 -17.833 -4.330 -3.464 1358 HA LYS 73 HA LYS 73 -18.829 -5.422 -5.958 1359 HB2 LYS 73 HB2 LYS 73 -19.667 -2.845 -4.559 1360 HB3 LYS 73 HB3 LYS 73 -20.581 -3.747 -5.770 1361 HG2 LYS 73 HG2 LYS 73 -19.983 -4.584 -2.909 1362 HG3 LYS 73 HG3 LYS 73 -21.556 -4.160 -3.594 1363 HD2 LYS 73 HD2 LYS 73 -21.526 -6.185 -4.995 1364 HD3 LYS 73 HD3 LYS 73 -19.893 -6.575 -4.444 1365 HE2 LYS 73 HE2 LYS 73 -20.801 -6.793 -2.111 1366 HE3 LYS 73 HE3 LYS 73 -22.425 -6.566 -2.771 1367 HZ1 LYS 73 HZ1 LYS 73 -20.558 -8.728 -3.576 1368 HZ2 LYS 73 HZ2 LYS 73 -22.168 -8.549 -4.066 1369 HZ3 LYS 73 HZ3 LYS 73 -21.809 -8.909 -2.455 1370 H LEU 74 H LEU 74 -16.247 -3.436 -5.259 1371 HA LEU 74 HA LEU 74 -16.385 -1.641 -7.515 1372 HB2 LEU 74 HB2 LEU 74 -14.268 -2.323 -5.462 1373 HB3 LEU 74 HB3 LEU 74 -13.777 -1.486 -6.919 1374 HG LEU 74 HG LEU 74 -14.109 0.111 -5.097 1375 HD11 LEU 74 HD11 LEU 74 -14.558 0.879 -7.365 1376 HD12 LEU 74 HD12 LEU 74 -15.596 1.701 -6.204 1377 HD13 LEU 74 HD13 LEU 74 -16.257 0.412 -7.217 1378 HD21 LEU 74 HD21 LEU 74 -15.756 -1.109 -3.756 1379 HD22 LEU 74 HD22 LEU 74 -16.999 -0.817 -4.970 1380 HD23 LEU 74 HD23 LEU 74 -16.301 0.536 -4.072 1381 H GLU 75 H GLU 75 -15.283 -1.799 -9.463 1382 HA GLU 75 HA GLU 75 -15.240 -4.396 -10.643 1383 HB2 GLU 75 HB2 GLU 75 -14.328 -1.720 -11.771 1384 HB3 GLU 75 HB3 GLU 75 -14.584 -3.188 -12.721 1385 HG2 GLU 75 HG2 GLU 75 -16.976 -3.149 -12.204 1386 HG3 GLU 75 HG3 GLU 75 -16.752 -1.752 -11.144 1387 H ASP 76 H ASP 76 -12.706 -2.206 -9.521 1388 HA ASP 76 HA ASP 76 -10.482 -3.585 -10.622 1389 HB2 ASP 76 HB2 ASP 76 -9.137 -2.428 -8.836 1390 HB3 ASP 76 HB3 ASP 76 -10.110 -1.354 -9.818 1391 H VAL 77 H VAL 77 -12.130 -3.790 -7.468 1392 HA VAL 77 HA VAL 77 -10.593 -5.908 -6.384 1393 HB VAL 77 HB VAL 77 -13.423 -4.988 -5.696 1394 HG11 VAL 77 HG11 VAL 77 -11.563 -6.790 -4.085 1395 HG12 VAL 77 HG12 VAL 77 -13.073 -7.282 -4.859 1396 HG13 VAL 77 HG13 VAL 77 -13.104 -6.135 -3.519 1397 HG21 VAL 77 HG21 VAL 77 -11.695 -3.232 -5.406 1398 HG22 VAL 77 HG22 VAL 77 -10.769 -4.320 -4.361 1399 HG23 VAL 77 HG23 VAL 77 -12.363 -3.753 -3.856 1400 H VAL 78 H VAL 78 -10.396 -7.418 -7.968 1401 HA VAL 78 HA VAL 78 -12.390 -8.839 -9.348 1402 HB VAL 78 HB VAL 78 -9.664 -9.912 -8.452 1403 HG11 VAL 78 HG11 VAL 78 -11.408 -10.753 -10.802 1404 HG12 VAL 78 HG12 VAL 78 -11.135 -11.683 -9.326 1405 HG13 VAL 78 HG13 VAL 78 -9.797 -11.384 -10.440 1406 HG21 VAL 78 HG21 VAL 78 -8.756 -9.094 -10.603 1407 HG22 VAL 78 HG22 VAL 78 -9.354 -7.766 -9.605 1408 HG23 VAL 78 HG23 VAL 78 -10.311 -8.338 -10.975 1409 H LYS 79 H LYS 79 -10.762 -9.427 -6.251 1410 HA LYS 79 HA LYS 79 -13.095 -10.832 -5.172 1411 HB2 LYS 79 HB2 LYS 79 -10.279 -12.030 -5.134 1412 HB3 LYS 79 HB3 LYS 79 -11.605 -12.600 -4.124 1413 HG2 LYS 79 HG2 LYS 79 -12.855 -13.299 -6.122 1414 HG3 LYS 79 HG3 LYS 79 -11.567 -12.682 -7.158 1415 HD2 LYS 79 HD2 LYS 79 -11.304 -14.958 -5.147 1416 HD3 LYS 79 HD3 LYS 79 -11.422 -15.135 -6.899 1417 HE2 LYS 79 HE2 LYS 79 -9.276 -13.937 -7.173 1418 HE3 LYS 79 HE3 LYS 79 -9.163 -13.726 -5.422 1419 HZ1 LYS 79 HZ1 LYS 79 -9.112 -16.135 -5.192 1420 HZ2 LYS 79 HZ2 LYS 79 -7.830 -15.573 -6.128 1421 HZ3 LYS 79 HZ3 LYS 79 -9.155 -16.320 -6.870 1422 H VAL 80 H VAL 80 -13.255 -10.512 -2.925 1423 HA VAL 80 HA VAL 80 -10.988 -9.150 -1.551 1424 HB VAL 80 HB VAL 80 -13.103 -7.788 -1.555 1425 HG11 VAL 80 HG11 VAL 80 -14.796 -9.567 -1.524 1426 HG12 VAL 80 HG12 VAL 80 -15.042 -8.451 -0.180 1427 HG13 VAL 80 HG13 VAL 80 -14.306 -10.029 0.110 1428 HG21 VAL 80 HG21 VAL 80 -11.454 -7.502 0.245 1429 HG22 VAL 80 HG22 VAL 80 -12.247 -8.758 1.197 1430 HG23 VAL 80 HG23 VAL 80 -13.090 -7.244 0.858 1431 H GLN 81 H GLN 81 -10.197 -10.151 0.292 1432 HA GLN 81 HA GLN 81 -11.458 -12.651 1.261 1433 HB2 GLN 81 HB2 GLN 81 -8.550 -12.270 0.429 1434 HB3 GLN 81 HB3 GLN 81 -9.111 -13.647 1.376 1435 HG2 GLN 81 HG2 GLN 81 -10.409 -14.500 -0.443 1436 HG3 GLN 81 HG3 GLN 81 -10.270 -12.993 -1.345 1437 HE21 GLN 81 HE21 GLN 81 -8.499 -15.844 -0.266 1438 HE22 GLN 81 HE22 GLN 81 -7.258 -15.725 -1.455 1439 H ARG 82 H ARG 82 -11.146 -13.067 3.428 1440 HA ARG 82 HA ARG 82 -9.916 -10.932 5.080 1441 HB2 ARG 82 HB2 ARG 82 -12.186 -12.822 5.856 1442 HB3 ARG 82 HB3 ARG 82 -11.551 -11.490 6.821 1443 HG2 ARG 82 HG2 ARG 82 -12.406 -9.878 5.162 1444 HG3 ARG 82 HG3 ARG 82 -13.024 -11.208 4.175 1445 HD2 ARG 82 HD2 ARG 82 -14.835 -10.225 5.491 1446 HD3 ARG 82 HD3 ARG 82 -14.515 -11.873 6.047 1447 HE ARG 82 HE ARG 82 -13.049 -9.926 7.545 1448 HH11 ARG 82 HH11 ARG 82 -16.224 -11.399 7.303 1449 HH12 ARG 82 HH12 ARG 82 -16.630 -11.070 8.950 1450 HH21 ARG 82 HH21 ARG 82 -13.626 -9.482 9.707 1451 HH22 ARG 82 HH22 ARG 82 -15.174 -9.992 10.302 1452 H ASN 83 H ASN 83 -7.876 -11.845 5.285 1453 HA ASN 83 HA ASN 83 -7.599 -14.655 6.136 1454 HB2 ASN 83 HB2 ASN 83 -5.384 -12.677 5.432 1455 HB3 ASN 83 HB3 ASN 83 -5.211 -14.414 5.644 1456 HD21 ASN 83 HD21 ASN 83 -4.300 -14.614 3.585 1457 HD22 ASN 83 HD22 ASN 83 -5.230 -14.472 2.135 1458 H GLN 84 H GLN 84 -6.384 -15.190 8.021 1459 HA GLN 84 HA GLN 84 -6.729 -13.300 10.223 1460 HB2 GLN 84 HB2 GLN 84 -7.455 -15.674 10.470 1461 HB3 GLN 84 HB3 GLN 84 -5.796 -16.210 10.223 1462 HG2 GLN 84 HG2 GLN 84 -5.108 -15.066 12.297 1463 HG3 GLN 84 HG3 GLN 84 -6.754 -14.485 12.530 1464 HE21 GLN 84 HE21 GLN 84 -5.922 -17.747 11.432 1465 HE22 GLN 84 HE22 GLN 84 -6.482 -18.549 12.851 1466 H SER 85 H SER 85 -5.017 -12.484 11.463 1467 HA SER 85 HA SER 85 -2.592 -12.085 9.984 1468 HB2 SER 85 HB2 SER 85 -3.581 -10.182 11.116 1469 HB3 SER 85 HB3 SER 85 -3.414 -10.976 12.668 1470 HG SER 85 HG SER 85 -1.603 -9.870 12.664 1471 H ASP 86 H ASP 86 -0.856 -13.168 10.096 1472 HA ASP 86 HA ASP 86 0.138 -14.356 12.570 1473 HB2 ASP 86 HB2 ASP 86 -1.071 -16.137 11.150 1474 HB3 ASP 86 HB3 ASP 86 0.143 -15.864 9.909 1475 HA PRO 87 HA PRO 87 3.677 -11.940 11.240 1476 HB2 PRO 87 HB2 PRO 87 5.712 -13.567 12.366 1477 HB3 PRO 87 HB3 PRO 87 4.819 -12.291 13.216 1478 HG2 PRO 87 HG2 PRO 87 4.302 -15.250 13.186 1479 HG3 PRO 87 HG3 PRO 87 4.239 -14.109 14.551 1480 HD2 PRO 87 HD2 PRO 87 1.974 -14.932 13.429 1481 HD3 PRO 87 HD3 PRO 87 2.152 -13.218 13.884 1482 H THR 88 H THR 88 3.665 -15.438 10.598 1483 HA THR 88 HA THR 88 5.837 -15.295 8.690 1484 HB THR 88 HB THR 88 5.523 -17.671 8.305 1485 HG1 THR 88 HG1 THR 88 3.446 -18.013 10.120 1486 HG21 THR 88 HG21 THR 88 6.717 -17.042 10.373 1487 HG22 THR 88 HG22 THR 88 5.828 -18.551 10.594 1488 HG23 THR 88 HG23 THR 88 5.191 -17.045 11.261 1489 H MET 89 H MET 89 2.305 -15.224 8.555 1490 HA MET 89 HA MET 89 1.812 -15.966 5.910 1491 HB2 MET 89 HB2 MET 89 -0.061 -15.621 7.401 1492 HB3 MET 89 HB3 MET 89 0.374 -13.940 7.686 1493 HG2 MET 89 HG2 MET 89 -1.606 -14.187 6.192 1494 HG3 MET 89 HG3 MET 89 -0.271 -13.334 5.412 1495 HE1 MET 89 HE1 MET 89 -1.094 -13.629 2.975 1496 HE2 MET 89 HE2 MET 89 -2.591 -14.367 3.558 1497 HE3 MET 89 HE3 MET 89 -1.656 -15.151 2.283 1498 H PHE 90 H PHE 90 2.411 -12.696 7.203 1499 HA PHE 90 HA PHE 90 2.319 -11.223 4.834 1500 HB2 PHE 90 HB2 PHE 90 2.266 -10.310 7.195 1501 HB3 PHE 90 HB3 PHE 90 3.985 -10.639 7.332 1502 HD1 PHE 90 HD2 PHE 90 5.638 -9.194 6.167 1503 HD2 PHE 90 HD1 PHE 90 1.430 -8.424 5.855 1504 HE1 PHE 90 HE2 PHE 90 6.108 -6.945 5.288 1505 HE2 PHE 90 HE1 PHE 90 1.917 -6.177 4.984 1506 HZ PHE 90 HZ PHE 90 4.249 -5.436 4.705 1507 H ASN 91 H ASN 91 5.027 -12.909 6.405 1508 HA ASN 91 HA ASN 91 7.058 -11.897 4.624 1509 HB2 ASN 91 HB2 ASN 91 7.613 -12.505 6.945 1510 HB3 ASN 91 HB3 ASN 91 7.113 -14.169 6.658 1511 HD21 ASN 91 HD21 ASN 91 9.517 -11.729 5.799 1512 HD22 ASN 91 HD22 ASN 91 10.735 -12.845 5.295 1513 H LYS 92 H LYS 92 4.865 -14.610 4.664 1514 HA LYS 92 HA LYS 92 6.396 -16.465 3.170 1515 HB2 LYS 92 HB2 LYS 92 4.496 -17.134 4.652 1516 HB3 LYS 92 HB3 LYS 92 3.364 -16.399 3.520 1517 HG2 LYS 92 HG2 LYS 92 3.412 -18.813 3.172 1518 HG3 LYS 92 HG3 LYS 92 4.100 -17.995 1.763 1519 HD2 LYS 92 HD2 LYS 92 6.408 -18.448 2.740 1520 HD3 LYS 92 HD3 LYS 92 5.622 -19.429 3.982 1521 HE2 LYS 92 HE2 LYS 92 5.541 -19.937 0.987 1522 HE3 LYS 92 HE3 LYS 92 6.504 -20.830 2.161 1523 HZ1 LYS 92 HZ1 LYS 92 4.460 -21.569 3.213 1524 HZ2 LYS 92 HZ2 LYS 92 4.508 -22.027 1.589 1525 HZ3 LYS 92 HZ3 LYS 92 3.542 -20.730 2.072 1526 H ILE 93 H ILE 93 3.696 -14.270 2.167 1527 HA ILE 93 HA ILE 93 3.959 -15.101 -0.594 1528 HB ILE 93 HB ILE 93 2.346 -13.379 -1.206 1529 HG12 ILE 93 HG12 ILE 93 3.219 -11.697 0.655 1530 HG13 ILE 93 HG13 ILE 93 1.554 -11.639 0.131 1531 HG21 ILE 93 HG21 ILE 93 0.395 -14.190 0.092 1532 HG22 ILE 93 HG22 ILE 93 1.487 -14.911 1.276 1533 HG23 ILE 93 HG23 ILE 93 1.471 -15.507 -0.387 1534 HD11 ILE 93 HD11 ILE 93 2.550 -12.920 2.647 1535 HD12 ILE 93 HD12 ILE 93 0.864 -12.831 2.128 1536 HD13 ILE 93 HD13 ILE 93 1.755 -11.356 2.499 1537 H ALA 94 H ALA 94 5.288 -12.554 1.404 1538 HA ALA 94 HA ALA 94 6.318 -10.851 -0.608 1539 HB1 ALA 94 HB1 ALA 94 7.767 -9.957 1.181 1540 HB2 ALA 94 HB2 ALA 94 7.358 -11.336 2.208 1541 HB3 ALA 94 HB3 ALA 94 6.109 -10.176 1.750 1542 H VAL 95 H VAL 95 7.629 -13.794 0.917 1543 HA VAL 95 HA VAL 95 10.101 -13.654 -0.634 1544 HB VAL 95 HB VAL 95 10.106 -14.439 1.768 1545 HG11 VAL 95 HG11 VAL 95 8.809 -16.955 0.666 1546 HG12 VAL 95 HG12 VAL 95 8.064 -15.799 1.773 1547 HG13 VAL 95 HG13 VAL 95 9.450 -16.755 2.301 1548 HG21 VAL 95 HG21 VAL 95 11.755 -16.256 1.415 1549 HG22 VAL 95 HG22 VAL 95 12.009 -14.915 0.295 1550 HG23 VAL 95 HG23 VAL 95 11.233 -16.398 -0.268 1551 H PHE 96 H PHE 96 6.970 -15.145 -0.909 1552 HA PHE 96 HA PHE 96 7.776 -17.287 -2.694 1553 HB2 PHE 96 HB2 PHE 96 5.814 -17.472 -1.126 1554 HB3 PHE 96 HB3 PHE 96 4.979 -16.239 -2.058 1555 HD1 PHE 96 HD1 PHE 96 6.474 -19.653 -2.316 1556 HD2 PHE 96 HD2 PHE 96 3.638 -16.887 -3.939 1557 HE1 PHE 96 HE1 PHE 96 5.562 -21.426 -3.758 1558 HE2 PHE 96 HE2 PHE 96 2.741 -18.664 -5.379 1559 HZ PHE 96 HZ PHE 96 3.701 -20.930 -5.295 1560 H PHE 97 H PHE 97 6.700 -13.978 -2.959 1561 HA PHE 97 HA PHE 97 6.040 -12.608 -4.624 1562 HB2 PHE 97 HB2 PHE 97 7.817 -12.401 -6.478 1563 HB3 PHE 97 HB3 PHE 97 8.347 -12.192 -4.823 1564 HD1 PHE 97 HD2 PHE 97 8.342 -14.662 -7.661 1565 HD2 PHE 97 HD1 PHE 97 10.099 -13.545 -3.918 1566 HE1 PHE 97 HE2 PHE 97 10.091 -16.357 -7.972 1567 HE2 PHE 97 HE1 PHE 97 11.844 -15.245 -4.252 1568 HZ PHE 97 HZ PHE 97 11.844 -16.650 -6.270 1569 H GLN 98 H GLN 98 4.138 -14.143 -4.891 1570 HA GLN 98 HA GLN 98 3.936 -15.595 -7.363 1571 HB2 GLN 98 HB2 GLN 98 1.524 -15.831 -6.806 1572 HB3 GLN 98 HB3 GLN 98 2.578 -16.309 -5.481 1573 HG2 GLN 98 HG2 GLN 98 2.124 -14.231 -4.304 1574 HG3 GLN 98 HG3 GLN 98 1.166 -13.632 -5.656 1575 HE21 GLN 98 HE21 GLN 98 -0.853 -14.588 -6.081 1576 HE22 GLN 98 HE22 GLN 98 -1.707 -15.463 -4.863 Start of MODEL 3 1 H1 GLY 1 H1 GLY 1 9.806 7.515 -17.959 2 H2 GLY 1 H2 GLY 1 8.503 7.468 -19.041 3 H3 GLY 1 H3 GLY 1 8.507 8.577 -17.771 4 HA2 GLY 1 HA3 GLY 1 9.052 9.688 -19.833 5 HA3 GLY 1 HA2 GLY 1 10.402 9.717 -18.701 6 H SER 2 H SER 2 11.330 10.216 -20.984 7 HA SER 2 HA SER 2 11.798 8.038 -22.772 8 HB2 SER 2 HB2 SER 2 11.739 10.447 -23.453 9 HB3 SER 2 HB3 SER 2 13.253 10.710 -22.590 10 HG SER 2 HG SER 2 13.640 8.653 -24.191 11 H MET 3 H MET 3 12.662 6.379 -21.462 12 HA MET 3 HA MET 3 15.547 6.380 -21.145 13 HB2 MET 3 HB2 MET 3 15.502 5.668 -18.744 14 HB3 MET 3 HB3 MET 3 14.908 7.308 -18.967 15 HG2 MET 3 HG2 MET 3 13.453 6.363 -17.393 16 HG3 MET 3 HG3 MET 3 12.551 6.291 -18.904 17 HE1 MET 3 HE1 MET 3 14.428 2.663 -16.729 18 HE2 MET 3 HE2 MET 3 14.303 4.280 -16.039 19 HE3 MET 3 HE3 MET 3 15.431 3.967 -17.360 20 H GLN 4 H GLN 4 16.413 4.211 -20.805 21 HA GLN 4 HA GLN 4 14.607 2.102 -21.791 22 HB2 GLN 4 HB2 GLN 4 16.677 0.801 -22.282 23 HB3 GLN 4 HB3 GLN 4 16.582 2.331 -23.142 24 HG2 GLN 4 HG2 GLN 4 18.198 3.326 -21.564 25 HG3 GLN 4 HG3 GLN 4 18.291 1.796 -20.693 26 HE21 GLN 4 HE21 GLN 4 19.136 3.469 -23.639 27 HE22 GLN 4 HE22 GLN 4 20.282 2.311 -24.209 28 H ASN 5 H ASN 5 13.808 0.677 -20.467 29 HA ASN 5 HA ASN 5 14.820 0.413 -17.707 30 HB2 ASN 5 HB2 ASN 5 12.482 -0.388 -17.194 31 HB3 ASN 5 HB3 ASN 5 12.563 1.266 -17.772 32 HD21 ASN 5 HD21 ASN 5 10.363 -0.804 -17.796 33 HD22 ASN 5 HD22 ASN 5 9.813 -0.833 -19.425 34 H THR 6 H THR 6 16.225 -1.285 -17.662 35 HA THR 6 HA THR 6 15.638 -3.776 -19.116 36 HB THR 6 HB THR 6 17.983 -4.409 -18.382 37 HG1 THR 6 HG1 THR 6 19.232 -2.907 -17.319 38 HG21 THR 6 HG21 THR 6 17.744 -1.757 -19.867 39 HG22 THR 6 HG22 THR 6 17.621 -3.360 -20.595 40 HG23 THR 6 HG23 THR 6 19.150 -2.827 -19.898 41 H THR 7 H THR 7 16.932 -3.112 -15.823 42 HA THR 7 HA THR 7 15.090 -5.137 -14.651 43 HB THR 7 HB THR 7 17.045 -5.639 -13.009 44 HG1 THR 7 HG1 THR 7 18.668 -4.687 -15.147 45 HG21 THR 7 HG21 THR 7 16.349 -7.274 -14.728 46 HG22 THR 7 HG22 THR 7 18.099 -7.288 -14.499 47 HG23 THR 7 HG23 THR 7 17.402 -6.483 -15.906 48 H HIS 8 H HIS 8 16.989 -2.199 -14.199 49 HA HIS 8 HA HIS 8 15.721 -1.563 -11.639 50 HB2 HIS 8 HB2 HIS 8 17.753 -0.026 -13.308 51 HB3 HIS 8 HB3 HIS 8 17.142 0.499 -11.742 52 HD1 HIS 8 HD1 HIS 8 17.347 -2.047 -10.105 53 HD2 HIS 8 HD2 HIS 8 20.317 -0.812 -12.731 54 HE1 HIS 8 HE1 HIS 8 19.466 -3.103 -9.287 55 HE2 HIS 8 HE2 HIS 8 21.250 -2.267 -10.826 56 H ASP 9 H ASP 9 13.952 -1.884 -13.810 57 HA ASP 9 HA ASP 9 12.857 0.493 -14.825 58 HB2 ASP 9 HB2 ASP 9 12.059 -1.640 -15.682 59 HB3 ASP 9 HB3 ASP 9 11.620 -2.195 -14.071 60 H ASN 10 H ASN 10 11.758 -1.435 -12.018 61 HA ASN 10 HA ASN 10 10.268 0.787 -10.958 62 HB2 ASN 10 HB2 ASN 10 9.592 -0.759 -9.149 63 HB3 ASN 10 HB3 ASN 10 9.339 -1.470 -10.736 64 HD21 ASN 10 HD21 ASN 10 11.300 -1.583 -7.835 65 HD22 ASN 10 HD22 ASN 10 12.009 -3.122 -8.138 66 H VAL 11 H VAL 11 11.074 2.273 -9.696 67 HA VAL 11 HA VAL 11 13.518 2.009 -8.184 68 HB VAL 11 HB VAL 11 13.130 4.377 -7.520 69 HG11 VAL 11 HG11 VAL 11 12.835 3.894 -10.508 70 HG12 VAL 11 HG12 VAL 11 14.347 3.877 -9.599 71 HG13 VAL 11 HG13 VAL 11 13.433 5.377 -9.756 72 HG21 VAL 11 HG21 VAL 11 10.607 4.231 -9.233 73 HG22 VAL 11 HG22 VAL 11 11.260 5.687 -8.471 74 HG23 VAL 11 HG23 VAL 11 10.638 4.368 -7.476 75 H ILE 12 H ILE 12 13.632 2.221 -5.987 76 HA ILE 12 HA ILE 12 11.457 1.136 -4.388 77 HB ILE 12 HB ILE 12 14.287 1.670 -3.374 78 HG12 ILE 12 HG12 ILE 12 14.618 0.436 -5.493 79 HG13 ILE 12 HG13 ILE 12 15.057 -0.550 -4.109 80 HG21 ILE 12 HG21 ILE 12 12.619 0.976 -1.717 81 HG22 ILE 12 HG22 ILE 12 13.865 -0.255 -1.911 82 HG23 ILE 12 HG23 ILE 12 12.276 -0.488 -2.644 83 HD11 ILE 12 HD11 ILE 12 13.936 -1.849 -5.797 84 HD12 ILE 12 HD12 ILE 12 12.529 -0.789 -5.733 85 HD13 ILE 12 HD13 ILE 12 12.951 -1.785 -4.336 86 H LEU 13 H LEU 13 10.164 3.020 -4.168 87 HA LEU 13 HA LEU 13 11.350 5.476 -3.076 88 HB2 LEU 13 HB2 LEU 13 8.501 4.842 -3.959 89 HB3 LEU 13 HB3 LEU 13 9.027 6.408 -3.353 90 HG LEU 13 HG LEU 13 9.942 5.059 -5.925 91 HD11 LEU 13 HD11 LEU 13 7.752 6.044 -6.129 92 HD12 LEU 13 HD12 LEU 13 8.919 6.994 -7.040 93 HD13 LEU 13 HD13 LEU 13 8.328 7.580 -5.479 94 HD21 LEU 13 HD21 LEU 13 11.838 6.214 -4.947 95 HD22 LEU 13 HD22 LEU 13 10.881 7.685 -4.749 96 HD23 LEU 13 HD23 LEU 13 11.259 7.083 -6.365 97 H GLU 14 H GLU 14 11.838 5.196 -0.962 98 HA GLU 14 HA GLU 14 9.956 3.949 0.893 99 HB2 GLU 14 HB2 GLU 14 12.386 3.454 1.129 100 HB3 GLU 14 HB3 GLU 14 12.712 5.157 1.431 101 HG2 GLU 14 HG2 GLU 14 11.218 5.008 3.464 102 HG3 GLU 14 HG3 GLU 14 11.086 3.275 3.178 103 H LEU 15 H LEU 15 8.255 5.335 1.096 104 HA LEU 15 HA LEU 15 8.662 8.083 2.021 105 HB2 LEU 15 HB2 LEU 15 6.184 6.423 1.417 106 HB3 LEU 15 HB3 LEU 15 6.077 7.957 2.260 107 HG LEU 15 HG LEU 15 5.554 8.280 -0.081 108 HD11 LEU 15 HD11 LEU 15 7.081 10.086 -0.638 109 HD12 LEU 15 HD12 LEU 15 8.235 9.508 0.567 110 HD13 LEU 15 HD13 LEU 15 6.652 10.110 1.071 111 HD21 LEU 15 HD21 LEU 15 8.305 7.213 -0.780 112 HD22 LEU 15 HD22 LEU 15 7.138 7.908 -1.912 113 HD23 LEU 15 HD23 LEU 15 6.769 6.400 -1.081 114 H THR 16 H THR 16 9.348 8.204 4.055 115 HA THR 16 HA THR 16 8.485 6.408 6.176 116 HB THR 16 HB THR 16 10.202 8.932 6.319 117 HG1 THR 16 HG1 THR 16 11.068 7.055 5.113 118 HG21 THR 16 HG21 THR 16 10.892 8.134 8.543 119 HG22 THR 16 HG22 THR 16 9.814 6.744 8.399 120 HG23 THR 16 HG23 THR 16 9.138 8.375 8.503 121 H VAL 17 H VAL 17 6.375 6.728 6.625 122 HA VAL 17 HA VAL 17 5.428 9.479 7.189 123 HB VAL 17 HB VAL 17 3.298 9.014 6.393 124 HG11 VAL 17 HG11 VAL 17 5.098 7.470 4.496 125 HG12 VAL 17 HG12 VAL 17 4.842 9.220 4.517 126 HG13 VAL 17 HG13 VAL 17 3.509 8.144 4.094 127 HG21 VAL 17 HG21 VAL 17 2.795 6.933 7.529 128 HG22 VAL 17 HG22 VAL 17 3.864 6.033 6.457 129 HG23 VAL 17 HG23 VAL 17 2.383 6.756 5.823 130 H ARG 18 H ARG 18 4.214 9.766 9.039 131 HA ARG 18 HA ARG 18 3.959 7.480 10.916 132 HB2 ARG 18 HB2 ARG 18 3.500 9.241 12.650 133 HB3 ARG 18 HB3 ARG 18 5.113 9.299 11.955 134 HG2 ARG 18 HG2 ARG 18 4.436 11.205 10.540 135 HG3 ARG 18 HG3 ARG 18 2.823 11.160 11.263 136 HD2 ARG 18 HD2 ARG 18 5.429 11.665 12.749 137 HD3 ARG 18 HD3 ARG 18 4.230 12.890 12.318 138 HE ARG 18 HE ARG 18 3.774 10.658 14.227 139 HH11 ARG 18 HH11 ARG 18 3.092 13.966 13.226 140 HH12 ARG 18 HH12 ARG 18 2.054 14.275 14.578 141 HH21 ARG 18 HH21 ARG 18 2.415 11.063 15.955 142 HH22 ARG 18 HH22 ARG 18 1.668 12.623 16.130 143 H ASN 19 H ASN 19 1.872 7.161 11.963 144 HA ASN 19 HA ASN 19 -0.127 7.091 9.915 145 HB2 ASN 19 HB2 ASN 19 -0.093 5.997 12.746 146 HB3 ASN 19 HB3 ASN 19 -1.480 5.818 11.675 147 HD21 ASN 19 HD21 ASN 19 -1.347 3.577 11.556 148 HD22 ASN 19 HD22 ASN 19 -0.063 2.741 10.761 149 H HIS 20 H HIS 20 -0.446 9.330 9.681 150 HA HIS 20 HA HIS 20 -2.257 10.772 11.427 151 HB2 HIS 20 HB2 HIS 20 -1.356 11.169 8.536 152 HB3 HIS 20 HB3 HIS 20 -2.500 12.244 9.305 153 HD1 HIS 20 HD1 HIS 20 -1.558 14.013 10.897 154 HD2 HIS 20 HD2 HIS 20 1.314 11.379 9.477 155 HE1 HIS 20 HE1 HIS 20 0.648 14.991 11.571 156 HE2 HIS 20 HE2 HIS 20 2.350 13.519 10.460 157 HA PRO 21 HA PRO 21 -6.117 8.956 9.893 158 HB2 PRO 21 HB2 PRO 21 -7.226 11.747 9.660 159 HB3 PRO 21 HB3 PRO 21 -7.838 10.358 10.587 160 HG2 PRO 21 HG2 PRO 21 -6.658 12.395 11.842 161 HG3 PRO 21 HG3 PRO 21 -6.387 10.718 12.374 162 HD2 PRO 21 HD2 PRO 21 -4.574 12.491 10.738 163 HD3 PRO 21 HD3 PRO 21 -4.167 11.376 12.065 164 H GLY 22 H GLY 22 -5.478 8.185 7.887 165 HA2 GLY 22 HA2 GLY 22 -5.985 7.904 5.636 166 HA3 GLY 22 HA3 GLY 22 -6.557 9.564 5.556 167 H VAL 23 H VAL 23 -3.374 8.002 6.321 168 HA VAL 23 HA VAL 23 -1.937 9.930 4.662 169 HB VAL 23 HB VAL 23 -0.752 7.354 5.801 170 HG11 VAL 23 HG11 VAL 23 0.507 9.990 4.967 171 HG12 VAL 23 HG12 VAL 23 0.622 8.454 4.098 172 HG13 VAL 23 HG13 VAL 23 1.374 8.631 5.683 173 HG21 VAL 23 HG21 VAL 23 -0.893 10.046 7.185 174 HG22 VAL 23 HG22 VAL 23 0.036 8.647 7.737 175 HG23 VAL 23 HG23 VAL 23 -1.729 8.569 7.675 176 H MET 24 H MET 24 -2.906 6.564 4.525 177 HA MET 24 HA MET 24 -1.323 5.651 2.423 178 HB2 MET 24 HB2 MET 24 -4.093 4.664 3.229 179 HB3 MET 24 HB3 MET 24 -2.907 3.760 2.291 180 HG2 MET 24 HG2 MET 24 -2.649 4.605 5.191 181 HG3 MET 24 HG3 MET 24 -2.915 2.967 4.585 182 HE1 MET 24 HE1 MET 24 -0.596 3.683 6.692 183 HE2 MET 24 HE2 MET 24 0.768 2.792 6.017 184 HE3 MET 24 HE3 MET 24 -0.833 2.053 6.059 185 H THR 25 H THR 25 -4.374 7.397 2.376 186 HA THR 25 HA THR 25 -5.000 7.140 -0.399 187 HB THR 25 HB THR 25 -6.477 9.195 0.103 188 HG1 THR 25 HG1 THR 25 -6.434 10.019 2.118 189 HG21 THR 25 HG21 THR 25 -7.381 6.893 0.317 190 HG22 THR 25 HG22 THR 25 -8.050 7.964 1.552 191 HG23 THR 25 HG23 THR 25 -6.782 6.812 1.979 192 H HIS 26 H HIS 26 -3.108 9.463 1.497 193 HA HIS 26 HA HIS 26 -2.731 11.472 -0.459 194 HB2 HIS 26 HB2 HIS 26 -1.067 10.729 1.989 195 HB3 HIS 26 HB3 HIS 26 -0.696 12.119 0.974 196 HD1 HIS 26 HD1 HIS 26 -1.077 13.469 3.259 197 HD2 HIS 26 HD2 HIS 26 -4.473 11.751 1.615 198 HE1 HIS 26 HE1 HIS 26 -3.008 14.606 4.374 199 HE2 HIS 26 HE2 HIS 26 -5.031 13.399 3.508 200 H VAL 27 H VAL 27 -0.552 8.778 0.541 201 HA VAL 27 HA VAL 27 1.467 9.317 -1.346 202 HB VAL 27 HB VAL 27 2.393 7.091 -0.879 203 HG11 VAL 27 HG11 VAL 27 2.676 7.256 1.574 204 HG12 VAL 27 HG12 VAL 27 1.301 8.361 1.664 205 HG13 VAL 27 HG13 VAL 27 2.766 8.842 0.806 206 HG21 VAL 27 HG21 VAL 27 -0.165 6.443 0.638 207 HG22 VAL 27 HG22 VAL 27 1.290 5.439 0.590 208 HG23 VAL 27 HG23 VAL 27 0.356 5.709 -0.882 209 H CYS 28 H CYS 28 -1.243 6.998 -1.489 210 HA CYS 28 HA CYS 28 -0.789 5.944 -4.038 211 HB2 CYS 28 HB2 CYS 28 -3.307 6.246 -2.372 212 HB3 CYS 28 HB3 CYS 28 -3.250 5.298 -3.858 213 HG CYS 28 HG CYS 28 -2.573 4.332 -0.852 214 H GLY 29 H GLY 29 -2.349 8.920 -3.044 215 HA2 GLY 29 HA2 GLY 29 -3.696 9.633 -5.411 216 HA3 GLY 29 HA3 GLY 29 -3.127 10.730 -4.166 217 H LEU 30 H LEU 30 -0.388 10.390 -4.257 218 HA LEU 30 HA LEU 30 0.358 12.048 -6.420 219 HB2 LEU 30 HB2 LEU 30 1.925 10.585 -4.300 220 HB3 LEU 30 HB3 LEU 30 2.801 11.269 -5.656 221 HG LEU 30 HG LEU 30 2.891 12.827 -3.819 222 HD11 LEU 30 HD11 LEU 30 0.993 13.893 -5.927 223 HD12 LEU 30 HD12 LEU 30 2.750 13.790 -6.057 224 HD13 LEU 30 HD13 LEU 30 2.022 14.849 -4.856 225 HD21 LEU 30 HD21 LEU 30 -0.142 12.835 -3.769 226 HD22 LEU 30 HD22 LEU 30 0.914 13.873 -2.805 227 HD23 LEU 30 HD23 LEU 30 0.924 12.130 -2.550 228 H PHE 31 H PHE 31 0.610 8.535 -6.002 229 HA PHE 31 HA PHE 31 2.156 8.121 -8.425 230 HB2 PHE 31 HB2 PHE 31 0.646 6.188 -6.622 231 HB3 PHE 31 HB3 PHE 31 1.620 5.672 -8.002 232 HD1 PHE 31 HD2 PHE 31 4.080 6.026 -7.998 233 HD2 PHE 31 HD1 PHE 31 1.728 6.920 -4.561 234 HE1 PHE 31 HE2 PHE 31 6.098 6.161 -6.632 235 HE2 PHE 31 HE1 PHE 31 3.762 7.074 -3.193 236 HZ PHE 31 HZ PHE 31 5.963 6.693 -4.233 237 H ALA 32 H ALA 32 -1.302 7.960 -7.644 238 HA ALA 32 HA ALA 32 -2.162 6.742 -10.074 239 HB1 ALA 32 HB1 ALA 32 -4.428 7.378 -9.362 240 HB2 ALA 32 HB2 ALA 32 -3.751 8.436 -8.116 241 HB3 ALA 32 HB3 ALA 32 -3.511 6.690 -8.019 242 H ARG 33 H ARG 33 -1.749 10.121 -9.066 243 HA ARG 33 HA ARG 33 -3.219 11.262 -11.249 244 HB2 ARG 33 HB2 ARG 33 -2.488 13.434 -10.403 245 HB3 ARG 33 HB3 ARG 33 -3.046 12.409 -9.084 246 HG2 ARG 33 HG2 ARG 33 -0.643 11.866 -8.576 247 HG3 ARG 33 HG3 ARG 33 -0.166 13.056 -9.792 248 HD2 ARG 33 HD2 ARG 33 -1.854 13.667 -7.339 249 HD3 ARG 33 HD3 ARG 33 -0.111 13.932 -7.461 250 HE ARG 33 HE ARG 33 -1.336 15.246 -9.604 251 HH11 ARG 33 HH11 ARG 33 -1.207 15.545 -6.094 252 HH12 ARG 33 HH12 ARG 33 -1.466 17.263 -6.115 253 HH21 ARG 33 HH21 ARG 33 -1.697 17.482 -9.618 254 HH22 ARG 33 HH22 ARG 33 -1.745 18.363 -8.121 255 H ARG 34 H ARG 34 -0.012 10.045 -11.112 256 HA ARG 34 HA ARG 34 1.128 11.600 -13.212 257 HB2 ARG 34 HB2 ARG 34 2.579 10.268 -11.783 258 HB3 ARG 34 HB3 ARG 34 1.673 8.799 -12.136 259 HG2 ARG 34 HG2 ARG 34 2.473 9.004 -14.546 260 HG3 ARG 34 HG3 ARG 34 3.534 10.310 -14.004 261 HD2 ARG 34 HD2 ARG 34 4.754 8.831 -12.567 262 HD3 ARG 34 HD3 ARG 34 3.562 7.542 -12.769 263 HE ARG 34 HE ARG 34 4.817 8.341 -15.235 264 HH11 ARG 34 HH11 ARG 34 5.108 6.257 -12.418 265 HH12 ARG 34 HH12 ARG 34 6.149 5.121 -13.209 266 HH21 ARG 34 HH21 ARG 34 6.204 6.853 -16.270 267 HH22 ARG 34 HH22 ARG 34 6.774 5.458 -15.406 268 H ALA 35 H ALA 35 0.147 8.176 -13.380 269 HA ALA 35 HA ALA 35 -1.660 8.164 -15.468 270 HB1 ALA 35 HB1 ALA 35 -0.272 7.571 -17.452 271 HB2 ALA 35 HB2 ALA 35 1.198 7.883 -16.521 272 HB3 ALA 35 HB3 ALA 35 0.089 9.204 -16.886 273 H PHE 36 H PHE 36 1.405 6.643 -14.555 274 HA PHE 36 HA PHE 36 0.245 3.943 -14.678 275 HB2 PHE 36 HB2 PHE 36 2.422 4.319 -15.814 276 HB3 PHE 36 HB3 PHE 36 3.138 4.863 -14.303 277 HD1 PHE 36 HD1 PHE 36 1.193 1.858 -15.536 278 HD2 PHE 36 HD2 PHE 36 4.543 3.278 -13.271 279 HE1 PHE 36 HE1 PHE 36 1.861 -0.464 -15.043 280 HE2 PHE 36 HE2 PHE 36 5.195 0.956 -12.783 281 HZ PHE 36 HZ PHE 36 3.855 -0.916 -13.665 282 H ASN 37 H ASN 37 -0.457 2.995 -12.880 283 HA ASN 37 HA ASN 37 -0.025 4.087 -10.238 284 HB2 ASN 37 HB2 ASN 37 -1.438 1.564 -11.197 285 HB3 ASN 37 HB3 ASN 37 -1.285 1.978 -9.498 286 HD21 ASN 37 HD21 ASN 37 -1.943 4.280 -12.149 287 HD22 ASN 37 HD22 ASN 37 -3.517 4.707 -11.593 288 H VAL 38 H VAL 38 0.495 2.278 -8.517 289 HA VAL 38 HA VAL 38 3.262 1.639 -8.869 290 HB VAL 38 HB VAL 38 1.391 0.842 -6.594 291 HG11 VAL 38 HG11 VAL 38 4.402 1.181 -6.681 292 HG12 VAL 38 HG12 VAL 38 3.526 -0.351 -6.591 293 HG13 VAL 38 HG13 VAL 38 3.448 0.790 -5.246 294 HG21 VAL 38 HG21 VAL 38 2.107 2.895 -5.443 295 HG22 VAL 38 HG22 VAL 38 1.291 3.285 -6.957 296 HG23 VAL 38 HG23 VAL 38 3.051 3.378 -6.855 297 H GLU 39 H GLU 39 4.198 -0.363 -9.221 298 HA GLU 39 HA GLU 39 2.640 -2.504 -10.346 299 HB2 GLU 39 HB2 GLU 39 4.933 -1.890 -11.133 300 HB3 GLU 39 HB3 GLU 39 5.599 -2.393 -9.586 301 HG2 GLU 39 HG2 GLU 39 6.021 -4.134 -11.194 302 HG3 GLU 39 HG3 GLU 39 4.805 -4.724 -10.060 303 H GLY 40 H GLY 40 4.566 -2.062 -7.391 304 HA2 GLY 40 HA2 GLY 40 2.886 -3.969 -5.907 305 HA3 GLY 40 HA3 GLY 40 4.605 -4.338 -6.030 306 H ILE 41 H ILE 41 3.068 -3.686 -3.603 307 HA ILE 41 HA ILE 41 4.448 -1.205 -2.720 308 HB ILE 41 HB ILE 41 1.636 -2.068 -1.837 309 HG12 ILE 41 HG12 ILE 41 2.433 0.282 -3.618 310 HG13 ILE 41 HG13 ILE 41 1.607 -1.176 -4.150 311 HG21 ILE 41 HG21 ILE 41 2.850 -0.921 -0.028 312 HG22 ILE 41 HG22 ILE 41 1.517 0.073 -0.614 313 HG23 ILE 41 HG23 ILE 41 3.174 0.448 -1.095 314 HD11 ILE 41 HD11 ILE 41 0.059 0.664 -3.965 315 HD12 ILE 41 HD12 ILE 41 0.487 0.913 -2.272 316 HD13 ILE 41 HD13 ILE 41 -0.333 -0.570 -2.770 317 H LEU 42 H LEU 42 5.306 -1.269 -0.683 318 HA LEU 42 HA LEU 42 4.651 -3.459 1.164 319 HB2 LEU 42 HB2 LEU 42 6.814 -4.075 0.113 320 HB3 LEU 42 HB3 LEU 42 7.482 -2.502 0.527 321 HG LEU 42 HG LEU 42 7.290 -3.058 2.953 322 HD11 LEU 42 HD11 LEU 42 6.336 -5.771 2.023 323 HD12 LEU 42 HD12 LEU 42 5.404 -4.565 2.916 324 HD13 LEU 42 HD13 LEU 42 6.789 -5.344 3.677 325 HD21 LEU 42 HD21 LEU 42 9.094 -4.696 3.055 326 HD22 LEU 42 HD22 LEU 42 9.378 -3.499 1.794 327 HD23 LEU 42 HD23 LEU 42 8.824 -5.119 1.360 328 H CYS 43 H CYS 43 4.695 -2.797 3.312 329 HA CYS 43 HA CYS 43 5.529 -0.117 4.082 330 HB2 CYS 43 HB2 CYS 43 3.256 0.374 3.407 331 HB3 CYS 43 HB3 CYS 43 2.637 -1.047 4.233 332 HG CYS 43 HG CYS 43 4.003 1.626 5.867 333 H LEU 44 H LEU 44 6.899 -0.755 5.616 334 HA LEU 44 HA LEU 44 6.296 -2.959 7.461 335 HB2 LEU 44 HB2 LEU 44 8.509 -2.724 6.179 336 HB3 LEU 44 HB3 LEU 44 8.860 -1.350 7.204 337 HG LEU 44 HG LEU 44 8.642 -2.988 9.203 338 HD11 LEU 44 HD11 LEU 44 8.976 -5.362 8.687 339 HD12 LEU 44 HD12 LEU 44 8.844 -5.018 6.962 340 HD13 LEU 44 HD13 LEU 44 7.457 -4.766 8.026 341 HD21 LEU 44 HD21 LEU 44 10.809 -2.107 8.431 342 HD22 LEU 44 HD22 LEU 44 10.929 -3.398 7.234 343 HD23 LEU 44 HD23 LEU 44 10.957 -3.784 8.957 344 HA PRO 45 HA PRO 45 5.182 0.423 10.385 345 HB2 PRO 45 HB2 PRO 45 4.286 -1.245 12.411 346 HB3 PRO 45 HB3 PRO 45 3.294 -0.770 11.017 347 HG2 PRO 45 HG2 PRO 45 4.821 -3.317 11.448 348 HG3 PRO 45 HG3 PRO 45 3.186 -3.080 10.786 349 HD2 PRO 45 HD2 PRO 45 5.334 -3.516 9.182 350 HD3 PRO 45 HD3 PRO 45 3.978 -2.483 8.675 351 H ILE 46 H ILE 46 6.973 1.334 11.179 352 HA ILE 46 HA ILE 46 9.155 -0.106 12.355 353 HB ILE 46 HB ILE 46 8.638 2.902 12.316 354 HG12 ILE 46 HG12 ILE 46 8.732 2.054 10.009 355 HG13 ILE 46 HG13 ILE 46 10.204 2.950 10.354 356 HG21 ILE 46 HG21 ILE 46 11.204 1.362 12.856 357 HG22 ILE 46 HG22 ILE 46 10.271 2.306 14.026 358 HG23 ILE 46 HG23 ILE 46 11.079 3.116 12.684 359 HD11 ILE 46 HD11 ILE 46 11.396 0.803 10.671 360 HD12 ILE 46 HD12 ILE 46 10.701 0.991 9.063 361 HD13 ILE 46 HD13 ILE 46 9.909 -0.054 10.241 362 H GLN 47 H GLN 47 8.777 -1.071 14.219 363 HA GLN 47 HA GLN 47 6.495 -0.625 15.792 364 HB2 GLN 47 HB2 GLN 47 7.375 -2.505 17.182 365 HB3 GLN 47 HB3 GLN 47 7.395 -2.841 15.460 366 HG2 GLN 47 HG2 GLN 47 9.832 -2.266 15.416 367 HG3 GLN 47 HG3 GLN 47 9.777 -2.089 17.168 368 HE21 GLN 47 HE21 GLN 47 8.065 -4.609 15.340 369 HE22 GLN 47 HE22 GLN 47 8.991 -5.921 15.974 370 H ASP 48 H ASP 48 9.639 0.807 16.152 371 HA ASP 48 HA ASP 48 9.630 0.901 19.034 372 HB2 ASP 48 HB2 ASP 48 11.782 1.777 18.915 373 HB3 ASP 48 HB3 ASP 48 11.700 0.904 17.394 374 H SER 49 H SER 49 8.297 2.813 16.545 375 HA SER 49 HA SER 49 7.444 4.952 18.385 376 HB2 SER 49 HB2 SER 49 8.775 5.446 15.676 377 HB3 SER 49 HB3 SER 49 8.092 6.679 16.723 378 HG SER 49 HG SER 49 9.831 5.361 18.191 379 H ASP 50 H ASP 50 5.822 6.453 17.046 380 HA ASP 50 HA ASP 50 3.975 4.792 15.491 381 HB2 ASP 50 HB2 ASP 50 2.485 6.786 15.493 382 HB3 ASP 50 HB3 ASP 50 2.946 6.283 17.109 383 H LYS 51 H LYS 51 5.495 4.378 13.799 384 HA LYS 51 HA LYS 51 5.078 6.120 11.570 385 HB2 LYS 51 HB2 LYS 51 7.418 6.590 10.965 386 HB3 LYS 51 HB3 LYS 51 7.018 7.317 12.513 387 HG2 LYS 51 HG2 LYS 51 8.244 5.516 13.690 388 HG3 LYS 51 HG3 LYS 51 8.620 4.762 12.135 389 HD2 LYS 51 HD2 LYS 51 9.859 6.835 11.461 390 HD3 LYS 51 HD3 LYS 51 9.538 7.520 13.057 391 HE2 LYS 51 HE2 LYS 51 11.156 5.004 12.507 392 HE3 LYS 51 HE3 LYS 51 11.822 6.589 12.893 393 HZ1 LYS 51 HZ1 LYS 51 11.790 5.154 14.829 394 HZ2 LYS 51 HZ2 LYS 51 10.124 4.938 14.695 395 HZ3 LYS 51 HZ3 LYS 51 10.749 6.464 15.067 396 H SER 52 H SER 52 6.210 5.248 9.598 397 HA SER 52 HA SER 52 6.764 2.420 9.494 398 HB2 SER 52 HB2 SER 52 4.254 2.484 9.553 399 HB3 SER 52 HB3 SER 52 4.251 3.551 8.146 400 HG SER 52 HG SER 52 4.111 1.019 8.035 401 H HIS 53 H HIS 53 7.628 1.829 7.443 402 HA HIS 53 HA HIS 53 8.263 4.062 5.574 403 HB2 HIS 53 HB2 HIS 53 9.684 1.401 6.029 404 HB3 HIS 53 HB3 HIS 53 10.118 2.555 4.776 405 HD1 HIS 53 HD1 HIS 53 12.182 1.655 6.829 406 HD2 HIS 53 HD2 HIS 53 9.830 5.049 7.246 407 HE1 HIS 53 HE1 HIS 53 13.491 3.202 8.306 408 HE2 HIS 53 HE2 HIS 53 12.180 5.342 8.257 409 H ILE 54 H ILE 54 7.254 3.952 3.636 410 HA ILE 54 HA ILE 54 5.987 1.411 2.802 411 HB ILE 54 HB ILE 54 5.143 4.249 1.987 412 HG12 ILE 54 HG12 ILE 54 2.976 3.714 3.261 413 HG13 ILE 54 HG13 ILE 54 3.802 2.332 3.961 414 HG21 ILE 54 HG21 ILE 54 4.718 2.561 0.242 415 HG22 ILE 54 HG22 ILE 54 3.203 3.148 0.923 416 HG23 ILE 54 HG23 ILE 54 3.828 1.565 1.397 417 HD11 ILE 54 HD11 ILE 54 4.586 5.214 4.318 418 HD12 ILE 54 HD12 ILE 54 5.356 3.822 5.081 419 HD13 ILE 54 HD13 ILE 54 3.688 4.231 5.472 420 H TRP 55 H TRP 55 7.528 0.492 1.486 421 HA TRP 55 HA TRP 55 8.970 2.080 -0.524 422 HB2 TRP 55 HB2 TRP 55 9.054 -0.924 0.032 423 HB3 TRP 55 HB3 TRP 55 10.090 -0.071 -1.107 424 HD1 TRP 55 HD1 TRP 55 12.178 1.287 -0.072 425 HE1 TRP 55 HE1 TRP 55 13.292 1.233 2.247 426 HE3 TRP 55 HE3 TRP 55 8.519 -1.128 2.499 427 HZ2 TRP 55 HZ2 TRP 55 12.692 0.269 4.834 428 HZ3 TRP 55 HZ3 TRP 55 8.852 -1.578 4.871 429 HH2 TRP 55 HH2 TRP 55 10.897 -0.896 6.037 430 H LEU 56 H LEU 56 7.637 2.641 -2.185 431 HA LEU 56 HA LEU 56 5.832 0.642 -3.351 432 HB2 LEU 56 HB2 LEU 56 6.137 3.568 -4.132 433 HB3 LEU 56 HB3 LEU 56 4.886 2.455 -4.659 434 HG LEU 56 HG LEU 56 4.521 2.325 -1.919 435 HD11 LEU 56 HD11 LEU 56 6.223 3.999 -1.443 436 HD12 LEU 56 HD12 LEU 56 4.626 4.565 -0.961 437 HD13 LEU 56 HD13 LEU 56 5.370 5.181 -2.439 438 HD21 LEU 56 HD21 LEU 56 2.724 2.668 -3.536 439 HD22 LEU 56 HD22 LEU 56 3.206 4.351 -3.748 440 HD23 LEU 56 HD23 LEU 56 2.579 3.800 -2.191 441 H LEU 57 H LEU 57 6.485 -0.545 -4.955 442 HA LEU 57 HA LEU 57 8.896 -0.048 -6.491 443 HB2 LEU 57 HB2 LEU 57 6.916 -2.380 -6.661 444 HB3 LEU 57 HB3 LEU 57 8.453 -2.285 -7.496 445 HG LEU 57 HG LEU 57 8.727 -3.824 -5.690 446 HD11 LEU 57 HD11 LEU 57 10.513 -2.861 -4.371 447 HD12 LEU 57 HD12 LEU 57 10.023 -1.234 -4.850 448 HD13 LEU 57 HD13 LEU 57 10.626 -2.370 -6.060 449 HD21 LEU 57 HD21 LEU 57 7.654 -1.746 -3.760 450 HD22 LEU 57 HD22 LEU 57 8.275 -3.345 -3.331 451 HD23 LEU 57 HD23 LEU 57 6.813 -3.198 -4.303 452 H VAL 58 H VAL 58 8.510 1.569 -7.903 453 HA VAL 58 HA VAL 58 6.490 1.148 -10.033 454 HB VAL 58 HB VAL 58 5.498 2.703 -8.260 455 HG11 VAL 58 HG11 VAL 58 7.492 3.884 -7.556 456 HG12 VAL 58 HG12 VAL 58 6.264 5.026 -8.103 457 HG13 VAL 58 HG13 VAL 58 7.636 4.641 -9.144 458 HG21 VAL 58 HG21 VAL 58 4.597 4.359 -9.871 459 HG22 VAL 58 HG22 VAL 58 4.621 2.730 -10.547 460 HG23 VAL 58 HG23 VAL 58 5.851 3.901 -11.029 461 H ASN 59 H ASN 59 7.221 2.056 -12.064 462 HA ASN 59 HA ASN 59 10.027 2.629 -12.188 463 HB2 ASN 59 HB2 ASN 59 9.632 3.079 -14.633 464 HB3 ASN 59 HB3 ASN 59 9.156 1.486 -14.068 465 HD21 ASN 59 HD21 ASN 59 7.805 1.118 -15.774 466 HD22 ASN 59 HD22 ASN 59 6.302 1.946 -15.994 467 H ASP 60 H ASP 60 11.102 4.551 -12.495 468 HA ASP 60 HA ASP 60 9.843 6.888 -11.383 469 HB2 ASP 60 HB2 ASP 60 12.216 6.296 -10.911 470 HB3 ASP 60 HB3 ASP 60 12.628 6.572 -12.595 471 H ASP 61 H ASP 61 9.475 8.876 -12.380 472 HA ASP 61 HA ASP 61 9.790 9.108 -15.303 473 HB2 ASP 61 HB2 ASP 61 7.359 8.567 -14.584 474 HB3 ASP 61 HB3 ASP 61 7.324 10.135 -13.804 475 H GLN 62 H GLN 62 10.201 11.273 -15.945 476 HA GLN 62 HA GLN 62 11.822 12.753 -14.193 477 HB2 GLN 62 HB2 GLN 62 10.555 13.572 -16.841 478 HB3 GLN 62 HB3 GLN 62 11.819 14.483 -16.022 479 HG2 GLN 62 HG2 GLN 62 12.116 11.629 -17.030 480 HG3 GLN 62 HG3 GLN 62 12.675 13.064 -17.884 481 HE21 GLN 62 HE21 GLN 62 13.205 10.995 -15.116 482 HE22 GLN 62 HE22 GLN 62 14.792 11.568 -14.742 483 H ARG 63 H ARG 63 8.392 13.100 -15.043 484 HA ARG 63 HA ARG 63 8.120 15.571 -13.517 485 HB2 ARG 63 HB2 ARG 63 5.899 15.753 -14.254 486 HB3 ARG 63 HB3 ARG 63 6.792 15.138 -15.634 487 HG2 ARG 63 HG2 ARG 63 5.855 12.904 -15.288 488 HG3 ARG 63 HG3 ARG 63 5.011 13.454 -13.834 489 HD2 ARG 63 HD2 ARG 63 3.738 15.084 -15.202 490 HD3 ARG 63 HD3 ARG 63 4.578 14.528 -16.650 491 HE ARG 63 HE ARG 63 3.390 12.286 -15.617 492 HH11 ARG 63 HH11 ARG 63 2.234 15.439 -16.682 493 HH12 ARG 63 HH12 ARG 63 0.689 14.836 -17.191 494 HH21 ARG 63 HH21 ARG 63 1.393 11.501 -16.347 495 HH22 ARG 63 HH22 ARG 63 0.217 12.593 -16.998 496 H LEU 64 H LEU 64 7.665 12.148 -13.029 497 HA LEU 64 HA LEU 64 6.122 12.261 -10.649 498 HB2 LEU 64 HB2 LEU 64 6.267 10.196 -11.888 499 HB3 LEU 64 HB3 LEU 64 8.001 10.111 -11.685 500 HG LEU 64 HG LEU 64 6.449 10.095 -9.113 501 HD11 LEU 64 HD11 LEU 64 4.939 8.709 -10.449 502 HD12 LEU 64 HD12 LEU 64 5.786 7.745 -9.243 503 HD13 LEU 64 HD13 LEU 64 6.290 7.679 -10.937 504 HD21 LEU 64 HD21 LEU 64 8.691 8.332 -10.143 505 HD22 LEU 64 HD22 LEU 64 8.048 8.340 -8.498 506 HD23 LEU 64 HD23 LEU 64 8.875 9.763 -9.125 507 H GLU 65 H GLU 65 9.561 12.675 -11.267 508 HA GLU 65 HA GLU 65 10.601 12.611 -8.658 509 HB2 GLU 65 HB2 GLU 65 11.431 14.465 -10.937 510 HB3 GLU 65 HB3 GLU 65 12.405 14.080 -9.518 511 HG2 GLU 65 HG2 GLU 65 12.468 11.690 -10.263 512 HG3 GLU 65 HG3 GLU 65 11.580 12.153 -11.717 513 H GLN 66 H GLN 66 8.984 15.216 -10.431 514 HA GLN 66 HA GLN 66 9.188 17.275 -8.488 515 HB2 GLN 66 HB2 GLN 66 8.620 17.736 -10.853 516 HB3 GLN 66 HB3 GLN 66 7.129 16.823 -10.696 517 HG2 GLN 66 HG2 GLN 66 6.593 19.174 -10.675 518 HG3 GLN 66 HG3 GLN 66 6.291 18.524 -9.066 519 HE21 GLN 66 HE21 GLN 66 7.683 19.131 -7.360 520 HE22 GLN 66 HE22 GLN 66 8.704 20.520 -7.472 521 H MET 67 H MET 67 6.911 14.617 -8.976 522 HA MET 67 HA MET 67 4.991 15.499 -7.022 523 HB2 MET 67 HB2 MET 67 5.253 12.673 -8.118 524 HB3 MET 67 HB3 MET 67 3.823 13.439 -7.434 525 HG2 MET 67 HG2 MET 67 5.101 13.931 -10.127 526 HG3 MET 67 HG3 MET 67 3.462 13.389 -9.776 527 HE1 MET 67 HE1 MET 67 1.522 15.019 -8.911 528 HE2 MET 67 HE2 MET 67 1.766 16.729 -8.560 529 HE3 MET 67 HE3 MET 67 2.491 15.505 -7.520 530 H ILE 68 H ILE 68 7.835 13.419 -6.979 531 HA ILE 68 HA ILE 68 7.669 12.367 -4.353 532 HB ILE 68 HB ILE 68 10.103 13.050 -6.079 533 HG12 ILE 68 HG12 ILE 68 8.804 10.341 -5.517 534 HG13 ILE 68 HG13 ILE 68 8.626 11.262 -7.002 535 HG21 ILE 68 HG21 ILE 68 10.106 11.424 -3.515 536 HG22 ILE 68 HG22 ILE 68 10.825 13.019 -3.731 537 HG23 ILE 68 HG23 ILE 68 11.482 11.634 -4.603 538 HD11 ILE 68 HD11 ILE 68 10.198 9.466 -7.320 539 HD12 ILE 68 HD12 ILE 68 11.182 10.019 -5.968 540 HD13 ILE 68 HD13 ILE 68 11.051 11.005 -7.428 541 H SER 69 H SER 69 8.968 15.409 -5.645 542 HA SER 69 HA SER 69 9.899 16.521 -3.199 543 HB2 SER 69 HB2 SER 69 9.035 17.935 -5.759 544 HB3 SER 69 HB3 SER 69 10.058 18.616 -4.486 545 HG SER 69 HG SER 69 11.287 16.448 -5.101 546 H GLN 70 H GLN 70 6.769 16.489 -4.824 547 HA GLN 70 HA GLN 70 5.522 18.573 -3.300 548 HB2 GLN 70 HB2 GLN 70 4.875 17.699 -5.654 549 HB3 GLN 70 HB3 GLN 70 4.089 16.358 -4.840 550 HG2 GLN 70 HG2 GLN 70 3.371 19.271 -4.381 551 HG3 GLN 70 HG3 GLN 70 2.584 18.254 -5.577 552 HE21 GLN 70 HE21 GLN 70 2.481 15.885 -3.828 553 HE22 GLN 70 HE22 GLN 70 1.266 16.221 -2.653 554 H ILE 71 H ILE 71 5.534 15.008 -3.151 555 HA ILE 71 HA ILE 71 3.607 14.790 -1.061 556 HB ILE 71 HB ILE 71 4.104 12.950 -2.693 557 HG12 ILE 71 HG12 ILE 71 4.283 12.233 0.266 558 HG13 ILE 71 HG13 ILE 71 2.814 12.427 -0.685 559 HG21 ILE 71 HG21 ILE 71 5.998 11.442 -2.363 560 HG22 ILE 71 HG22 ILE 71 6.604 12.463 -1.055 561 HG23 ILE 71 HG23 ILE 71 6.551 13.081 -2.706 562 HD11 ILE 71 HD11 ILE 71 4.876 10.255 -0.989 563 HD12 ILE 71 HD12 ILE 71 3.448 10.453 -2.011 564 HD13 ILE 71 HD13 ILE 71 3.264 10.108 -0.294 565 H ASP 72 H ASP 72 7.094 15.122 -1.154 566 HA ASP 72 HA ASP 72 7.755 14.569 1.499 567 HB2 ASP 72 HB2 ASP 72 9.482 14.839 -0.177 568 HB3 ASP 72 HB3 ASP 72 8.968 16.482 -0.541 569 H LYS 73 H LYS 73 6.190 17.378 0.085 570 HA LYS 73 HA LYS 73 6.613 19.250 2.210 571 HB2 LYS 73 HB2 LYS 73 4.486 19.213 0.035 572 HB3 LYS 73 HB3 LYS 73 4.869 20.598 1.049 573 HG2 LYS 73 HG2 LYS 73 6.845 19.304 -0.854 574 HG3 LYS 73 HG3 LYS 73 5.794 20.637 -1.308 575 HD2 LYS 73 HD2 LYS 73 7.482 22.010 -0.664 576 HD3 LYS 73 HD3 LYS 73 7.042 21.621 0.995 577 HE2 LYS 73 HE2 LYS 73 9.064 20.006 -0.596 578 HE3 LYS 73 HE3 LYS 73 9.509 21.400 0.382 579 HZ1 LYS 73 HZ1 LYS 73 9.861 19.398 1.625 580 HZ2 LYS 73 HZ2 LYS 73 8.283 18.875 1.358 581 HZ3 LYS 73 HZ3 LYS 73 8.570 20.229 2.327 582 H LEU 74 H LEU 74 4.384 16.630 1.764 583 HA LEU 74 HA LEU 74 2.255 17.489 3.440 584 HB2 LEU 74 HB2 LEU 74 3.133 14.790 2.378 585 HB3 LEU 74 HB3 LEU 74 1.908 14.845 3.630 586 HG LEU 74 HG LEU 74 0.878 14.622 1.418 587 HD11 LEU 74 HD11 LEU 74 -0.367 15.799 3.145 588 HD12 LEU 74 HD12 LEU 74 -0.748 16.427 1.546 589 HD13 LEU 74 HD13 LEU 74 0.315 17.343 2.618 590 HD21 LEU 74 HD21 LEU 74 0.986 16.384 -0.287 591 HD22 LEU 74 HD22 LEU 74 2.583 15.724 0.043 592 HD23 LEU 74 HD23 LEU 74 2.134 17.292 0.705 593 H GLU 75 H GLU 75 1.868 17.195 5.568 594 HA GLU 75 HA GLU 75 4.039 17.034 7.424 595 HB2 GLU 75 HB2 GLU 75 1.019 17.096 7.836 596 HB3 GLU 75 HB3 GLU 75 2.200 17.291 9.132 597 HG2 GLU 75 HG2 GLU 75 2.979 19.386 8.224 598 HG3 GLU 75 HG3 GLU 75 2.080 19.146 6.727 599 H ASP 76 H ASP 76 2.107 14.687 5.936 600 HA ASP 76 HA ASP 76 2.106 12.593 7.855 601 HB2 ASP 76 HB2 ASP 76 2.161 12.318 4.815 602 HB3 ASP 76 HB3 ASP 76 1.541 11.150 5.979 603 H VAL 77 H VAL 77 4.182 13.452 5.155 604 HA VAL 77 HA VAL 77 5.937 11.192 5.427 605 HB VAL 77 HB VAL 77 6.011 13.623 3.580 606 HG11 VAL 77 HG11 VAL 77 7.609 12.373 2.186 607 HG12 VAL 77 HG12 VAL 77 7.642 11.064 3.373 608 HG13 VAL 77 HG13 VAL 77 8.275 12.656 3.798 609 HG21 VAL 77 HG21 VAL 77 5.089 10.775 3.039 610 HG22 VAL 77 HG22 VAL 77 5.123 12.097 1.870 611 HG23 VAL 77 HG23 VAL 77 4.032 12.175 3.254 612 H VAL 78 H VAL 78 6.982 11.320 7.316 613 HA VAL 78 HA VAL 78 8.308 13.495 8.516 614 HB VAL 78 HB VAL 78 9.097 10.541 8.705 615 HG11 VAL 78 HG11 VAL 78 9.507 12.803 10.696 616 HG12 VAL 78 HG12 VAL 78 10.758 12.033 9.714 617 HG13 VAL 78 HG13 VAL 78 9.924 11.106 10.961 618 HG21 VAL 78 HG21 VAL 78 6.987 11.996 10.340 619 HG22 VAL 78 HG22 VAL 78 7.560 10.350 10.629 620 HG23 VAL 78 HG23 VAL 78 6.697 10.733 9.138 621 H LYS 79 H LYS 79 9.423 10.924 6.344 622 HA LYS 79 HA LYS 79 11.600 12.594 5.298 623 HB2 LYS 79 HB2 LYS 79 11.968 9.689 6.195 624 HB3 LYS 79 HB3 LYS 79 13.146 10.607 5.265 625 HG2 LYS 79 HG2 LYS 79 13.596 12.066 7.131 626 HG3 LYS 79 HG3 LYS 79 12.261 11.372 8.058 627 HD2 LYS 79 HD2 LYS 79 13.421 9.196 8.153 628 HD3 LYS 79 HD3 LYS 79 14.731 9.827 7.152 629 HE2 LYS 79 HE2 LYS 79 14.010 10.844 9.926 630 HE3 LYS 79 HE3 LYS 79 15.329 9.732 9.561 631 HZ1 LYS 79 HZ1 LYS 79 16.288 11.486 8.129 632 HZ2 LYS 79 HZ2 LYS 79 16.199 11.931 9.753 633 HZ3 LYS 79 HZ3 LYS 79 15.081 12.548 8.647 634 H VAL 80 H VAL 80 11.901 12.262 3.111 635 HA VAL 80 HA VAL 80 10.423 10.043 1.782 636 HB VAL 80 HB VAL 80 9.785 12.354 1.027 637 HG11 VAL 80 HG11 VAL 80 11.324 13.709 -0.352 638 HG12 VAL 80 HG12 VAL 80 12.632 12.572 -0.013 639 HG13 VAL 80 HG13 VAL 80 11.923 13.518 1.297 640 HG21 VAL 80 HG21 VAL 80 11.122 10.692 -1.136 641 HG22 VAL 80 HG22 VAL 80 9.889 11.930 -1.401 642 HG23 VAL 80 HG23 VAL 80 9.493 10.466 -0.503 643 H GLN 81 H GLN 81 11.609 8.797 0.242 644 HA GLN 81 HA GLN 81 14.471 9.265 -0.117 645 HB2 GLN 81 HB2 GLN 81 14.254 7.942 2.023 646 HB3 GLN 81 HB3 GLN 81 13.435 6.670 1.124 647 HG2 GLN 81 HG2 GLN 81 15.482 6.277 -0.201 648 HG3 GLN 81 HG3 GLN 81 16.301 7.576 0.671 649 HE21 GLN 81 HE21 GLN 81 15.026 4.331 0.898 650 HE22 GLN 81 HE22 GLN 81 15.793 3.905 2.385 651 H ARG 82 H ARG 82 15.244 8.343 -1.974 652 HA ARG 82 HA ARG 82 13.522 6.590 -3.574 653 HB2 ARG 82 HB2 ARG 82 13.924 7.997 -5.604 654 HB3 ARG 82 HB3 ARG 82 12.925 8.776 -4.391 655 HG2 ARG 82 HG2 ARG 82 14.905 10.133 -3.685 656 HG3 ARG 82 HG3 ARG 82 15.836 9.391 -4.991 657 HD2 ARG 82 HD2 ARG 82 13.364 11.135 -5.284 658 HD3 ARG 82 HD3 ARG 82 15.024 11.568 -5.701 659 HE ARG 82 HE ARG 82 13.714 9.310 -7.073 660 HH11 ARG 82 HH11 ARG 82 15.079 12.559 -7.309 661 HH12 ARG 82 HH12 ARG 82 15.082 12.544 -9.042 662 HH21 ARG 82 HH21 ARG 82 13.697 9.346 -9.340 663 HH22 ARG 82 HH22 ARG 82 14.303 10.739 -10.173 664 H ASN 83 H ASN 83 14.674 4.896 -4.156 665 HA ASN 83 HA ASN 83 17.560 5.134 -4.820 666 HB2 ASN 83 HB2 ASN 83 16.304 2.787 -3.292 667 HB3 ASN 83 HB3 ASN 83 18.006 2.993 -3.684 668 HD21 ASN 83 HD21 ASN 83 19.220 4.596 -2.514 669 HD22 ASN 83 HD22 ASN 83 18.669 5.169 -0.978 670 H GLN 84 H GLN 84 17.813 4.470 -6.952 671 HA GLN 84 HA GLN 84 15.725 2.838 -8.198 672 HB2 GLN 84 HB2 GLN 84 16.656 4.781 -9.437 673 HB3 GLN 84 HB3 GLN 84 18.245 4.021 -9.454 674 HG2 GLN 84 HG2 GLN 84 17.357 2.171 -10.832 675 HG3 GLN 84 HG3 GLN 84 15.746 2.877 -10.751 676 HE21 GLN 84 HE21 GLN 84 15.264 4.685 -12.022 677 HE22 GLN 84 HE22 GLN 84 16.290 5.214 -13.304 678 H SER 85 H SER 85 15.877 0.818 -7.428 679 HA SER 85 HA SER 85 18.311 -0.765 -7.925 680 HB2 SER 85 HB2 SER 85 18.448 0.111 -5.575 681 HB3 SER 85 HB3 SER 85 16.900 -0.650 -5.211 682 HG SER 85 HG SER 85 18.633 -1.957 -4.556 683 H ASP 86 H ASP 86 17.732 -3.175 -7.262 684 HA ASP 86 HA ASP 86 15.621 -4.000 -8.993 685 HB2 ASP 86 HB2 ASP 86 17.269 -5.628 -7.008 686 HB3 ASP 86 HB3 ASP 86 16.231 -6.316 -8.258 687 HA PRO 87 HA PRO 87 12.050 -4.246 -6.281 688 HB2 PRO 87 HB2 PRO 87 10.870 -6.643 -7.115 689 HB3 PRO 87 HB3 PRO 87 10.750 -5.105 -7.994 690 HG2 PRO 87 HG2 PRO 87 12.651 -7.388 -8.474 691 HG3 PRO 87 HG3 PRO 87 11.691 -6.457 -9.648 692 HD2 PRO 87 HD2 PRO 87 14.285 -5.910 -9.311 693 HD3 PRO 87 HD3 PRO 87 13.118 -4.582 -9.536 694 H THR 88 H THR 88 14.406 -6.782 -6.287 695 HA THR 88 HA THR 88 13.507 -8.476 -4.223 696 HB THR 88 HB THR 88 15.930 -9.155 -4.093 697 HG1 THR 88 HG1 THR 88 17.391 -8.079 -5.492 698 HG21 THR 88 HG21 THR 88 16.150 -9.957 -6.427 699 HG22 THR 88 HG22 THR 88 14.880 -8.841 -6.940 700 HG23 THR 88 HG23 THR 88 14.499 -10.174 -5.843 701 H MET 89 H MET 89 14.746 -5.247 -4.002 702 HA MET 89 HA MET 89 15.774 -5.246 -1.379 703 HB2 MET 89 HB2 MET 89 14.321 -3.013 -2.854 704 HB3 MET 89 HB3 MET 89 15.251 -2.803 -1.373 705 HG2 MET 89 HG2 MET 89 16.353 -3.662 -4.062 706 HG3 MET 89 HG3 MET 89 16.509 -2.069 -3.337 707 HE1 MET 89 HE1 MET 89 19.127 -5.743 -2.487 708 HE2 MET 89 HE2 MET 89 18.244 -5.363 -3.967 709 HE3 MET 89 HE3 MET 89 17.378 -5.949 -2.546 710 H PHE 90 H PHE 90 12.427 -4.907 -2.612 711 HA PHE 90 HA PHE 90 11.158 -4.269 -0.180 712 HB2 PHE 90 HB2 PHE 90 9.208 -4.252 -1.392 713 HB3 PHE 90 HB3 PHE 90 10.227 -4.508 -2.792 714 HD1 PHE 90 HD1 PHE 90 7.817 -6.102 -0.459 715 HD2 PHE 90 HD2 PHE 90 10.180 -6.692 -3.977 716 HE1 PHE 90 HE1 PHE 90 6.593 -8.176 -0.957 717 HE2 PHE 90 HE2 PHE 90 8.954 -8.761 -4.458 718 HZ PHE 90 HZ PHE 90 7.159 -9.508 -2.944 719 H ASN 91 H ASN 91 11.931 -7.365 -1.692 720 HA ASN 91 HA ASN 91 10.689 -9.120 0.128 721 HB2 ASN 91 HB2 ASN 91 11.467 -9.785 -2.125 722 HB3 ASN 91 HB3 ASN 91 13.130 -9.488 -1.661 723 HD21 ASN 91 HD21 ASN 91 11.478 -11.918 -2.557 724 HD22 ASN 91 HD22 ASN 91 11.987 -13.161 -1.481 725 H LYS 92 H LYS 92 13.911 -7.634 0.029 726 HA LYS 92 HA LYS 92 15.232 -9.069 2.005 727 HB2 LYS 92 HB2 LYS 92 16.342 -7.486 0.429 728 HB3 LYS 92 HB3 LYS 92 15.663 -6.124 1.304 729 HG2 LYS 92 HG2 LYS 92 17.423 -8.099 2.767 730 HG3 LYS 92 HG3 LYS 92 18.164 -6.896 1.716 731 HD2 LYS 92 HD2 LYS 92 17.253 -5.078 3.043 732 HD3 LYS 92 HD3 LYS 92 16.292 -6.196 4.011 733 HE2 LYS 92 HE2 LYS 92 18.282 -5.432 5.235 734 HE3 LYS 92 HE3 LYS 92 18.349 -7.171 4.948 735 HZ1 LYS 92 HZ1 LYS 92 19.778 -5.103 3.357 736 HZ2 LYS 92 HZ2 LYS 92 19.862 -6.767 3.102 737 HZ3 LYS 92 HZ3 LYS 92 20.490 -6.101 4.519 738 H ILE 93 H ILE 93 13.610 -5.854 2.525 739 HA ILE 93 HA ILE 93 14.028 -6.116 5.392 740 HB ILE 93 HB ILE 93 12.862 -4.016 5.737 741 HG12 ILE 93 HG12 ILE 93 11.139 -4.448 3.814 742 HG13 ILE 93 HG13 ILE 93 11.632 -2.809 4.164 743 HG21 ILE 93 HG21 ILE 93 14.781 -3.847 3.388 744 HG22 ILE 93 HG22 ILE 93 15.211 -3.883 5.099 745 HG23 ILE 93 HG23 ILE 93 14.329 -2.503 4.443 746 HD11 ILE 93 HD11 ILE 93 11.434 -3.197 1.807 747 HD12 ILE 93 HD12 ILE 93 12.634 -4.485 1.887 748 HD13 ILE 93 HD13 ILE 93 13.099 -2.814 2.232 749 H ALA 94 H ALA 94 11.398 -6.883 3.223 750 HA ALA 94 HA ALA 94 9.244 -7.054 5.037 751 HB1 ALA 94 HB1 ALA 94 9.771 -8.689 2.529 752 HB2 ALA 94 HB2 ALA 94 8.934 -7.137 2.606 753 HB3 ALA 94 HB3 ALA 94 8.213 -8.561 3.358 754 H VAL 95 H VAL 95 11.722 -9.444 4.100 755 HA VAL 95 HA VAL 95 10.669 -11.494 5.858 756 HB VAL 95 HB VAL 95 11.735 -12.072 3.661 757 HG11 VAL 95 HG11 VAL 95 14.179 -12.133 3.439 758 HG12 VAL 95 HG12 VAL 95 14.352 -11.323 4.997 759 HG13 VAL 95 HG13 VAL 95 13.595 -10.480 3.644 760 HG21 VAL 95 HG21 VAL 95 11.483 -13.784 5.403 761 HG22 VAL 95 HG22 VAL 95 13.056 -13.355 6.078 762 HG23 VAL 95 HG23 VAL 95 12.951 -14.062 4.463 763 H PHE 96 H PHE 96 13.081 -8.984 6.014 764 HA PHE 96 HA PHE 96 14.645 -10.067 8.166 765 HB2 PHE 96 HB2 PHE 96 15.377 -8.360 6.335 766 HB3 PHE 96 HB3 PHE 96 14.545 -7.139 7.284 767 HD1 PHE 96 HD2 PHE 96 17.362 -9.564 7.287 768 HD2 PHE 96 HD1 PHE 96 15.616 -6.193 9.263 769 HE1 PHE 96 HE2 PHE 96 19.405 -9.290 8.628 770 HE2 PHE 96 HE1 PHE 96 17.667 -5.924 10.594 771 HZ PHE 96 HZ PHE 96 19.559 -7.473 10.287 772 H PHE 97 H PHE 97 11.847 -8.067 7.781 773 HA PHE 97 HA PHE 97 10.064 -7.690 9.044 774 HB2 PHE 97 HB2 PHE 97 10.386 -9.831 10.209 775 HB3 PHE 97 HB3 PHE 97 11.534 -9.096 11.323 776 HD1 PHE 97 HD1 PHE 97 7.954 -9.056 10.254 777 HD2 PHE 97 HD2 PHE 97 10.754 -7.984 13.320 778 HE1 PHE 97 HE1 PHE 97 6.100 -8.444 11.747 779 HE2 PHE 97 HE2 PHE 97 8.890 -7.378 14.802 780 HZ PHE 97 HZ PHE 97 6.564 -7.601 14.016 781 H GLN 98 H GLN 98 13.049 -7.000 10.812 782 HA GLN 98 HA GLN 98 12.954 -4.273 10.961 783 HB2 GLN 98 HB2 GLN 98 10.799 -4.751 12.376 784 HB3 GLN 98 HB3 GLN 98 11.863 -5.382 13.619 785 HG2 GLN 98 HG2 GLN 98 11.958 -2.527 12.566 786 HG3 GLN 98 HG3 GLN 98 11.046 -3.024 13.980 787 HE21 GLN 98 HE21 GLN 98 12.215 -3.751 15.834 788 HE22 GLN 98 HE22 GLN 98 13.833 -3.226 16.123 789 H1 GLY 1 H1 GLY 1 -13.893 -1.351 18.330 790 H2 GLY 1 H2 GLY 1 -14.156 -1.790 16.722 791 H3 GLY 1 H3 GLY 1 -13.198 -2.767 17.718 792 HA2 GLY 1 HA3 GLY 1 -16.105 -2.283 18.011 793 HA3 GLY 1 HA2 GLY 1 -15.355 -3.758 17.409 794 H SER 2 H SER 2 -16.775 -4.574 19.244 795 HA SER 2 HA SER 2 -15.727 -4.159 21.960 796 HB2 SER 2 HB2 SER 2 -18.203 -3.991 21.435 797 HB3 SER 2 HB3 SER 2 -18.200 -5.708 21.047 798 HG SER 2 HG SER 2 -17.318 -5.929 23.300 799 H MET 3 H MET 3 -14.173 -5.653 19.993 800 HA MET 3 HA MET 3 -14.193 -8.423 21.048 801 HB2 MET 3 HB2 MET 3 -13.003 -7.392 18.423 802 HB3 MET 3 HB3 MET 3 -13.022 -9.066 18.961 803 HG2 MET 3 HG2 MET 3 -15.485 -9.077 18.813 804 HG3 MET 3 HG3 MET 3 -15.450 -7.405 18.252 805 HE1 MET 3 HE1 MET 3 -13.720 -7.777 14.723 806 HE2 MET 3 HE2 MET 3 -12.899 -7.404 16.238 807 HE3 MET 3 HE3 MET 3 -14.455 -6.655 15.869 808 H GLN 4 H GLN 4 -12.464 -9.010 22.270 809 HA GLN 4 HA GLN 4 -10.325 -7.210 22.858 810 HB2 GLN 4 HB2 GLN 4 -9.419 -9.076 24.250 811 HB3 GLN 4 HB3 GLN 4 -11.108 -8.725 24.589 812 HG2 GLN 4 HG2 GLN 4 -11.801 -10.692 23.279 813 HG3 GLN 4 HG3 GLN 4 -10.116 -11.041 22.896 814 HE21 GLN 4 HE21 GLN 4 -12.566 -11.106 25.372 815 HE22 GLN 4 HE22 GLN 4 -11.699 -12.095 26.494 816 H ASN 5 H ASN 5 -8.381 -7.015 21.880 817 HA ASN 5 HA ASN 5 -7.791 -8.711 19.560 818 HB2 ASN 5 HB2 ASN 5 -6.206 -6.929 18.901 819 HB3 ASN 5 HB3 ASN 5 -7.828 -6.307 19.149 820 HD21 ASN 5 HD21 ASN 5 -5.156 -4.995 19.216 821 HD22 ASN 5 HD22 ASN 5 -5.097 -4.165 20.727 822 H THR 6 H THR 6 -6.063 -9.995 19.404 823 HA THR 6 HA THR 6 -4.271 -10.374 21.743 824 HB THR 6 HB THR 6 -4.156 -12.765 21.004 825 HG1 THR 6 HG1 THR 6 -6.374 -12.458 19.312 826 HG21 THR 6 HG21 THR 6 -7.013 -11.817 21.463 827 HG22 THR 6 HG22 THR 6 -5.829 -12.179 22.724 828 HG23 THR 6 HG23 THR 6 -6.427 -13.469 21.678 829 H THR 7 H THR 7 -2.446 -12.132 20.448 830 HA THR 7 HA THR 7 -0.783 -10.593 18.797 831 HB THR 7 HB THR 7 0.180 -12.914 18.108 832 HG1 THR 7 HG1 THR 7 -1.378 -13.940 20.225 833 HG21 THR 7 HG21 THR 7 1.160 -11.608 19.973 834 HG22 THR 7 HG22 THR 7 1.176 -13.339 20.316 835 HG23 THR 7 HG23 THR 7 -0.029 -12.303 21.082 836 H HIS 8 H HIS 8 -3.673 -12.362 18.026 837 HA HIS 8 HA HIS 8 -3.333 -12.122 15.112 838 HB2 HIS 8 HB2 HIS 8 -5.719 -13.204 16.677 839 HB3 HIS 8 HB3 HIS 8 -5.406 -13.399 14.954 840 HD1 HIS 8 HD1 HIS 8 -2.979 -14.754 14.517 841 HD2 HIS 8 HD2 HIS 8 -4.979 -15.374 18.105 842 HE1 HIS 8 HE1 HIS 8 -2.098 -16.916 15.427 843 HE2 HIS 8 HE2 HIS 8 -3.259 -17.228 17.622 844 H ASP 9 H ASP 9 -3.464 -9.744 16.814 845 HA ASP 9 HA ASP 9 -5.814 -8.291 16.780 846 HB2 ASP 9 HB2 ASP 9 -3.862 -7.373 17.870 847 HB3 ASP 9 HB3 ASP 9 -2.913 -7.442 16.401 848 H ASN 10 H ASN 10 -3.255 -8.179 14.305 849 HA ASN 10 HA ASN 10 -4.953 -6.817 12.428 850 HB2 ASN 10 HB2 ASN 10 -2.962 -6.816 10.945 851 HB3 ASN 10 HB3 ASN 10 -2.584 -6.208 12.551 852 HD21 ASN 10 HD21 ASN 10 -2.160 -8.895 10.341 853 HD22 ASN 10 HD22 ASN 10 -0.865 -9.644 11.192 854 H VAL 11 H VAL 11 -6.215 -7.768 11.004 855 HA VAL 11 HA VAL 11 -6.048 -10.555 10.268 856 HB VAL 11 HB VAL 11 -8.104 -10.116 8.924 857 HG11 VAL 11 HG11 VAL 11 -8.261 -9.077 11.777 858 HG12 VAL 11 HG12 VAL 11 -8.292 -10.772 11.287 859 HG13 VAL 11 HG13 VAL 11 -9.614 -9.700 10.825 860 HG21 VAL 11 HG21 VAL 11 -7.921 -7.254 9.976 861 HG22 VAL 11 HG22 VAL 11 -9.255 -7.931 9.034 862 HG23 VAL 11 HG23 VAL 11 -7.662 -7.741 8.301 863 H ILE 12 H ILE 12 -5.764 -11.258 8.173 864 HA ILE 12 HA ILE 12 -4.003 -9.705 6.457 865 HB ILE 12 HB ILE 12 -4.737 -12.633 6.025 866 HG12 ILE 12 HG12 ILE 12 -4.091 -12.499 8.411 867 HG13 ILE 12 HG13 ILE 12 -2.893 -13.382 7.481 868 HG21 ILE 12 HG21 ILE 12 -3.420 -11.540 4.266 869 HG22 ILE 12 HG22 ILE 12 -2.483 -12.803 5.064 870 HG23 ILE 12 HG23 ILE 12 -2.174 -11.105 5.443 871 HD11 ILE 12 HD11 ILE 12 -1.860 -11.971 9.138 872 HD12 ILE 12 HD12 ILE 12 -2.644 -10.543 8.464 873 HD13 ILE 12 HD13 ILE 12 -1.430 -11.416 7.521 874 H LEU 13 H LEU 13 -5.541 -8.333 5.449 875 HA LEU 13 HA LEU 13 -7.842 -9.499 4.055 876 HB2 LEU 13 HB2 LEU 13 -6.953 -6.601 4.377 877 HB3 LEU 13 HB3 LEU 13 -8.405 -7.105 3.520 878 HG LEU 13 HG LEU 13 -7.856 -7.429 6.497 879 HD11 LEU 13 HD11 LEU 13 -8.483 -5.174 5.916 880 HD12 LEU 13 HD12 LEU 13 -9.796 -5.953 6.791 881 HD13 LEU 13 HD13 LEU 13 -9.902 -5.743 5.037 882 HD21 LEU 13 HD21 LEU 13 -9.053 -9.387 5.716 883 HD22 LEU 13 HD22 LEU 13 -10.254 -8.373 4.912 884 HD23 LEU 13 HD23 LEU 13 -10.117 -8.362 6.672 885 H GLU 14 H GLU 14 -7.162 -10.571 2.269 886 HA GLU 14 HA GLU 14 -5.228 -9.387 0.423 887 HB2 GLU 14 HB2 GLU 14 -5.100 -11.821 0.913 888 HB3 GLU 14 HB3 GLU 14 -6.716 -12.047 0.252 889 HG2 GLU 14 HG2 GLU 14 -5.857 -11.192 -1.963 890 HG3 GLU 14 HG3 GLU 14 -4.239 -11.155 -1.268 891 H LEU 15 H LEU 15 -6.242 -7.670 -0.525 892 HA LEU 15 HA LEU 15 -8.727 -8.038 -2.026 893 HB2 LEU 15 HB2 LEU 15 -6.860 -5.673 -1.606 894 HB3 LEU 15 HB3 LEU 15 -8.121 -5.639 -2.825 895 HG LEU 15 HG LEU 15 -8.877 -4.473 -0.848 896 HD11 LEU 15 HD11 LEU 15 -10.994 -5.596 -0.444 897 HD12 LEU 15 HD12 LEU 15 -10.359 -7.086 -1.146 898 HD13 LEU 15 HD13 LEU 15 -10.552 -5.644 -2.148 899 HD21 LEU 15 HD21 LEU 15 -8.472 -7.024 0.742 900 HD22 LEU 15 HD22 LEU 15 -9.209 -5.532 1.337 901 HD23 LEU 15 HD23 LEU 15 -7.510 -5.552 0.875 902 H THR 16 H THR 16 -8.489 -9.227 -3.807 903 HA THR 16 HA THR 16 -6.134 -9.148 -5.516 904 HB THR 16 HB THR 16 -8.811 -10.563 -5.922 905 HG1 THR 16 HG1 THR 16 -7.406 -11.246 -4.085 906 HG21 THR 16 HG21 THR 16 -7.643 -11.912 -7.624 907 HG22 THR 16 HG22 THR 16 -6.167 -10.979 -7.377 908 HG23 THR 16 HG23 THR 16 -7.594 -10.197 -8.066 909 H VAL 17 H VAL 17 -5.986 -7.214 -6.514 910 HA VAL 17 HA VAL 17 -8.338 -6.182 -7.992 911 HB VAL 17 HB VAL 17 -7.730 -3.975 -7.618 912 HG11 VAL 17 HG11 VAL 17 -6.982 -5.342 -5.012 913 HG12 VAL 17 HG12 VAL 17 -8.614 -4.930 -5.557 914 HG13 VAL 17 HG13 VAL 17 -7.462 -3.645 -5.189 915 HG21 VAL 17 HG21 VAL 17 -5.393 -3.999 -8.249 916 HG22 VAL 17 HG22 VAL 17 -4.948 -4.825 -6.758 917 HG23 VAL 17 HG23 VAL 17 -5.550 -3.165 -6.701 918 H ARG 18 H ARG 18 -7.982 -5.466 -10.066 919 HA ARG 18 HA ARG 18 -5.323 -5.966 -11.284 920 HB2 ARG 18 HB2 ARG 18 -6.540 -5.835 -13.474 921 HB3 ARG 18 HB3 ARG 18 -7.026 -7.178 -12.451 922 HG2 ARG 18 HG2 ARG 18 -9.070 -5.959 -11.814 923 HG3 ARG 18 HG3 ARG 18 -8.584 -4.612 -12.852 924 HD2 ARG 18 HD2 ARG 18 -9.143 -7.456 -13.779 925 HD3 ARG 18 HD3 ARG 18 -10.225 -6.075 -13.974 926 HE ARG 18 HE ARG 18 -7.571 -6.345 -15.280 927 HH11 ARG 18 HH11 ARG 18 -10.868 -5.141 -15.356 928 HH12 ARG 18 HH12 ARG 18 -10.715 -4.468 -16.938 929 HH21 ARG 18 HH21 ARG 18 -7.378 -5.460 -17.346 930 HH22 ARG 18 HH22 ARG 18 -8.729 -4.647 -18.072 931 H ASN 19 H ASN 19 -4.450 -4.271 -12.692 932 HA ASN 19 HA ASN 19 -4.506 -1.823 -11.206 933 HB2 ASN 19 HB2 ASN 19 -2.830 -2.722 -13.571 934 HB3 ASN 19 HB3 ASN 19 -2.670 -1.122 -12.853 935 HD21 ASN 19 HD21 ASN 19 -0.565 -1.421 -12.122 936 HD22 ASN 19 HD22 ASN 19 -0.140 -2.521 -10.861 937 H HIS 20 H HIS 20 -6.678 -1.236 -11.656 938 HA HIS 20 HA HIS 20 -7.353 0.184 -14.088 939 HB2 HIS 20 HB2 HIS 20 -8.545 0.139 -11.274 940 HB3 HIS 20 HB3 HIS 20 -9.211 1.133 -12.549 941 HD1 HIS 20 HD1 HIS 20 -10.714 -0.016 -14.262 942 HD2 HIS 20 HD2 HIS 20 -8.928 -2.666 -11.624 943 HE1 HIS 20 HE1 HIS 20 -11.878 -2.210 -14.621 944 HE2 HIS 20 HE2 HIS 20 -10.927 -3.720 -12.854 945 HA PRO 21 HA PRO 21 -5.315 4.109 -13.077 946 HB2 PRO 21 HB2 PRO 21 -7.842 5.539 -13.867 947 HB3 PRO 21 HB3 PRO 21 -6.197 5.708 -14.518 948 HG2 PRO 21 HG2 PRO 21 -8.086 4.468 -15.935 949 HG3 PRO 21 HG3 PRO 21 -6.409 3.873 -15.936 950 HD2 PRO 21 HD2 PRO 21 -8.788 2.795 -14.422 951 HD3 PRO 21 HD3 PRO 21 -7.504 1.914 -15.287 952 H GLY 22 H GLY 22 -5.139 3.973 -10.855 953 HA2 GLY 22 HA2 GLY 22 -5.322 5.012 -8.787 954 HA3 GLY 22 HA3 GLY 22 -6.836 5.747 -9.285 955 H VAL 23 H VAL 23 -5.675 2.339 -8.849 956 HA VAL 23 HA VAL 23 -8.143 1.595 -7.469 957 HB VAL 23 HB VAL 23 -5.602 -0.099 -7.576 958 HG11 VAL 23 HG11 VAL 23 -8.531 -0.814 -7.196 959 HG12 VAL 23 HG12 VAL 23 -7.277 -0.843 -5.950 960 HG13 VAL 23 HG13 VAL 23 -7.207 -1.975 -7.299 961 HG21 VAL 23 HG21 VAL 23 -7.845 -0.072 -9.615 962 HG22 VAL 23 HG22 VAL 23 -6.527 -1.248 -9.542 963 HG23 VAL 23 HG23 VAL 23 -6.179 0.450 -9.882 964 H MET 24 H MET 24 -4.790 2.243 -6.695 965 HA MET 24 HA MET 24 -4.649 1.206 -4.107 966 HB2 MET 24 HB2 MET 24 -3.062 3.535 -5.265 967 HB3 MET 24 HB3 MET 24 -2.606 2.564 -3.867 968 HG2 MET 24 HG2 MET 24 -2.799 1.612 -6.736 969 HG3 MET 24 HG3 MET 24 -1.323 1.870 -5.805 970 HE1 MET 24 HE1 MET 24 -1.906 -0.854 -7.404 971 HE2 MET 24 HE2 MET 24 -1.434 -2.065 -6.212 972 HE3 MET 24 HE3 MET 24 -0.448 -0.619 -6.437 973 H THR 25 H THR 25 -5.837 4.308 -5.270 974 HA THR 25 HA THR 25 -6.124 5.617 -2.751 975 HB THR 25 HB THR 25 -7.745 7.108 -4.069 976 HG1 THR 25 HG1 THR 25 -8.043 6.682 -6.220 977 HG21 THR 25 HG21 THR 25 -5.346 7.677 -3.904 978 HG22 THR 25 HG22 THR 25 -5.986 8.105 -5.495 979 HG23 THR 25 HG23 THR 25 -4.997 6.655 -5.302 980 H HIS 26 H HIS 26 -8.247 3.537 -4.701 981 HA HIS 26 HA HIS 26 -10.666 3.897 -3.284 982 HB2 HIS 26 HB2 HIS 26 -9.701 1.566 -5.000 983 HB3 HIS 26 HB3 HIS 26 -11.324 1.646 -4.322 984 HD1 HIS 26 HD1 HIS 26 -12.015 1.532 -6.927 985 HD2 HIS 26 HD2 HIS 26 -10.186 5.047 -5.695 986 HE1 HIS 26 HE1 HIS 26 -12.537 3.219 -8.710 987 HE2 HIS 26 HE2 HIS 26 -11.240 5.265 -8.034 988 H VAL 27 H VAL 27 -8.208 1.279 -3.023 989 HA VAL 27 HA VAL 27 -9.488 -0.113 -0.943 990 HB VAL 27 HB VAL 27 -7.398 -1.336 -0.557 991 HG11 VAL 27 HG11 VAL 27 -7.035 -2.257 -2.823 992 HG12 VAL 27 HG12 VAL 27 -7.854 -0.861 -3.528 993 HG13 VAL 27 HG13 VAL 27 -8.750 -1.984 -2.503 994 HG21 VAL 27 HG21 VAL 27 -6.008 0.644 -2.403 995 HG22 VAL 27 HG22 VAL 27 -5.294 -0.837 -1.755 996 HG23 VAL 27 HG23 VAL 27 -5.740 0.477 -0.666 997 H CYS 28 H CYS 28 -6.872 2.305 -0.801 998 HA CYS 28 HA CYS 28 -6.521 2.415 1.970 999 HB2 CYS 28 HB2 CYS 28 -6.001 4.424 -0.246 1000 HB3 CYS 28 HB3 CYS 28 -5.459 4.676 1.412 1001 HG CYS 28 HG CYS 28 -3.919 3.135 -0.968 1002 H GLY 29 H GLY 29 -8.898 3.945 -0.092 1003 HA2 GLY 29 HA2 GLY 29 -9.898 5.953 1.607 1004 HA3 GLY 29 HA3 GLY 29 -10.769 5.166 0.302 1005 H LEU 30 H LEU 30 -10.863 2.534 1.178 1006 HA LEU 30 HA LEU 30 -13.103 2.586 2.903 1007 HB2 LEU 30 HB2 LEU 30 -11.465 0.365 1.690 1008 HB3 LEU 30 HB3 LEU 30 -12.589 -0.040 2.973 1009 HG LEU 30 HG LEU 30 -13.658 -0.465 0.857 1010 HD11 LEU 30 HD11 LEU 30 -14.863 2.037 2.069 1011 HD12 LEU 30 HD12 LEU 30 -15.093 0.383 2.639 1012 HD13 LEU 30 HD13 LEU 30 -15.693 0.853 1.054 1013 HD21 LEU 30 HD21 LEU 30 -13.132 2.420 0.086 1014 HD22 LEU 30 HD22 LEU 30 -14.078 1.253 -0.845 1015 HD23 LEU 30 HD23 LEU 30 -12.354 0.992 -0.600 1016 H PHE 31 H PHE 31 -9.696 1.975 3.553 1017 HA PHE 31 HA PHE 31 -10.101 1.017 6.258 1018 HB2 PHE 31 HB2 PHE 31 -7.596 1.789 4.704 1019 HB3 PHE 31 HB3 PHE 31 -7.557 1.162 6.354 1020 HD1 PHE 31 HD2 PHE 31 -8.310 -1.165 6.825 1021 HD2 PHE 31 HD1 PHE 31 -7.997 0.283 2.826 1022 HE1 PHE 31 HE2 PHE 31 -8.452 -3.446 5.970 1023 HE2 PHE 31 HE1 PHE 31 -8.153 -2.017 1.971 1024 HZ PHE 31 HZ PHE 31 -8.384 -3.893 3.551 1025 H ALA 32 H ALA 32 -9.180 4.083 4.749 1026 HA ALA 32 HA ALA 32 -8.446 5.452 7.136 1027 HB1 ALA 32 HB1 ALA 32 -8.513 7.485 5.759 1028 HB2 ALA 32 HB2 ALA 32 -9.350 6.604 4.475 1029 HB3 ALA 32 HB3 ALA 32 -7.693 6.175 4.908 1030 H ARG 33 H ARG 33 -11.511 5.158 5.351 1031 HA ARG 33 HA ARG 33 -12.878 7.241 6.764 1032 HB2 ARG 33 HB2 ARG 33 -14.875 6.537 5.540 1033 HB3 ARG 33 HB3 ARG 33 -13.484 6.608 4.459 1034 HG2 ARG 33 HG2 ARG 33 -13.247 4.119 4.690 1035 HG3 ARG 33 HG3 ARG 33 -14.738 4.105 5.636 1036 HD2 ARG 33 HD2 ARG 33 -14.516 5.122 2.785 1037 HD3 ARG 33 HD3 ARG 33 -15.061 3.504 3.242 1038 HE ARG 33 HE ARG 33 -16.636 5.334 4.639 1039 HH11 ARG 33 HH11 ARG 33 -16.095 4.400 1.274 1040 HH12 ARG 33 HH12 ARG 33 -17.701 4.827 0.778 1041 HH21 ARG 33 HH21 ARG 33 -18.729 5.913 3.957 1042 HH22 ARG 33 HH22 ARG 33 -19.195 5.686 2.297 1043 H ARG 34 H ARG 34 -12.197 4.004 7.693 1044 HA ARG 34 HA ARG 34 -14.359 3.613 9.510 1045 HB2 ARG 34 HB2 ARG 34 -12.979 1.716 8.852 1046 HB3 ARG 34 HB3 ARG 34 -11.507 2.537 9.367 1047 HG2 ARG 34 HG2 ARG 34 -12.390 2.420 11.750 1048 HG3 ARG 34 HG3 ARG 34 -13.689 1.389 11.139 1049 HD2 ARG 34 HD2 ARG 34 -12.138 -0.307 10.466 1050 HD3 ARG 34 HD3 ARG 34 -10.753 0.761 10.726 1051 HE ARG 34 HE ARG 34 -12.298 0.287 13.109 1052 HH11 ARG 34 HH11 ARG 34 -9.688 -0.947 11.102 1053 HH12 ARG 34 HH12 ARG 34 -8.955 -1.847 12.389 1054 HH21 ARG 34 HH21 ARG 34 -11.334 -0.910 14.797 1055 HH22 ARG 34 HH22 ARG 34 -9.890 -1.826 14.490 1056 H ALA 35 H ALA 35 -10.953 4.277 10.345 1057 HA ALA 35 HA ALA 35 -11.129 6.560 11.873 1058 HB1 ALA 35 HB1 ALA 35 -11.245 5.723 14.213 1059 HB2 ALA 35 HB2 ALA 35 -11.571 4.091 13.617 1060 HB3 ALA 35 HB3 ALA 35 -12.739 5.381 13.339 1061 H PHE 36 H PHE 36 -9.956 3.232 12.159 1062 HA PHE 36 HA PHE 36 -7.204 4.114 12.728 1063 HB2 PHE 36 HB2 PHE 36 -8.178 2.368 14.206 1064 HB3 PHE 36 HB3 PHE 36 -8.478 1.334 12.816 1065 HD1 PHE 36 HD1 PHE 36 -5.541 3.214 14.282 1066 HD2 PHE 36 HD2 PHE 36 -6.962 -0.464 12.605 1067 HE1 PHE 36 HE1 PHE 36 -3.315 2.205 14.581 1068 HE2 PHE 36 HE2 PHE 36 -4.729 -1.457 12.904 1069 HZ PHE 36 HZ PHE 36 -2.904 -0.126 13.888 1070 H ASN 37 H ASN 37 -5.764 4.207 11.117 1071 HA ASN 37 HA ASN 37 -6.283 3.182 8.466 1072 HB2 ASN 37 HB2 ASN 37 -3.848 4.538 9.691 1073 HB3 ASN 37 HB3 ASN 37 -3.874 3.961 8.033 1074 HD21 ASN 37 HD21 ASN 37 -6.589 5.555 9.717 1075 HD22 ASN 37 HD22 ASN 37 -6.598 6.949 8.705 1076 H VAL 38 H VAL 38 -4.229 2.043 7.454 1077 HA VAL 38 HA VAL 38 -4.157 -0.579 8.602 1078 HB VAL 38 HB VAL 38 -2.563 0.516 6.242 1079 HG11 VAL 38 HG11 VAL 38 -3.415 -2.309 6.945 1080 HG12 VAL 38 HG12 VAL 38 -1.777 -1.654 7.059 1081 HG13 VAL 38 HG13 VAL 38 -2.551 -1.825 5.482 1082 HG21 VAL 38 HG21 VAL 38 -4.389 -0.264 4.791 1083 HG22 VAL 38 HG22 VAL 38 -4.975 0.962 5.916 1084 HG23 VAL 38 HG23 VAL 38 -5.334 -0.742 6.205 1085 H GLU 39 H GLU 39 -2.467 -1.580 9.679 1086 HA GLU 39 HA GLU 39 -0.421 0.005 10.930 1087 HB2 GLU 39 HB2 GLU 39 -1.555 -1.926 12.038 1088 HB3 GLU 39 HB3 GLU 39 -0.829 -3.023 10.873 1089 HG2 GLU 39 HG2 GLU 39 0.405 -3.187 12.927 1090 HG3 GLU 39 HG3 GLU 39 1.430 -2.374 11.745 1091 H GLY 40 H GLY 40 -0.469 -2.567 8.483 1092 HA2 GLY 40 HA2 GLY 40 1.972 -1.559 7.213 1093 HA3 GLY 40 HA3 GLY 40 2.020 -3.207 7.836 1094 H ILE 41 H ILE 41 2.203 -2.345 5.034 1095 HA ILE 41 HA ILE 41 -0.207 -3.646 3.878 1096 HB ILE 41 HB ILE 41 1.286 -1.273 2.622 1097 HG12 ILE 41 HG12 ILE 41 -1.510 -1.325 3.853 1098 HG13 ILE 41 HG13 ILE 41 -0.098 -0.534 4.543 1099 HG21 ILE 41 HG21 ILE 41 0.402 -2.811 0.915 1100 HG22 ILE 41 HG22 ILE 41 -0.467 -1.278 0.885 1101 HG23 ILE 41 HG23 ILE 41 -1.210 -2.697 1.627 1102 HD11 ILE 41 HD11 ILE 41 -1.565 1.082 3.518 1103 HD12 ILE 41 HD12 ILE 41 -1.488 0.240 1.970 1104 HD13 ILE 41 HD13 ILE 41 -0.043 1.012 2.632 1105 H LEU 42 H LEU 42 0.182 -5.018 2.192 1106 HA LEU 42 HA LEU 42 2.813 -5.109 0.887 1107 HB2 LEU 42 HB2 LEU 42 2.803 -6.961 2.540 1108 HB3 LEU 42 HB3 LEU 42 1.279 -7.553 1.892 1109 HG LEU 42 HG LEU 42 2.403 -8.076 -0.274 1110 HD11 LEU 42 HD11 LEU 42 4.950 -7.183 1.088 1111 HD12 LEU 42 HD12 LEU 42 4.149 -6.409 -0.283 1112 HD13 LEU 42 HD13 LEU 42 4.844 -8.017 -0.467 1113 HD21 LEU 42 HD21 LEU 42 3.701 -9.995 0.484 1114 HD22 LEU 42 HD22 LEU 42 2.218 -9.810 1.415 1115 HD23 LEU 42 HD23 LEU 42 3.763 -9.323 2.118 1116 H CYS 43 H CYS 43 2.663 -5.648 -1.285 1117 HA CYS 43 HA CYS 43 0.132 -6.385 -2.522 1118 HB2 CYS 43 HB2 CYS 43 -0.113 -3.975 -2.552 1119 HB3 CYS 43 HB3 CYS 43 1.542 -3.751 -3.097 1120 HG CYS 43 HG CYS 43 -0.870 -5.239 -5.007 1121 H LEU 44 H LEU 44 0.869 -8.170 -3.469 1122 HA LEU 44 HA LEU 44 3.512 -8.300 -4.743 1123 HB2 LEU 44 HB2 LEU 44 2.662 -10.051 -3.092 1124 HB3 LEU 44 HB3 LEU 44 1.485 -10.516 -4.302 1125 HG LEU 44 HG LEU 44 3.516 -11.022 -5.842 1126 HD11 LEU 44 HD11 LEU 44 5.634 -11.507 -4.706 1127 HD12 LEU 44 HD12 LEU 44 4.978 -10.876 -3.192 1128 HD13 LEU 44 HD13 LEU 44 5.207 -9.801 -4.574 1129 HD21 LEU 44 HD21 LEU 44 2.124 -12.768 -4.836 1130 HD22 LEU 44 HD22 LEU 44 3.087 -12.714 -3.358 1131 HD23 LEU 44 HD23 LEU 44 3.818 -13.251 -4.872 1132 HA PRO 45 HA PRO 45 1.111 -7.684 -8.636 1133 HB2 PRO 45 HB2 PRO 45 3.326 -7.542 -10.300 1134 HB3 PRO 45 HB3 PRO 45 2.719 -6.168 -9.354 1135 HG2 PRO 45 HG2 PRO 45 4.998 -8.018 -8.727 1136 HG3 PRO 45 HG3 PRO 45 4.906 -6.248 -8.557 1137 HD2 PRO 45 HD2 PRO 45 4.597 -7.908 -6.436 1138 HD3 PRO 45 HD3 PRO 45 3.715 -6.367 -6.554 1139 H ILE 46 H ILE 46 0.126 -9.539 -9.191 1140 HA ILE 46 HA ILE 46 1.435 -12.079 -9.406 1141 HB ILE 46 HB ILE 46 -1.377 -11.289 -10.292 1142 HG12 ILE 46 HG12 ILE 46 -1.115 -10.865 -7.885 1143 HG13 ILE 46 HG13 ILE 46 -2.135 -12.276 -8.118 1144 HG21 ILE 46 HG21 ILE 46 -0.178 -14.042 -9.812 1145 HG22 ILE 46 HG22 ILE 46 -0.658 -13.354 -11.369 1146 HG23 ILE 46 HG23 ILE 46 -1.880 -13.710 -10.149 1147 HD11 ILE 46 HD11 ILE 46 -0.207 -13.723 -7.557 1148 HD12 ILE 46 HD12 ILE 46 -0.648 -12.606 -6.267 1149 HD13 ILE 46 HD13 ILE 46 0.763 -12.272 -7.268 1150 H GLN 47 H GLN 47 2.843 -12.330 -10.986 1151 HA GLN 47 HA GLN 47 3.148 -10.522 -13.119 1152 HB2 GLN 47 HB2 GLN 47 5.132 -11.910 -13.709 1153 HB3 GLN 47 HB3 GLN 47 5.051 -11.500 -12.005 1154 HG2 GLN 47 HG2 GLN 47 4.094 -13.775 -11.550 1155 HG3 GLN 47 HG3 GLN 47 4.363 -14.176 -13.245 1156 HE21 GLN 47 HE21 GLN 47 6.594 -12.257 -11.262 1157 HE22 GLN 47 HE22 GLN 47 7.850 -13.437 -11.234 1158 H ASP 48 H ASP 48 1.365 -13.509 -13.098 1159 HA ASP 48 HA ASP 48 1.933 -14.240 -15.833 1160 HB2 ASP 48 HB2 ASP 48 0.650 -16.167 -15.474 1161 HB3 ASP 48 HB3 ASP 48 1.195 -15.804 -13.843 1162 H SER 49 H SER 49 -0.282 -12.126 -14.283 1163 HA SER 49 HA SER 49 -1.748 -11.545 -16.776 1164 HB2 SER 49 HB2 SER 49 -3.094 -12.064 -14.076 1165 HB3 SER 49 HB3 SER 49 -3.903 -11.555 -15.549 1166 HG SER 49 HG SER 49 -2.561 -13.743 -16.148 1167 H ASP 50 H ASP 50 -3.222 -9.500 -16.311 1168 HA ASP 50 HA ASP 50 -1.693 -7.466 -14.866 1169 HB2 ASP 50 HB2 ASP 50 -3.363 -5.859 -15.782 1170 HB3 ASP 50 HB3 ASP 50 -2.582 -6.808 -17.035 1171 H LYS 51 H LYS 51 -1.946 -8.515 -12.811 1172 HA LYS 51 HA LYS 51 -4.066 -7.349 -11.279 1173 HB2 LYS 51 HB2 LYS 51 -5.021 -9.391 -10.291 1174 HB3 LYS 51 HB3 LYS 51 -5.306 -9.343 -12.024 1175 HG2 LYS 51 HG2 LYS 51 -3.500 -11.004 -12.377 1176 HG3 LYS 51 HG3 LYS 51 -3.195 -11.035 -10.635 1177 HD2 LYS 51 HD2 LYS 51 -5.546 -11.835 -10.274 1178 HD3 LYS 51 HD3 LYS 51 -5.773 -11.878 -12.023 1179 HE2 LYS 51 HE2 LYS 51 -3.759 -13.541 -10.469 1180 HE3 LYS 51 HE3 LYS 51 -5.306 -14.118 -11.083 1181 HZ1 LYS 51 HZ1 LYS 51 -3.477 -14.752 -12.532 1182 HZ2 LYS 51 HZ2 LYS 51 -3.047 -13.139 -12.754 1183 HZ3 LYS 51 HZ3 LYS 51 -4.528 -13.704 -13.340 1184 H SER 52 H SER 52 -3.862 -8.000 -8.937 1185 HA SER 52 HA SER 52 -1.264 -8.784 -7.969 1186 HB2 SER 52 HB2 SER 52 -0.895 -6.387 -8.625 1187 HB3 SER 52 HB3 SER 52 -2.240 -5.900 -7.592 1188 HG SER 52 HG SER 52 0.181 -5.982 -6.845 1189 H HIS 53 H HIS 53 -1.307 -9.124 -5.690 1190 HA HIS 53 HA HIS 53 -3.984 -9.002 -4.381 1191 HB2 HIS 53 HB2 HIS 53 -1.563 -10.752 -3.770 1192 HB3 HIS 53 HB3 HIS 53 -3.025 -10.712 -2.794 1193 HD1 HIS 53 HD1 HIS 53 -2.026 -13.332 -3.998 1194 HD2 HIS 53 HD2 HIS 53 -4.817 -10.868 -5.823 1195 HE1 HIS 53 HE1 HIS 53 -3.395 -14.839 -5.461 1196 HE2 HIS 53 HE2 HIS 53 -5.248 -13.359 -6.285 1197 H ILE 54 H ILE 54 -4.159 -7.520 -2.777 1198 HA ILE 54 HA ILE 54 -1.705 -6.339 -1.624 1199 HB ILE 54 HB ILE 54 -4.475 -5.027 -1.807 1200 HG12 ILE 54 HG12 ILE 54 -3.313 -3.347 -3.364 1201 HG13 ILE 54 HG13 ILE 54 -1.962 -4.464 -3.460 1202 HG21 ILE 54 HG21 ILE 54 -3.187 -4.322 0.173 1203 HG22 ILE 54 HG22 ILE 54 -3.343 -2.994 -0.974 1204 HG23 ILE 54 HG23 ILE 54 -1.819 -3.880 -0.853 1205 HD11 ILE 54 HD11 ILE 54 -4.773 -5.022 -4.374 1206 HD12 ILE 54 HD12 ILE 54 -3.389 -6.104 -4.540 1207 HD13 ILE 54 HD13 ILE 54 -3.417 -4.568 -5.404 1208 H TRP 55 H TRP 55 -1.377 -7.545 0.218 1209 HA TRP 55 HA TRP 55 -3.601 -8.235 2.013 1210 HB2 TRP 55 HB2 TRP 55 -0.606 -8.765 2.306 1211 HB3 TRP 55 HB3 TRP 55 -1.855 -9.368 3.390 1212 HD1 TRP 55 HD1 TRP 55 -3.263 -11.508 2.552 1213 HE1 TRP 55 HE1 TRP 55 -2.860 -13.203 0.661 1214 HE3 TRP 55 HE3 TRP 55 0.244 -8.934 -0.077 1215 HZ2 TRP 55 HZ2 TRP 55 -1.241 -13.423 -1.649 1216 HZ3 TRP 55 HZ3 TRP 55 1.165 -9.936 -2.098 1217 HH2 TRP 55 HH2 TRP 55 0.445 -12.142 -2.888 1218 H LEU 56 H LEU 56 -4.307 -6.459 3.110 1219 HA LEU 56 HA LEU 56 -2.362 -4.613 4.308 1220 HB2 LEU 56 HB2 LEU 56 -5.397 -4.397 4.331 1221 HB3 LEU 56 HB3 LEU 56 -4.244 -3.169 4.823 1222 HG LEU 56 HG LEU 56 -3.428 -3.573 2.210 1223 HD11 LEU 56 HD11 LEU 56 -5.202 -5.167 1.723 1224 HD12 LEU 56 HD12 LEU 56 -5.373 -3.712 0.745 1225 HD13 LEU 56 HD13 LEU 56 -6.427 -3.966 2.140 1226 HD21 LEU 56 HD21 LEU 56 -3.834 -1.381 3.204 1227 HD22 LEU 56 HD22 LEU 56 -5.576 -1.617 3.069 1228 HD23 LEU 56 HD23 LEU 56 -4.586 -1.493 1.611 1229 H LEU 57 H LEU 57 -1.706 -4.914 6.279 1230 HA LEU 57 HA LEU 57 -2.929 -6.763 8.155 1231 HB2 LEU 57 HB2 LEU 57 -0.400 -5.062 8.457 1232 HB3 LEU 57 HB3 LEU 57 -0.935 -6.300 9.574 1233 HG LEU 57 HG LEU 57 0.908 -7.203 8.352 1234 HD11 LEU 57 HD11 LEU 57 -0.004 -9.173 7.285 1235 HD12 LEU 57 HD12 LEU 57 -1.596 -8.415 7.189 1236 HD13 LEU 57 HD13 LEU 57 -0.880 -8.778 8.762 1237 HD21 LEU 57 HD21 LEU 57 -0.463 -6.484 5.746 1238 HD22 LEU 57 HD22 LEU 57 1.063 -7.359 5.914 1239 HD23 LEU 57 HD23 LEU 57 0.945 -5.682 6.442 1240 H VAL 58 H VAL 58 -4.744 -5.816 8.939 1241 HA VAL 58 HA VAL 58 -4.501 -3.385 10.589 1242 HB VAL 58 HB VAL 58 -5.419 -2.762 8.284 1243 HG11 VAL 58 HG11 VAL 58 -6.711 -4.745 7.773 1244 HG12 VAL 58 HG12 VAL 58 -7.735 -3.310 7.700 1245 HG13 VAL 58 HG13 VAL 58 -7.830 -4.390 9.092 1246 HG21 VAL 58 HG21 VAL 58 -7.236 -1.308 9.136 1247 HG22 VAL 58 HG22 VAL 58 -5.832 -1.305 10.205 1248 HG23 VAL 58 HG23 VAL 58 -7.266 -2.241 10.638 1249 H ASN 59 H ASN 59 -5.943 -3.483 12.424 1250 HA ASN 59 HA ASN 59 -7.002 -6.077 13.031 1251 HB2 ASN 59 HB2 ASN 59 -7.946 -4.992 15.109 1252 HB3 ASN 59 HB3 ASN 59 -6.207 -4.856 14.898 1253 HD21 ASN 59 HD21 ASN 59 -6.007 -3.126 16.242 1254 HD22 ASN 59 HD22 ASN 59 -6.596 -1.546 15.863 1255 H ASP 60 H ASP 60 -9.097 -6.814 13.072 1256 HA ASP 60 HA ASP 60 -10.888 -5.673 11.123 1257 HB2 ASP 60 HB2 ASP 60 -10.594 -8.122 11.347 1258 HB3 ASP 60 HB3 ASP 60 -11.262 -8.074 12.966 1259 H ASP 61 H ASP 61 -12.941 -4.870 11.448 1260 HA ASP 61 HA ASP 61 -13.906 -4.354 14.185 1261 HB2 ASP 61 HB2 ASP 61 -12.780 -2.300 13.054 1262 HB3 ASP 61 HB3 ASP 61 -14.107 -2.308 11.915 1263 H GLN 62 H GLN 62 -16.202 -4.345 14.281 1264 HA GLN 62 HA GLN 62 -17.454 -6.232 12.607 1265 HB2 GLN 62 HB2 GLN 62 -18.670 -4.274 14.602 1266 HB3 GLN 62 HB3 GLN 62 -19.546 -5.616 13.868 1267 HG2 GLN 62 HG2 GLN 62 -17.079 -5.912 15.622 1268 HG3 GLN 62 HG3 GLN 62 -18.740 -6.103 16.179 1269 HE21 GLN 62 HE21 GLN 62 -16.195 -7.510 14.228 1270 HE22 GLN 62 HE22 GLN 62 -16.902 -9.073 14.080 1271 H ARG 63 H ARG 63 -17.426 -2.692 12.537 1272 HA ARG 63 HA ARG 63 -19.394 -2.575 10.385 1273 HB2 ARG 63 HB2 ARG 63 -19.374 -0.236 10.530 1274 HB3 ARG 63 HB3 ARG 63 -19.244 -0.793 12.188 1275 HG2 ARG 63 HG2 ARG 63 -16.868 -0.210 12.232 1276 HG3 ARG 63 HG3 ARG 63 -16.927 0.270 10.532 1277 HD2 ARG 63 HD2 ARG 63 -18.579 2.025 11.083 1278 HD3 ARG 63 HD3 ARG 63 -18.539 1.541 12.779 1279 HE ARG 63 HE ARG 63 -15.942 2.177 12.192 1280 HH11 ARG 63 HH11 ARG 63 -19.022 3.896 11.967 1281 HH12 ARG 63 HH12 ARG 63 -18.307 5.452 12.230 1282 HH21 ARG 63 HH21 ARG 63 -15.045 4.231 12.606 1283 HH22 ARG 63 HH22 ARG 63 -16.055 5.637 12.593 1284 H LEU 64 H LEU 64 -15.919 -2.612 10.745 1285 HA LEU 64 HA LEU 64 -15.222 -1.769 8.128 1286 HB2 LEU 64 HB2 LEU 64 -13.550 -1.793 9.870 1287 HB3 LEU 64 HB3 LEU 64 -13.714 -3.519 10.102 1288 HG LEU 64 HG LEU 64 -12.853 -2.719 7.338 1289 HD11 LEU 64 HD11 LEU 64 -11.571 -1.054 8.594 1290 HD12 LEU 64 HD12 LEU 64 -10.515 -2.291 7.919 1291 HD13 LEU 64 HD13 LEU 64 -10.920 -2.319 9.639 1292 HD21 LEU 64 HD21 LEU 64 -11.770 -4.767 9.294 1293 HD22 LEU 64 HD22 LEU 64 -11.294 -4.594 7.601 1294 HD23 LEU 64 HD23 LEU 64 -12.941 -5.072 8.008 1295 H GLU 65 H GLU 65 -16.325 -4.866 9.399 1296 HA GLU 65 HA GLU 65 -15.837 -6.561 7.214 1297 HB2 GLU 65 HB2 GLU 65 -18.265 -6.563 9.060 1298 HB3 GLU 65 HB3 GLU 65 -17.722 -7.918 8.072 1299 HG2 GLU 65 HG2 GLU 65 -15.618 -8.003 9.429 1300 HG3 GLU 65 HG3 GLU 65 -16.255 -6.708 10.442 1301 H GLN 66 H GLN 66 -18.493 -4.289 7.818 1302 HA GLN 66 HA GLN 66 -20.042 -4.785 5.495 1303 HB2 GLN 66 HB2 GLN 66 -20.942 -3.563 7.445 1304 HB3 GLN 66 HB3 GLN 66 -19.777 -2.272 7.205 1305 HG2 GLN 66 HG2 GLN 66 -21.945 -1.534 6.427 1306 HG3 GLN 66 HG3 GLN 66 -20.877 -1.710 5.037 1307 HE21 GLN 66 HE21 GLN 66 -21.272 -3.401 3.556 1308 HE22 GLN 66 HE22 GLN 66 -22.785 -4.231 3.503 1309 H MET 67 H MET 67 -17.223 -2.751 6.124 1310 HA MET 67 HA MET 67 -17.306 -1.346 3.613 1311 HB2 MET 67 HB2 MET 67 -14.889 -1.574 5.449 1312 HB3 MET 67 HB3 MET 67 -15.235 -0.316 4.265 1313 HG2 MET 67 HG2 MET 67 -16.526 -0.760 6.959 1314 HG3 MET 67 HG3 MET 67 -15.680 0.668 6.371 1315 HE1 MET 67 HE1 MET 67 -16.761 2.431 4.669 1316 HE2 MET 67 HE2 MET 67 -18.366 2.253 3.961 1317 HE3 MET 67 HE3 MET 67 -17.064 1.171 3.471 1318 H ILE 68 H ILE 68 -15.780 -4.290 4.788 1319 HA ILE 68 HA ILE 68 -14.130 -4.938 2.573 1320 HB ILE 68 HB ILE 68 -15.580 -6.737 4.581 1321 HG12 ILE 68 HG12 ILE 68 -12.638 -5.917 4.465 1322 HG13 ILE 68 HG13 ILE 68 -13.835 -5.252 5.571 1323 HG21 ILE 68 HG21 ILE 68 -13.430 -7.589 2.614 1324 HG22 ILE 68 HG22 ILE 68 -15.129 -8.060 2.561 1325 HG23 ILE 68 HG23 ILE 68 -14.111 -8.596 3.896 1326 HD11 ILE 68 HD11 ILE 68 -12.449 -6.857 6.711 1327 HD12 ILE 68 HD12 ILE 68 -12.830 -8.105 5.529 1328 HD13 ILE 68 HD13 ILE 68 -14.092 -7.488 6.601 1329 H SER 69 H SER 69 -17.560 -5.496 3.276 1330 HA SER 69 HA SER 69 -18.203 -6.972 0.923 1331 HB2 SER 69 HB2 SER 69 -20.024 -5.321 2.726 1332 HB3 SER 69 HB3 SER 69 -20.536 -6.594 1.613 1333 HG SER 69 HG SER 69 -18.833 -7.824 3.033 1334 H GLN 70 H GLN 70 -18.027 -3.543 1.703 1335 HA GLN 70 HA GLN 70 -19.504 -2.554 -0.551 1336 HB2 GLN 70 HB2 GLN 70 -19.101 -1.397 1.732 1337 HB3 GLN 70 HB3 GLN 70 -17.496 -0.996 1.147 1338 HG2 GLN 70 HG2 GLN 70 -20.065 -0.119 -0.210 1339 HG3 GLN 70 HG3 GLN 70 -19.228 0.840 0.997 1340 HE21 GLN 70 HE21 GLN 70 -16.538 0.239 -0.060 1341 HE22 GLN 70 HE22 GLN 70 -16.403 1.132 -1.527 1342 H ILE 71 H ILE 71 -16.043 -2.916 0.245 1343 HA ILE 71 HA ILE 71 -15.038 -1.678 -2.111 1344 HB ILE 71 HB ILE 71 -13.729 -1.902 0.019 1345 HG12 ILE 71 HG12 ILE 71 -12.387 -2.938 -2.518 1346 HG13 ILE 71 HG13 ILE 71 -12.550 -1.257 -2.023 1347 HG21 ILE 71 HG21 ILE 71 -12.524 -3.958 0.555 1348 HG22 ILE 71 HG22 ILE 71 -13.302 -4.788 -0.795 1349 HG23 ILE 71 HG23 ILE 71 -14.267 -4.228 0.571 1350 HD11 ILE 71 HD11 ILE 71 -10.877 -3.371 -0.680 1351 HD12 ILE 71 HD12 ILE 71 -11.064 -1.707 -0.113 1352 HD13 ILE 71 HD13 ILE 71 -10.307 -2.030 -1.670 1353 H ASP 72 H ASP 72 -15.989 -4.936 -1.302 1354 HA ASP 72 HA ASP 72 -14.934 -6.367 -3.459 1355 HB2 ASP 72 HB2 ASP 72 -15.843 -7.519 -1.537 1356 HB3 ASP 72 HB3 ASP 72 -17.419 -6.764 -1.741 1357 H LYS 73 H LYS 73 -17.680 -4.199 -3.265 1358 HA LYS 73 HA LYS 73 -19.046 -5.002 -5.650 1359 HB2 LYS 73 HB2 LYS 73 -19.179 -2.386 -4.101 1360 HB3 LYS 73 HB3 LYS 73 -20.332 -2.898 -5.328 1361 HG2 LYS 73 HG2 LYS 73 -19.847 -4.407 -2.739 1362 HG3 LYS 73 HG3 LYS 73 -21.065 -3.153 -2.918 1363 HD2 LYS 73 HD2 LYS 73 -22.496 -4.820 -3.485 1364 HD3 LYS 73 HD3 LYS 73 -21.675 -4.865 -5.038 1365 HE2 LYS 73 HE2 LYS 73 -20.818 -6.560 -2.669 1366 HE3 LYS 73 HE3 LYS 73 -22.000 -7.094 -3.856 1367 HZ1 LYS 73 HZ1 LYS 73 -19.846 -7.953 -4.416 1368 HZ2 LYS 73 HZ2 LYS 73 -19.159 -6.416 -4.384 1369 HZ3 LYS 73 HZ3 LYS 73 -20.279 -6.811 -5.584 1370 H LEU 74 H LEU 74 -16.272 -2.999 -5.040 1371 HA LEU 74 HA LEU 74 -16.346 -1.333 -7.334 1372 HB2 LEU 74 HB2 LEU 74 -14.155 -2.146 -5.413 1373 HB3 LEU 74 HB3 LEU 74 -13.715 -1.314 -6.890 1374 HG LEU 74 HG LEU 74 -13.854 0.263 -5.023 1375 HD11 LEU 74 HD11 LEU 74 -14.376 1.088 -7.251 1376 HD12 LEU 74 HD12 LEU 74 -15.295 1.953 -6.023 1377 HD13 LEU 74 HD13 LEU 74 -16.089 0.722 -7.012 1378 HD21 LEU 74 HD21 LEU 74 -15.957 0.799 -3.874 1379 HD22 LEU 74 HD22 LEU 74 -15.507 -0.883 -3.617 1380 HD23 LEU 74 HD23 LEU 74 -16.787 -0.487 -4.761 1381 H GLU 75 H GLU 75 -15.532 -1.553 -9.345 1382 HA GLU 75 HA GLU 75 -15.293 -4.144 -10.537 1383 HB2 GLU 75 HB2 GLU 75 -14.786 -1.355 -11.648 1384 HB3 GLU 75 HB3 GLU 75 -14.857 -2.816 -12.634 1385 HG2 GLU 75 HG2 GLU 75 -17.197 -3.129 -12.171 1386 HG3 GLU 75 HG3 GLU 75 -17.177 -1.919 -10.889 1387 H ASP 76 H ASP 76 -13.072 -2.121 -8.987 1388 HA ASP 76 HA ASP 76 -10.620 -2.838 -10.222 1389 HB2 ASP 76 HB2 ASP 76 -11.057 -2.104 -7.290 1390 HB3 ASP 76 HB3 ASP 76 -9.580 -1.920 -8.228 1391 H VAL 77 H VAL 77 -12.403 -4.019 -7.434 1392 HA VAL 77 HA VAL 77 -10.472 -6.013 -6.685 1393 HB VAL 77 HB VAL 77 -13.251 -5.348 -5.598 1394 HG11 VAL 77 HG11 VAL 77 -12.656 -6.646 -3.592 1395 HG12 VAL 77 HG12 VAL 77 -11.133 -7.132 -4.343 1396 HG13 VAL 77 HG13 VAL 77 -12.665 -7.678 -5.026 1397 HG21 VAL 77 HG21 VAL 77 -10.497 -4.628 -4.525 1398 HG22 VAL 77 HG22 VAL 77 -12.043 -4.215 -3.779 1399 HG23 VAL 77 HG23 VAL 77 -11.603 -3.519 -5.340 1400 H VAL 78 H VAL 78 -10.316 -7.546 -8.191 1401 HA VAL 78 HA VAL 78 -12.358 -8.898 -9.602 1402 HB VAL 78 HB VAL 78 -9.610 -10.006 -8.839 1403 HG11 VAL 78 HG11 VAL 78 -11.404 -10.683 -11.200 1404 HG12 VAL 78 HG12 VAL 78 -11.098 -11.707 -9.794 1405 HG13 VAL 78 HG13 VAL 78 -9.787 -11.332 -10.911 1406 HG21 VAL 78 HG21 VAL 78 -10.291 -8.261 -11.236 1407 HG22 VAL 78 HG22 VAL 78 -8.738 -9.052 -10.941 1408 HG23 VAL 78 HG23 VAL 78 -9.307 -7.792 -9.844 1409 H LYS 79 H LYS 79 -10.562 -9.645 -6.644 1410 HA LYS 79 HA LYS 79 -12.761 -11.279 -5.596 1411 HB2 LYS 79 HB2 LYS 79 -9.832 -12.159 -5.580 1412 HB3 LYS 79 HB3 LYS 79 -11.120 -12.951 -4.680 1413 HG2 LYS 79 HG2 LYS 79 -12.169 -13.723 -6.707 1414 HG3 LYS 79 HG3 LYS 79 -11.078 -12.751 -7.703 1415 HD2 LYS 79 HD2 LYS 79 -9.159 -14.113 -6.991 1416 HD3 LYS 79 HD3 LYS 79 -10.189 -15.030 -5.888 1417 HE2 LYS 79 HE2 LYS 79 -10.514 -14.991 -8.910 1418 HE3 LYS 79 HE3 LYS 79 -9.681 -16.249 -7.997 1419 HZ1 LYS 79 HZ1 LYS 79 -11.795 -16.630 -6.776 1420 HZ2 LYS 79 HZ2 LYS 79 -11.887 -16.982 -8.424 1421 HZ3 LYS 79 HZ3 LYS 79 -12.565 -15.556 -7.832 1422 H VAL 80 H VAL 80 -12.998 -11.041 -3.389 1423 HA VAL 80 HA VAL 80 -10.942 -9.470 -1.904 1424 HB VAL 80 HB VAL 80 -13.231 -8.422 -1.979 1425 HG11 VAL 80 HG11 VAL 80 -15.108 -9.393 -0.697 1426 HG12 VAL 80 HG12 VAL 80 -14.152 -10.845 -0.391 1427 HG13 VAL 80 HG13 VAL 80 -14.629 -10.435 -2.040 1428 HG21 VAL 80 HG21 VAL 80 -12.363 -9.277 0.806 1429 HG22 VAL 80 HG22 VAL 80 -13.402 -7.899 0.429 1430 HG23 VAL 80 HG23 VAL 80 -11.724 -7.915 -0.113 1431 H GLN 81 H GLN 81 -10.299 -10.312 0.142 1432 HA GLN 81 HA GLN 81 -11.295 -12.916 1.030 1433 HB2 GLN 81 HB2 GLN 81 -9.496 -13.376 -0.678 1434 HB3 GLN 81 HB3 GLN 81 -8.356 -12.484 0.323 1435 HG2 GLN 81 HG2 GLN 81 -8.624 -14.144 2.128 1436 HG3 GLN 81 HG3 GLN 81 -9.802 -15.023 1.146 1437 HE21 GLN 81 HE21 GLN 81 -6.430 -14.221 1.544 1438 HE22 GLN 81 HE22 GLN 81 -5.804 -15.366 0.412 1439 H ARG 82 H ARG 82 -10.968 -13.257 3.214 1440 HA ARG 82 HA ARG 82 -9.386 -11.326 4.764 1441 HB2 ARG 82 HB2 ARG 82 -11.286 -10.995 6.364 1442 HB3 ARG 82 HB3 ARG 82 -11.569 -10.302 4.777 1443 HG2 ARG 82 HG2 ARG 82 -13.035 -12.243 4.223 1444 HG3 ARG 82 HG3 ARG 82 -12.789 -12.861 5.859 1445 HD2 ARG 82 HD2 ARG 82 -14.126 -10.243 5.084 1446 HD3 ARG 82 HD3 ARG 82 -14.905 -11.679 5.755 1447 HE ARG 82 HE ARG 82 -12.842 -10.278 7.321 1448 HH11 ARG 82 HH11 ARG 82 -16.238 -11.182 7.005 1449 HH12 ARG 82 HH12 ARG 82 -16.619 -10.713 8.633 1450 HH21 ARG 82 HH21 ARG 82 -13.373 -9.682 9.432 1451 HH22 ARG 82 HH22 ARG 82 -14.998 -9.867 9.997 1452 H ASN 83 H ASN 83 -8.054 -12.485 5.973 1453 HA ASN 83 HA ASN 83 -8.929 -15.029 7.243 1454 HB2 ASN 83 HB2 ASN 83 -6.123 -14.462 6.145 1455 HB3 ASN 83 HB3 ASN 83 -6.695 -15.976 6.834 1456 HD21 ASN 83 HD21 ASN 83 -8.165 -17.274 5.562 1457 HD22 ASN 83 HD22 ASN 83 -8.255 -17.075 3.848 1458 H GLN 84 H GLN 84 -8.817 -14.767 9.484 1459 HA GLN 84 HA GLN 84 -7.219 -12.567 10.579 1460 HB2 GLN 84 HB2 GLN 84 -9.515 -12.923 11.439 1461 HB3 GLN 84 HB3 GLN 84 -9.066 -14.525 12.017 1462 HG2 GLN 84 HG2 GLN 84 -7.457 -13.520 13.603 1463 HG3 GLN 84 HG3 GLN 84 -7.835 -11.915 12.984 1464 HE21 GLN 84 HE21 GLN 84 -9.798 -10.941 13.549 1465 HE22 GLN 84 HE22 GLN 84 -10.769 -11.523 14.854 1466 H SER 85 H SER 85 -5.127 -13.136 10.436 1467 HA SER 85 HA SER 85 -4.126 -15.480 11.917 1468 HB2 SER 85 HB2 SER 85 -4.438 -16.170 9.521 1469 HB3 SER 85 HB3 SER 85 -3.388 -14.849 9.012 1470 HG SER 85 HG SER 85 -2.320 -16.885 9.169 1471 H ASP 86 H ASP 86 -1.559 -15.340 11.760 1472 HA ASP 86 HA ASP 86 -0.819 -12.938 13.115 1473 HB2 ASP 86 HB2 ASP 86 0.889 -15.242 12.080 1474 HB3 ASP 86 HB3 ASP 86 1.467 -13.982 13.165 1475 HA PRO 87 HA PRO 87 0.636 -10.272 9.795 1476 HB2 PRO 87 HB2 PRO 87 2.942 -9.168 10.934 1477 HB3 PRO 87 HB3 PRO 87 1.285 -8.660 11.326 1478 HG2 PRO 87 HG2 PRO 87 3.046 -10.598 12.812 1479 HG3 PRO 87 HG3 PRO 87 2.053 -9.264 13.449 1480 HD2 PRO 87 HD2 PRO 87 1.155 -11.772 13.589 1481 HD3 PRO 87 HD3 PRO 87 0.034 -10.453 13.173 1482 H THR 88 H THR 88 2.687 -12.773 11.042 1483 HA THR 88 HA THR 88 4.926 -12.645 9.361 1484 HB THR 88 HB THR 88 5.203 -15.079 9.961 1485 HG1 THR 88 HG1 THR 88 3.617 -16.031 11.273 1486 HG21 THR 88 HG21 THR 88 5.404 -14.744 12.413 1487 HG22 THR 88 HG22 THR 88 4.431 -13.274 12.297 1488 HG23 THR 88 HG23 THR 88 6.023 -13.347 11.534 1489 H MET 89 H MET 89 1.672 -13.573 8.584 1490 HA MET 89 HA MET 89 2.108 -15.254 6.367 1491 HB2 MET 89 HB2 MET 89 -0.153 -13.267 6.831 1492 HB3 MET 89 HB3 MET 89 -0.157 -14.527 5.601 1493 HG2 MET 89 HG2 MET 89 -0.115 -14.971 8.596 1494 HG3 MET 89 HG3 MET 89 -1.508 -15.153 7.541 1495 HE1 MET 89 HE1 MET 89 1.786 -18.247 8.299 1496 HE2 MET 89 HE2 MET 89 1.227 -16.968 9.380 1497 HE3 MET 89 HE3 MET 89 2.260 -16.577 8.004 1498 H PHE 90 H PHE 90 2.057 -11.679 6.650 1499 HA PHE 90 HA PHE 90 2.188 -11.067 3.900 1500 HB2 PHE 90 HB2 PHE 90 2.230 -8.866 4.554 1501 HB3 PHE 90 HB3 PHE 90 1.979 -9.480 6.172 1502 HD1 PHE 90 HD1 PHE 90 4.449 -7.976 3.845 1503 HD2 PHE 90 HD2 PHE 90 3.809 -9.338 7.851 1504 HE1 PHE 90 HE1 PHE 90 6.530 -6.882 4.572 1505 HE2 PHE 90 HE2 PHE 90 5.889 -8.247 8.558 1506 HZ PHE 90 HZ PHE 90 7.255 -7.020 6.915 1507 H ASN 91 H ASN 91 4.688 -11.713 6.301 1508 HA ASN 91 HA ASN 91 6.994 -11.175 4.778 1509 HB2 ASN 91 HB2 ASN 91 6.956 -11.392 7.244 1510 HB3 ASN 91 HB3 ASN 91 6.534 -13.087 7.109 1511 HD21 ASN 91 HD21 ASN 91 8.856 -11.580 8.336 1512 HD22 ASN 91 HD22 ASN 91 10.251 -12.396 7.730 1513 H LYS 92 H LYS 92 4.981 -14.069 5.149 1514 HA LYS 92 HA LYS 92 6.635 -16.020 4.055 1515 HB2 LYS 92 HB2 LYS 92 4.564 -16.493 5.357 1516 HB3 LYS 92 HB3 LYS 92 3.577 -15.945 4.010 1517 HG2 LYS 92 HG2 LYS 92 5.515 -18.222 3.590 1518 HG3 LYS 92 HG3 LYS 92 4.003 -18.532 4.437 1519 HD2 LYS 92 HD2 LYS 92 2.706 -17.843 2.497 1520 HD3 LYS 92 HD3 LYS 92 4.158 -17.295 1.660 1521 HE2 LYS 92 HE2 LYS 92 3.384 -19.461 0.795 1522 HE3 LYS 92 HE3 LYS 92 4.979 -19.607 1.533 1523 HZ1 LYS 92 HZ1 LYS 92 2.405 -20.357 2.815 1524 HZ2 LYS 92 HZ2 LYS 92 3.932 -20.506 3.522 1525 HZ3 LYS 92 HZ3 LYS 92 3.533 -21.433 2.170 1526 H ILE 93 H ILE 93 3.957 -14.311 2.298 1527 HA ILE 93 HA ILE 93 4.793 -15.493 -0.203 1528 HB ILE 93 HB ILE 93 3.034 -14.257 -1.329 1529 HG12 ILE 93 HG12 ILE 93 3.314 -12.136 0.188 1530 HG13 ILE 93 HG13 ILE 93 1.739 -12.528 -0.457 1531 HG21 ILE 93 HG21 ILE 93 2.032 -15.443 1.284 1532 HG22 ILE 93 HG22 ILE 93 2.376 -16.322 -0.209 1533 HG23 ILE 93 HG23 ILE 93 1.053 -15.157 -0.160 1534 HD11 ILE 93 HD11 ILE 93 1.608 -11.750 1.807 1535 HD12 ILE 93 HD12 ILE 93 2.657 -13.058 2.350 1536 HD13 ILE 93 HD13 ILE 93 1.054 -13.418 1.696 1537 H ALA 94 H ALA 94 5.461 -12.480 1.436 1538 HA ALA 94 HA ALA 94 6.408 -10.908 -0.709 1539 HB1 ALA 94 HB1 ALA 94 7.298 -10.915 2.197 1540 HB2 ALA 94 HB2 ALA 94 5.970 -9.975 1.516 1541 HB3 ALA 94 HB3 ALA 94 7.630 -9.629 1.028 1542 H VAL 95 H VAL 95 8.070 -13.269 1.394 1543 HA VAL 95 HA VAL 95 10.607 -12.951 0.027 1544 HB VAL 95 HB VAL 95 10.500 -13.418 2.489 1545 HG11 VAL 95 HG11 VAL 95 10.114 -15.698 3.321 1546 HG12 VAL 95 HG12 VAL 95 9.657 -16.224 1.699 1547 HG13 VAL 95 HG13 VAL 95 8.667 -15.039 2.552 1548 HG21 VAL 95 HG21 VAL 95 12.580 -13.816 1.246 1549 HG22 VAL 95 HG22 VAL 95 12.070 -15.466 0.879 1550 HG23 VAL 95 HG23 VAL 95 12.401 -14.995 2.548 1551 H PHE 96 H PHE 96 7.841 -15.052 -0.158 1552 HA PHE 96 HA PHE 96 9.119 -17.214 -1.582 1553 HB2 PHE 96 HB2 PHE 96 7.006 -17.321 -0.074 1554 HB3 PHE 96 HB3 PHE 96 6.117 -16.664 -1.438 1555 HD1 PHE 96 HD2 PHE 96 8.024 -19.591 -0.194 1556 HD2 PHE 96 HD1 PHE 96 5.537 -18.094 -3.330 1557 HE1 PHE 96 HE2 PHE 96 7.722 -21.875 -1.062 1558 HE2 PHE 96 HE1 PHE 96 5.235 -20.369 -4.184 1559 HZ PHE 96 HZ PHE 96 6.331 -22.265 -3.061 1560 H PHE 97 H PHE 97 7.646 -14.192 -2.418 1561 HA PHE 97 HA PHE 97 7.185 -13.044 -4.288 1562 HB2 PHE 97 HB2 PHE 97 8.810 -15.203 -5.678 1563 HB3 PHE 97 HB3 PHE 97 8.105 -13.849 -6.548 1564 HD1 PHE 97 HD2 PHE 97 8.751 -11.442 -5.628 1565 HD2 PHE 97 HD1 PHE 97 11.035 -14.994 -4.896 1566 HE1 PHE 97 HE2 PHE 97 10.763 -10.076 -5.242 1567 HE2 PHE 97 HE1 PHE 97 13.036 -13.619 -4.516 1568 HZ PHE 97 HZ PHE 97 12.906 -11.160 -4.696 1569 H GLN 98 H GLN 98 5.574 -15.546 -3.367 1570 HA GLN 98 HA GLN 98 3.488 -15.241 -5.330 1571 HB2 GLN 98 HB2 GLN 98 4.903 -17.035 -6.361 1572 HB3 GLN 98 HB3 GLN 98 4.669 -18.026 -4.926 1573 HG2 GLN 98 HG2 GLN 98 3.195 -18.724 -6.777 1574 HG3 GLN 98 HG3 GLN 98 2.272 -18.188 -5.374 1575 HE21 GLN 98 HE21 GLN 98 1.088 -16.247 -5.505 1576 HE22 GLN 98 HE22 GLN 98 0.754 -15.472 -7.014 Start of MODEL 4 1 H1 GLY 1 H1 GLY 1 1.399 3.048 -22.172 2 H2 GLY 1 H2 GLY 1 1.521 4.717 -22.378 3 H3 GLY 1 H3 GLY 1 2.333 3.960 -21.103 4 HA2 GLY 1 HA3 GLY 1 2.895 3.633 -23.992 5 HA3 GLY 1 HA2 GLY 1 3.884 4.513 -22.838 6 H SER 2 H SER 2 3.717 1.701 -24.491 7 HA SER 2 HA SER 2 4.402 -0.270 -22.540 8 HB2 SER 2 HB2 SER 2 4.843 -0.350 -25.556 9 HB3 SER 2 HB3 SER 2 4.727 -1.731 -24.462 10 HG SER 2 HG SER 2 2.780 -0.669 -25.779 11 H MET 3 H MET 3 6.324 -0.309 -21.490 12 HA MET 3 HA MET 3 8.840 0.455 -22.888 13 HB2 MET 3 HB2 MET 3 8.165 0.937 -19.944 14 HB3 MET 3 HB3 MET 3 9.693 1.326 -20.725 15 HG2 MET 3 HG2 MET 3 8.432 2.901 -22.231 16 HG3 MET 3 HG3 MET 3 7.005 2.612 -21.239 17 HE1 MET 3 HE1 MET 3 8.413 2.411 -18.286 18 HE2 MET 3 HE2 MET 3 6.912 3.290 -18.591 19 HE3 MET 3 HE3 MET 3 8.250 4.086 -17.764 20 H GLN 4 H GLN 4 10.733 -0.373 -21.149 21 HA GLN 4 HA GLN 4 10.730 -3.229 -21.411 22 HB2 GLN 4 HB2 GLN 4 12.658 -1.401 -19.908 23 HB3 GLN 4 HB3 GLN 4 12.948 -3.099 -20.261 24 HG2 GLN 4 HG2 GLN 4 12.667 -0.897 -22.328 25 HG3 GLN 4 HG3 GLN 4 14.187 -1.603 -21.776 26 HE21 GLN 4 HE21 GLN 4 14.678 -3.759 -22.375 27 HE22 GLN 4 HE22 GLN 4 13.905 -4.524 -23.721 28 H ASN 5 H ASN 5 8.919 -3.937 -20.151 29 HA ASN 5 HA ASN 5 8.573 -3.303 -17.393 30 HB2 ASN 5 HB2 ASN 5 6.954 -5.288 -17.412 31 HB3 ASN 5 HB3 ASN 5 6.600 -3.988 -18.535 32 HD21 ASN 5 HD21 ASN 5 7.593 -7.323 -18.239 33 HD22 ASN 5 HD22 ASN 5 7.394 -7.729 -19.908 34 H THR 6 H THR 6 10.495 -3.602 -16.382 35 HA THR 6 HA THR 6 11.470 -6.342 -15.855 36 HB THR 6 HB THR 6 13.292 -4.013 -16.686 37 HG1 THR 6 HG1 THR 6 12.234 -6.197 -18.176 38 HG21 THR 6 HG21 THR 6 15.042 -5.749 -16.878 39 HG22 THR 6 HG22 THR 6 13.907 -6.964 -16.288 40 HG23 THR 6 HG23 THR 6 14.422 -5.650 -15.228 41 H THR 7 H THR 7 12.753 -6.468 -13.886 42 HA THR 7 HA THR 7 11.914 -4.714 -11.761 43 HB THR 7 HB THR 7 12.041 -7.084 -11.300 44 HG1 THR 7 HG1 THR 7 14.145 -5.751 -9.906 45 HG21 THR 7 HG21 THR 7 14.144 -8.383 -11.295 46 HG22 THR 7 HG22 THR 7 15.008 -6.988 -11.941 47 HG23 THR 7 HG23 THR 7 13.764 -7.776 -12.910 48 H HIS 8 H HIS 8 12.883 -2.887 -12.943 49 HA HIS 8 HA HIS 8 15.177 -1.744 -11.849 50 HB2 HIS 8 HB2 HIS 8 15.712 -3.365 -14.289 51 HB3 HIS 8 HB3 HIS 8 16.231 -1.697 -14.483 52 HD1 HIS 8 HD1 HIS 8 18.261 -4.036 -14.394 53 HD2 HIS 8 HD2 HIS 8 17.218 -1.701 -11.123 54 HE1 HIS 8 HE1 HIS 8 20.187 -4.221 -12.789 55 HE2 HIS 8 HE2 HIS 8 19.582 -2.695 -10.885 56 H ASP 9 H ASP 9 12.955 -1.971 -14.560 57 HA ASP 9 HA ASP 9 12.770 0.722 -15.345 58 HB2 ASP 9 HB2 ASP 9 11.722 -0.987 -16.685 59 HB3 ASP 9 HB3 ASP 9 10.768 -1.574 -15.335 60 H ASN 10 H ASN 10 10.984 -1.129 -12.869 61 HA ASN 10 HA ASN 10 9.662 1.190 -11.791 62 HB2 ASN 10 HB2 ASN 10 8.875 -0.326 -9.999 63 HB3 ASN 10 HB3 ASN 10 8.606 -1.036 -11.585 64 HD21 ASN 10 HD21 ASN 10 10.434 -1.282 -8.602 65 HD22 ASN 10 HD22 ASN 10 11.072 -2.860 -8.894 66 H VAL 11 H VAL 11 10.272 2.379 -10.065 67 HA VAL 11 HA VAL 11 12.969 2.054 -8.953 68 HB VAL 11 HB VAL 11 12.957 4.431 -8.402 69 HG11 VAL 11 HG11 VAL 11 12.095 4.018 -11.290 70 HG12 VAL 11 HG12 VAL 11 13.730 3.848 -10.652 71 HG13 VAL 11 HG13 VAL 11 12.955 5.430 -10.666 72 HG21 VAL 11 HG21 VAL 11 10.158 4.635 -9.609 73 HG22 VAL 11 HG22 VAL 11 11.119 5.968 -8.962 74 HG23 VAL 11 HG23 VAL 11 10.531 4.703 -7.889 75 H ILE 12 H ILE 12 13.213 2.492 -6.674 76 HA ILE 12 HA ILE 12 10.896 1.357 -5.195 77 HB ILE 12 HB ILE 12 13.847 1.227 -4.393 78 HG12 ILE 12 HG12 ILE 12 13.577 0.182 -6.641 79 HG13 ILE 12 HG13 ILE 12 14.047 -0.977 -5.412 80 HG21 ILE 12 HG21 ILE 12 11.492 -0.516 -3.613 81 HG22 ILE 12 HG22 ILE 12 12.269 0.704 -2.602 82 HG23 ILE 12 HG23 ILE 12 13.162 -0.738 -3.087 83 HD11 ILE 12 HD11 ILE 12 11.292 -0.631 -6.589 84 HD12 ILE 12 HD12 ILE 12 11.728 -1.790 -5.330 85 HD13 ILE 12 HD13 ILE 12 12.440 -1.923 -6.937 86 H LEU 13 H LEU 13 9.945 3.404 -4.723 87 HA LEU 13 HA LEU 13 11.576 5.490 -3.427 88 HB2 LEU 13 HB2 LEU 13 8.655 5.508 -4.320 89 HB3 LEU 13 HB3 LEU 13 9.516 6.889 -3.654 90 HG LEU 13 HG LEU 13 10.198 5.510 -6.276 91 HD11 LEU 13 HD11 LEU 13 8.080 6.715 -6.446 92 HD12 LEU 13 HD12 LEU 13 9.336 7.526 -7.375 93 HD13 LEU 13 HD13 LEU 13 8.835 8.181 -5.813 94 HD21 LEU 13 HD21 LEU 13 12.195 6.459 -5.237 95 HD22 LEU 13 HD22 LEU 13 11.385 8.013 -5.031 96 HD23 LEU 13 HD23 LEU 13 11.735 7.406 -6.651 97 H GLU 14 H GLU 14 11.903 4.885 -1.240 98 HA GLU 14 HA GLU 14 9.503 4.164 0.288 99 HB2 GLU 14 HB2 GLU 14 10.834 3.540 2.141 100 HB3 GLU 14 HB3 GLU 14 11.540 2.811 0.712 101 HG2 GLU 14 HG2 GLU 14 13.372 4.389 0.733 102 HG3 GLU 14 HG3 GLU 14 12.619 5.311 2.038 103 H LEU 15 H LEU 15 8.582 5.399 1.762 104 HA LEU 15 HA LEU 15 9.907 7.903 2.576 105 HB2 LEU 15 HB2 LEU 15 7.373 8.835 2.571 106 HB3 LEU 15 HB3 LEU 15 8.452 8.994 1.205 107 HG LEU 15 HG LEU 15 7.357 6.921 0.195 108 HD11 LEU 15 HD11 LEU 15 6.350 5.948 2.191 109 HD12 LEU 15 HD12 LEU 15 5.128 6.259 0.961 110 HD13 LEU 15 HD13 LEU 15 5.273 7.335 2.353 111 HD21 LEU 15 HD21 LEU 15 5.398 8.145 -0.654 112 HD22 LEU 15 HD22 LEU 15 6.836 9.162 -0.615 113 HD23 LEU 15 HD23 LEU 15 5.592 9.350 0.624 114 H THR 16 H THR 16 10.042 8.089 4.660 115 HA THR 16 HA THR 16 8.656 6.260 6.446 116 HB THR 16 HB THR 16 10.708 8.448 7.057 117 HG1 THR 16 HG1 THR 16 11.392 6.456 5.934 118 HG21 THR 16 HG21 THR 16 9.532 6.342 8.933 119 HG22 THR 16 HG22 THR 16 9.176 8.070 8.991 120 HG23 THR 16 HG23 THR 16 10.809 7.495 9.338 121 H VAL 17 H VAL 17 6.564 6.894 6.325 122 HA VAL 17 HA VAL 17 5.832 9.621 7.158 123 HB VAL 17 HB VAL 17 3.588 9.116 6.483 124 HG11 VAL 17 HG11 VAL 17 5.503 8.085 4.357 125 HG12 VAL 17 HG12 VAL 17 5.081 9.772 4.660 126 HG13 VAL 17 HG13 VAL 17 3.856 8.655 4.060 127 HG21 VAL 17 HG21 VAL 17 3.334 6.811 7.251 128 HG22 VAL 17 HG22 VAL 17 4.442 6.236 6.007 129 HG23 VAL 17 HG23 VAL 17 2.876 6.911 5.550 130 H ARG 18 H ARG 18 4.654 9.949 9.051 131 HA ARG 18 HA ARG 18 4.374 7.662 10.900 132 HB2 ARG 18 HB2 ARG 18 3.862 9.349 12.619 133 HB3 ARG 18 HB3 ARG 18 5.424 9.610 11.867 134 HG2 ARG 18 HG2 ARG 18 4.338 11.412 10.457 135 HG3 ARG 18 HG3 ARG 18 2.893 11.218 11.455 136 HD2 ARG 18 HD2 ARG 18 5.646 12.134 12.333 137 HD3 ARG 18 HD3 ARG 18 4.142 13.057 12.359 138 HE ARG 18 HE ARG 18 3.880 10.738 13.976 139 HH11 ARG 18 HH11 ARG 18 5.441 13.901 14.067 140 HH12 ARG 18 HH12 ARG 18 5.472 13.952 15.801 141 HH21 ARG 18 HH21 ARG 18 4.026 10.765 16.201 142 HH22 ARG 18 HH22 ARG 18 4.663 12.161 17.016 143 H ASN 19 H ASN 19 2.257 7.206 11.858 144 HA ASN 19 HA ASN 19 0.468 6.947 9.628 145 HB2 ASN 19 HB2 ASN 19 1.055 5.132 11.380 146 HB3 ASN 19 HB3 ASN 19 -0.116 5.911 12.435 147 HD21 ASN 19 HD21 ASN 19 -0.169 3.188 11.266 148 HD22 ASN 19 HD22 ASN 19 -1.624 3.093 10.343 149 H HIS 20 H HIS 20 -0.064 9.134 9.364 150 HA HIS 20 HA HIS 20 -2.017 10.493 11.044 151 HB2 HIS 20 HB2 HIS 20 -0.807 11.049 8.297 152 HB3 HIS 20 HB3 HIS 20 -2.099 12.042 8.935 153 HD1 HIS 20 HD1 HIS 20 -1.502 13.612 10.932 154 HD2 HIS 20 HD2 HIS 20 1.712 11.533 9.345 155 HE1 HIS 20 HE1 HIS 20 0.540 14.795 11.773 156 HE2 HIS 20 HE2 HIS 20 2.457 13.647 10.626 157 HA PRO 21 HA PRO 21 -5.879 8.938 9.317 158 HB2 PRO 21 HB2 PRO 21 -6.448 11.758 8.354 159 HB3 PRO 21 HB3 PRO 21 -7.496 10.639 9.256 160 HG2 PRO 21 HG2 PRO 21 -6.315 12.618 10.538 161 HG3 PRO 21 HG3 PRO 21 -6.382 11.001 11.282 162 HD2 PRO 21 HD2 PRO 21 -4.057 12.366 9.943 163 HD3 PRO 21 HD3 PRO 21 -4.079 11.312 11.376 164 H GLY 22 H GLY 22 -5.147 7.640 7.680 165 HA2 GLY 22 HA2 GLY 22 -5.198 6.767 5.582 166 HA3 GLY 22 HA3 GLY 22 -6.152 8.162 5.109 167 H VAL 23 H VAL 23 -2.727 7.820 6.198 168 HA VAL 23 HA VAL 23 -1.651 9.620 4.307 169 HB VAL 23 HB VAL 23 -0.075 7.239 5.396 170 HG11 VAL 23 HG11 VAL 23 1.843 8.800 5.188 171 HG12 VAL 23 HG12 VAL 23 0.763 10.035 4.537 172 HG13 VAL 23 HG13 VAL 23 1.041 8.540 3.637 173 HG21 VAL 23 HG21 VAL 23 -0.530 9.891 6.802 174 HG22 VAL 23 HG22 VAL 23 0.560 8.606 7.333 175 HG23 VAL 23 HG23 VAL 23 -1.184 8.329 7.300 176 H MET 24 H MET 24 -2.360 6.240 4.165 177 HA MET 24 HA MET 24 -0.874 5.437 1.921 178 HB2 MET 24 HB2 MET 24 -3.472 4.314 3.050 179 HB3 MET 24 HB3 MET 24 -2.393 3.470 1.942 180 HG2 MET 24 HG2 MET 24 -2.028 2.634 4.169 181 HG3 MET 24 HG3 MET 24 -0.605 3.559 3.687 182 HE1 MET 24 HE1 MET 24 0.408 3.978 6.055 183 HE2 MET 24 HE2 MET 24 -0.796 2.845 6.674 184 HE3 MET 24 HE3 MET 24 -0.556 4.401 7.469 185 H THR 25 H THR 25 -4.105 6.853 2.259 186 HA THR 25 HA THR 25 -4.903 6.727 -0.472 187 HB THR 25 HB THR 25 -5.800 8.792 1.600 188 HG1 THR 25 HG1 THR 25 -7.515 7.093 1.893 189 HG21 THR 25 HG21 THR 25 -7.278 7.551 -0.758 190 HG22 THR 25 HG22 THR 25 -6.629 9.194 -0.715 191 HG23 THR 25 HG23 THR 25 -7.939 8.734 0.374 192 H HIS 26 H HIS 26 -3.024 9.043 1.438 193 HA HIS 26 HA HIS 26 -2.970 11.202 -0.419 194 HB2 HIS 26 HB2 HIS 26 -0.877 10.581 1.721 195 HB3 HIS 26 HB3 HIS 26 -1.131 12.134 0.931 196 HD1 HIS 26 HD1 HIS 26 -1.196 11.933 3.990 197 HD2 HIS 26 HD2 HIS 26 -4.592 11.636 1.619 198 HE1 HIS 26 HE1 HIS 26 -3.118 12.497 5.493 199 HE2 HIS 26 HE2 HIS 26 -5.157 12.172 4.077 200 H VAL 27 H VAL 27 -0.561 8.638 0.331 201 HA VAL 27 HA VAL 27 1.401 9.492 -1.488 202 HB VAL 27 HB VAL 27 2.551 7.365 -1.149 203 HG11 VAL 27 HG11 VAL 27 1.246 8.268 1.449 204 HG12 VAL 27 HG12 VAL 27 2.691 8.955 0.709 205 HG13 VAL 27 HG13 VAL 27 2.724 7.307 1.326 206 HG21 VAL 27 HG21 VAL 27 0.031 6.288 0.175 207 HG22 VAL 27 HG22 VAL 27 1.590 5.460 0.106 208 HG23 VAL 27 HG23 VAL 27 0.690 5.773 -1.379 209 H CYS 28 H CYS 28 -1.143 7.028 -1.799 210 HA CYS 28 HA CYS 28 -0.525 6.166 -4.411 211 HB2 CYS 28 HB2 CYS 28 -3.119 6.046 -2.835 212 HB3 CYS 28 HB3 CYS 28 -2.784 5.117 -4.295 213 HG CYS 28 HG CYS 28 -2.343 4.145 -1.332 214 H GLY 29 H GLY 29 -2.458 8.841 -3.181 215 HA2 GLY 29 HA2 GLY 29 -3.819 9.635 -5.520 216 HA3 GLY 29 HA3 GLY 29 -3.379 10.679 -4.175 217 H LEU 30 H LEU 30 -0.568 10.455 -4.286 218 HA LEU 30 HA LEU 30 0.062 12.412 -6.250 219 HB2 LEU 30 HB2 LEU 30 1.679 10.881 -4.226 220 HB3 LEU 30 HB3 LEU 30 2.549 11.707 -5.505 221 HG LEU 30 HG LEU 30 2.530 13.135 -3.568 222 HD11 LEU 30 HD11 LEU 30 0.568 14.261 -5.584 223 HD12 LEU 30 HD12 LEU 30 2.326 14.281 -5.717 224 HD13 LEU 30 HD13 LEU 30 1.538 15.186 -4.431 225 HD21 LEU 30 HD21 LEU 30 -0.499 12.976 -3.521 226 HD22 LEU 30 HD22 LEU 30 0.508 13.992 -2.483 227 HD23 LEU 30 HD23 LEU 30 0.607 12.238 -2.357 228 H PHE 31 H PHE 31 0.640 8.901 -6.140 229 HA PHE 31 HA PHE 31 2.187 8.888 -8.601 230 HB2 PHE 31 HB2 PHE 31 0.948 6.582 -7.044 231 HB3 PHE 31 HB3 PHE 31 2.051 6.397 -8.410 232 HD1 PHE 31 HD2 PHE 31 4.399 7.467 -8.221 233 HD2 PHE 31 HD1 PHE 31 1.850 6.891 -4.842 234 HE1 PHE 31 HE2 PHE 31 6.324 7.712 -6.712 235 HE2 PHE 31 HE1 PHE 31 3.782 7.157 -3.345 236 HZ PHE 31 HZ PHE 31 6.022 7.566 -4.278 237 H ALA 32 H ALA 32 -1.193 8.339 -7.790 238 HA ALA 32 HA ALA 32 -2.048 7.188 -10.246 239 HB1 ALA 32 HB1 ALA 32 -3.326 6.981 -8.151 240 HB2 ALA 32 HB2 ALA 32 -4.321 7.654 -9.441 241 HB3 ALA 32 HB3 ALA 32 -3.674 8.713 -8.180 242 H ARG 33 H ARG 33 -1.828 10.532 -9.105 243 HA ARG 33 HA ARG 33 -3.483 11.695 -11.123 244 HB2 ARG 33 HB2 ARG 33 -2.801 13.852 -10.208 245 HB3 ARG 33 HB3 ARG 33 -3.155 12.723 -8.905 246 HG2 ARG 33 HG2 ARG 33 -0.715 12.327 -8.608 247 HG3 ARG 33 HG3 ARG 33 -0.390 13.529 -9.860 248 HD2 ARG 33 HD2 ARG 33 -1.845 14.063 -7.251 249 HD3 ARG 33 HD3 ARG 33 -0.152 14.454 -7.574 250 HE ARG 33 HE ARG 33 -1.307 15.772 -9.550 251 HH11 ARG 33 HH11 ARG 33 -2.278 15.666 -6.184 252 HH12 ARG 33 HH12 ARG 33 -2.975 17.252 -6.204 253 HH21 ARG 33 HH21 ARG 33 -2.228 17.840 -9.585 254 HH22 ARG 33 HH22 ARG 33 -2.946 18.491 -8.144 255 H ARG 34 H ARG 34 -0.322 10.537 -11.338 256 HA ARG 34 HA ARG 34 0.663 12.275 -13.415 257 HB2 ARG 34 HB2 ARG 34 2.259 11.029 -12.076 258 HB3 ARG 34 HB3 ARG 34 1.445 9.507 -12.413 259 HG2 ARG 34 HG2 ARG 34 2.134 9.851 -14.876 260 HG3 ARG 34 HG3 ARG 34 3.186 11.145 -14.289 261 HD2 ARG 34 HD2 ARG 34 4.409 9.600 -12.892 262 HD3 ARG 34 HD3 ARG 34 3.265 8.300 -13.241 263 HE ARG 34 HE ARG 34 4.726 9.408 -15.518 264 HH11 ARG 34 HH11 ARG 34 4.480 6.846 -13.129 265 HH12 ARG 34 HH12 ARG 34 5.499 5.755 -14.008 266 HH21 ARG 34 HH21 ARG 34 6.130 8.004 -16.632 267 HH22 ARG 34 HH22 ARG 34 6.437 6.408 -16.003 268 H ALA 35 H ALA 35 -0.121 8.804 -13.529 269 HA ALA 35 HA ALA 35 -2.028 8.683 -15.520 270 HB1 ALA 35 HB1 ALA 35 -0.399 9.741 -17.047 271 HB2 ALA 35 HB2 ALA 35 -0.734 8.087 -17.558 272 HB3 ALA 35 HB3 ALA 35 0.774 8.468 -16.715 273 H PHE 36 H PHE 36 1.146 7.231 -14.818 274 HA PHE 36 HA PHE 36 0.052 4.525 -14.865 275 HB2 PHE 36 HB2 PHE 36 2.226 4.903 -15.966 276 HB3 PHE 36 HB3 PHE 36 2.913 5.519 -14.465 277 HD1 PHE 36 HD2 PHE 36 0.950 2.426 -15.444 278 HD2 PHE 36 HD1 PHE 36 4.426 4.002 -13.507 279 HE1 PHE 36 HE2 PHE 36 1.658 0.145 -14.841 280 HE2 PHE 36 HE1 PHE 36 5.121 1.721 -12.908 281 HZ PHE 36 HZ PHE 36 3.743 -0.209 -13.575 282 H ASN 37 H ASN 37 -0.202 3.271 -13.130 283 HA ASN 37 HA ASN 37 -0.368 4.495 -10.489 284 HB2 ASN 37 HB2 ASN 37 -1.148 1.691 -11.418 285 HB3 ASN 37 HB3 ASN 37 -1.659 2.479 -9.925 286 HD21 ASN 37 HD21 ASN 37 -3.055 1.419 -12.424 287 HD22 ASN 37 HD22 ASN 37 -4.137 2.693 -12.865 288 H VAL 38 H VAL 38 0.287 2.980 -8.606 289 HA VAL 38 HA VAL 38 3.000 2.009 -8.885 290 HB VAL 38 HB VAL 38 1.139 1.608 -6.484 291 HG11 VAL 38 HG11 VAL 38 3.153 0.188 -6.457 292 HG12 VAL 38 HG12 VAL 38 3.243 1.412 -5.189 293 HG13 VAL 38 HG13 VAL 38 4.178 1.609 -6.674 294 HG21 VAL 38 HG21 VAL 38 2.127 3.644 -5.494 295 HG22 VAL 38 HG22 VAL 38 1.269 4.017 -6.990 296 HG23 VAL 38 HG23 VAL 38 3.031 3.936 -6.983 297 H GLU 39 H GLU 39 3.643 -0.132 -9.006 298 HA GLU 39 HA GLU 39 1.575 -2.093 -9.710 299 HB2 GLU 39 HB2 GLU 39 3.569 -1.609 -11.230 300 HB3 GLU 39 HB3 GLU 39 4.599 -2.362 -10.015 301 HG2 GLU 39 HG2 GLU 39 4.049 -3.912 -11.851 302 HG3 GLU 39 HG3 GLU 39 3.431 -4.495 -10.305 303 H GLY 40 H GLY 40 4.293 -1.591 -7.459 304 HA2 GLY 40 HA2 GLY 40 3.248 -3.820 -5.760 305 HA3 GLY 40 HA3 GLY 40 4.965 -3.695 -6.128 306 H ILE 41 H ILE 41 3.284 -3.439 -3.570 307 HA ILE 41 HA ILE 41 4.522 -0.922 -2.568 308 HB ILE 41 HB ILE 41 1.717 -1.935 -1.869 309 HG12 ILE 41 HG12 ILE 41 2.557 0.592 -3.356 310 HG13 ILE 41 HG13 ILE 41 1.744 -0.800 -4.061 311 HG21 ILE 41 HG21 ILE 41 1.478 0.035 -0.419 312 HG22 ILE 41 HG22 ILE 41 3.138 0.510 -0.774 313 HG23 ILE 41 HG23 ILE 41 2.820 -0.979 0.116 314 HD11 ILE 41 HD11 ILE 41 0.594 1.081 -2.002 315 HD12 ILE 41 HD12 ILE 41 -0.226 -0.332 -2.674 316 HD13 ILE 41 HD13 ILE 41 0.204 1.019 -3.721 317 H LEU 42 H LEU 42 5.395 -1.074 -0.523 318 HA LEU 42 HA LEU 42 4.862 -3.441 1.131 319 HB2 LEU 42 HB2 LEU 42 6.881 -3.977 -0.202 320 HB3 LEU 42 HB3 LEU 42 7.663 -2.503 0.353 321 HG LEU 42 HG LEU 42 7.859 -3.370 2.620 322 HD11 LEU 42 HD11 LEU 42 6.262 -5.778 1.705 323 HD12 LEU 42 HD12 LEU 42 5.713 -4.516 2.811 324 HD13 LEU 42 HD13 LEU 42 7.030 -5.587 3.282 325 HD21 LEU 42 HD21 LEU 42 9.304 -5.328 2.261 326 HD22 LEU 42 HD22 LEU 42 9.597 -4.091 1.040 327 HD23 LEU 42 HD23 LEU 42 8.653 -5.526 0.630 328 H CYS 43 H CYS 43 3.730 -2.142 2.553 329 HA CYS 43 HA CYS 43 5.033 0.154 3.840 330 HB2 CYS 43 HB2 CYS 43 2.640 0.334 3.290 331 HB3 CYS 43 HB3 CYS 43 2.290 -1.091 4.256 332 HG CYS 43 HG CYS 43 3.664 1.665 5.710 333 H LEU 44 H LEU 44 6.573 -0.491 5.202 334 HA LEU 44 HA LEU 44 6.218 -2.838 6.953 335 HB2 LEU 44 HB2 LEU 44 8.262 -2.410 5.365 336 HB3 LEU 44 HB3 LEU 44 8.763 -1.241 6.567 337 HG LEU 44 HG LEU 44 8.816 -3.127 8.267 338 HD11 LEU 44 HD11 LEU 44 7.293 -4.696 7.158 339 HD12 LEU 44 HD12 LEU 44 8.862 -5.447 7.438 340 HD13 LEU 44 HD13 LEU 44 8.433 -4.885 5.820 341 HD21 LEU 44 HD21 LEU 44 10.633 -3.439 5.848 342 HD22 LEU 44 HD22 LEU 44 10.958 -4.047 7.475 343 HD23 LEU 44 HD23 LEU 44 10.871 -2.311 7.187 344 HA PRO 45 HA PRO 45 5.286 0.562 9.902 345 HB2 PRO 45 HB2 PRO 45 4.155 -0.993 11.873 346 HB3 PRO 45 HB3 PRO 45 3.284 -0.515 10.403 347 HG2 PRO 45 HG2 PRO 45 4.635 -3.119 11.018 348 HG3 PRO 45 HG3 PRO 45 3.067 -2.824 10.233 349 HD2 PRO 45 HD2 PRO 45 5.331 -3.415 8.819 350 HD3 PRO 45 HD3 PRO 45 4.028 -2.400 8.165 351 H ILE 46 H ILE 46 6.929 1.404 11.000 352 HA ILE 46 HA ILE 46 9.069 0.011 12.254 353 HB ILE 46 HB ILE 46 8.105 2.871 12.739 354 HG12 ILE 46 HG12 ILE 46 8.596 2.454 10.315 355 HG13 ILE 46 HG13 ILE 46 9.666 3.643 11.036 356 HG21 ILE 46 HG21 ILE 46 9.641 2.145 14.493 357 HG22 ILE 46 HG22 ILE 46 10.420 3.348 13.465 358 HG23 ILE 46 HG23 ILE 46 10.828 1.641 13.284 359 HD11 ILE 46 HD11 ILE 46 10.824 2.178 9.495 360 HD12 ILE 46 HD12 ILE 46 10.369 0.774 10.458 361 HD13 ILE 46 HD13 ILE 46 11.452 1.992 11.135 362 H GLN 47 H GLN 47 8.931 -1.085 14.174 363 HA GLN 47 HA GLN 47 6.611 -0.875 15.891 364 HB2 GLN 47 HB2 GLN 47 7.623 -2.674 17.207 365 HB3 GLN 47 HB3 GLN 47 7.717 -3.042 15.495 366 HG2 GLN 47 HG2 GLN 47 10.108 -2.254 15.518 367 HG3 GLN 47 HG3 GLN 47 9.977 -2.106 17.269 368 HE21 GLN 47 HE21 GLN 47 10.039 -4.354 14.578 369 HE22 GLN 47 HE22 GLN 47 10.375 -5.765 15.519 370 H ASP 48 H ASP 48 9.724 0.568 15.783 371 HA ASP 48 HA ASP 48 10.256 1.025 18.504 372 HB2 ASP 48 HB2 ASP 48 12.011 1.161 16.817 373 HB3 ASP 48 HB3 ASP 48 11.193 2.485 16.003 374 H SER 49 H SER 49 8.483 2.954 16.114 375 HA SER 49 HA SER 49 7.313 4.667 18.187 376 HB2 SER 49 HB2 SER 49 8.898 5.831 15.839 377 HB3 SER 49 HB3 SER 49 7.944 6.770 16.989 378 HG SER 49 HG SER 49 10.206 5.163 17.613 379 H ASP 50 H ASP 50 5.737 6.330 16.905 380 HA ASP 50 HA ASP 50 4.051 4.755 15.162 381 HB2 ASP 50 HB2 ASP 50 2.520 6.670 15.155 382 HB3 ASP 50 HB3 ASP 50 3.034 6.329 16.795 383 H LYS 51 H LYS 51 5.609 4.317 13.562 384 HA LYS 51 HA LYS 51 5.841 6.310 11.424 385 HB2 LYS 51 HB2 LYS 51 8.277 4.847 12.570 386 HB3 LYS 51 HB3 LYS 51 8.285 5.792 11.093 387 HG2 LYS 51 HG2 LYS 51 7.761 6.931 13.857 388 HG3 LYS 51 HG3 LYS 51 9.328 6.940 13.045 389 HD2 LYS 51 HD2 LYS 51 8.450 8.362 11.262 390 HD3 LYS 51 HD3 LYS 51 6.821 8.265 11.941 391 HE2 LYS 51 HE2 LYS 51 7.864 10.406 12.507 392 HE3 LYS 51 HE3 LYS 51 7.601 9.451 13.966 393 HZ1 LYS 51 HZ1 LYS 51 10.190 9.679 12.523 394 HZ2 LYS 51 HZ2 LYS 51 9.919 8.840 13.964 395 HZ3 LYS 51 HZ3 LYS 51 9.776 10.521 13.928 396 H SER 52 H SER 52 6.393 5.302 9.398 397 HA SER 52 HA SER 52 6.594 2.450 9.091 398 HB2 SER 52 HB2 SER 52 4.095 2.792 9.396 399 HB3 SER 52 HB3 SER 52 4.098 3.837 7.975 400 HG SER 52 HG SER 52 3.711 1.324 7.930 401 H HIS 53 H HIS 53 7.932 2.174 7.342 402 HA HIS 53 HA HIS 53 8.046 4.370 5.349 403 HB2 HIS 53 HB2 HIS 53 10.319 3.523 4.700 404 HB3 HIS 53 HB3 HIS 53 10.208 4.228 6.301 405 HD1 HIS 53 HD1 HIS 53 12.611 2.653 5.808 406 HD2 HIS 53 HD2 HIS 53 9.117 0.850 7.160 407 HE1 HIS 53 HE1 HIS 53 13.334 0.546 6.977 408 HE2 HIS 53 HE2 HIS 53 11.213 -0.428 7.900 409 H ILE 54 H ILE 54 7.375 4.032 3.357 410 HA ILE 54 HA ILE 54 6.466 1.300 2.635 411 HB ILE 54 HB ILE 54 5.268 3.953 1.677 412 HG12 ILE 54 HG12 ILE 54 3.195 3.138 3.043 413 HG13 ILE 54 HG13 ILE 54 4.322 2.095 3.893 414 HG21 ILE 54 HG21 ILE 54 5.003 2.149 0.043 415 HG22 ILE 54 HG22 ILE 54 3.443 2.552 0.759 416 HG23 ILE 54 HG23 ILE 54 4.299 1.099 1.278 417 HD11 ILE 54 HD11 ILE 54 4.412 5.098 3.788 418 HD12 ILE 54 HD12 ILE 54 5.546 4.061 4.657 419 HD13 ILE 54 HD13 ILE 54 3.848 4.105 5.131 420 H TRP 55 H TRP 55 7.602 0.422 0.937 421 HA TRP 55 HA TRP 55 9.057 2.142 -0.955 422 HB2 TRP 55 HB2 TRP 55 8.931 -0.911 -0.733 423 HB3 TRP 55 HB3 TRP 55 9.917 -0.030 -1.900 424 HD1 TRP 55 HD1 TRP 55 12.268 0.898 -1.030 425 HE1 TRP 55 HE1 TRP 55 13.531 0.749 1.199 426 HE3 TRP 55 HE3 TRP 55 8.565 -1.023 1.843 427 HZ2 TRP 55 HZ2 TRP 55 13.013 -0.091 3.839 428 HZ3 TRP 55 HZ3 TRP 55 9.006 -1.468 4.192 429 HH2 TRP 55 HH2 TRP 55 11.184 -1.015 5.187 430 H LEU 56 H LEU 56 7.863 2.966 -2.554 431 HA LEU 56 HA LEU 56 5.633 1.495 -3.766 432 HB2 LEU 56 HB2 LEU 56 6.590 4.361 -4.188 433 HB3 LEU 56 HB3 LEU 56 5.245 3.631 -5.043 434 HG LEU 56 HG LEU 56 4.263 4.975 -3.369 435 HD11 LEU 56 HD11 LEU 56 3.171 2.814 -3.574 436 HD12 LEU 56 HD12 LEU 56 3.020 3.441 -1.935 437 HD13 LEU 56 HD13 LEU 56 4.177 2.153 -2.282 438 HD21 LEU 56 HD21 LEU 56 4.820 4.949 -0.976 439 HD22 LEU 56 HD22 LEU 56 6.208 5.406 -1.959 440 HD23 LEU 56 HD23 LEU 56 6.110 3.780 -1.280 441 H LEU 57 H LEU 57 6.184 0.153 -5.311 442 HA LEU 57 HA LEU 57 8.463 0.498 -7.093 443 HB2 LEU 57 HB2 LEU 57 6.469 -1.742 -6.629 444 HB3 LEU 57 HB3 LEU 57 7.471 -1.736 -8.069 445 HG LEU 57 HG LEU 57 9.500 -1.926 -6.747 446 HD11 LEU 57 HD11 LEU 57 7.764 -1.772 -4.270 447 HD12 LEU 57 HD12 LEU 57 8.966 -0.589 -4.808 448 HD13 LEU 57 HD13 LEU 57 9.480 -2.195 -4.295 449 HD21 LEU 57 HD21 LEU 57 9.159 -4.171 -5.809 450 HD22 LEU 57 HD22 LEU 57 8.339 -3.985 -7.358 451 HD23 LEU 57 HD23 LEU 57 7.409 -3.933 -5.858 452 H VAL 58 H VAL 58 7.978 2.154 -8.357 453 HA VAL 58 HA VAL 58 5.901 1.834 -10.435 454 HB VAL 58 HB VAL 58 4.986 3.359 -8.609 455 HG11 VAL 58 HG11 VAL 58 5.887 5.619 -8.266 456 HG12 VAL 58 HG12 VAL 58 7.240 5.241 -9.334 457 HG13 VAL 58 HG13 VAL 58 7.052 4.375 -7.807 458 HG21 VAL 58 HG21 VAL 58 5.450 4.759 -11.269 459 HG22 VAL 58 HG22 VAL 58 4.201 5.182 -10.093 460 HG23 VAL 58 HG23 VAL 58 4.148 3.621 -10.912 461 H ASN 59 H ASN 59 6.740 2.668 -12.486 462 HA ASN 59 HA ASN 59 9.531 3.400 -12.500 463 HB2 ASN 59 HB2 ASN 59 9.216 3.807 -14.960 464 HB3 ASN 59 HB3 ASN 59 8.784 2.194 -14.415 465 HD21 ASN 59 HD21 ASN 59 7.285 1.543 -15.789 466 HD22 ASN 59 HD22 ASN 59 5.853 2.409 -16.224 467 H ASP 60 H ASP 60 10.408 5.378 -12.265 468 HA ASP 60 HA ASP 60 8.715 7.572 -11.574 469 HB2 ASP 60 HB2 ASP 60 10.608 8.698 -10.780 470 HB3 ASP 60 HB3 ASP 60 11.062 7.015 -10.554 471 H ASP 61 H ASP 61 9.358 9.765 -12.428 472 HA ASP 61 HA ASP 61 9.572 9.931 -15.336 473 HB2 ASP 61 HB2 ASP 61 7.086 9.489 -14.441 474 HB3 ASP 61 HB3 ASP 61 7.147 11.162 -13.947 475 H GLN 62 H GLN 62 9.777 12.268 -15.956 476 HA GLN 62 HA GLN 62 11.174 13.923 -14.100 477 HB2 GLN 62 HB2 GLN 62 9.764 14.710 -16.688 478 HB3 GLN 62 HB3 GLN 62 10.929 15.705 -15.820 479 HG2 GLN 62 HG2 GLN 62 11.498 13.036 -17.148 480 HG3 GLN 62 HG3 GLN 62 11.966 14.620 -17.757 481 HE21 GLN 62 HE21 GLN 62 12.633 12.157 -15.388 482 HE22 GLN 62 HE22 GLN 62 14.148 12.782 -14.858 483 H ARG 63 H ARG 63 7.802 13.540 -14.952 484 HA ARG 63 HA ARG 63 6.747 15.787 -13.512 485 HB2 ARG 63 HB2 ARG 63 5.642 14.410 -15.446 486 HB3 ARG 63 HB3 ARG 63 5.192 13.253 -14.200 487 HG2 ARG 63 HG2 ARG 63 3.298 14.669 -14.521 488 HG3 ARG 63 HG3 ARG 63 4.024 15.179 -12.992 489 HD2 ARG 63 HD2 ARG 63 3.395 17.140 -14.315 490 HD3 ARG 63 HD3 ARG 63 5.157 17.054 -14.189 491 HE ARG 63 HE ARG 63 3.797 15.940 -16.555 492 HH11 ARG 63 HH11 ARG 63 6.005 18.373 -15.289 493 HH12 ARG 63 HH12 ARG 63 6.548 18.845 -16.864 494 HH21 ARG 63 HH21 ARG 63 4.544 16.561 -18.577 495 HH22 ARG 63 HH22 ARG 63 5.726 17.822 -18.730 496 H LEU 64 H LEU 64 7.370 12.403 -12.803 497 HA LEU 64 HA LEU 64 5.880 11.957 -10.471 498 HB2 LEU 64 HB2 LEU 64 7.339 10.375 -12.051 499 HB3 LEU 64 HB3 LEU 64 8.602 10.686 -10.896 500 HG LEU 64 HG LEU 64 7.722 8.569 -10.352 501 HD11 LEU 64 HD11 LEU 64 6.784 8.710 -8.144 502 HD12 LEU 64 HD12 LEU 64 6.389 10.412 -8.389 503 HD13 LEU 64 HD13 LEU 64 8.073 9.890 -8.368 504 HD21 LEU 64 HD21 LEU 64 5.708 8.572 -11.667 505 HD22 LEU 64 HD22 LEU 64 4.904 9.652 -10.522 506 HD23 LEU 64 HD23 LEU 64 5.356 8.015 -10.033 507 H GLU 65 H GLU 65 9.134 13.250 -10.968 508 HA GLU 65 HA GLU 65 10.095 13.328 -8.335 509 HB2 GLU 65 HB2 GLU 65 10.742 15.179 -10.662 510 HB3 GLU 65 HB3 GLU 65 11.720 14.996 -9.204 511 HG2 GLU 65 HG2 GLU 65 12.116 12.623 -9.772 512 HG3 GLU 65 HG3 GLU 65 11.152 12.810 -11.233 513 H GLN 66 H GLN 66 8.064 15.610 -10.093 514 HA GLN 66 HA GLN 66 8.121 17.709 -8.142 515 HB2 GLN 66 HB2 GLN 66 6.017 17.124 -10.272 516 HB3 GLN 66 HB3 GLN 66 6.164 18.623 -9.363 517 HG2 GLN 66 HG2 GLN 66 8.121 17.524 -11.395 518 HG3 GLN 66 HG3 GLN 66 7.092 18.946 -11.565 519 HE21 GLN 66 HE21 GLN 66 7.613 20.818 -10.312 520 HE22 GLN 66 HE22 GLN 66 9.217 21.084 -9.732 521 H MET 67 H MET 67 6.003 14.920 -8.736 522 HA MET 67 HA MET 67 4.140 15.407 -6.653 523 HB2 MET 67 HB2 MET 67 4.931 12.890 -8.152 524 HB3 MET 67 HB3 MET 67 3.765 12.828 -6.834 525 HG2 MET 67 HG2 MET 67 2.638 12.917 -8.983 526 HG3 MET 67 HG3 MET 67 2.294 14.369 -8.044 527 HE1 MET 67 HE1 MET 67 2.257 15.626 -11.768 528 HE2 MET 67 HE2 MET 67 1.350 15.557 -10.257 529 HE3 MET 67 HE3 MET 67 1.686 14.075 -11.156 530 H ILE 68 H ILE 68 7.257 13.685 -6.699 531 HA ILE 68 HA ILE 68 7.223 12.648 -4.050 532 HB ILE 68 HB ILE 68 9.657 13.461 -5.728 533 HG12 ILE 68 HG12 ILE 68 8.415 10.681 -5.461 534 HG13 ILE 68 HG13 ILE 68 8.193 11.740 -6.848 535 HG21 ILE 68 HG21 ILE 68 9.521 11.596 -3.321 536 HG22 ILE 68 HG22 ILE 68 10.249 13.203 -3.349 537 HG23 ILE 68 HG23 ILE 68 10.957 11.901 -4.301 538 HD11 ILE 68 HD11 ILE 68 10.816 10.572 -5.920 539 HD12 ILE 68 HD12 ILE 68 10.604 11.654 -7.299 540 HD13 ILE 68 HD13 ILE 68 9.862 10.054 -7.311 541 H SER 69 H SER 69 8.372 15.670 -5.480 542 HA SER 69 HA SER 69 9.575 16.803 -3.173 543 HB2 SER 69 HB2 SER 69 10.165 17.500 -5.472 544 HB3 SER 69 HB3 SER 69 8.547 18.158 -5.705 545 HG SER 69 HG SER 69 10.396 19.027 -3.723 546 H GLN 70 H GLN 70 6.315 16.899 -4.516 547 HA GLN 70 HA GLN 70 5.298 19.022 -2.891 548 HB2 GLN 70 HB2 GLN 70 4.366 18.232 -5.128 549 HB3 GLN 70 HB3 GLN 70 3.726 16.818 -4.311 550 HG2 GLN 70 HG2 GLN 70 2.947 19.654 -3.565 551 HG3 GLN 70 HG3 GLN 70 2.094 18.715 -4.776 552 HE21 GLN 70 HE21 GLN 70 2.216 16.195 -3.323 553 HE22 GLN 70 HE22 GLN 70 1.143 16.345 -1.984 554 H ILE 71 H ILE 71 5.027 15.456 -2.788 555 HA ILE 71 HA ILE 71 3.366 15.370 -0.497 556 HB ILE 71 HB ILE 71 3.504 13.536 -2.208 557 HG12 ILE 71 HG12 ILE 71 3.854 12.788 0.726 558 HG13 ILE 71 HG13 ILE 71 2.339 13.101 -0.111 559 HG21 ILE 71 HG21 ILE 71 5.260 11.822 -2.072 560 HG22 ILE 71 HG22 ILE 71 6.080 12.740 -0.809 561 HG23 ILE 71 HG23 ILE 71 5.962 13.402 -2.439 562 HD11 ILE 71 HD11 ILE 71 4.186 10.770 -0.534 563 HD12 ILE 71 HD12 ILE 71 2.709 11.077 -1.458 564 HD13 ILE 71 HD13 ILE 71 2.621 10.763 0.276 565 H ASP 72 H ASP 72 6.820 15.423 -0.926 566 HA ASP 72 HA ASP 72 7.735 14.586 1.567 567 HB2 ASP 72 HB2 ASP 72 9.297 14.853 -0.230 568 HB3 ASP 72 HB3 ASP 72 8.836 16.525 -0.496 569 H LYS 73 H LYS 73 6.345 17.661 0.569 570 HA LYS 73 HA LYS 73 7.130 19.127 2.944 571 HB2 LYS 73 HB2 LYS 73 5.125 19.978 0.816 572 HB3 LYS 73 HB3 LYS 73 5.956 21.017 1.969 573 HG2 LYS 73 HG2 LYS 73 7.137 19.578 -0.417 574 HG3 LYS 73 HG3 LYS 73 7.023 21.320 -0.152 575 HD2 LYS 73 HD2 LYS 73 8.659 21.147 1.702 576 HD3 LYS 73 HD3 LYS 73 8.746 19.399 1.472 577 HE2 LYS 73 HE2 LYS 73 9.596 19.828 -0.861 578 HE3 LYS 73 HE3 LYS 73 9.673 21.546 -0.458 579 HZ1 LYS 73 HZ1 LYS 73 11.157 19.352 0.889 580 HZ2 LYS 73 HZ2 LYS 73 11.190 20.972 1.370 581 HZ3 LYS 73 HZ3 LYS 73 11.808 20.528 -0.138 582 H LEU 74 H LEU 74 4.692 16.896 2.329 583 HA LEU 74 HA LEU 74 2.611 17.930 4.037 584 HB2 LEU 74 HB2 LEU 74 3.163 15.251 2.730 585 HB3 LEU 74 HB3 LEU 74 1.979 15.331 4.017 586 HG LEU 74 HG LEU 74 0.947 15.411 1.757 587 HD11 LEU 74 HD11 LEU 74 -0.582 17.291 2.162 588 HD12 LEU 74 HD12 LEU 74 0.529 17.948 3.366 589 HD13 LEU 74 HD13 LEU 74 -0.253 16.391 3.643 590 HD21 LEU 74 HD21 LEU 74 2.302 18.112 1.426 591 HD22 LEU 74 HD22 LEU 74 1.143 17.378 0.313 592 HD23 LEU 74 HD23 LEU 74 2.722 16.640 0.554 593 H GLU 75 H GLU 75 2.103 17.241 6.126 594 HA GLU 75 HA GLU 75 4.287 16.777 7.924 595 HB2 GLU 75 HB2 GLU 75 1.284 16.784 8.430 596 HB3 GLU 75 HB3 GLU 75 2.521 16.817 9.688 597 HG2 GLU 75 HG2 GLU 75 3.276 19.012 8.986 598 HG3 GLU 75 HG3 GLU 75 2.231 18.973 7.567 599 H ASP 76 H ASP 76 2.370 14.694 6.089 600 HA ASP 76 HA ASP 76 2.393 12.341 7.690 601 HB2 ASP 76 HB2 ASP 76 2.449 12.572 4.639 602 HB3 ASP 76 HB3 ASP 76 1.918 11.182 5.574 603 H VAL 77 H VAL 77 4.430 13.434 4.973 604 HA VAL 77 HA VAL 77 6.289 11.253 5.244 605 HB VAL 77 HB VAL 77 6.237 13.690 3.404 606 HG11 VAL 77 HG11 VAL 77 8.187 11.351 3.317 607 HG12 VAL 77 HG12 VAL 77 8.589 13.022 3.719 608 HG13 VAL 77 HG13 VAL 77 8.043 12.616 2.093 609 HG21 VAL 77 HG21 VAL 77 5.709 10.746 2.830 610 HG22 VAL 77 HG22 VAL 77 5.622 12.068 1.659 611 HG23 VAL 77 HG23 VAL 77 4.471 11.999 2.994 612 H VAL 78 H VAL 78 7.352 11.371 7.120 613 HA VAL 78 HA VAL 78 8.569 13.697 8.257 614 HB VAL 78 HB VAL 78 9.383 10.799 8.810 615 HG11 VAL 78 HG11 VAL 78 9.392 13.243 10.625 616 HG12 VAL 78 HG12 VAL 78 10.809 12.513 9.864 617 HG13 VAL 78 HG13 VAL 78 9.899 11.612 11.076 618 HG21 VAL 78 HG21 VAL 78 6.927 10.904 8.917 619 HG22 VAL 78 HG22 VAL 78 7.015 12.263 10.044 620 HG23 VAL 78 HG23 VAL 78 7.615 10.674 10.527 621 H LYS 79 H LYS 79 9.700 10.939 6.331 622 HA LYS 79 HA LYS 79 11.879 12.532 5.166 623 HB2 LYS 79 HB2 LYS 79 12.256 9.731 6.337 624 HB3 LYS 79 HB3 LYS 79 13.413 10.508 5.258 625 HG2 LYS 79 HG2 LYS 79 13.751 12.310 6.931 626 HG3 LYS 79 HG3 LYS 79 12.624 11.494 8.017 627 HD2 LYS 79 HD2 LYS 79 14.136 9.519 8.092 628 HD3 LYS 79 HD3 LYS 79 15.254 10.340 7.000 629 HE2 LYS 79 HE2 LYS 79 15.591 12.115 8.711 630 HE3 LYS 79 HE3 LYS 79 14.511 11.247 9.806 631 HZ1 LYS 79 HZ1 LYS 79 16.813 10.769 10.305 632 HZ2 LYS 79 HZ2 LYS 79 17.086 10.228 8.729 633 HZ3 LYS 79 HZ3 LYS 79 16.048 9.367 9.746 634 H VAL 80 H VAL 80 12.379 11.937 3.026 635 HA VAL 80 HA VAL 80 10.940 9.637 1.822 636 HB VAL 80 HB VAL 80 9.858 11.852 1.154 637 HG11 VAL 80 HG11 VAL 80 12.460 12.392 -0.306 638 HG12 VAL 80 HG12 VAL 80 11.828 13.292 1.075 639 HG13 VAL 80 HG13 VAL 80 10.971 13.329 -0.468 640 HG21 VAL 80 HG21 VAL 80 9.667 11.313 -1.256 641 HG22 VAL 80 HG22 VAL 80 9.576 9.860 -0.260 642 HG23 VAL 80 HG23 VAL 80 11.064 10.240 -1.131 643 H GLN 81 H GLN 81 12.148 8.532 0.171 644 HA GLN 81 HA GLN 81 14.948 9.233 -0.254 645 HB2 GLN 81 HB2 GLN 81 15.010 8.116 1.935 646 HB3 GLN 81 HB3 GLN 81 14.113 6.739 1.301 647 HG2 GLN 81 HG2 GLN 81 16.007 6.188 -0.184 648 HG3 GLN 81 HG3 GLN 81 16.904 7.573 0.432 649 HE21 GLN 81 HE21 GLN 81 15.707 4.373 1.177 650 HE22 GLN 81 HE22 GLN 81 16.667 4.128 2.591 651 H ARG 82 H ARG 82 15.441 8.735 -2.285 652 HA ARG 82 HA ARG 82 13.841 6.861 -3.872 653 HB2 ARG 82 HB2 ARG 82 16.235 8.568 -4.713 654 HB3 ARG 82 HB3 ARG 82 15.162 7.678 -5.786 655 HG2 ARG 82 HG2 ARG 82 13.290 9.188 -5.131 656 HG3 ARG 82 HG3 ARG 82 14.410 10.101 -4.115 657 HD2 ARG 82 HD2 ARG 82 15.795 10.595 -6.136 658 HD3 ARG 82 HD3 ARG 82 14.611 9.739 -7.130 659 HE ARG 82 HE ARG 82 13.391 11.840 -5.633 660 HH11 ARG 82 HH11 ARG 82 15.372 11.266 -8.491 661 HH12 ARG 82 HH12 ARG 82 14.853 12.722 -9.287 662 HH21 ARG 82 HH21 ARG 82 12.761 13.772 -6.687 663 HH22 ARG 82 HH22 ARG 82 13.383 14.133 -8.266 664 H ASN 83 H ASN 83 14.429 4.735 -3.793 665 HA ASN 83 HA ASN 83 17.275 3.956 -3.442 666 HB2 ASN 83 HB2 ASN 83 14.785 2.201 -3.227 667 HB3 ASN 83 HB3 ASN 83 16.435 1.704 -2.872 668 HD21 ASN 83 HD21 ASN 83 13.970 1.759 -1.246 669 HD22 ASN 83 HD22 ASN 83 14.386 2.639 0.183 670 H GLN 84 H GLN 84 18.217 2.457 -4.878 671 HA GLN 84 HA GLN 84 17.170 2.399 -7.602 672 HB2 GLN 84 HB2 GLN 84 19.330 1.272 -8.149 673 HB3 GLN 84 HB3 GLN 84 19.567 2.786 -7.289 674 HG2 GLN 84 HG2 GLN 84 19.950 1.523 -5.186 675 HG3 GLN 84 HG3 GLN 84 19.767 0.015 -6.078 676 HE21 GLN 84 HE21 GLN 84 21.246 0.553 -8.378 677 HE22 GLN 84 HE22 GLN 84 22.902 0.770 -7.946 678 H SER 85 H SER 85 16.636 0.485 -8.713 679 HA SER 85 HA SER 85 15.136 -1.300 -7.056 680 HB2 SER 85 HB2 SER 85 14.265 -0.359 -9.194 681 HB3 SER 85 HB3 SER 85 15.412 -1.359 -10.058 682 HG SER 85 HG SER 85 13.075 -2.084 -9.529 683 H ASP 86 H ASP 86 15.492 -3.317 -6.536 684 HA ASP 86 HA ASP 86 17.588 -4.943 -7.747 685 HB2 ASP 86 HB2 ASP 86 18.850 -3.748 -6.037 686 HB3 ASP 86 HB3 ASP 86 17.592 -4.012 -4.839 687 HA PRO 87 HA PRO 87 14.089 -7.743 -7.302 688 HB2 PRO 87 HB2 PRO 87 15.510 -10.159 -7.563 689 HB3 PRO 87 HB3 PRO 87 14.984 -9.141 -8.917 690 HG2 PRO 87 HG2 PRO 87 17.666 -9.224 -7.569 691 HG3 PRO 87 HG3 PRO 87 17.280 -9.172 -9.307 692 HD2 PRO 87 HD2 PRO 87 18.039 -6.951 -8.054 693 HD3 PRO 87 HD3 PRO 87 16.717 -6.883 -9.246 694 H THR 88 H THR 88 16.990 -8.183 -5.323 695 HA THR 88 HA THR 88 15.563 -9.847 -3.367 696 HB THR 88 HB THR 88 17.898 -10.070 -2.342 697 HG1 THR 88 HG1 THR 88 18.655 -8.112 -3.611 698 HG21 THR 88 HG21 THR 88 17.581 -10.984 -5.227 699 HG22 THR 88 HG22 THR 88 16.965 -11.830 -3.804 700 HG23 THR 88 HG23 THR 88 18.704 -11.661 -4.043 701 H MET 89 H MET 89 16.284 -6.529 -3.796 702 HA MET 89 HA MET 89 16.743 -5.544 -1.236 703 HB2 MET 89 HB2 MET 89 16.811 -4.043 -3.130 704 HB3 MET 89 HB3 MET 89 15.128 -4.362 -3.531 705 HG2 MET 89 HG2 MET 89 15.452 -2.133 -2.517 706 HG3 MET 89 HG3 MET 89 14.381 -3.145 -1.549 707 HE1 MET 89 HE1 MET 89 16.264 -0.940 1.146 708 HE2 MET 89 HE2 MET 89 14.678 -1.487 0.602 709 HE3 MET 89 HE3 MET 89 15.665 -0.454 -0.438 710 H PHE 90 H PHE 90 13.661 -6.171 -2.839 711 HA PHE 90 HA PHE 90 11.802 -5.425 -0.950 712 HB2 PHE 90 HB2 PHE 90 11.278 -6.052 -3.277 713 HB3 PHE 90 HB3 PHE 90 11.700 -7.724 -2.951 714 HD1 PHE 90 HD1 PHE 90 10.157 -9.177 -1.667 715 HD2 PHE 90 HD2 PHE 90 9.114 -5.123 -2.554 716 HE1 PHE 90 HE1 PHE 90 7.804 -9.667 -1.139 717 HE2 PHE 90 HE2 PHE 90 6.761 -5.619 -2.013 718 HZ PHE 90 HZ PHE 90 6.112 -7.890 -1.314 719 H ASN 91 H ASN 91 13.480 -8.539 -1.261 720 HA ASN 91 HA ASN 91 12.079 -9.875 0.840 721 HB2 ASN 91 HB2 ASN 91 13.177 -11.077 -1.056 722 HB3 ASN 91 HB3 ASN 91 14.752 -10.583 -0.449 723 HD21 ASN 91 HD21 ASN 91 11.969 -12.645 0.139 724 HD22 ASN 91 HD22 ASN 91 12.739 -13.679 1.288 725 H LYS 92 H LYS 92 15.187 -8.145 0.607 726 HA LYS 92 HA LYS 92 16.392 -8.797 3.023 727 HB2 LYS 92 HB2 LYS 92 16.490 -6.146 1.526 728 HB3 LYS 92 HB3 LYS 92 17.554 -6.539 2.875 729 HG2 LYS 92 HG2 LYS 92 18.655 -8.264 1.639 730 HG3 LYS 92 HG3 LYS 92 17.431 -8.235 0.366 731 HD2 LYS 92 HD2 LYS 92 18.163 -5.888 -0.201 732 HD3 LYS 92 HD3 LYS 92 19.469 -6.051 0.976 733 HE2 LYS 92 HE2 LYS 92 20.478 -7.847 -0.318 734 HE3 LYS 92 HE3 LYS 92 19.092 -7.891 -1.413 735 HZ1 LYS 92 HZ1 LYS 92 19.659 -5.739 -2.234 736 HZ2 LYS 92 HZ2 LYS 92 21.036 -6.715 -2.318 737 HZ3 LYS 92 HZ3 LYS 92 20.892 -5.554 -1.097 738 H ILE 93 H ILE 93 14.197 -5.969 2.458 739 HA ILE 93 HA ILE 93 14.274 -5.332 5.300 740 HB ILE 93 HB ILE 93 12.855 -3.447 4.898 741 HG12 ILE 93 HG12 ILE 93 11.328 -4.684 3.155 742 HG13 ILE 93 HG13 ILE 93 11.571 -2.960 2.989 743 HG21 ILE 93 HG21 ILE 93 14.180 -2.190 3.212 744 HG22 ILE 93 HG22 ILE 93 14.895 -3.707 2.657 745 HG23 ILE 93 HG23 ILE 93 15.195 -3.138 4.300 746 HD11 ILE 93 HD11 ILE 93 11.598 -4.084 0.858 747 HD12 ILE 93 HD12 ILE 93 12.954 -5.083 1.378 748 HD13 ILE 93 HD13 ILE 93 13.159 -3.337 1.196 749 H ALA 94 H ALA 94 12.084 -7.084 3.161 750 HA ALA 94 HA ALA 94 9.790 -7.163 4.803 751 HB1 ALA 94 HB1 ALA 94 9.130 -9.149 3.509 752 HB2 ALA 94 HB2 ALA 94 10.767 -9.276 2.853 753 HB3 ALA 94 HB3 ALA 94 9.765 -7.881 2.457 754 H VAL 95 H VAL 95 12.640 -9.301 4.684 755 HA VAL 95 HA VAL 95 11.706 -11.027 6.812 756 HB VAL 95 HB VAL 95 13.153 -11.857 4.912 757 HG11 VAL 95 HG11 VAL 95 15.591 -11.513 4.961 758 HG12 VAL 95 HG12 VAL 95 15.416 -10.394 6.314 759 HG13 VAL 95 HG13 VAL 95 14.734 -9.986 4.740 760 HG21 VAL 95 HG21 VAL 95 12.912 -13.213 6.945 761 HG22 VAL 95 HG22 VAL 95 14.264 -12.368 7.700 762 HG23 VAL 95 HG23 VAL 95 14.541 -13.389 6.287 763 H PHE 96 H PHE 96 13.570 -8.087 6.600 764 HA PHE 96 HA PHE 96 14.824 -8.276 9.189 765 HB2 PHE 96 HB2 PHE 96 15.721 -6.881 7.298 766 HB3 PHE 96 HB3 PHE 96 14.362 -5.781 7.501 767 HD1 PHE 96 HD2 PHE 96 16.955 -7.427 9.697 768 HD2 PHE 96 HD1 PHE 96 14.893 -3.807 8.700 769 HE1 PHE 96 HE2 PHE 96 18.262 -6.209 11.382 770 HE2 PHE 96 HE1 PHE 96 16.207 -2.601 10.395 771 HZ PHE 96 HZ PHE 96 17.894 -3.798 11.736 772 H PHE 97 H PHE 97 11.802 -7.039 7.939 773 HA PHE 97 HA PHE 97 10.003 -5.996 8.776 774 HB2 PHE 97 HB2 PHE 97 8.897 -7.210 10.679 775 HB3 PHE 97 HB3 PHE 97 9.441 -8.242 9.374 776 HD1 PHE 97 HD2 PHE 97 10.134 -7.238 12.908 777 HD2 PHE 97 HD1 PHE 97 11.037 -10.019 9.785 778 HE1 PHE 97 HE2 PHE 97 11.269 -8.698 14.528 779 HE2 PHE 97 HE1 PHE 97 12.164 -11.475 11.421 780 HZ PHE 97 HZ PHE 97 12.280 -10.814 13.789 781 H GLN 98 H GLN 98 12.022 -4.276 9.302 782 HA GLN 98 HA GLN 98 10.918 -2.923 11.692 783 HB2 GLN 98 HB2 GLN 98 13.239 -3.791 12.196 784 HB3 GLN 98 HB3 GLN 98 13.859 -2.822 10.868 785 HG2 GLN 98 HG2 GLN 98 14.288 -1.693 12.977 786 HG3 GLN 98 HG3 GLN 98 13.124 -0.764 12.036 787 HE21 GLN 98 HE21 GLN 98 13.532 -2.875 14.801 788 HE22 GLN 98 HE22 GLN 98 12.083 -2.422 15.615 789 H1 GLY 1 H1 GLY 1 -5.380 5.243 19.146 790 H2 GLY 1 H2 GLY 1 -5.153 6.048 20.609 791 H3 GLY 1 H3 GLY 1 -6.526 6.363 19.680 792 HA2 GLY 1 HA3 GLY 1 -7.086 4.969 21.552 793 HA3 GLY 1 HA2 GLY 1 -7.334 4.131 20.026 794 H SER 2 H SER 2 -6.218 3.657 23.061 795 HA SER 2 HA SER 2 -3.888 2.057 22.578 796 HB2 SER 2 HB2 SER 2 -4.216 1.351 24.970 797 HB3 SER 2 HB3 SER 2 -4.178 3.100 24.756 798 HG SER 2 HG SER 2 -6.490 1.473 25.078 799 H MET 3 H MET 3 -4.103 0.314 21.348 800 HA MET 3 HA MET 3 -6.365 -1.579 21.681 801 HB2 MET 3 HB2 MET 3 -4.565 -1.077 19.259 802 HB3 MET 3 HB3 MET 3 -5.894 -2.228 19.317 803 HG2 MET 3 HG2 MET 3 -7.526 -0.506 19.359 804 HG3 MET 3 HG3 MET 3 -6.337 0.724 19.785 805 HE1 MET 3 HE1 MET 3 -3.932 0.044 17.711 806 HE2 MET 3 HE2 MET 3 -4.503 1.673 18.080 807 HE3 MET 3 HE3 MET 3 -4.366 1.143 16.404 808 H GLN 4 H GLN 4 -5.275 -3.821 20.489 809 HA GLN 4 HA GLN 4 -3.180 -4.608 22.369 810 HB2 GLN 4 HB2 GLN 4 -4.706 -6.202 20.270 811 HB3 GLN 4 HB3 GLN 4 -3.494 -6.888 21.345 812 HG2 GLN 4 HG2 GLN 4 -6.069 -5.569 22.249 813 HG3 GLN 4 HG3 GLN 4 -5.811 -7.308 22.113 814 HE21 GLN 4 HE21 GLN 4 -4.386 -8.326 23.589 815 HE22 GLN 4 HE22 GLN 4 -3.956 -7.586 25.091 816 H ASN 5 H ASN 5 -1.108 -4.414 21.891 817 HA ASN 5 HA ASN 5 -0.040 -3.807 19.307 818 HB2 ASN 5 HB2 ASN 5 2.177 -4.026 20.405 819 HB3 ASN 5 HB3 ASN 5 1.080 -3.029 21.352 820 HD21 ASN 5 HD21 ASN 5 3.466 -4.483 22.202 821 HD22 ASN 5 HD22 ASN 5 2.955 -5.534 23.473 822 H THR 6 H THR 6 -0.932 -6.719 20.822 823 HA THR 6 HA THR 6 0.586 -8.759 19.789 824 HB THR 6 HB THR 6 -2.473 -8.728 19.982 825 HG1 THR 6 HG1 THR 6 -0.455 -8.867 21.959 826 HG21 THR 6 HG21 THR 6 -2.249 -11.114 20.528 827 HG22 THR 6 HG22 THR 6 -0.494 -11.008 20.376 828 HG23 THR 6 HG23 THR 6 -1.518 -10.786 18.953 829 H THR 7 H THR 7 0.843 -9.710 17.746 830 HA THR 7 HA THR 7 0.062 -8.433 15.362 831 HB THR 7 HB THR 7 2.001 -9.953 15.421 832 HG1 THR 7 HG1 THR 7 0.043 -10.052 13.526 833 HG21 THR 7 HG21 THR 7 0.000 -12.232 15.674 834 HG22 THR 7 HG22 THR 7 1.147 -11.725 16.915 835 HG23 THR 7 HG23 THR 7 1.735 -12.414 15.400 836 H HIS 8 H HIS 8 -1.583 -10.792 17.328 837 HA HIS 8 HA HIS 8 -3.593 -11.512 15.362 838 HB2 HIS 8 HB2 HIS 8 -3.322 -12.157 18.330 839 HB3 HIS 8 HB3 HIS 8 -4.554 -12.842 17.268 840 HD1 HIS 8 HD1 HIS 8 -1.405 -13.732 18.652 841 HD2 HIS 8 HD2 HIS 8 -3.119 -14.150 14.890 842 HE1 HIS 8 HE1 HIS 8 -0.093 -15.541 17.506 843 HE2 HIS 8 HE2 HIS 8 -1.145 -15.770 15.237 844 H ASP 9 H ASP 9 -3.231 -8.622 16.628 845 HA ASP 9 HA ASP 9 -6.043 -8.086 17.296 846 HB2 ASP 9 HB2 ASP 9 -4.229 -6.880 18.517 847 HB3 ASP 9 HB3 ASP 9 -3.680 -6.174 17.003 848 H ASN 10 H ASN 10 -3.604 -7.269 14.849 849 HA ASN 10 HA ASN 10 -5.484 -6.053 13.028 850 HB2 ASN 10 HB2 ASN 10 -3.551 -5.900 11.465 851 HB3 ASN 10 HB3 ASN 10 -3.165 -5.240 13.047 852 HD21 ASN 10 HD21 ASN 10 -2.552 -7.879 10.817 853 HD22 ASN 10 HD22 ASN 10 -1.146 -8.482 11.618 854 H VAL 11 H VAL 11 -6.309 -6.941 11.185 855 HA VAL 11 HA VAL 11 -6.198 -9.855 10.842 856 HB VAL 11 HB VAL 11 -8.341 -9.744 9.684 857 HG11 VAL 11 HG11 VAL 11 -8.472 -8.196 12.300 858 HG12 VAL 11 HG12 VAL 11 -8.432 -9.951 12.124 859 HG13 VAL 11 HG13 VAL 11 -9.823 -9.042 11.537 860 HG21 VAL 11 HG21 VAL 11 -8.353 -6.719 10.113 861 HG22 VAL 11 HG22 VAL 11 -9.640 -7.675 9.373 862 HG23 VAL 11 HG23 VAL 11 -8.080 -7.525 8.571 863 H ILE 12 H ILE 12 -6.121 -10.641 8.651 864 HA ILE 12 HA ILE 12 -4.310 -8.942 7.029 865 HB ILE 12 HB ILE 12 -4.494 -11.994 6.998 866 HG12 ILE 12 HG12 ILE 12 -3.964 -11.245 9.315 867 HG13 ILE 12 HG13 ILE 12 -2.646 -12.138 8.580 868 HG21 ILE 12 HG21 ILE 12 -2.250 -10.124 6.185 869 HG22 ILE 12 HG22 ILE 12 -3.314 -11.015 5.096 870 HG23 ILE 12 HG23 ILE 12 -2.193 -11.889 6.140 871 HD11 ILE 12 HD11 ILE 12 -2.798 -9.150 8.953 872 HD12 ILE 12 HD12 ILE 12 -1.465 -10.018 8.185 873 HD13 ILE 12 HD13 ILE 12 -1.829 -10.287 9.888 874 H LEU 13 H LEU 13 -5.994 -7.947 5.809 875 HA LEU 13 HA LEU 13 -7.968 -9.646 4.424 876 HB2 LEU 13 HB2 LEU 13 -7.705 -6.608 4.569 877 HB3 LEU 13 HB3 LEU 13 -9.018 -7.472 3.782 878 HG LEU 13 HG LEU 13 -8.414 -7.559 6.762 879 HD11 LEU 13 HD11 LEU 13 -9.250 -5.361 6.101 880 HD12 LEU 13 HD12 LEU 13 -10.454 -6.228 7.050 881 HD13 LEU 13 HD13 LEU 13 -10.637 -6.103 5.297 882 HD21 LEU 13 HD21 LEU 13 -9.426 -9.654 6.010 883 HD22 LEU 13 HD22 LEU 13 -10.733 -8.772 5.216 884 HD23 LEU 13 HD23 LEU 13 -10.578 -8.731 6.974 885 H GLU 14 H GLU 14 -6.942 -10.603 2.606 886 HA GLU 14 HA GLU 14 -5.493 -8.787 0.810 887 HB2 GLU 14 HB2 GLU 14 -4.677 -10.625 -0.439 888 HB3 GLU 14 HB3 GLU 14 -4.438 -10.997 1.257 889 HG2 GLU 14 HG2 GLU 14 -6.266 -12.586 1.225 890 HG3 GLU 14 HG3 GLU 14 -6.689 -12.131 -0.427 891 H LEU 15 H LEU 15 -6.199 -8.179 -1.122 892 HA LEU 15 HA LEU 15 -8.636 -9.395 -2.217 893 HB2 LEU 15 HB2 LEU 15 -9.095 -6.863 -3.048 894 HB3 LEU 15 HB3 LEU 15 -9.748 -7.515 -1.563 895 HG LEU 15 HG LEU 15 -7.803 -6.423 -0.320 896 HD11 LEU 15 HD11 LEU 15 -6.239 -6.090 -2.160 897 HD12 LEU 15 HD12 LEU 15 -6.614 -4.559 -1.375 898 HD13 LEU 15 HD13 LEU 15 -7.349 -4.954 -2.931 899 HD21 LEU 15 HD21 LEU 15 -8.835 -4.189 -0.302 900 HD22 LEU 15 HD22 LEU 15 -10.047 -5.468 -0.274 901 HD23 LEU 15 HD23 LEU 15 -9.733 -4.586 -1.772 902 H THR 16 H THR 16 -8.369 -10.039 -4.192 903 HA THR 16 HA THR 16 -5.964 -9.402 -5.694 904 HB THR 16 HB THR 16 -8.296 -11.266 -6.370 905 HG1 THR 16 HG1 THR 16 -6.738 -11.811 -4.613 906 HG21 THR 16 HG21 THR 16 -5.637 -10.894 -7.823 907 HG22 THR 16 HG22 THR 16 -7.211 -10.377 -8.434 908 HG23 THR 16 HG23 THR 16 -6.869 -12.096 -8.216 909 H VAL 17 H VAL 17 -6.223 -7.300 -6.241 910 HA VAL 17 HA VAL 17 -8.519 -6.521 -7.913 911 HB VAL 17 HB VAL 17 -7.814 -4.245 -7.655 912 HG11 VAL 17 HG11 VAL 17 -7.644 -5.626 -4.951 913 HG12 VAL 17 HG12 VAL 17 -9.118 -5.129 -5.783 914 HG13 VAL 17 HG13 VAL 17 -7.985 -3.909 -5.204 915 HG21 VAL 17 HG21 VAL 17 -5.383 -4.445 -7.816 916 HG22 VAL 17 HG22 VAL 17 -5.311 -5.236 -6.242 917 HG23 VAL 17 HG23 VAL 17 -5.800 -3.544 -6.356 918 H ARG 18 H ARG 18 -8.193 -5.878 -10.040 919 HA ARG 18 HA ARG 18 -5.523 -6.337 -11.219 920 HB2 ARG 18 HB2 ARG 18 -6.653 -6.130 -13.398 921 HB3 ARG 18 HB3 ARG 18 -7.345 -7.399 -12.403 922 HG2 ARG 18 HG2 ARG 18 -9.212 -5.797 -11.818 923 HG3 ARG 18 HG3 ARG 18 -8.548 -4.694 -13.028 924 HD2 ARG 18 HD2 ARG 18 -9.685 -7.468 -13.471 925 HD3 ARG 18 HD3 ARG 18 -10.315 -5.936 -14.077 926 HE ARG 18 HE ARG 18 -7.683 -6.339 -15.054 927 HH11 ARG 18 HH11 ARG 18 -10.957 -7.549 -15.594 928 HH12 ARG 18 HH12 ARG 18 -10.619 -8.024 -17.228 929 HH21 ARG 18 HH21 ARG 18 -7.244 -7.074 -17.105 930 HH22 ARG 18 HH22 ARG 18 -8.507 -7.757 -18.087 931 H ASN 19 H ASN 19 -4.527 -4.604 -12.506 932 HA ASN 19 HA ASN 19 -4.486 -2.329 -10.750 933 HB2 ASN 19 HB2 ASN 19 -2.437 -3.549 -11.759 934 HB3 ASN 19 HB3 ASN 19 -2.744 -2.638 -13.230 935 HD21 ASN 19 HD21 ASN 19 -0.396 -2.543 -11.422 936 HD22 ASN 19 HD22 ASN 19 -0.273 -0.908 -10.890 937 H HIS 20 H HIS 20 -6.559 -1.528 -11.212 938 HA HIS 20 HA HIS 20 -7.150 0.041 -13.588 939 HB2 HIS 20 HB2 HIS 20 -8.503 -0.317 -10.876 940 HB3 HIS 20 HB3 HIS 20 -9.099 0.850 -12.038 941 HD1 HIS 20 HD1 HIS 20 -10.315 -0.067 -14.115 942 HD2 HIS 20 HD2 HIS 20 -9.117 -2.985 -11.436 943 HE1 HIS 20 HE1 HIS 20 -11.528 -2.144 -14.808 944 HE2 HIS 20 HE2 HIS 20 -10.979 -3.818 -13.019 945 HA PRO 21 HA PRO 21 -5.406 4.055 -12.463 946 HB2 PRO 21 HB2 PRO 21 -8.241 5.139 -12.440 947 HB3 PRO 21 HB3 PRO 21 -6.788 5.791 -13.232 948 HG2 PRO 21 HG2 PRO 21 -8.590 4.514 -14.684 949 HG3 PRO 21 HG3 PRO 21 -6.856 4.221 -14.970 950 HD2 PRO 21 HD2 PRO 21 -8.851 2.483 -13.533 951 HD3 PRO 21 HD3 PRO 21 -7.509 2.017 -14.604 952 H GLY 22 H GLY 22 -4.666 3.644 -10.412 953 HA2 GLY 22 HA2 GLY 22 -4.305 4.165 -8.227 954 HA3 GLY 22 HA3 GLY 22 -5.596 5.345 -8.376 955 H VAL 23 H VAL 23 -5.601 1.739 -8.527 956 HA VAL 23 HA VAL 23 -7.925 1.393 -6.968 957 HB VAL 23 HB VAL 23 -5.657 -0.652 -6.995 958 HG11 VAL 23 HG11 VAL 23 -7.524 -2.272 -6.768 959 HG12 VAL 23 HG12 VAL 23 -8.676 -0.936 -6.742 960 HG13 VAL 23 HG13 VAL 23 -7.500 -1.113 -5.435 961 HG21 VAL 23 HG21 VAL 23 -7.799 -0.317 -9.119 962 HG22 VAL 23 HG22 VAL 23 -6.625 -1.634 -9.023 963 HG23 VAL 23 HG23 VAL 23 -6.078 0.018 -9.323 964 H MET 24 H MET 24 -4.600 1.787 -6.112 965 HA MET 24 HA MET 24 -4.592 0.874 -3.450 966 HB2 MET 24 HB2 MET 24 -2.816 2.937 -4.818 967 HB3 MET 24 HB3 MET 24 -2.446 2.113 -3.304 968 HG2 MET 24 HG2 MET 24 -1.200 1.071 -5.078 969 HG3 MET 24 HG3 MET 24 -2.442 -0.059 -4.540 970 HE1 MET 24 HE1 MET 24 -2.467 -1.620 -6.630 971 HE2 MET 24 HE2 MET 24 -1.034 -0.752 -7.184 972 HE3 MET 24 HE3 MET 24 -2.381 -1.033 -8.288 973 H THR 25 H THR 25 -5.353 4.010 -4.908 974 HA THR 25 HA THR 25 -5.712 5.494 -2.499 975 HB THR 25 HB THR 25 -7.090 6.008 -5.183 976 HG1 THR 25 HG1 THR 25 -5.100 7.425 -5.377 977 HG21 THR 25 HG21 THR 25 -6.196 7.924 -2.989 978 HG22 THR 25 HG22 THR 25 -7.869 7.460 -3.319 979 HG23 THR 25 HG23 THR 25 -6.955 8.382 -4.515 980 H HIS 26 H HIS 26 -7.808 3.432 -4.476 981 HA HIS 26 HA HIS 26 -10.313 4.076 -3.295 982 HB2 HIS 26 HB2 HIS 26 -9.562 1.446 -4.658 983 HB3 HIS 26 HB3 HIS 26 -11.193 2.050 -4.387 984 HD1 HIS 26 HD1 HIS 26 -10.294 1.304 -7.220 985 HD2 HIS 26 HD2 HIS 26 -9.976 5.143 -5.673 986 HE1 HIS 26 HE1 HIS 26 -10.164 2.825 -9.210 987 HE2 HIS 26 HE2 HIS 26 -9.795 5.114 -8.244 988 H VAL 27 H VAL 27 -8.078 1.307 -2.754 989 HA VAL 27 HA VAL 27 -9.652 -0.004 -0.838 990 HB VAL 27 HB VAL 27 -7.728 -1.408 -0.309 991 HG11 VAL 27 HG11 VAL 27 -7.773 -0.762 -3.281 992 HG12 VAL 27 HG12 VAL 27 -8.846 -1.877 -2.436 993 HG13 VAL 27 HG13 VAL 27 -7.128 -2.242 -2.565 994 HG21 VAL 27 HG21 VAL 27 -5.970 0.549 -1.842 995 HG22 VAL 27 HG22 VAL 27 -5.449 -1.011 -1.197 996 HG23 VAL 27 HG23 VAL 27 -5.947 0.276 -0.098 997 H CYS 28 H CYS 28 -6.967 2.280 -0.458 998 HA CYS 28 HA CYS 28 -6.839 2.276 2.358 999 HB2 CYS 28 HB2 CYS 28 -5.927 4.334 0.318 1000 HB3 CYS 28 HB3 CYS 28 -5.439 4.316 2.012 1001 HG CYS 28 HG CYS 28 -3.864 3.011 -0.376 1002 H GLY 29 H GLY 29 -8.801 4.064 0.055 1003 HA2 GLY 29 HA2 GLY 29 -9.860 6.075 1.724 1004 HA3 GLY 29 HA3 GLY 29 -10.634 5.412 0.292 1005 H LEU 30 H LEU 30 -10.885 2.715 1.136 1006 HA LEU 30 HA LEU 30 -13.342 2.858 2.561 1007 HB2 LEU 30 HB2 LEU 30 -11.680 0.599 1.471 1008 HB3 LEU 30 HB3 LEU 30 -12.924 0.203 2.639 1009 HG LEU 30 HG LEU 30 -13.827 -0.153 0.438 1010 HD11 LEU 30 HD11 LEU 30 -15.042 2.391 1.549 1011 HD12 LEU 30 HD12 LEU 30 -15.396 0.746 2.079 1012 HD13 LEU 30 HD13 LEU 30 -15.819 1.248 0.447 1013 HD21 LEU 30 HD21 LEU 30 -13.141 2.713 -0.277 1014 HD22 LEU 30 HD22 LEU 30 -14.044 1.574 -1.283 1015 HD23 LEU 30 HD23 LEU 30 -12.353 1.261 -0.902 1016 H PHE 31 H PHE 31 -10.058 1.988 3.571 1017 HA PHE 31 HA PHE 31 -10.877 1.102 6.212 1018 HB2 PHE 31 HB2 PHE 31 -8.097 1.632 5.072 1019 HB3 PHE 31 HB3 PHE 31 -8.415 0.915 6.653 1020 HD1 PHE 31 HD2 PHE 31 -9.793 -1.277 6.730 1021 HD2 PHE 31 HD1 PHE 31 -8.028 0.216 3.139 1022 HE1 PHE 31 HE2 PHE 31 -9.992 -3.497 5.693 1023 HE2 PHE 31 HE1 PHE 31 -8.250 -2.006 2.109 1024 HZ PHE 31 HZ PHE 31 -9.232 -3.866 3.387 1025 H ALA 32 H ALA 32 -9.577 4.049 4.804 1026 HA ALA 32 HA ALA 32 -8.918 5.426 7.197 1027 HB1 ALA 32 HB1 ALA 32 -8.017 6.055 4.991 1028 HB2 ALA 32 HB2 ALA 32 -8.793 7.428 5.780 1029 HB3 ALA 32 HB3 ALA 32 -9.624 6.572 4.473 1030 H ARG 33 H ARG 33 -11.909 5.248 5.288 1031 HA ARG 33 HA ARG 33 -13.207 7.497 6.499 1032 HB2 ARG 33 HB2 ARG 33 -15.179 6.828 5.220 1033 HB3 ARG 33 HB3 ARG 33 -13.736 6.704 4.218 1034 HG2 ARG 33 HG2 ARG 33 -13.696 4.242 4.622 1035 HG3 ARG 33 HG3 ARG 33 -15.200 4.394 5.536 1036 HD2 ARG 33 HD2 ARG 33 -14.835 5.141 2.619 1037 HD3 ARG 33 HD3 ARG 33 -15.579 3.649 3.204 1038 HE ARG 33 HE ARG 33 -17.110 5.436 4.420 1039 HH11 ARG 33 HH11 ARG 33 -16.035 5.435 1.070 1040 HH12 ARG 33 HH12 ARG 33 -17.445 6.277 0.502 1041 HH21 ARG 33 HH21 ARG 33 -18.944 6.516 3.672 1042 HH22 ARG 33 HH22 ARG 33 -19.100 6.891 1.981 1043 H ARG 34 H ARG 34 -12.671 4.413 7.726 1044 HA ARG 34 HA ARG 34 -14.984 4.177 9.433 1045 HB2 ARG 34 HB2 ARG 34 -13.734 2.165 8.874 1046 HB3 ARG 34 HB3 ARG 34 -12.222 2.885 9.411 1047 HG2 ARG 34 HG2 ARG 34 -13.241 2.908 11.779 1048 HG3 ARG 34 HG3 ARG 34 -14.513 1.868 11.128 1049 HD2 ARG 34 HD2 ARG 34 -12.905 0.170 10.529 1050 HD3 ARG 34 HD3 ARG 34 -11.553 1.236 10.923 1051 HE ARG 34 HE ARG 34 -13.371 0.575 13.111 1052 HH11 ARG 34 HH11 ARG 34 -10.327 -0.134 11.499 1053 HH12 ARG 34 HH12 ARG 34 -9.662 -0.982 12.856 1054 HH21 ARG 34 HH21 ARG 34 -12.528 -0.599 14.854 1055 HH22 ARG 34 HH22 ARG 34 -10.913 -1.249 14.773 1056 H ALA 35 H ALA 35 -11.556 4.583 10.306 1057 HA ALA 35 HA ALA 35 -11.583 6.939 11.750 1058 HB1 ALA 35 HB1 ALA 35 -13.256 5.904 13.253 1059 HB2 ALA 35 HB2 ALA 35 -11.744 6.199 14.115 1060 HB3 ALA 35 HB3 ALA 35 -12.158 4.565 13.580 1061 H PHE 36 H PHE 36 -10.557 3.549 12.170 1062 HA PHE 36 HA PHE 36 -7.792 4.352 12.718 1063 HB2 PHE 36 HB2 PHE 36 -8.760 2.601 14.155 1064 HB3 PHE 36 HB3 PHE 36 -9.124 1.604 12.749 1065 HD1 PHE 36 HD2 PHE 36 -6.051 3.436 13.999 1066 HD2 PHE 36 HD1 PHE 36 -7.707 -0.260 12.619 1067 HE1 PHE 36 HE2 PHE 36 -3.845 2.364 14.197 1068 HE2 PHE 36 HE1 PHE 36 -5.498 -1.320 12.816 1069 HZ PHE 36 HZ PHE 36 -3.564 -0.012 13.609 1070 H ASN 37 H ASN 37 -6.136 4.012 11.368 1071 HA ASN 37 HA ASN 37 -6.663 3.572 8.533 1072 HB2 ASN 37 HB2 ASN 37 -4.063 4.301 9.968 1073 HB3 ASN 37 HB3 ASN 37 -4.378 4.442 8.239 1074 HD21 ASN 37 HD21 ASN 37 -3.744 6.372 10.536 1075 HD22 ASN 37 HD22 ASN 37 -4.879 7.653 10.311 1076 H VAL 38 H VAL 38 -4.876 2.296 7.338 1077 HA VAL 38 HA VAL 38 -4.457 -0.326 8.487 1078 HB VAL 38 HB VAL 38 -3.213 0.775 5.913 1079 HG11 VAL 38 HG11 VAL 38 -2.185 -1.309 6.735 1080 HG12 VAL 38 HG12 VAL 38 -3.081 -1.606 5.245 1081 HG13 VAL 38 HG13 VAL 38 -3.771 -2.084 6.798 1082 HG21 VAL 38 HG21 VAL 38 -5.104 -0.225 4.675 1083 HG22 VAL 38 HG22 VAL 38 -5.664 1.035 5.777 1084 HG23 VAL 38 HG23 VAL 38 -5.880 -0.664 6.200 1085 H GLU 39 H GLU 39 -2.519 -1.135 9.295 1086 HA GLU 39 HA GLU 39 -0.485 0.857 10.030 1087 HB2 GLU 39 HB2 GLU 39 -1.636 -0.613 11.769 1088 HB3 GLU 39 HB3 GLU 39 -0.792 -1.993 11.074 1089 HG2 GLU 39 HG2 GLU 39 0.350 -1.183 13.083 1090 HG3 GLU 39 HG3 GLU 39 1.374 -0.972 11.663 1091 H GLY 40 H GLY 40 -0.859 -2.258 8.372 1092 HA2 GLY 40 HA2 GLY 40 1.830 -1.946 7.142 1093 HA3 GLY 40 HA3 GLY 40 1.358 -3.476 7.876 1094 H ILE 41 H ILE 41 1.942 -2.551 5.009 1095 HA ILE 41 HA ILE 41 -0.447 -3.759 3.711 1096 HB ILE 41 HB ILE 41 1.146 -1.358 2.669 1097 HG12 ILE 41 HG12 ILE 41 -1.760 -1.512 3.584 1098 HG13 ILE 41 HG13 ILE 41 -0.454 -0.690 4.428 1099 HG21 ILE 41 HG21 ILE 41 -0.370 -1.318 0.737 1100 HG22 ILE 41 HG22 ILE 41 -1.180 -2.767 1.328 1101 HG23 ILE 41 HG23 ILE 41 0.505 -2.850 0.817 1102 HD11 ILE 41 HD11 ILE 41 -1.587 0.063 1.736 1103 HD12 ILE 41 HD12 ILE 41 -0.250 0.880 2.551 1104 HD13 ILE 41 HD13 ILE 41 -1.859 0.886 3.271 1105 H LEU 42 H LEU 42 0.027 -5.138 2.015 1106 HA LEU 42 HA LEU 42 2.766 -5.330 0.991 1107 HB2 LEU 42 HB2 LEU 42 2.629 -6.960 2.853 1108 HB3 LEU 42 HB3 LEU 42 1.215 -7.707 2.123 1109 HG LEU 42 HG LEU 42 2.538 -8.590 0.279 1110 HD11 LEU 42 HD11 LEU 42 4.901 -7.065 1.412 1111 HD12 LEU 42 HD12 LEU 42 4.043 -6.704 -0.088 1112 HD13 LEU 42 HD13 LEU 42 4.956 -8.203 0.063 1113 HD21 LEU 42 HD21 LEU 42 4.087 -10.082 1.474 1114 HD22 LEU 42 HD22 LEU 42 2.569 -9.909 2.351 1115 HD23 LEU 42 HD23 LEU 42 4.007 -9.043 2.902 1116 H CYS 43 H CYS 43 2.029 -4.482 -0.942 1117 HA CYS 43 HA CYS 43 -0.085 -5.840 -2.461 1118 HB2 CYS 43 HB2 CYS 43 0.013 -3.381 -2.544 1119 HB3 CYS 43 HB3 CYS 43 1.660 -3.448 -3.151 1120 HG CYS 43 HG CYS 43 -0.868 -4.877 -4.926 1121 H LEU 44 H LEU 44 0.586 -7.733 -3.224 1122 HA LEU 44 HA LEU 44 3.308 -8.105 -4.296 1123 HB2 LEU 44 HB2 LEU 44 2.179 -9.580 -2.452 1124 HB3 LEU 44 HB3 LEU 44 1.252 -10.265 -3.770 1125 HG LEU 44 HG LEU 44 3.441 -10.975 -4.838 1126 HD11 LEU 44 HD11 LEU 44 4.946 -9.373 -3.743 1127 HD12 LEU 44 HD12 LEU 44 5.463 -11.026 -3.429 1128 HD13 LEU 44 HD13 LEU 44 4.621 -10.116 -2.173 1129 HD21 LEU 44 HD21 LEU 44 2.871 -12.073 -2.061 1130 HD22 LEU 44 HD22 LEU 44 3.775 -12.894 -3.336 1131 HD23 LEU 44 HD23 LEU 44 2.060 -12.555 -3.555 1132 HA PRO 45 HA PRO 45 0.910 -7.659 -8.188 1133 HB2 PRO 45 HB2 PRO 45 3.044 -7.249 -9.873 1134 HB3 PRO 45 HB3 PRO 45 2.387 -5.980 -8.822 1135 HG2 PRO 45 HG2 PRO 45 4.801 -7.706 -8.392 1136 HG3 PRO 45 HG3 PRO 45 4.597 -5.964 -8.100 1137 HD2 PRO 45 HD2 PRO 45 4.453 -7.814 -6.094 1138 HD3 PRO 45 HD3 PRO 45 3.542 -6.289 -6.060 1139 H ILE 46 H ILE 46 0.083 -9.408 -9.098 1140 HA ILE 46 HA ILE 46 1.338 -11.948 -9.398 1141 HB ILE 46 HB ILE 46 -1.136 -10.844 -10.813 1142 HG12 ILE 46 HG12 ILE 46 -1.369 -10.721 -8.333 1143 HG13 ILE 46 HG13 ILE 46 -2.497 -11.863 -9.046 1144 HG21 ILE 46 HG21 ILE 46 -0.297 -12.856 -11.926 1145 HG22 ILE 46 HG22 ILE 46 -1.818 -13.198 -11.104 1146 HG23 ILE 46 HG23 ILE 46 -0.295 -13.733 -10.392 1147 HD11 ILE 46 HD11 ILE 46 -1.574 -12.658 -6.954 1148 HD12 ILE 46 HD12 ILE 46 0.058 -12.585 -7.620 1149 HD13 ILE 46 HD13 ILE 46 -1.122 -13.717 -8.291 1150 H GLN 47 H GLN 47 2.816 -12.484 -10.943 1151 HA GLN 47 HA GLN 47 3.455 -10.687 -13.131 1152 HB2 GLN 47 HB2 GLN 47 5.342 -12.157 -13.582 1153 HB3 GLN 47 HB3 GLN 47 5.226 -11.882 -11.854 1154 HG2 GLN 47 HG2 GLN 47 4.115 -14.114 -11.619 1155 HG3 GLN 47 HG3 GLN 47 4.401 -14.389 -13.334 1156 HE21 GLN 47 HE21 GLN 47 5.925 -14.078 -10.191 1157 HE22 GLN 47 HE22 GLN 47 7.433 -14.787 -10.640 1158 H ASP 48 H ASP 48 1.493 -13.453 -12.681 1159 HA ASP 48 HA ASP 48 1.630 -14.678 -15.220 1160 HB2 ASP 48 HB2 ASP 48 0.843 -15.889 -13.257 1161 HB3 ASP 48 HB3 ASP 48 -0.484 -14.760 -13.026 1162 H SER 49 H SER 49 -0.504 -12.177 -13.890 1163 HA SER 49 HA SER 49 -1.470 -11.405 -16.551 1164 HB2 SER 49 HB2 SER 49 -3.382 -12.226 -14.305 1165 HB3 SER 49 HB3 SER 49 -3.869 -11.483 -15.830 1166 HG SER 49 HG SER 49 -2.602 -14.005 -15.494 1167 H ASP 50 H ASP 50 -3.044 -9.373 -16.206 1168 HA ASP 50 HA ASP 50 -1.704 -7.464 -14.515 1169 HB2 ASP 50 HB2 ASP 50 -3.297 -5.801 -15.361 1170 HB3 ASP 50 HB3 ASP 50 -2.659 -6.746 -16.693 1171 H LYS 51 H LYS 51 -1.920 -8.555 -12.538 1172 HA LYS 51 HA LYS 51 -4.362 -7.994 -11.025 1173 HB2 LYS 51 HB2 LYS 51 -3.100 -10.784 -11.118 1174 HB3 LYS 51 HB3 LYS 51 -4.348 -10.294 -9.989 1175 HG2 LYS 51 HG2 LYS 51 -4.714 -10.432 -12.998 1176 HG3 LYS 51 HG3 LYS 51 -5.168 -11.712 -11.870 1177 HD2 LYS 51 HD2 LYS 51 -6.811 -10.266 -10.805 1178 HD3 LYS 51 HD3 LYS 51 -6.286 -8.884 -11.773 1179 HE2 LYS 51 HE2 LYS 51 -8.371 -9.810 -12.664 1180 HE3 LYS 51 HE3 LYS 51 -7.061 -10.038 -13.824 1181 HZ1 LYS 51 HZ1 LYS 51 -8.054 -12.122 -11.950 1182 HZ2 LYS 51 HZ2 LYS 51 -6.870 -12.326 -13.135 1183 HZ3 LYS 51 HZ3 LYS 51 -8.464 -12.013 -13.587 1184 H SER 52 H SER 52 -3.954 -8.095 -8.721 1185 HA SER 52 HA SER 52 -1.327 -8.503 -7.633 1186 HB2 SER 52 HB2 SER 52 -1.168 -6.147 -8.573 1187 HB3 SER 52 HB3 SER 52 -2.492 -5.670 -7.510 1188 HG SER 52 HG SER 52 -0.035 -5.538 -6.894 1189 H HIS 53 H HIS 53 -1.706 -9.374 -5.612 1190 HA HIS 53 HA HIS 53 -4.271 -8.713 -4.293 1191 HB2 HIS 53 HB2 HIS 53 -3.987 -10.799 -2.928 1192 HB3 HIS 53 HB3 HIS 53 -4.271 -11.052 -4.639 1193 HD1 HIS 53 HD1 HIS 53 -3.275 -13.385 -3.207 1194 HD2 HIS 53 HD2 HIS 53 -0.644 -10.580 -4.781 1195 HE1 HIS 53 HE1 HIS 53 -1.109 -14.607 -3.574 1196 HE2 HIS 53 HE2 HIS 53 0.416 -12.915 -4.609 1197 H ILE 54 H ILE 54 -4.302 -7.580 -2.482 1198 HA ILE 54 HA ILE 54 -1.696 -6.782 -1.299 1199 HB ILE 54 HB ILE 54 -4.263 -5.108 -1.389 1200 HG12 ILE 54 HG12 ILE 54 -2.819 -3.569 -2.932 1201 HG13 ILE 54 HG13 ILE 54 -1.811 -4.983 -3.186 1202 HG21 ILE 54 HG21 ILE 54 -2.869 -4.594 0.557 1203 HG22 ILE 54 HG22 ILE 54 -2.832 -3.253 -0.587 1204 HG23 ILE 54 HG23 ILE 54 -1.460 -4.358 -0.484 1205 HD11 ILE 54 HD11 ILE 54 -4.728 -4.734 -3.868 1206 HD12 ILE 54 HD12 ILE 54 -3.721 -6.159 -4.141 1207 HD13 ILE 54 HD13 ILE 54 -3.371 -4.654 -4.990 1208 H TRP 55 H TRP 55 -1.434 -7.512 0.792 1209 HA TRP 55 HA TRP 55 -3.767 -8.225 2.435 1210 HB2 TRP 55 HB2 TRP 55 -0.772 -8.481 3.016 1211 HB3 TRP 55 HB3 TRP 55 -2.055 -9.025 4.099 1212 HD1 TRP 55 HD1 TRP 55 -3.136 -11.413 3.577 1213 HE1 TRP 55 HE1 TRP 55 -2.687 -13.230 1.822 1214 HE3 TRP 55 HE3 TRP 55 -0.005 -8.824 0.549 1215 HZ2 TRP 55 HZ2 TRP 55 -1.186 -13.520 -0.545 1216 HZ3 TRP 55 HZ3 TRP 55 0.890 -9.917 -1.431 1217 HH2 TRP 55 HH2 TRP 55 0.319 -12.221 -1.980 1218 H LEU 56 H LEU 56 -4.737 -6.561 3.426 1219 HA LEU 56 HA LEU 56 -3.235 -4.254 4.438 1220 HB2 LEU 56 HB2 LEU 56 -6.238 -4.770 4.290 1221 HB3 LEU 56 HB3 LEU 56 -5.516 -3.326 4.975 1222 HG LEU 56 HG LEU 56 -6.248 -2.694 2.823 1223 HD11 LEU 56 HD11 LEU 56 -4.044 -1.815 3.339 1224 HD12 LEU 56 HD12 LEU 56 -4.239 -2.045 1.604 1225 HD13 LEU 56 HD13 LEU 56 -3.278 -3.192 2.540 1226 HD21 LEU 56 HD21 LEU 56 -5.764 -3.869 0.720 1227 HD22 LEU 56 HD22 LEU 56 -6.661 -4.891 1.840 1228 HD23 LEU 56 HD23 LEU 56 -4.928 -5.144 1.616 1229 H LEU 57 H LEU 57 -2.410 -4.488 6.382 1230 HA LEU 57 HA LEU 57 -3.532 -6.179 8.472 1231 HB2 LEU 57 HB2 LEU 57 -0.952 -4.617 8.176 1232 HB3 LEU 57 HB3 LEU 57 -1.454 -5.190 9.755 1233 HG LEU 57 HG LEU 57 -1.301 -7.509 9.041 1234 HD11 LEU 57 HD11 LEU 57 -0.585 -6.491 6.278 1235 HD12 LEU 57 HD12 LEU 57 -2.044 -7.378 6.746 1236 HD13 LEU 57 HD13 LEU 57 -0.472 -8.173 6.815 1237 HD21 LEU 57 HD21 LEU 57 1.125 -7.663 8.680 1238 HD22 LEU 57 HD22 LEU 57 0.725 -6.447 9.892 1239 HD23 LEU 57 HD23 LEU 57 1.178 -5.947 8.260 1240 H VAL 58 H VAL 58 -5.361 -5.178 9.064 1241 HA VAL 58 HA VAL 58 -5.176 -2.696 10.643 1242 HB VAL 58 HB VAL 58 -6.063 -2.150 8.322 1243 HG11 VAL 58 HG11 VAL 58 -8.299 -2.870 7.606 1244 HG12 VAL 58 HG12 VAL 58 -8.409 -3.927 9.015 1245 HG13 VAL 58 HG13 VAL 58 -7.193 -4.237 7.773 1246 HG21 VAL 58 HG21 VAL 58 -8.093 -1.749 10.547 1247 HG22 VAL 58 HG22 VAL 58 -8.021 -0.819 9.046 1248 HG23 VAL 58 HG23 VAL 58 -6.704 -0.710 10.211 1249 H ASN 59 H ASN 59 -6.588 -2.872 12.534 1250 HA ASN 59 HA ASN 59 -7.725 -5.485 13.005 1251 HB2 ASN 59 HB2 ASN 59 -8.616 -4.500 15.134 1252 HB3 ASN 59 HB3 ASN 59 -6.877 -4.373 14.938 1253 HD21 ASN 59 HD21 ASN 59 -6.409 -2.649 16.143 1254 HD22 ASN 59 HD22 ASN 59 -7.097 -1.076 15.948 1255 H ASP 60 H ASP 60 -9.724 -6.203 12.470 1256 HA ASP 60 HA ASP 60 -11.392 -4.559 10.839 1257 HB2 ASP 60 HB2 ASP 60 -12.619 -6.469 10.265 1258 HB3 ASP 60 HB3 ASP 60 -11.028 -7.135 10.589 1259 H ASP 61 H ASP 61 -13.789 -4.686 11.187 1260 HA ASP 61 HA ASP 61 -14.673 -4.089 13.906 1261 HB2 ASP 61 HB2 ASP 61 -13.608 -1.998 12.616 1262 HB3 ASP 61 HB3 ASP 61 -15.109 -2.008 11.718 1263 H GLN 62 H GLN 62 -17.080 -3.899 13.913 1264 HA GLN 62 HA GLN 62 -18.484 -5.544 12.066 1265 HB2 GLN 62 HB2 GLN 62 -19.575 -3.426 13.972 1266 HB3 GLN 62 HB3 GLN 62 -20.549 -4.641 13.149 1267 HG2 GLN 62 HG2 GLN 62 -18.398 -5.181 15.225 1268 HG3 GLN 62 HG3 GLN 62 -20.136 -5.271 15.483 1269 HE21 GLN 62 HE21 GLN 62 -17.383 -6.819 14.016 1270 HE22 GLN 62 HE22 GLN 62 -18.140 -8.334 13.682 1271 H ARG 63 H ARG 63 -17.735 -2.131 12.168 1272 HA ARG 63 HA ARG 63 -19.389 -1.271 9.984 1273 HB2 ARG 63 HB2 ARG 63 -18.317 0.159 11.895 1274 HB3 ARG 63 HB3 ARG 63 -16.850 0.132 10.929 1275 HG2 ARG 63 HG2 ARG 63 -17.951 2.180 10.419 1276 HG3 ARG 63 HG3 ARG 63 -18.231 1.130 9.024 1277 HD2 ARG 63 HD2 ARG 63 -20.294 2.304 9.613 1278 HD3 ARG 63 HD3 ARG 63 -20.491 0.577 9.935 1279 HE ARG 63 HE ARG 63 -19.717 2.415 12.106 1280 HH11 ARG 63 HH11 ARG 63 -22.125 0.194 10.855 1281 HH12 ARG 63 HH12 ARG 63 -23.017 0.139 12.341 1282 HH21 ARG 63 HH21 ARG 63 -20.858 2.305 14.037 1283 HH22 ARG 63 HH22 ARG 63 -22.298 1.337 14.142 1284 H LEU 64 H LEU 64 -16.076 -2.388 10.372 1285 HA LEU 64 HA LEU 64 -14.857 -1.642 7.965 1286 HB2 LEU 64 HB2 LEU 64 -13.956 -2.779 10.208 1287 HB3 LEU 64 HB3 LEU 64 -14.195 -4.265 9.340 1288 HG LEU 64 HG LEU 64 -11.894 -3.788 9.198 1289 HD11 LEU 64 HD11 LEU 64 -11.347 -3.463 6.881 1290 HD12 LEU 64 HD12 LEU 64 -12.967 -2.846 6.554 1291 HD13 LEU 64 HD13 LEU 64 -12.744 -4.519 7.068 1292 HD21 LEU 64 HD21 LEU 64 -11.861 -1.510 9.961 1293 HD22 LEU 64 HD22 LEU 64 -12.493 -0.930 8.416 1294 HD23 LEU 64 HD23 LEU 64 -10.888 -1.665 8.501 1295 H GLU 65 H GLU 65 -16.757 -4.492 8.840 1296 HA GLU 65 HA GLU 65 -16.380 -6.122 6.593 1297 HB2 GLU 65 HB2 GLU 65 -18.800 -5.910 8.428 1298 HB3 GLU 65 HB3 GLU 65 -18.461 -7.261 7.344 1299 HG2 GLU 65 HG2 GLU 65 -16.364 -7.716 8.594 1300 HG3 GLU 65 HG3 GLU 65 -16.750 -6.401 9.700 1301 H GLN 66 H GLN 66 -18.602 -3.449 7.115 1302 HA GLN 66 HA GLN 66 -20.189 -3.834 4.752 1303 HB2 GLN 66 HB2 GLN 66 -19.792 -1.325 6.439 1304 HB3 GLN 66 HB3 GLN 66 -21.042 -1.550 5.219 1305 HG2 GLN 66 HG2 GLN 66 -20.773 -3.042 7.840 1306 HG3 GLN 66 HG3 GLN 66 -22.000 -1.850 7.414 1307 HE21 GLN 66 HE21 GLN 66 -23.640 -2.451 5.921 1308 HE22 GLN 66 HE22 GLN 66 -24.015 -4.107 5.608 1309 H MET 67 H MET 67 -17.314 -1.935 5.574 1310 HA MET 67 HA MET 67 -16.994 -0.623 3.075 1311 HB2 MET 67 HB2 MET 67 -15.069 -1.245 5.337 1312 HB3 MET 67 HB3 MET 67 -14.501 -0.481 3.856 1313 HG2 MET 67 HG2 MET 67 -14.898 1.179 5.579 1314 HG3 MET 67 HG3 MET 67 -16.023 1.408 4.239 1315 HE1 MET 67 HE1 MET 67 -18.056 2.557 7.408 1316 HE2 MET 67 HE2 MET 67 -17.485 3.029 5.807 1317 HE3 MET 67 HE3 MET 67 -16.330 2.771 7.116 1318 H ILE 68 H ILE 68 -15.872 -3.773 4.298 1319 HA ILE 68 HA ILE 68 -14.249 -4.542 2.090 1320 HB ILE 68 HB ILE 68 -15.815 -6.366 3.994 1321 HG12 ILE 68 HG12 ILE 68 -12.886 -5.517 4.222 1322 HG13 ILE 68 HG13 ILE 68 -14.193 -4.835 5.182 1323 HG21 ILE 68 HG21 ILE 68 -13.434 -7.021 2.209 1324 HG22 ILE 68 HG22 ILE 68 -15.095 -7.565 1.967 1325 HG23 ILE 68 HG23 ILE 68 -14.181 -8.126 3.365 1326 HD11 ILE 68 HD11 ILE 68 -13.292 -7.716 5.221 1327 HD12 ILE 68 HD12 ILE 68 -14.614 -7.039 6.174 1328 HD13 ILE 68 HD13 ILE 68 -12.961 -6.491 6.446 1329 H SER 69 H SER 69 -17.661 -4.995 2.892 1330 HA SER 69 HA SER 69 -18.402 -6.626 0.697 1331 HB2 SER 69 HB2 SER 69 -19.699 -6.522 2.804 1332 HB3 SER 69 HB3 SER 69 -20.127 -4.843 2.472 1333 HG SER 69 HG SER 69 -20.791 -7.079 0.843 1334 H GLN 70 H GLN 70 -18.284 -3.132 1.193 1335 HA GLN 70 HA GLN 70 -19.761 -2.354 -1.128 1336 HB2 GLN 70 HB2 GLN 70 -19.361 -0.941 0.955 1337 HB3 GLN 70 HB3 GLN 70 -17.703 -0.713 0.430 1338 HG2 GLN 70 HG2 GLN 70 -20.101 0.163 -1.209 1339 HG3 GLN 70 HG3 GLN 70 -19.316 1.198 -0.032 1340 HE21 GLN 70 HE21 GLN 70 -16.606 0.402 -0.703 1341 HE22 GLN 70 HE22 GLN 70 -16.258 1.083 -2.246 1342 H ILE 71 H ILE 71 -16.277 -2.495 -0.341 1343 HA ILE 71 HA ILE 71 -15.385 -1.524 -2.846 1344 HB ILE 71 HB ILE 71 -14.045 -1.395 -0.723 1345 HG12 ILE 71 HG12 ILE 71 -12.709 -2.588 -3.191 1346 HG13 ILE 71 HG13 ILE 71 -12.947 -0.881 -2.840 1347 HG21 ILE 71 HG21 ILE 71 -12.669 -3.296 0.006 1348 HG22 ILE 71 HG22 ILE 71 -13.397 -4.319 -1.233 1349 HG23 ILE 71 HG23 ILE 71 -14.385 -3.704 0.091 1350 HD11 ILE 71 HD11 ILE 71 -11.123 -2.782 -1.396 1351 HD12 ILE 71 HD12 ILE 71 -11.381 -1.089 -0.955 1352 HD13 ILE 71 HD13 ILE 71 -10.663 -1.499 -2.512 1353 H ASP 72 H ASP 72 -16.117 -4.719 -1.651 1354 HA ASP 72 HA ASP 72 -14.880 -6.334 -3.547 1355 HB2 ASP 72 HB2 ASP 72 -15.822 -7.365 -1.609 1356 HB3 ASP 72 HB3 ASP 72 -17.408 -6.669 -1.899 1357 H LYS 73 H LYS 73 -17.858 -4.447 -3.748 1358 HA LYS 73 HA LYS 73 -18.804 -5.686 -6.187 1359 HB2 LYS 73 HB2 LYS 73 -19.821 -3.119 -4.900 1360 HB3 LYS 73 HB3 LYS 73 -20.663 -4.126 -6.074 1361 HG2 LYS 73 HG2 LYS 73 -20.055 -4.770 -3.180 1362 HG3 LYS 73 HG3 LYS 73 -21.639 -4.562 -3.930 1363 HD2 LYS 73 HD2 LYS 73 -21.303 -6.637 -5.237 1364 HD3 LYS 73 HD3 LYS 73 -19.690 -6.827 -4.541 1365 HE2 LYS 73 HE2 LYS 73 -20.791 -6.974 -2.269 1366 HE3 LYS 73 HE3 LYS 73 -22.350 -7.020 -3.095 1367 HZ1 LYS 73 HZ1 LYS 73 -20.135 -8.973 -3.414 1368 HZ2 LYS 73 HZ2 LYS 73 -21.594 -9.018 -4.269 1369 HZ3 LYS 73 HZ3 LYS 73 -21.590 -9.233 -2.593 1370 H LEU 74 H LEU 74 -16.417 -3.399 -5.586 1371 HA LEU 74 HA LEU 74 -16.673 -1.763 -7.949 1372 HB2 LEU 74 HB2 LEU 74 -14.494 -2.206 -5.887 1373 HB3 LEU 74 HB3 LEU 74 -14.078 -1.420 -7.394 1374 HG LEU 74 HG LEU 74 -14.490 0.202 -5.568 1375 HD11 LEU 74 HD11 LEU 74 -15.959 1.734 -6.811 1376 HD12 LEU 74 HD12 LEU 74 -16.504 0.400 -7.830 1377 HD13 LEU 74 HD13 LEU 74 -14.817 0.919 -7.878 1378 HD21 LEU 74 HD21 LEU 74 -17.384 -0.729 -5.615 1379 HD22 LEU 74 HD22 LEU 74 -16.731 0.613 -4.669 1380 HD23 LEU 74 HD23 LEU 74 -16.231 -1.037 -4.319 1381 H GLU 75 H GLU 75 -15.456 -1.914 -9.847 1382 HA GLU 75 HA GLU 75 -14.950 -4.524 -10.903 1383 HB2 GLU 75 HB2 GLU 75 -14.316 -1.775 -12.061 1384 HB3 GLU 75 HB3 GLU 75 -14.274 -3.292 -12.963 1385 HG2 GLU 75 HG2 GLU 75 -16.680 -3.599 -12.644 1386 HG3 GLU 75 HG3 GLU 75 -16.758 -2.156 -11.635 1387 H ASP 76 H ASP 76 -13.056 -2.421 -9.063 1388 HA ASP 76 HA ASP 76 -10.431 -3.103 -9.927 1389 HB2 ASP 76 HB2 ASP 76 -11.363 -2.314 -7.121 1390 HB3 ASP 76 HB3 ASP 76 -9.727 -2.197 -7.754 1391 H VAL 77 H VAL 77 -12.460 -4.217 -7.216 1392 HA VAL 77 HA VAL 77 -10.620 -6.298 -6.452 1393 HB VAL 77 HB VAL 77 -13.369 -5.502 -5.384 1394 HG11 VAL 77 HG11 VAL 77 -11.463 -7.583 -4.235 1395 HG12 VAL 77 HG12 VAL 77 -13.038 -7.910 -4.962 1396 HG13 VAL 77 HG13 VAL 77 -12.936 -6.996 -3.457 1397 HG21 VAL 77 HG21 VAL 77 -10.588 -5.140 -4.194 1398 HG22 VAL 77 HG22 VAL 77 -12.110 -4.607 -3.468 1399 HG23 VAL 77 HG23 VAL 77 -11.545 -3.872 -4.969 1400 H VAL 78 H VAL 78 -10.486 -7.771 -8.021 1401 HA VAL 78 HA VAL 78 -12.644 -9.029 -9.403 1402 HB VAL 78 HB VAL 78 -9.869 -10.235 -8.944 1403 HG11 VAL 78 HG11 VAL 78 -11.783 -10.515 -11.293 1404 HG12 VAL 78 HG12 VAL 78 -11.499 -11.728 -10.041 1405 HG13 VAL 78 HG13 VAL 78 -10.200 -11.279 -11.146 1406 HG21 VAL 78 HG21 VAL 78 -9.538 -7.910 -9.662 1407 HG22 VAL 78 HG22 VAL 78 -10.601 -8.163 -11.051 1408 HG23 VAL 78 HG23 VAL 78 -9.066 -9.027 -10.943 1409 H LYS 79 H LYS 79 -10.628 -9.877 -6.592 1410 HA LYS 79 HA LYS 79 -12.796 -11.488 -5.422 1411 HB2 LYS 79 HB2 LYS 79 -9.903 -12.450 -5.672 1412 HB3 LYS 79 HB3 LYS 79 -11.094 -13.187 -4.604 1413 HG2 LYS 79 HG2 LYS 79 -12.479 -13.787 -6.571 1414 HG3 LYS 79 HG3 LYS 79 -11.256 -13.076 -7.629 1415 HD2 LYS 79 HD2 LYS 79 -9.591 -14.733 -6.810 1416 HD3 LYS 79 HD3 LYS 79 -10.818 -15.436 -5.753 1417 HE2 LYS 79 HE2 LYS 79 -12.161 -16.057 -7.744 1418 HE3 LYS 79 HE3 LYS 79 -10.911 -15.376 -8.789 1419 HZ1 LYS 79 HZ1 LYS 79 -10.697 -17.762 -8.596 1420 HZ2 LYS 79 HZ2 LYS 79 -10.555 -17.653 -6.919 1421 HZ3 LYS 79 HZ3 LYS 79 -9.350 -17.004 -7.908 1422 H VAL 80 H VAL 80 -12.802 -11.455 -3.143 1423 HA VAL 80 HA VAL 80 -10.630 -10.000 -1.737 1424 HB VAL 80 HB VAL 80 -12.717 -8.546 -1.949 1425 HG11 VAL 80 HG11 VAL 80 -14.022 -10.588 -0.126 1426 HG12 VAL 80 HG12 VAL 80 -14.457 -10.254 -1.802 1427 HG13 VAL 80 HG13 VAL 80 -14.699 -9.017 -0.568 1428 HG21 VAL 80 HG21 VAL 80 -12.715 -7.784 0.408 1429 HG22 VAL 80 HG22 VAL 80 -11.081 -8.125 -0.164 1430 HG23 VAL 80 HG23 VAL 80 -11.903 -9.276 0.892 1431 H GLN 81 H GLN 81 -10.156 -10.831 0.392 1432 HA GLN 81 HA GLN 81 -11.390 -13.331 1.260 1433 HB2 GLN 81 HB2 GLN 81 -9.810 -14.096 -0.472 1434 HB3 GLN 81 HB3 GLN 81 -8.495 -13.205 0.289 1435 HG2 GLN 81 HG2 GLN 81 -8.636 -14.682 2.267 1436 HG3 GLN 81 HG3 GLN 81 -9.962 -15.569 1.520 1437 HE21 GLN 81 HE21 GLN 81 -6.527 -14.918 1.388 1438 HE22 GLN 81 HE22 GLN 81 -6.113 -16.251 0.377 1439 H ARG 82 H ARG 82 -11.470 -13.282 3.401 1440 HA ARG 82 HA ARG 82 -9.783 -11.523 5.021 1441 HB2 ARG 82 HB2 ARG 82 -12.011 -13.424 5.893 1442 HB3 ARG 82 HB3 ARG 82 -11.243 -12.193 6.887 1443 HG2 ARG 82 HG2 ARG 82 -12.220 -10.434 5.427 1444 HG3 ARG 82 HG3 ARG 82 -13.028 -11.693 4.487 1445 HD2 ARG 82 HD2 ARG 82 -14.221 -12.435 6.544 1446 HD3 ARG 82 HD3 ARG 82 -13.441 -11.131 7.446 1447 HE ARG 82 HE ARG 82 -14.897 -10.138 5.186 1448 HH11 ARG 82 HH11 ARG 82 -15.301 -11.310 8.486 1449 HH12 ARG 82 HH12 ARG 82 -16.782 -10.438 8.745 1450 HH21 ARG 82 HH21 ARG 82 -16.869 -9.015 5.551 1451 HH22 ARG 82 HH22 ARG 82 -17.664 -9.146 7.088 1452 H ASN 83 H ASN 83 -7.806 -12.352 5.584 1453 HA ASN 83 HA ASN 83 -7.471 -15.249 6.144 1454 HB2 ASN 83 HB2 ASN 83 -5.321 -13.099 5.870 1455 HB3 ASN 83 HB3 ASN 83 -5.040 -14.827 6.049 1456 HD21 ASN 83 HD21 ASN 83 -4.287 -12.898 3.949 1457 HD22 ASN 83 HD22 ASN 83 -4.863 -13.584 2.473 1458 H GLN 84 H GLN 84 -6.507 -15.933 8.106 1459 HA GLN 84 HA GLN 84 -6.939 -14.215 10.426 1460 HB2 GLN 84 HB2 GLN 84 -6.450 -16.208 11.761 1461 HB3 GLN 84 HB3 GLN 84 -7.611 -16.610 10.503 1462 HG2 GLN 84 HG2 GLN 84 -5.719 -17.587 9.164 1463 HG3 GLN 84 HG3 GLN 84 -4.664 -17.328 10.556 1464 HE21 GLN 84 HE21 GLN 84 -5.455 -18.350 12.627 1465 HE22 GLN 84 HE22 GLN 84 -6.196 -19.906 12.512 1466 H SER 85 H SER 85 -5.274 -13.575 11.839 1467 HA SER 85 HA SER 85 -2.912 -12.798 10.432 1468 HB2 SER 85 HB2 SER 85 -4.155 -11.305 12.019 1469 HB3 SER 85 HB3 SER 85 -3.540 -12.286 13.336 1470 HG SER 85 HG SER 85 -2.357 -10.273 12.506 1471 H ASP 86 H ASP 86 -0.901 -13.448 10.628 1472 HA ASP 86 HA ASP 86 0.006 -15.334 12.644 1473 HB2 ASP 86 HB2 ASP 86 -0.940 -16.875 11.005 1474 HB3 ASP 86 HB3 ASP 86 -0.192 -16.009 9.673 1475 HA PRO 87 HA PRO 87 3.371 -12.374 12.178 1476 HB2 PRO 87 HB2 PRO 87 5.390 -13.885 13.421 1477 HB3 PRO 87 HB3 PRO 87 4.167 -12.931 14.281 1478 HG2 PRO 87 HG2 PRO 87 4.157 -15.873 13.664 1479 HG3 PRO 87 HG3 PRO 87 3.743 -15.041 15.184 1480 HD2 PRO 87 HD2 PRO 87 1.805 -15.904 13.568 1481 HD3 PRO 87 HD3 PRO 87 1.650 -14.322 14.370 1482 H THR 88 H THR 88 3.808 -15.732 11.129 1483 HA THR 88 HA THR 88 6.088 -15.035 9.423 1484 HB THR 88 HB THR 88 6.163 -17.562 9.017 1485 HG1 THR 88 HG1 THR 88 3.849 -17.717 9.865 1486 HG21 THR 88 HG21 THR 88 6.397 -16.630 11.908 1487 HG22 THR 88 HG22 THR 88 7.649 -16.482 10.675 1488 HG23 THR 88 HG23 THR 88 7.145 -18.079 11.226 1489 H MET 89 H MET 89 2.681 -15.291 9.092 1490 HA MET 89 HA MET 89 2.255 -16.293 6.536 1491 HB2 MET 89 HB2 MET 89 0.365 -15.710 7.934 1492 HB3 MET 89 HB3 MET 89 0.847 -14.020 7.993 1493 HG2 MET 89 HG2 MET 89 -1.102 -14.358 6.538 1494 HG3 MET 89 HG3 MET 89 0.276 -13.755 5.616 1495 HE1 MET 89 HE1 MET 89 -1.556 -16.062 2.995 1496 HE2 MET 89 HE2 MET 89 -0.864 -14.466 3.272 1497 HE3 MET 89 HE3 MET 89 -2.285 -14.980 4.182 1498 H PHE 90 H PHE 90 3.004 -12.980 7.504 1499 HA PHE 90 HA PHE 90 3.029 -11.630 5.101 1500 HB2 PHE 90 HB2 PHE 90 3.181 -10.565 7.320 1501 HB3 PHE 90 HB3 PHE 90 4.789 -11.225 7.557 1502 HD1 PHE 90 HD1 PHE 90 6.735 -10.244 6.374 1503 HD2 PHE 90 HD2 PHE 90 2.814 -8.598 5.883 1504 HE1 PHE 90 HE1 PHE 90 7.713 -8.181 5.455 1505 HE2 PHE 90 HE2 PHE 90 3.803 -6.541 4.954 1506 HZ PHE 90 HZ PHE 90 6.249 -6.336 4.749 1507 H ASN 91 H ASN 91 5.651 -13.505 6.592 1508 HA ASN 91 HA ASN 91 7.664 -12.855 4.670 1509 HB2 ASN 91 HB2 ASN 91 8.176 -13.577 7.010 1510 HB3 ASN 91 HB3 ASN 91 7.569 -15.184 6.640 1511 HD21 ASN 91 HD21 ASN 91 10.166 -12.892 6.068 1512 HD22 ASN 91 HD22 ASN 91 11.294 -14.035 5.424 1513 H LYS 92 H LYS 92 5.368 -15.539 5.073 1514 HA LYS 92 HA LYS 92 6.405 -17.431 3.316 1515 HB2 LYS 92 HB2 LYS 92 3.500 -16.861 4.019 1516 HB3 LYS 92 HB3 LYS 92 4.019 -18.289 3.126 1517 HG2 LYS 92 HG2 LYS 92 5.200 -19.168 5.011 1518 HG3 LYS 92 HG3 LYS 92 5.077 -17.642 5.893 1519 HD2 LYS 92 HD2 LYS 92 2.574 -17.951 5.955 1520 HD3 LYS 92 HD3 LYS 92 2.791 -19.542 5.222 1521 HE2 LYS 92 HE2 LYS 92 4.041 -20.315 7.159 1522 HE3 LYS 92 HE3 LYS 92 4.028 -18.695 7.863 1523 HZ1 LYS 92 HZ1 LYS 92 1.674 -18.824 8.151 1524 HZ2 LYS 92 HZ2 LYS 92 2.368 -20.210 8.827 1525 HZ3 LYS 92 HZ3 LYS 92 1.590 -20.300 7.329 1526 H ILE 93 H ILE 93 3.951 -14.891 2.547 1527 HA ILE 93 HA ILE 93 3.983 -15.656 -0.255 1528 HB ILE 93 HB ILE 93 2.314 -13.992 -0.696 1529 HG12 ILE 93 HG12 ILE 93 3.352 -12.200 0.920 1530 HG13 ILE 93 HG13 ILE 93 1.620 -12.213 0.679 1531 HG21 ILE 93 HG21 ILE 93 0.502 -14.703 0.851 1532 HG22 ILE 93 HG22 ILE 93 1.711 -15.395 1.935 1533 HG23 ILE 93 HG23 ILE 93 1.497 -16.059 0.314 1534 HD11 ILE 93 HD11 ILE 93 2.209 -11.798 2.979 1535 HD12 ILE 93 HD12 ILE 93 3.061 -13.338 3.063 1536 HD13 ILE 93 HD13 ILE 93 1.310 -13.307 2.823 1537 H ALA 94 H ALA 94 5.551 -13.213 1.718 1538 HA ALA 94 HA ALA 94 6.382 -11.433 -0.320 1539 HB1 ALA 94 HB1 ALA 94 8.070 -10.643 1.293 1540 HB2 ALA 94 HB2 ALA 94 7.760 -12.051 2.317 1541 HB3 ALA 94 HB3 ALA 94 6.494 -10.849 2.064 1542 H VAL 95 H VAL 95 7.910 -14.352 1.025 1543 HA VAL 95 HA VAL 95 10.227 -14.205 -0.714 1544 HB VAL 95 HB VAL 95 10.326 -15.165 1.620 1545 HG11 VAL 95 HG11 VAL 95 9.593 -17.481 2.044 1546 HG12 VAL 95 HG12 VAL 95 8.866 -17.552 0.437 1547 HG13 VAL 95 HG13 VAL 95 8.226 -16.437 1.644 1548 HG21 VAL 95 HG21 VAL 95 12.134 -15.614 0.027 1549 HG22 VAL 95 HG22 VAL 95 11.274 -17.025 -0.592 1550 HG23 VAL 95 HG23 VAL 95 11.879 -17.016 1.067 1551 H PHE 96 H PHE 96 7.053 -15.681 -0.804 1552 HA PHE 96 HA PHE 96 7.598 -17.473 -2.994 1553 HB2 PHE 96 HB2 PHE 96 5.705 -17.771 -1.329 1554 HB3 PHE 96 HB3 PHE 96 4.879 -16.421 -2.097 1555 HD1 PHE 96 HD2 PHE 96 6.579 -19.627 -3.167 1556 HD2 PHE 96 HD1 PHE 96 3.207 -17.046 -3.633 1557 HE1 PHE 96 HE2 PHE 96 5.598 -21.192 -4.791 1558 HE2 PHE 96 HE1 PHE 96 2.234 -18.609 -5.261 1559 HZ PHE 96 HZ PHE 96 3.425 -20.689 -5.841 1560 H PHE 97 H PHE 97 6.832 -14.125 -2.630 1561 HA PHE 97 HA PHE 97 6.378 -12.375 -3.957 1562 HB2 PHE 97 HB2 PHE 97 7.987 -12.065 -5.875 1563 HB3 PHE 97 HB3 PHE 97 8.731 -12.465 -4.340 1564 HD1 PHE 97 HD2 PHE 97 7.625 -14.072 -7.567 1565 HD2 PHE 97 HD1 PHE 97 10.344 -14.195 -4.261 1566 HE1 PHE 97 HE2 PHE 97 8.863 -15.898 -8.644 1567 HE2 PHE 97 HE1 PHE 97 11.576 -16.024 -5.357 1568 HZ PHE 97 HZ PHE 97 10.834 -16.874 -7.546 1569 H GLN 98 H GLN 98 4.473 -14.459 -4.383 1570 HA GLN 98 HA GLN 98 3.333 -13.589 -6.898 1571 HB2 GLN 98 HB2 GLN 98 4.911 -15.573 -7.407 1572 HB3 GLN 98 HB3 GLN 98 3.770 -16.588 -6.534 1573 HG2 GLN 98 HG2 GLN 98 3.455 -16.654 -9.002 1574 HG3 GLN 98 HG3 GLN 98 2.018 -16.108 -8.142 1575 HE21 GLN 98 HE21 GLN 98 4.755 -13.936 -8.661 1576 HE22 GLN 98 HE22 GLN 98 3.969 -12.935 -9.819 Start of MODEL 5 1 H1 GLY 1 H1 GLY 1 2.069 -4.508 -13.947 2 H2 GLY 1 H2 GLY 1 1.354 -5.941 -14.491 3 H3 GLY 1 H3 GLY 1 1.068 -4.493 -15.307 4 HA2 GLY 1 HA3 GLY 1 2.666 -5.942 -16.474 5 HA3 GLY 1 HA2 GLY 1 3.304 -4.353 -16.061 6 H SER 2 H SER 2 2.828 -7.358 -14.182 7 HA SER 2 HA SER 2 5.350 -6.972 -12.804 8 HB2 SER 2 HB2 SER 2 3.481 -9.342 -12.551 9 HB3 SER 2 HB3 SER 2 4.582 -8.682 -11.335 10 HG SER 2 HG SER 2 3.194 -6.735 -11.512 11 H MET 3 H MET 3 7.225 -8.002 -13.241 12 HA MET 3 HA MET 3 7.449 -10.541 -14.570 13 HB2 MET 3 HB2 MET 3 6.975 -9.061 -16.516 14 HB3 MET 3 HB3 MET 3 8.320 -8.023 -16.078 15 HG2 MET 3 HG2 MET 3 9.914 -9.700 -16.681 16 HG3 MET 3 HG3 MET 3 8.666 -10.936 -16.824 17 HE1 MET 3 HE1 MET 3 6.335 -9.528 -18.401 18 HE2 MET 3 HE2 MET 3 6.956 -11.116 -18.859 19 HE3 MET 3 HE3 MET 3 6.773 -9.853 -20.077 20 H GLN 4 H GLN 4 9.623 -11.367 -14.440 21 HA GLN 4 HA GLN 4 11.295 -10.420 -12.370 22 HB2 GLN 4 HB2 GLN 4 11.292 -12.779 -13.099 23 HB3 GLN 4 HB3 GLN 4 11.931 -12.319 -14.670 24 HG2 GLN 4 HG2 GLN 4 13.643 -13.324 -13.168 25 HG3 GLN 4 HG3 GLN 4 14.061 -11.698 -13.702 26 HE21 GLN 4 HE21 GLN 4 14.203 -10.035 -12.172 27 HE22 GLN 4 HE22 GLN 4 14.154 -10.329 -10.469 28 H ASN 5 H ASN 5 12.070 -8.421 -12.503 29 HA ASN 5 HA ASN 5 12.824 -7.132 -14.969 30 HB2 ASN 5 HB2 ASN 5 11.650 -5.929 -13.124 31 HB3 ASN 5 HB3 ASN 5 13.050 -6.170 -12.089 32 HD21 ASN 5 HD21 ASN 5 11.772 -4.413 -14.811 33 HD22 ASN 5 HD22 ASN 5 13.009 -3.209 -14.874 34 H THR 6 H THR 6 14.825 -6.447 -15.563 35 HA THR 6 HA THR 6 17.244 -7.200 -14.054 36 HB THR 6 HB THR 6 16.836 -7.679 -17.054 37 HG1 THR 6 HG1 THR 6 16.300 -9.235 -14.882 38 HG21 THR 6 HG21 THR 6 19.196 -8.422 -15.272 39 HG22 THR 6 HG22 THR 6 19.195 -7.132 -16.478 40 HG23 THR 6 HG23 THR 6 19.024 -8.814 -16.984 41 H THR 7 H THR 7 15.794 -5.420 -16.776 42 HA THR 7 HA THR 7 17.767 -3.302 -16.817 43 HB THR 7 HB THR 7 14.974 -3.355 -18.071 44 HG1 THR 7 HG1 THR 7 16.806 -5.041 -18.614 45 HG21 THR 7 HG21 THR 7 17.451 -1.741 -18.818 46 HG22 THR 7 HG22 THR 7 16.018 -1.102 -18.007 47 HG23 THR 7 HG23 THR 7 15.897 -1.708 -19.658 48 H HIS 8 H HIS 8 17.832 -2.018 -15.013 49 HA HIS 8 HA HIS 8 15.656 -1.665 -13.187 50 HB2 HIS 8 HB2 HIS 8 18.338 -0.218 -13.305 51 HB3 HIS 8 HB3 HIS 8 17.197 -0.116 -11.970 52 HD1 HIS 8 HD1 HIS 8 16.916 -2.298 -10.507 53 HD2 HIS 8 HD2 HIS 8 20.022 -2.425 -13.253 54 HE1 HIS 8 HE1 HIS 8 18.420 -4.156 -9.752 55 HE2 HIS 8 HE2 HIS 8 20.191 -4.314 -11.510 56 H ASP 9 H ASP 9 14.137 -0.832 -14.788 57 HA ASP 9 HA ASP 9 14.182 2.074 -15.189 58 HB2 ASP 9 HB2 ASP 9 12.129 -0.059 -15.936 59 HB3 ASP 9 HB3 ASP 9 11.873 1.668 -16.193 60 H ASN 10 H ASN 10 12.895 -0.414 -13.122 61 HA ASN 10 HA ASN 10 10.877 1.229 -11.891 62 HB2 ASN 10 HB2 ASN 10 10.361 -0.675 -10.512 63 HB3 ASN 10 HB3 ASN 10 10.709 -1.309 -12.113 64 HD21 ASN 10 HD21 ASN 10 11.670 -1.264 -8.791 65 HD22 ASN 10 HD22 ASN 10 12.941 -2.427 -8.919 66 H VAL 11 H VAL 11 10.966 2.138 -9.886 67 HA VAL 11 HA VAL 11 13.581 2.433 -8.580 68 HB VAL 11 HB VAL 11 12.901 4.721 -7.833 69 HG11 VAL 11 HG11 VAL 11 14.335 4.474 -9.804 70 HG12 VAL 11 HG12 VAL 11 13.294 5.887 -9.965 71 HG13 VAL 11 HG13 VAL 11 12.919 4.408 -10.854 72 HG21 VAL 11 HG21 VAL 11 10.424 4.491 -8.016 73 HG22 VAL 11 HG22 VAL 11 10.562 4.492 -9.776 74 HG23 VAL 11 HG23 VAL 11 11.020 5.927 -8.857 75 H ILE 12 H ILE 12 13.602 2.002 -6.542 76 HA ILE 12 HA ILE 12 11.262 1.140 -5.060 77 HB ILE 12 HB ILE 12 14.156 1.347 -4.080 78 HG12 ILE 12 HG12 ILE 12 14.137 -0.054 -6.130 79 HG13 ILE 12 HG13 ILE 12 14.522 -1.006 -4.706 80 HG21 ILE 12 HG21 ILE 12 12.459 1.062 -2.324 81 HG22 ILE 12 HG22 ILE 12 13.496 -0.356 -2.449 82 HG23 ILE 12 HG23 ILE 12 11.863 -0.400 -3.117 83 HD11 ILE 12 HD11 ILE 12 13.086 -2.218 -6.216 84 HD12 ILE 12 HD12 ILE 12 11.877 -0.937 -6.150 85 HD13 ILE 12 HD13 ILE 12 12.233 -1.891 -4.706 86 H LEU 13 H LEU 13 10.161 3.089 -4.832 87 HA LEU 13 HA LEU 13 11.545 5.459 -3.842 88 HB2 LEU 13 HB2 LEU 13 9.676 5.307 -5.724 89 HB3 LEU 13 HB3 LEU 13 8.567 5.372 -4.368 90 HG LEU 13 HG LEU 13 10.666 7.494 -5.015 91 HD11 LEU 13 HD11 LEU 13 8.795 8.891 -5.735 92 HD12 LEU 13 HD12 LEU 13 7.684 7.545 -5.480 93 HD13 LEU 13 HD13 LEU 13 8.941 7.431 -6.712 94 HD21 LEU 13 HD21 LEU 13 8.449 7.569 -2.936 95 HD22 LEU 13 HD22 LEU 13 9.509 8.916 -3.367 96 HD23 LEU 13 HD23 LEU 13 10.184 7.473 -2.617 97 H GLU 14 H GLU 14 11.922 5.374 -1.765 98 HA GLU 14 HA GLU 14 10.194 4.056 0.168 99 HB2 GLU 14 HB2 GLU 14 12.642 5.726 0.849 100 HB3 GLU 14 HB3 GLU 14 11.979 4.342 1.707 101 HG2 GLU 14 HG2 GLU 14 12.731 2.904 -0.225 102 HG3 GLU 14 HG3 GLU 14 13.524 4.323 -0.895 103 H LEU 15 H LEU 15 8.805 5.135 1.515 104 HA LEU 15 HA LEU 15 9.386 7.843 2.318 105 HB2 LEU 15 HB2 LEU 15 6.888 8.523 1.899 106 HB3 LEU 15 HB3 LEU 15 8.062 8.632 0.606 107 HG LEU 15 HG LEU 15 7.133 6.260 -0.101 108 HD11 LEU 15 HD11 LEU 15 4.772 7.278 1.496 109 HD12 LEU 15 HD12 LEU 15 5.719 5.825 1.817 110 HD13 LEU 15 HD13 LEU 15 4.745 5.928 0.356 111 HD21 LEU 15 HD21 LEU 15 5.476 7.315 -1.562 112 HD22 LEU 15 HD22 LEU 15 6.960 8.260 -1.478 113 HD23 LEU 15 HD23 LEU 15 5.532 8.785 -0.582 114 H THR 16 H THR 16 9.452 7.665 4.381 115 HA THR 16 HA THR 16 7.835 5.741 5.849 116 HB THR 16 HB THR 16 9.917 7.716 6.895 117 HG1 THR 16 HG1 THR 16 11.386 6.246 6.423 118 HG21 THR 16 HG21 THR 16 8.710 5.232 8.177 119 HG22 THR 16 HG22 THR 16 8.287 6.896 8.595 120 HG23 THR 16 HG23 THR 16 9.923 6.296 8.898 121 H VAL 17 H VAL 17 5.775 6.437 6.079 122 HA VAL 17 HA VAL 17 5.273 9.280 6.736 123 HB VAL 17 HB VAL 17 3.153 9.151 5.760 124 HG11 VAL 17 HG11 VAL 17 4.969 7.473 3.995 125 HG12 VAL 17 HG12 VAL 17 4.905 9.239 4.070 126 HG13 VAL 17 HG13 VAL 17 3.524 8.340 3.439 127 HG21 VAL 17 HG21 VAL 17 3.323 6.120 5.641 128 HG22 VAL 17 HG22 VAL 17 2.013 7.082 4.952 129 HG23 VAL 17 HG23 VAL 17 2.278 7.071 6.695 130 H ARG 18 H ARG 18 4.412 9.777 8.658 131 HA ARG 18 HA ARG 18 3.858 7.725 10.617 132 HB2 ARG 18 HB2 ARG 18 3.428 9.651 12.163 133 HB3 ARG 18 HB3 ARG 18 5.033 9.623 11.445 134 HG2 ARG 18 HG2 ARG 18 4.304 11.373 9.825 135 HG3 ARG 18 HG3 ARG 18 2.735 11.432 10.637 136 HD2 ARG 18 HD2 ARG 18 5.428 12.067 11.886 137 HD3 ARG 18 HD3 ARG 18 4.191 13.239 11.431 138 HE ARG 18 HE ARG 18 3.369 11.190 13.341 139 HH11 ARG 18 HH11 ARG 18 4.593 14.470 12.971 140 HH12 ARG 18 HH12 ARG 18 4.089 14.963 14.557 141 HH21 ARG 18 HH21 ARG 18 2.733 11.830 15.409 142 HH22 ARG 18 HH22 ARG 18 3.029 13.458 15.943 143 H ASN 19 H ASN 19 1.895 7.140 11.412 144 HA ASN 19 HA ASN 19 -0.121 7.166 9.370 145 HB2 ASN 19 HB2 ASN 19 -0.024 5.681 12.027 146 HB3 ASN 19 HB3 ASN 19 -1.240 5.426 10.779 147 HD21 ASN 19 HD21 ASN 19 -0.702 3.270 10.417 148 HD22 ASN 19 HD22 ASN 19 0.787 2.766 9.703 149 H HIS 20 H HIS 20 -0.643 9.436 9.580 150 HA HIS 20 HA HIS 20 -2.659 10.164 11.580 151 HB2 HIS 20 HB2 HIS 20 -1.980 11.606 8.970 152 HB3 HIS 20 HB3 HIS 20 -2.890 12.258 10.321 153 HD1 HIS 20 HD1 HIS 20 -1.279 12.273 12.654 154 HD2 HIS 20 HD2 HIS 20 0.529 12.555 8.931 155 HE1 HIS 20 HE1 HIS 20 0.949 13.343 13.067 156 HE2 HIS 20 HE2 HIS 20 1.897 13.734 10.773 157 HA PRO 21 HA PRO 21 -6.249 8.425 9.530 158 HB2 PRO 21 HB2 PRO 21 -7.494 11.181 9.469 159 HB3 PRO 21 HB3 PRO 21 -8.153 9.655 10.102 160 HG2 PRO 21 HG2 PRO 21 -7.254 11.496 11.783 161 HG3 PRO 21 HG3 PRO 21 -6.907 9.776 12.082 162 HD2 PRO 21 HD2 PRO 21 -5.083 11.907 10.977 163 HD3 PRO 21 HD3 PRO 21 -4.721 10.589 12.117 164 H GLY 22 H GLY 22 -5.451 7.863 7.503 165 HA2 GLY 22 HA2 GLY 22 -6.126 7.733 5.252 166 HA3 GLY 22 HA3 GLY 22 -6.559 9.431 5.267 167 H VAL 23 H VAL 23 -3.391 8.447 6.455 168 HA VAL 23 HA VAL 23 -2.032 10.003 4.469 169 HB VAL 23 HB VAL 23 0.080 9.206 5.474 170 HG11 VAL 23 HG11 VAL 23 -1.097 11.098 6.463 171 HG12 VAL 23 HG12 VAL 23 -0.285 10.160 7.718 172 HG13 VAL 23 HG13 VAL 23 -2.030 10.013 7.497 173 HG21 VAL 23 HG21 VAL 23 -1.650 7.428 7.246 174 HG22 VAL 23 HG22 VAL 23 0.093 7.689 7.417 175 HG23 VAL 23 HG23 VAL 23 -0.542 6.870 5.987 176 H MET 24 H MET 24 -2.803 6.606 4.715 177 HA MET 24 HA MET 24 -1.176 5.558 2.663 178 HB2 MET 24 HB2 MET 24 -4.031 4.643 3.235 179 HB3 MET 24 HB3 MET 24 -2.722 3.692 2.549 180 HG2 MET 24 HG2 MET 24 -2.987 2.913 4.764 181 HG3 MET 24 HG3 MET 24 -1.550 3.933 4.809 182 HE1 MET 24 HE1 MET 24 -5.413 3.724 5.682 183 HE2 MET 24 HE2 MET 24 -5.323 5.167 4.670 184 HE3 MET 24 HE3 MET 24 -5.688 5.319 6.388 185 H THR 25 H THR 25 -4.279 7.239 2.640 186 HA THR 25 HA THR 25 -4.894 6.951 -0.128 187 HB THR 25 HB THR 25 -5.964 9.133 1.715 188 HG1 THR 25 HG1 THR 25 -7.614 7.208 1.945 189 HG21 THR 25 HG21 THR 25 -8.055 8.827 0.423 190 HG22 THR 25 HG22 THR 25 -7.279 7.585 -0.563 191 HG23 THR 25 HG23 THR 25 -6.721 9.259 -0.651 192 H HIS 26 H HIS 26 -3.071 9.322 1.754 193 HA HIS 26 HA HIS 26 -2.805 11.418 -0.106 194 HB2 HIS 26 HB2 HIS 26 -0.950 10.448 2.109 195 HB3 HIS 26 HB3 HIS 26 -0.497 11.792 1.070 196 HD1 HIS 26 HD1 HIS 26 -0.466 13.379 3.080 197 HD2 HIS 26 HD2 HIS 26 -4.177 11.655 2.369 198 HE1 HIS 26 HE1 HIS 26 -2.099 14.712 4.441 199 HE2 HIS 26 HE2 HIS 26 -4.314 13.596 4.054 200 H VAL 27 H VAL 27 -0.518 8.732 0.545 201 HA VAL 27 HA VAL 27 1.264 9.425 -1.526 202 HB VAL 27 HB VAL 27 2.425 7.312 -1.072 203 HG11 VAL 27 HG11 VAL 27 2.841 7.617 1.360 204 HG12 VAL 27 HG12 VAL 27 1.386 8.611 1.481 205 HG13 VAL 27 HG13 VAL 27 2.753 9.161 0.510 206 HG21 VAL 27 HG21 VAL 27 0.501 5.768 -0.879 207 HG22 VAL 27 HG22 VAL 27 0.049 6.504 0.657 208 HG23 VAL 27 HG23 VAL 27 1.573 5.623 0.520 209 H CYS 28 H CYS 28 -1.308 6.948 -1.395 210 HA CYS 28 HA CYS 28 -0.899 5.841 -3.956 211 HB2 CYS 28 HB2 CYS 28 -3.360 5.904 -2.170 212 HB3 CYS 28 HB3 CYS 28 -3.227 4.916 -3.625 213 HG CYS 28 HG CYS 28 -2.201 4.272 -0.578 214 H GLY 29 H GLY 29 -2.846 8.568 -2.826 215 HA2 GLY 29 HA2 GLY 29 -4.274 9.094 -5.233 216 HA3 GLY 29 HA3 GLY 29 -4.007 10.221 -3.907 217 H LEU 30 H LEU 30 -1.143 10.124 -3.976 218 HA LEU 30 HA LEU 30 -0.695 12.188 -5.921 219 HB2 LEU 30 HB2 LEU 30 1.055 10.927 -3.799 220 HB3 LEU 30 HB3 LEU 30 1.638 12.195 -4.873 221 HG LEU 30 HG LEU 30 -0.772 12.516 -3.027 222 HD11 LEU 30 HD11 LEU 30 2.027 13.578 -2.605 223 HD12 LEU 30 HD12 LEU 30 1.265 12.270 -1.696 224 HD13 LEU 30 HD13 LEU 30 0.615 13.905 -1.595 225 HD21 LEU 30 HD21 LEU 30 -0.592 14.910 -3.538 226 HD22 LEU 30 HD22 LEU 30 -0.865 13.968 -5.002 227 HD23 LEU 30 HD23 LEU 30 0.752 14.590 -4.641 228 H PHE 31 H PHE 31 0.143 8.767 -5.723 229 HA PHE 31 HA PHE 31 1.823 8.856 -8.096 230 HB2 PHE 31 HB2 PHE 31 0.724 6.553 -6.445 231 HB3 PHE 31 HB3 PHE 31 1.641 6.290 -7.930 232 HD1 PHE 31 HD2 PHE 31 3.996 7.309 -8.103 233 HD2 PHE 31 HD1 PHE 31 1.902 6.955 -4.394 234 HE1 PHE 31 HE2 PHE 31 6.106 7.592 -6.870 235 HE2 PHE 31 HE1 PHE 31 4.010 7.257 -3.171 236 HZ PHE 31 HZ PHE 31 6.113 7.573 -4.406 237 H ALA 32 H ALA 32 -1.545 8.126 -7.371 238 HA ALA 32 HA ALA 32 -2.356 7.141 -9.894 239 HB1 ALA 32 HB1 ALA 32 -3.985 8.673 -7.836 240 HB2 ALA 32 HB2 ALA 32 -3.724 6.929 -7.854 241 HB3 ALA 32 HB3 ALA 32 -4.641 7.692 -9.154 242 H ARG 33 H ARG 33 -2.409 10.456 -8.555 243 HA ARG 33 HA ARG 33 -3.411 11.653 -10.996 244 HB2 ARG 33 HB2 ARG 33 -3.396 13.750 -9.807 245 HB3 ARG 33 HB3 ARG 33 -3.979 12.517 -8.694 246 HG2 ARG 33 HG2 ARG 33 -1.710 12.424 -7.655 247 HG3 ARG 33 HG3 ARG 33 -1.191 13.719 -8.735 248 HD2 ARG 33 HD2 ARG 33 -3.402 13.921 -6.667 249 HD3 ARG 33 HD3 ARG 33 -1.767 14.564 -6.490 250 HE ARG 33 HE ARG 33 -2.466 15.853 -8.669 251 HH11 ARG 33 HH11 ARG 33 -4.490 15.253 -5.846 252 HH12 ARG 33 HH12 ARG 33 -5.428 16.697 -6.068 253 HH21 ARG 33 HH21 ARG 33 -3.662 17.783 -8.907 254 HH22 ARG 33 HH22 ARG 33 -4.958 18.132 -7.801 255 H ARG 34 H ARG 34 -0.326 10.683 -9.976 256 HA ARG 34 HA ARG 34 1.368 12.671 -11.071 257 HB2 ARG 34 HB2 ARG 34 2.210 10.903 -9.547 258 HB3 ARG 34 HB3 ARG 34 1.833 9.669 -10.741 259 HG2 ARG 34 HG2 ARG 34 3.528 10.744 -12.278 260 HG3 ARG 34 HG3 ARG 34 3.968 11.818 -10.947 261 HD2 ARG 34 HD2 ARG 34 5.523 9.897 -11.145 262 HD3 ARG 34 HD3 ARG 34 4.671 9.889 -9.594 263 HE ARG 34 HE ARG 34 3.514 7.973 -10.236 264 HH11 ARG 34 HH11 ARG 34 5.407 9.139 -12.968 265 HH12 ARG 34 HH12 ARG 34 5.201 7.676 -13.876 266 HH21 ARG 34 HH21 ARG 34 3.238 6.074 -11.479 267 HH22 ARG 34 HH22 ARG 34 3.988 5.962 -13.043 268 H ALA 35 H ALA 35 0.480 9.467 -12.382 269 HA ALA 35 HA ALA 35 -0.309 10.288 -14.951 270 HB1 ALA 35 HB1 ALA 35 1.609 9.531 -16.326 271 HB2 ALA 35 HB2 ALA 35 2.552 9.235 -14.859 272 HB3 ALA 35 HB3 ALA 35 2.068 10.877 -15.281 273 H PHE 36 H PHE 36 1.624 7.707 -13.443 274 HA PHE 36 HA PHE 36 -0.298 5.656 -14.398 275 HB2 PHE 36 HB2 PHE 36 1.767 5.606 -15.761 276 HB3 PHE 36 HB3 PHE 36 2.753 5.520 -14.309 277 HD1 PHE 36 HD1 PHE 36 0.039 3.626 -16.107 278 HD2 PHE 36 HD2 PHE 36 3.462 3.398 -13.543 279 HE1 PHE 36 HE1 PHE 36 -0.034 1.168 -16.209 280 HE2 PHE 36 HE2 PHE 36 3.375 0.942 -13.656 281 HZ PHE 36 HZ PHE 36 1.634 -0.172 -14.989 282 H ASN 37 H ASN 37 -0.308 3.702 -13.104 283 HA ASN 37 HA ASN 37 -0.565 4.176 -10.305 284 HB2 ASN 37 HB2 ASN 37 -0.653 1.547 -11.864 285 HB3 ASN 37 HB3 ASN 37 -1.239 1.779 -10.218 286 HD21 ASN 37 HD21 ASN 37 -2.559 0.997 -12.812 287 HD22 ASN 37 HD22 ASN 37 -3.922 2.049 -12.929 288 H VAL 38 H VAL 38 0.308 2.317 -8.787 289 HA VAL 38 HA VAL 38 3.223 1.971 -9.139 290 HB VAL 38 HB VAL 38 1.493 1.407 -6.674 291 HG11 VAL 38 HG11 VAL 38 3.543 0.044 -6.706 292 HG12 VAL 38 HG12 VAL 38 3.639 1.276 -5.445 293 HG13 VAL 38 HG13 VAL 38 4.524 1.493 -6.958 294 HG21 VAL 38 HG21 VAL 38 1.522 3.813 -7.171 295 HG22 VAL 38 HG22 VAL 38 3.286 3.797 -7.244 296 HG23 VAL 38 HG23 VAL 38 2.464 3.472 -5.716 297 H GLU 39 H GLU 39 4.126 -0.132 -9.135 298 HA GLU 39 HA GLU 39 2.362 -2.273 -10.039 299 HB2 GLU 39 HB2 GLU 39 4.577 -1.659 -11.159 300 HB3 GLU 39 HB3 GLU 39 5.401 -2.302 -9.743 301 HG2 GLU 39 HG2 GLU 39 5.391 -3.948 -11.539 302 HG3 GLU 39 HG3 GLU 39 4.409 -4.525 -10.189 303 H GLY 40 H GLY 40 4.832 -1.727 -7.492 304 HA2 GLY 40 HA2 GLY 40 3.589 -3.889 -5.844 305 HA3 GLY 40 HA3 GLY 40 5.331 -3.789 -6.070 306 H ILE 41 H ILE 41 3.373 -3.430 -3.694 307 HA ILE 41 HA ILE 41 4.558 -0.919 -2.620 308 HB ILE 41 HB ILE 41 1.723 -1.929 -2.048 309 HG12 ILE 41 HG12 ILE 41 2.546 0.495 -3.714 310 HG13 ILE 41 HG13 ILE 41 1.910 -1.011 -4.363 311 HG21 ILE 41 HG21 ILE 41 2.697 -0.743 -0.126 312 HG22 ILE 41 HG22 ILE 41 1.379 0.188 -0.838 313 HG23 ILE 41 HG23 ILE 41 3.053 0.649 -1.153 314 HD11 ILE 41 HD11 ILE 41 0.429 0.931 -2.590 315 HD12 ILE 41 HD12 ILE 41 -0.212 -0.602 -3.187 316 HD13 ILE 41 HD13 ILE 41 0.199 0.683 -4.321 317 H LEU 42 H LEU 42 5.216 -1.042 -0.450 318 HA LEU 42 HA LEU 42 4.469 -3.337 1.196 319 HB2 LEU 42 HB2 LEU 42 6.479 -4.209 0.144 320 HB3 LEU 42 HB3 LEU 42 7.362 -2.723 0.464 321 HG LEU 42 HG LEU 42 7.315 -3.200 2.902 322 HD11 LEU 42 HD11 LEU 42 6.570 -5.357 3.773 323 HD12 LEU 42 HD12 LEU 42 5.938 -5.789 2.180 324 HD13 LEU 42 HD13 LEU 42 5.239 -4.433 3.070 325 HD21 LEU 42 HD21 LEU 42 8.413 -5.498 1.270 326 HD22 LEU 42 HD22 LEU 42 8.881 -5.080 2.922 327 HD23 LEU 42 HD23 LEU 42 9.221 -3.963 1.603 328 H CYS 43 H CYS 43 3.480 -2.034 2.673 329 HA CYS 43 HA CYS 43 4.923 0.143 3.994 330 HB2 CYS 43 HB2 CYS 43 2.517 0.422 3.565 331 HB3 CYS 43 HB3 CYS 43 2.159 -1.030 4.490 332 HG CYS 43 HG CYS 43 2.351 0.008 6.894 333 H LEU 44 H LEU 44 6.520 -0.663 5.199 334 HA LEU 44 HA LEU 44 6.239 -3.010 6.907 335 HB2 LEU 44 HB2 LEU 44 8.340 -2.364 5.554 336 HB3 LEU 44 HB3 LEU 44 8.590 -1.089 6.729 337 HG LEU 44 HG LEU 44 8.684 -2.920 8.523 338 HD11 LEU 44 HD11 LEU 44 9.185 -5.209 7.775 339 HD12 LEU 44 HD12 LEU 44 8.883 -4.739 6.100 340 HD13 LEU 44 HD13 LEU 44 7.569 -4.705 7.281 341 HD21 LEU 44 HD21 LEU 44 11.028 -3.522 8.009 342 HD22 LEU 44 HD22 LEU 44 10.711 -1.814 7.723 343 HD23 LEU 44 HD23 LEU 44 10.817 -2.928 6.358 344 HA PRO 45 HA PRO 45 4.686 0.099 9.869 345 HB2 PRO 45 HB2 PRO 45 3.720 -1.650 11.747 346 HB3 PRO 45 HB3 PRO 45 2.865 -1.281 10.244 347 HG2 PRO 45 HG2 PRO 45 4.552 -3.666 10.904 348 HG3 PRO 45 HG3 PRO 45 3.007 -3.586 10.027 349 HD2 PRO 45 HD2 PRO 45 5.421 -3.804 8.760 350 HD3 PRO 45 HD3 PRO 45 4.015 -2.988 8.031 351 H ILE 46 H ILE 46 6.159 1.172 10.970 352 HA ILE 46 HA ILE 46 8.548 0.009 12.015 353 HB ILE 46 HB ILE 46 7.466 2.847 12.200 354 HG12 ILE 46 HG12 ILE 46 7.904 2.173 9.880 355 HG13 ILE 46 HG13 ILE 46 9.115 3.343 10.384 356 HG21 ILE 46 HG21 ILE 46 10.246 1.852 12.911 357 HG22 ILE 46 HG22 ILE 46 9.043 2.506 14.029 358 HG23 ILE 46 HG23 ILE 46 9.765 3.549 12.803 359 HD11 ILE 46 HD11 ILE 46 10.107 1.593 9.051 360 HD12 ILE 46 HD12 ILE 46 9.503 0.356 10.150 361 HD13 ILE 46 HD13 ILE 46 10.728 1.505 10.698 362 H GLN 47 H GLN 47 8.621 -1.043 13.852 363 HA GLN 47 HA GLN 47 6.734 -1.006 15.953 364 HB2 GLN 47 HB2 GLN 47 8.427 -2.438 17.157 365 HB3 GLN 47 HB3 GLN 47 8.019 -2.991 15.543 366 HG2 GLN 47 HG2 GLN 47 10.107 -2.007 14.667 367 HG3 GLN 47 HG3 GLN 47 10.531 -1.476 16.294 368 HE21 GLN 47 HE21 GLN 47 10.200 -4.238 14.171 369 HE22 GLN 47 HE22 GLN 47 11.070 -5.348 15.166 370 H ASP 48 H ASP 48 9.464 0.991 15.348 371 HA ASP 48 HA ASP 48 10.302 1.591 17.974 372 HB2 ASP 48 HB2 ASP 48 11.908 1.968 16.302 373 HB3 ASP 48 HB3 ASP 48 10.773 2.787 15.242 374 H SER 49 H SER 49 7.994 3.228 15.798 375 HA SER 49 HA SER 49 6.667 4.593 17.952 376 HB2 SER 49 HB2 SER 49 7.119 6.933 16.983 377 HB3 SER 49 HB3 SER 49 8.468 6.188 17.837 378 HG SER 49 HG SER 49 9.570 6.333 16.085 379 H ASP 50 H ASP 50 5.177 6.453 16.754 380 HA ASP 50 HA ASP 50 3.338 4.894 15.212 381 HB2 ASP 50 HB2 ASP 50 1.928 6.976 15.249 382 HB3 ASP 50 HB3 ASP 50 2.441 6.441 16.838 383 H LYS 51 H LYS 51 4.810 4.444 13.415 384 HA LYS 51 HA LYS 51 4.088 5.987 11.136 385 HB2 LYS 51 HB2 LYS 51 6.376 6.520 10.315 386 HB3 LYS 51 HB3 LYS 51 5.980 7.395 11.786 387 HG2 LYS 51 HG2 LYS 51 7.381 5.849 13.102 388 HG3 LYS 51 HG3 LYS 51 7.751 4.937 11.633 389 HD2 LYS 51 HD2 LYS 51 8.749 7.038 10.654 390 HD3 LYS 51 HD3 LYS 51 8.507 7.829 12.210 391 HE2 LYS 51 HE2 LYS 51 10.194 5.335 11.826 392 HE3 LYS 51 HE3 LYS 51 10.842 6.974 11.806 393 HZ1 LYS 51 HZ1 LYS 51 10.076 7.268 14.071 394 HZ2 LYS 51 HZ2 LYS 51 11.099 5.926 13.968 395 HZ3 LYS 51 HZ3 LYS 51 9.428 5.709 14.086 396 H SER 52 H SER 52 5.001 5.051 9.143 397 HA SER 52 HA SER 52 5.838 2.253 9.251 398 HB2 SER 52 HB2 SER 52 3.367 3.222 7.727 399 HB3 SER 52 HB3 SER 52 4.031 1.591 7.701 400 HG SER 52 HG SER 52 2.934 2.931 9.946 401 H HIS 53 H HIS 53 7.059 1.716 7.451 402 HA HIS 53 HA HIS 53 7.902 3.964 5.708 403 HB2 HIS 53 HB2 HIS 53 9.565 2.925 7.304 404 HB3 HIS 53 HB3 HIS 53 9.372 1.386 6.482 405 HD1 HIS 53 HD1 HIS 53 12.101 2.342 6.694 406 HD2 HIS 53 HD2 HIS 53 9.697 3.543 3.521 407 HE1 HIS 53 HE1 HIS 53 13.670 3.020 4.879 408 HE2 HIS 53 HE2 HIS 53 12.207 3.443 2.901 409 H ILE 54 H ILE 54 6.913 3.836 3.745 410 HA ILE 54 HA ILE 54 6.104 1.220 2.659 411 HB ILE 54 HB ILE 54 5.216 3.974 1.673 412 HG12 ILE 54 HG12 ILE 54 2.943 3.277 2.753 413 HG13 ILE 54 HG13 ILE 54 3.881 2.119 3.682 414 HG21 ILE 54 HG21 ILE 54 3.440 2.728 0.488 415 HG22 ILE 54 HG22 ILE 54 4.114 1.206 1.077 416 HG23 ILE 54 HG23 ILE 54 5.049 2.214 -0.030 417 HD11 ILE 54 HD11 ILE 54 4.232 5.106 3.727 418 HD12 ILE 54 HD12 ILE 54 5.137 3.938 4.692 419 HD13 ILE 54 HD13 ILE 54 3.403 4.131 4.939 420 H TRP 55 H TRP 55 6.966 0.430 0.761 421 HA TRP 55 HA TRP 55 8.758 2.180 -0.840 422 HB2 TRP 55 HB2 TRP 55 8.710 -0.861 -0.570 423 HB3 TRP 55 HB3 TRP 55 9.722 0.017 -1.721 424 HD1 TRP 55 HD1 TRP 55 11.782 1.397 -0.737 425 HE1 TRP 55 HE1 TRP 55 13.049 1.268 1.484 426 HE3 TRP 55 HE3 TRP 55 8.428 -1.303 1.912 427 HZ2 TRP 55 HZ2 TRP 55 12.676 0.176 4.037 428 HZ3 TRP 55 HZ3 TRP 55 8.940 -1.857 4.232 429 HH2 TRP 55 HH2 TRP 55 11.022 -1.138 5.290 430 H LEU 56 H LEU 56 8.110 2.701 -2.802 431 HA LEU 56 HA LEU 56 5.797 1.341 -4.037 432 HB2 LEU 56 HB2 LEU 56 6.758 4.219 -4.373 433 HB3 LEU 56 HB3 LEU 56 5.475 3.485 -5.317 434 HG LEU 56 HG LEU 56 4.411 4.839 -3.675 435 HD11 LEU 56 HD11 LEU 56 3.047 3.290 -2.376 436 HD12 LEU 56 HD12 LEU 56 4.195 1.987 -2.694 437 HD13 LEU 56 HD13 LEU 56 3.289 2.714 -4.024 438 HD21 LEU 56 HD21 LEU 56 4.794 4.714 -1.262 439 HD22 LEU 56 HD22 LEU 56 6.267 5.153 -2.123 440 HD23 LEU 56 HD23 LEU 56 6.064 3.510 -1.512 441 H LEU 57 H LEU 57 6.555 -0.028 -5.446 442 HA LEU 57 HA LEU 57 8.938 0.379 -7.058 443 HB2 LEU 57 HB2 LEU 57 6.982 -1.913 -6.678 444 HB3 LEU 57 HB3 LEU 57 8.112 -1.917 -8.020 445 HG LEU 57 HG LEU 57 10.016 -2.054 -6.536 446 HD11 LEU 57 HD11 LEU 57 8.117 -1.798 -4.191 447 HD12 LEU 57 HD12 LEU 57 9.326 -0.615 -4.710 448 HD13 LEU 57 HD13 LEU 57 9.840 -2.184 -4.092 449 HD21 LEU 57 HD21 LEU 57 8.913 -4.145 -7.110 450 HD22 LEU 57 HD22 LEU 57 7.853 -4.007 -5.704 451 HD23 LEU 57 HD23 LEU 57 9.592 -4.240 -5.484 452 H VAL 58 H VAL 58 8.481 1.963 -8.461 453 HA VAL 58 HA VAL 58 6.532 1.373 -10.613 454 HB VAL 58 HB VAL 58 5.456 3.063 -9.081 455 HG11 VAL 58 HG11 VAL 58 6.310 5.372 -8.912 456 HG12 VAL 58 HG12 VAL 58 7.768 4.894 -9.790 457 HG13 VAL 58 HG13 VAL 58 7.427 4.203 -8.201 458 HG21 VAL 58 HG21 VAL 58 6.171 4.170 -11.824 459 HG22 VAL 58 HG22 VAL 58 4.815 4.707 -10.827 460 HG23 VAL 58 HG23 VAL 58 4.844 3.061 -11.460 461 H ASN 59 H ASN 59 7.343 2.037 -12.675 462 HA ASN 59 HA ASN 59 10.102 2.505 -12.964 463 HB2 ASN 59 HB2 ASN 59 9.714 2.903 -15.319 464 HB3 ASN 59 HB3 ASN 59 8.688 1.578 -14.795 465 HD21 ASN 59 HD21 ASN 59 6.536 3.107 -13.657 466 HD22 ASN 59 HD22 ASN 59 5.754 3.919 -14.946 467 H ASP 60 H ASP 60 11.292 4.324 -13.374 468 HA ASP 60 HA ASP 60 10.594 6.710 -12.067 469 HB2 ASP 60 HB2 ASP 60 12.918 5.880 -12.246 470 HB3 ASP 60 HB3 ASP 60 12.894 6.144 -13.976 471 H ASP 61 H ASP 61 10.409 8.791 -12.917 472 HA ASP 61 HA ASP 61 9.139 9.045 -15.584 473 HB2 ASP 61 HB2 ASP 61 7.480 8.762 -13.679 474 HB3 ASP 61 HB3 ASP 61 8.126 10.219 -12.950 475 H GLN 62 H GLN 62 9.276 11.258 -16.428 476 HA GLN 62 HA GLN 62 11.576 12.807 -15.728 477 HB2 GLN 62 HB2 GLN 62 9.119 13.655 -17.332 478 HB3 GLN 62 HB3 GLN 62 10.658 14.515 -17.285 479 HG2 GLN 62 HG2 GLN 62 11.754 12.526 -18.301 480 HG3 GLN 62 HG3 GLN 62 10.174 11.749 -18.429 481 HE21 GLN 62 HE21 GLN 62 8.514 13.056 -19.633 482 HE22 GLN 62 HE22 GLN 62 9.036 13.907 -21.042 483 H ARG 63 H ARG 63 8.227 12.822 -14.782 484 HA ARG 63 HA ARG 63 8.235 15.279 -13.275 485 HB2 ARG 63 HB2 ARG 63 6.197 14.361 -14.318 486 HB3 ARG 63 HB3 ARG 63 6.312 12.915 -13.330 487 HG2 ARG 63 HG2 ARG 63 5.910 14.316 -11.293 488 HG3 ARG 63 HG3 ARG 63 5.727 15.729 -12.334 489 HD2 ARG 63 HD2 ARG 63 3.975 13.245 -12.402 490 HD3 ARG 63 HD3 ARG 63 3.537 14.786 -11.669 491 HE ARG 63 HE ARG 63 3.349 15.755 -13.812 492 HH11 ARG 63 HH11 ARG 63 4.064 12.319 -14.064 493 HH12 ARG 63 HH12 ARG 63 3.544 12.208 -15.711 494 HH21 ARG 63 HH21 ARG 63 2.641 15.585 -15.962 495 HH22 ARG 63 HH22 ARG 63 2.733 14.067 -16.790 496 H LEU 64 H LEU 64 9.223 12.015 -12.643 497 HA LEU 64 HA LEU 64 8.207 11.239 -10.261 498 HB2 LEU 64 HB2 LEU 64 10.047 10.224 -11.976 499 HB3 LEU 64 HB3 LEU 64 11.128 10.631 -10.670 500 HG LEU 64 HG LEU 64 10.351 8.223 -10.769 501 HD11 LEU 64 HD11 LEU 64 9.702 9.633 -8.184 502 HD12 LEU 64 HD12 LEU 64 11.300 9.109 -8.722 503 HD13 LEU 64 HD13 LEU 64 10.051 7.913 -8.392 504 HD21 LEU 64 HD21 LEU 64 7.665 9.326 -9.881 505 HD22 LEU 64 HD22 LEU 64 8.117 7.619 -9.928 506 HD23 LEU 64 HD23 LEU 64 8.019 8.546 -11.422 507 H GLU 65 H GLU 65 11.361 12.958 -10.471 508 HA GLU 65 HA GLU 65 11.835 13.157 -7.682 509 HB2 GLU 65 HB2 GLU 65 12.952 14.795 -9.996 510 HB3 GLU 65 HB3 GLU 65 13.589 14.837 -8.354 511 HG2 GLU 65 HG2 GLU 65 14.213 12.487 -8.499 512 HG3 GLU 65 HG3 GLU 65 13.504 12.367 -10.108 513 H GLN 66 H GLN 66 10.309 15.339 -9.970 514 HA GLN 66 HA GLN 66 10.056 17.617 -8.253 515 HB2 GLN 66 HB2 GLN 66 8.592 16.823 -10.812 516 HB3 GLN 66 HB3 GLN 66 8.279 18.335 -9.972 517 HG2 GLN 66 HG2 GLN 66 9.766 18.693 -11.870 518 HG3 GLN 66 HG3 GLN 66 10.591 19.058 -10.359 519 HE21 GLN 66 HE21 GLN 66 10.384 16.818 -13.029 520 HE22 GLN 66 HE22 GLN 66 11.924 16.074 -12.781 521 H MET 67 H MET 67 8.043 14.821 -8.977 522 HA MET 67 HA MET 67 5.755 15.653 -7.459 523 HB2 MET 67 HB2 MET 67 5.783 13.993 -9.441 524 HB3 MET 67 HB3 MET 67 6.403 12.795 -8.308 525 HG2 MET 67 HG2 MET 67 3.964 12.606 -8.606 526 HG3 MET 67 HG3 MET 67 4.376 13.025 -6.937 527 HE1 MET 67 HE1 MET 67 1.837 13.832 -6.477 528 HE2 MET 67 HE2 MET 67 1.384 13.430 -8.135 529 HE3 MET 67 HE3 MET 67 1.001 15.020 -7.477 530 H ILE 68 H ILE 68 8.681 13.809 -6.872 531 HA ILE 68 HA ILE 68 8.147 12.798 -4.284 532 HB ILE 68 HB ILE 68 10.722 13.430 -5.772 533 HG12 ILE 68 HG12 ILE 68 9.553 10.794 -4.782 534 HG13 ILE 68 HG13 ILE 68 9.409 11.410 -6.425 535 HG21 ILE 68 HG21 ILE 68 10.617 12.325 -2.942 536 HG22 ILE 68 HG22 ILE 68 11.282 13.886 -3.425 537 HG23 ILE 68 HG23 ILE 68 12.059 12.395 -3.956 538 HD11 ILE 68 HD11 ILE 68 11.968 10.647 -5.039 539 HD12 ILE 68 HD12 ILE 68 11.832 11.285 -6.681 540 HD13 ILE 68 HD13 ILE 68 11.118 9.725 -6.277 541 H SER 69 H SER 69 9.551 15.863 -5.430 542 HA SER 69 HA SER 69 10.118 16.980 -2.885 543 HB2 SER 69 HB2 SER 69 11.111 17.788 -5.027 544 HB3 SER 69 HB3 SER 69 9.539 18.428 -5.503 545 HG SER 69 HG SER 69 11.121 19.225 -3.282 546 H GLN 70 H GLN 70 7.240 16.870 -4.887 547 HA GLN 70 HA GLN 70 5.716 18.869 -3.564 548 HB2 GLN 70 HB2 GLN 70 5.294 18.222 -5.880 549 HB3 GLN 70 HB3 GLN 70 5.008 16.556 -5.422 550 HG2 GLN 70 HG2 GLN 70 3.197 18.784 -4.471 551 HG3 GLN 70 HG3 GLN 70 2.985 18.032 -6.048 552 HE21 GLN 70 HE21 GLN 70 3.771 15.343 -5.078 553 HE22 GLN 70 HE22 GLN 70 2.439 14.780 -4.142 554 H ILE 71 H ILE 71 5.955 15.302 -3.262 555 HA ILE 71 HA ILE 71 3.971 15.204 -1.144 556 HB ILE 71 HB ILE 71 3.995 13.348 -2.688 557 HG12 ILE 71 HG12 ILE 71 4.927 12.479 0.077 558 HG13 ILE 71 HG13 ILE 71 3.271 12.810 -0.412 559 HG21 ILE 71 HG21 ILE 71 6.799 12.652 -1.792 560 HG22 ILE 71 HG22 ILE 71 6.360 13.370 -3.341 561 HG23 ILE 71 HG23 ILE 71 5.798 11.749 -2.938 562 HD11 ILE 71 HD11 ILE 71 5.004 10.550 -1.391 563 HD12 ILE 71 HD12 ILE 71 3.345 10.873 -1.910 564 HD13 ILE 71 HD13 ILE 71 3.679 10.445 -0.233 565 H ASP 72 H ASP 72 7.414 15.432 -1.354 566 HA ASP 72 HA ASP 72 8.299 14.499 1.135 567 HB2 ASP 72 HB2 ASP 72 9.935 15.006 -0.548 568 HB3 ASP 72 HB3 ASP 72 9.342 16.639 -0.760 569 H LYS 73 H LYS 73 7.007 17.641 0.170 570 HA LYS 73 HA LYS 73 7.590 18.922 2.685 571 HB2 LYS 73 HB2 LYS 73 6.453 20.899 1.692 572 HB3 LYS 73 HB3 LYS 73 7.747 20.255 0.693 573 HG2 LYS 73 HG2 LYS 73 6.052 19.126 -0.741 574 HG3 LYS 73 HG3 LYS 73 4.772 19.858 0.237 575 HD2 LYS 73 HD2 LYS 73 5.146 21.122 -1.858 576 HD3 LYS 73 HD3 LYS 73 5.520 22.111 -0.443 577 HE2 LYS 73 HE2 LYS 73 7.909 21.745 -0.772 578 HE3 LYS 73 HE3 LYS 73 7.593 20.631 -2.100 579 HZ1 LYS 73 HZ1 LYS 73 7.002 23.545 -2.063 580 HZ2 LYS 73 HZ2 LYS 73 6.600 22.499 -3.324 581 HZ3 LYS 73 HZ3 LYS 73 8.220 22.774 -2.942 582 H LEU 74 H LEU 74 5.383 16.639 2.135 583 HA LEU 74 HA LEU 74 3.129 17.739 3.615 584 HB2 LEU 74 HB2 LEU 74 3.785 15.064 2.370 585 HB3 LEU 74 HB3 LEU 74 2.563 15.118 3.620 586 HG LEU 74 HG LEU 74 1.552 15.161 1.376 587 HD11 LEU 74 HD11 LEU 74 0.345 16.239 3.205 588 HD12 LEU 74 HD12 LEU 74 0.037 17.060 1.678 589 HD13 LEU 74 HD13 LEU 74 1.143 17.777 2.855 590 HD21 LEU 74 HD21 LEU 74 3.333 16.299 0.132 591 HD22 LEU 74 HD22 LEU 74 2.970 17.812 0.960 592 HD23 LEU 74 HD23 LEU 74 1.779 17.086 -0.124 593 H GLU 75 H GLU 75 2.527 17.092 5.696 594 HA GLU 75 HA GLU 75 4.718 16.763 7.564 595 HB2 GLU 75 HB2 GLU 75 1.730 17.119 8.040 596 HB3 GLU 75 HB3 GLU 75 2.976 17.199 9.289 597 HG2 GLU 75 HG2 GLU 75 3.967 19.170 8.190 598 HG3 GLU 75 HG3 GLU 75 2.748 19.079 6.916 599 H ASP 76 H ASP 76 2.309 14.703 6.171 600 HA ASP 76 HA ASP 76 2.456 12.581 8.088 601 HB2 ASP 76 HB2 ASP 76 1.554 11.157 6.171 602 HB3 ASP 76 HB3 ASP 76 0.562 12.505 6.691 603 H VAL 77 H VAL 77 4.043 13.078 4.909 604 HA VAL 77 HA VAL 77 5.872 10.936 5.125 605 HB VAL 77 HB VAL 77 5.975 13.500 3.475 606 HG11 VAL 77 HG11 VAL 77 7.757 12.452 2.113 607 HG12 VAL 77 HG12 VAL 77 7.824 11.092 3.237 608 HG13 VAL 77 HG13 VAL 77 8.292 12.704 3.778 609 HG21 VAL 77 HG21 VAL 77 4.144 11.941 2.922 610 HG22 VAL 77 HG22 VAL 77 5.315 10.632 2.711 611 HG23 VAL 77 HG23 VAL 77 5.333 12.019 1.619 612 H VAL 78 H VAL 78 7.015 10.816 6.955 613 HA VAL 78 HA VAL 78 8.457 12.938 8.231 614 HB VAL 78 HB VAL 78 9.076 9.949 8.462 615 HG11 VAL 78 HG11 VAL 78 9.478 12.216 10.456 616 HG12 VAL 78 HG12 VAL 78 10.745 11.443 9.495 617 HG13 VAL 78 HG13 VAL 78 9.878 10.515 10.720 618 HG21 VAL 78 HG21 VAL 78 7.468 9.809 10.319 619 HG22 VAL 78 HG22 VAL 78 6.660 10.249 8.812 620 HG23 VAL 78 HG23 VAL 78 6.972 11.483 10.037 621 H LYS 79 H LYS 79 9.295 10.297 6.022 622 HA LYS 79 HA LYS 79 11.745 11.696 5.144 623 HB2 LYS 79 HB2 LYS 79 11.529 8.766 5.973 624 HB3 LYS 79 HB3 LYS 79 12.871 9.394 5.021 625 HG2 LYS 79 HG2 LYS 79 13.562 10.846 6.842 626 HG3 LYS 79 HG3 LYS 79 12.141 10.397 7.789 627 HD2 LYS 79 HD2 LYS 79 12.950 8.107 8.021 628 HD3 LYS 79 HD3 LYS 79 14.301 8.427 6.928 629 HE2 LYS 79 HE2 LYS 79 13.896 9.736 9.643 630 HE3 LYS 79 HE3 LYS 79 15.003 8.406 9.301 631 HZ1 LYS 79 HZ1 LYS 79 16.187 9.856 7.761 632 HZ2 LYS 79 HZ2 LYS 79 16.170 10.502 9.318 633 HZ3 LYS 79 HZ3 LYS 79 15.146 11.133 8.128 634 H VAL 80 H VAL 80 12.014 11.666 2.947 635 HA VAL 80 HA VAL 80 10.629 9.573 1.373 636 HB VAL 80 HB VAL 80 9.649 11.977 1.066 637 HG11 VAL 80 HG11 VAL 80 10.759 13.431 -0.577 638 HG12 VAL 80 HG12 VAL 80 12.164 12.369 -0.581 639 HG13 VAL 80 HG13 VAL 80 11.727 13.244 0.887 640 HG21 VAL 80 HG21 VAL 80 9.071 10.113 -0.420 641 HG22 VAL 80 HG22 VAL 80 10.515 10.405 -1.392 642 HG23 VAL 80 HG23 VAL 80 9.225 11.609 -1.345 643 H GLN 81 H GLN 81 11.849 8.624 -0.186 644 HA GLN 81 HA GLN 81 14.624 9.283 -0.710 645 HB2 GLN 81 HB2 GLN 81 13.829 6.768 0.837 646 HB3 GLN 81 HB3 GLN 81 15.410 7.008 0.108 647 HG2 GLN 81 HG2 GLN 81 15.924 8.799 1.642 648 HG3 GLN 81 HG3 GLN 81 14.272 8.829 2.247 649 HE21 GLN 81 HE21 GLN 81 16.048 5.833 1.698 650 HE22 GLN 81 HE22 GLN 81 16.211 5.433 3.365 651 H ARG 82 H ARG 82 15.461 7.943 -2.474 652 HA ARG 82 HA ARG 82 13.681 5.995 -3.711 653 HB2 ARG 82 HB2 ARG 82 13.906 7.218 -5.991 654 HB3 ARG 82 HB3 ARG 82 12.739 7.828 -4.836 655 HG2 ARG 82 HG2 ARG 82 13.719 9.772 -5.669 656 HG3 ARG 82 HG3 ARG 82 14.545 9.523 -4.139 657 HD2 ARG 82 HD2 ARG 82 16.465 8.530 -5.408 658 HD3 ARG 82 HD3 ARG 82 15.634 8.937 -6.915 659 HE ARG 82 HE ARG 82 16.479 10.937 -4.891 660 HH11 ARG 82 HH11 ARG 82 16.087 10.029 -8.271 661 HH12 ARG 82 HH12 ARG 82 16.695 11.549 -8.855 662 HH21 ARG 82 HH21 ARG 82 17.229 12.913 -5.693 663 HH22 ARG 82 HH22 ARG 82 17.334 13.161 -7.407 664 H ASN 83 H ASN 83 14.763 4.454 -4.816 665 HA ASN 83 HA ASN 83 17.620 4.735 -5.473 666 HB2 ASN 83 HB2 ASN 83 16.468 2.669 -3.538 667 HB3 ASN 83 HB3 ASN 83 18.016 2.436 -4.341 668 HD21 ASN 83 HD21 ASN 83 19.788 3.781 -3.740 669 HD22 ASN 83 HD22 ASN 83 19.767 4.682 -2.267 670 H GLN 84 H GLN 84 18.078 3.719 -7.362 671 HA GLN 84 HA GLN 84 15.924 2.284 -8.736 672 HB2 GLN 84 HB2 GLN 84 18.653 3.212 -9.737 673 HB3 GLN 84 HB3 GLN 84 17.389 2.498 -10.740 674 HG2 GLN 84 HG2 GLN 84 15.903 4.384 -10.228 675 HG3 GLN 84 HG3 GLN 84 17.141 5.104 -9.204 676 HE21 GLN 84 HE21 GLN 84 15.808 6.198 -11.551 677 HE22 GLN 84 HE22 GLN 84 17.061 6.592 -12.676 678 H SER 85 H SER 85 15.852 0.340 -7.717 679 HA SER 85 HA SER 85 18.110 -1.528 -8.078 680 HB2 SER 85 HB2 SER 85 18.097 -0.754 -5.707 681 HB3 SER 85 HB3 SER 85 16.419 -1.264 -5.546 682 HG SER 85 HG SER 85 17.743 -2.870 -4.740 683 H ASP 86 H ASP 86 17.351 -3.811 -7.764 684 HA ASP 86 HA ASP 86 15.150 -4.320 -9.555 685 HB2 ASP 86 HB2 ASP 86 15.823 -6.711 -9.332 686 HB3 ASP 86 HB3 ASP 86 17.188 -5.678 -9.732 687 HA PRO 87 HA PRO 87 11.695 -4.611 -6.997 688 HB2 PRO 87 HB2 PRO 87 10.485 -7.079 -7.640 689 HB3 PRO 87 HB3 PRO 87 10.353 -5.586 -8.589 690 HG2 PRO 87 HG2 PRO 87 12.226 -7.898 -8.985 691 HG3 PRO 87 HG3 PRO 87 11.297 -6.976 -10.192 692 HD2 PRO 87 HD2 PRO 87 13.889 -6.478 -9.867 693 HD3 PRO 87 HD3 PRO 87 12.756 -5.125 -10.099 694 H THR 88 H THR 88 13.804 -7.440 -6.634 695 HA THR 88 HA THR 88 12.433 -8.686 -4.453 696 HB THR 88 HB THR 88 14.372 -10.121 -4.208 697 HG1 THR 88 HG1 THR 88 16.088 -9.159 -5.999 698 HG21 THR 88 HG21 THR 88 14.677 -10.957 -6.509 699 HG22 THR 88 HG22 THR 88 14.019 -9.457 -7.160 700 HG23 THR 88 HG23 THR 88 12.983 -10.539 -6.227 701 H MET 89 H MET 89 14.263 -5.853 -4.499 702 HA MET 89 HA MET 89 15.390 -5.533 -2.028 703 HB2 MET 89 HB2 MET 89 15.378 -3.754 -3.690 704 HB3 MET 89 HB3 MET 89 13.626 -3.630 -3.627 705 HG2 MET 89 HG2 MET 89 14.628 -1.752 -2.482 706 HG3 MET 89 HG3 MET 89 13.779 -2.762 -1.316 707 HE1 MET 89 HE1 MET 89 16.781 -1.231 0.704 708 HE2 MET 89 HE2 MET 89 15.028 -1.401 0.620 709 HE3 MET 89 HE3 MET 89 15.884 -0.450 -0.597 710 H PHE 90 H PHE 90 11.914 -5.517 -2.852 711 HA PHE 90 HA PHE 90 10.895 -4.697 -0.360 712 HB2 PHE 90 HB2 PHE 90 8.773 -5.019 -1.258 713 HB3 PHE 90 HB3 PHE 90 9.699 -4.987 -2.747 714 HD1 PHE 90 HD2 PHE 90 10.235 -7.219 -3.912 715 HD2 PHE 90 HD1 PHE 90 7.520 -6.951 -0.622 716 HE1 PHE 90 HE2 PHE 90 9.321 -9.424 -4.492 717 HE2 PHE 90 HE1 PHE 90 6.609 -9.166 -1.207 718 HZ PHE 90 HZ PHE 90 7.509 -10.398 -3.139 719 H ASN 91 H ASN 91 11.674 -7.890 -1.637 720 HA ASN 91 HA ASN 91 10.666 -9.438 0.535 721 HB2 ASN 91 HB2 ASN 91 10.904 -10.506 -1.606 722 HB3 ASN 91 HB3 ASN 91 12.590 -10.019 -1.753 723 HD21 ASN 91 HD21 ASN 91 10.392 -12.121 0.030 724 HD22 ASN 91 HD22 ASN 91 11.589 -13.286 0.469 725 H LYS 92 H LYS 92 13.824 -8.127 -0.338 726 HA LYS 92 HA LYS 92 15.437 -9.433 1.552 727 HB2 LYS 92 HB2 LYS 92 16.275 -8.241 -0.472 728 HB3 LYS 92 HB3 LYS 92 15.863 -6.700 0.271 729 HG2 LYS 92 HG2 LYS 92 18.248 -7.083 0.480 730 HG3 LYS 92 HG3 LYS 92 17.508 -7.160 2.083 731 HD2 LYS 92 HD2 LYS 92 17.550 -9.644 1.973 732 HD3 LYS 92 HD3 LYS 92 18.294 -9.558 0.374 733 HE2 LYS 92 HE2 LYS 92 20.264 -8.432 1.361 734 HE3 LYS 92 HE3 LYS 92 19.512 -8.526 2.957 735 HZ1 LYS 92 HZ1 LYS 92 21.102 -10.302 2.626 736 HZ2 LYS 92 HZ2 LYS 92 20.268 -10.844 1.261 737 HZ3 LYS 92 HZ3 LYS 92 19.543 -10.940 2.784 738 H ILE 93 H ILE 93 13.732 -6.299 1.794 739 HA ILE 93 HA ILE 93 14.699 -5.749 4.479 740 HB ILE 93 HB ILE 93 13.141 -3.796 4.409 741 HG12 ILE 93 HG12 ILE 93 12.088 -5.260 2.014 742 HG13 ILE 93 HG13 ILE 93 11.244 -4.238 3.161 743 HG21 ILE 93 HG21 ILE 93 14.874 -4.052 1.931 744 HG22 ILE 93 HG22 ILE 93 15.428 -3.572 3.537 745 HG23 ILE 93 HG23 ILE 93 14.304 -2.542 2.649 746 HD11 ILE 93 HD11 ILE 93 11.130 -3.298 0.974 747 HD12 ILE 93 HD12 ILE 93 12.884 -3.336 0.804 748 HD13 ILE 93 HD13 ILE 93 12.134 -2.264 1.986 749 H ALA 94 H ALA 94 11.872 -7.272 3.036 750 HA ALA 94 HA ALA 94 10.055 -7.109 5.190 751 HB1 ALA 94 HB1 ALA 94 10.242 -9.261 3.053 752 HB2 ALA 94 HB2 ALA 94 9.375 -7.730 2.909 753 HB3 ALA 94 HB3 ALA 94 8.840 -8.936 4.081 754 H VAL 95 H VAL 95 12.678 -9.402 4.519 755 HA VAL 95 HA VAL 95 11.931 -11.279 6.561 756 HB VAL 95 HB VAL 95 14.074 -12.384 6.199 757 HG11 VAL 95 HG11 VAL 95 12.277 -12.812 4.580 758 HG12 VAL 95 HG12 VAL 95 13.853 -12.906 3.792 759 HG13 VAL 95 HG13 VAL 95 12.837 -11.478 3.566 760 HG21 VAL 95 HG21 VAL 95 15.556 -10.429 6.021 761 HG22 VAL 95 HG22 VAL 95 14.854 -10.016 4.456 762 HG23 VAL 95 HG23 VAL 95 15.778 -11.508 4.642 763 H PHE 96 H PHE 96 13.741 -8.302 6.636 764 HA PHE 96 HA PHE 96 14.923 -8.845 9.255 765 HB2 PHE 96 HB2 PHE 96 15.021 -6.360 7.490 766 HB3 PHE 96 HB3 PHE 96 15.856 -6.515 9.033 767 HD1 PHE 96 HD2 PHE 96 17.242 -8.925 9.150 768 HD2 PHE 96 HD1 PHE 96 16.444 -6.619 5.634 769 HE1 PHE 96 HE2 PHE 96 19.181 -9.947 8.030 770 HE2 PHE 96 HE1 PHE 96 18.385 -7.650 4.522 771 HZ PHE 96 HZ PHE 96 19.754 -9.312 5.719 772 H PHE 97 H PHE 97 12.255 -7.003 7.866 773 HA PHE 97 HA PHE 97 10.430 -5.973 8.698 774 HB2 PHE 97 HB2 PHE 97 10.116 -8.104 9.958 775 HB3 PHE 97 HB3 PHE 97 11.056 -7.457 11.295 776 HD1 PHE 97 HD2 PHE 97 8.026 -6.550 9.244 777 HD2 PHE 97 HD1 PHE 97 9.829 -6.583 13.127 778 HE1 PHE 97 HE2 PHE 97 5.973 -5.601 10.211 779 HE2 PHE 97 HE1 PHE 97 7.766 -5.629 14.085 780 HZ PHE 97 HZ PHE 97 5.840 -5.140 12.627 781 H GLN 98 H GLN 98 13.253 -4.869 9.142 782 HA GLN 98 HA GLN 98 12.606 -2.729 11.081 783 HB2 GLN 98 HB2 GLN 98 15.298 -4.114 10.679 784 HB3 GLN 98 HB3 GLN 98 15.044 -2.689 11.688 785 HG2 GLN 98 HG2 GLN 98 13.552 -3.969 13.161 786 HG3 GLN 98 HG3 GLN 98 13.730 -5.390 12.132 787 HE21 GLN 98 HE21 GLN 98 15.731 -6.506 12.133 788 HE22 GLN 98 HE22 GLN 98 16.859 -6.328 13.432 789 H1 GLY 1 H1 GLY 1 1.555 1.963 15.579 790 H2 GLY 1 H2 GLY 1 2.084 1.498 14.044 791 H3 GLY 1 H3 GLY 1 2.576 2.978 14.692 792 HA2 GLY 1 HA3 GLY 1 4.363 1.382 14.835 793 HA3 GLY 1 HA2 GLY 1 3.805 1.863 16.431 794 H SER 2 H SER 2 4.314 -0.751 14.287 795 HA SER 2 HA SER 2 2.480 -2.637 15.519 796 HB2 SER 2 HB2 SER 2 3.064 -2.674 13.077 797 HB3 SER 2 HB3 SER 2 4.705 -3.148 13.500 798 HG SER 2 HG SER 2 3.232 -4.889 12.929 799 H MET 3 H MET 3 3.716 -4.941 15.800 800 HA MET 3 HA MET 3 6.222 -4.976 17.162 801 HB2 MET 3 HB2 MET 3 4.581 -3.888 18.853 802 HB3 MET 3 HB3 MET 3 3.759 -5.437 18.925 803 HG2 MET 3 HG2 MET 3 5.696 -6.490 19.888 804 HG3 MET 3 HG3 MET 3 6.680 -5.054 19.611 805 HE1 MET 3 HE1 MET 3 5.209 -2.504 22.191 806 HE2 MET 3 HE2 MET 3 4.850 -2.648 20.472 807 HE3 MET 3 HE3 MET 3 6.511 -2.813 21.042 808 H GLN 4 H GLN 4 6.417 -7.379 18.211 809 HA GLN 4 HA GLN 4 5.523 -9.305 16.267 810 HB2 GLN 4 HB2 GLN 4 7.709 -9.400 17.656 811 HB3 GLN 4 HB3 GLN 4 6.716 -9.924 19.008 812 HG2 GLN 4 HG2 GLN 4 7.646 -11.895 18.056 813 HG3 GLN 4 HG3 GLN 4 5.952 -11.869 17.560 814 HE21 GLN 4 HE21 GLN 4 5.473 -11.446 15.344 815 HE22 GLN 4 HE22 GLN 4 6.675 -11.593 14.119 816 H ASN 5 H ASN 5 3.243 -8.982 16.352 817 HA ASN 5 HA ASN 5 1.761 -9.208 18.841 818 HB2 ASN 5 HB2 ASN 5 1.134 -7.540 17.086 819 HB3 ASN 5 HB3 ASN 5 0.751 -8.862 15.983 820 HD21 ASN 5 HD21 ASN 5 -1.407 -8.178 15.806 821 HD22 ASN 5 HD22 ASN 5 -2.542 -8.399 17.088 822 H THR 6 H THR 6 1.692 -11.214 19.606 823 HA THR 6 HA THR 6 1.553 -13.613 18.042 824 HB THR 6 HB THR 6 1.024 -13.332 21.036 825 HG1 THR 6 HG1 THR 6 3.165 -12.479 19.804 826 HG21 THR 6 HG21 THR 6 2.310 -15.600 19.455 827 HG22 THR 6 HG22 THR 6 0.645 -15.603 20.044 828 HG23 THR 6 HG23 THR 6 1.986 -15.581 21.190 829 H THR 7 H THR 7 -0.762 -11.429 19.398 830 HA THR 7 HA THR 7 -3.042 -13.200 19.424 831 HB THR 7 HB THR 7 -2.941 -10.148 19.617 832 HG1 THR 7 HG1 THR 7 -2.695 -12.204 21.567 833 HG21 THR 7 HG21 THR 7 -5.090 -12.107 20.532 834 HG22 THR 7 HG22 THR 7 -5.229 -11.001 19.162 835 HG23 THR 7 HG23 THR 7 -5.106 -10.364 20.804 836 H HIS 8 H HIS 8 -4.794 -13.124 17.960 837 HA HIS 8 HA HIS 8 -4.214 -12.072 15.254 838 HB2 HIS 8 HB2 HIS 8 -6.141 -14.260 16.149 839 HB3 HIS 8 HB3 HIS 8 -5.883 -13.754 14.479 840 HD1 HIS 8 HD1 HIS 8 -2.596 -13.620 15.328 841 HD2 HIS 8 HD2 HIS 8 -5.227 -16.834 15.215 842 HE1 HIS 8 HE1 HIS 8 -1.161 -15.662 15.091 843 HE2 HIS 8 HE2 HIS 8 -2.784 -17.553 14.825 844 H ASP 9 H ASP 9 -5.165 -10.358 17.384 845 HA ASP 9 HA ASP 9 -7.859 -9.574 16.824 846 HB2 ASP 9 HB2 ASP 9 -7.336 -7.486 17.961 847 HB3 ASP 9 HB3 ASP 9 -6.638 -8.822 18.862 848 H ASN 10 H ASN 10 -4.718 -8.914 15.413 849 HA ASN 10 HA ASN 10 -5.698 -7.116 13.385 850 HB2 ASN 10 HB2 ASN 10 -3.468 -7.165 12.446 851 HB3 ASN 10 HB3 ASN 10 -3.278 -7.128 14.192 852 HD21 ASN 10 HD21 ASN 10 -2.743 -8.972 11.299 853 HD22 ASN 10 HD22 ASN 10 -1.839 -10.248 12.029 854 H VAL 11 H VAL 11 -6.106 -7.630 11.250 855 HA VAL 11 HA VAL 11 -6.533 -10.464 10.576 856 HB VAL 11 HB VAL 11 -8.431 -9.773 9.100 857 HG11 VAL 11 HG11 VAL 11 -8.894 -10.646 11.336 858 HG12 VAL 11 HG12 VAL 11 -10.105 -9.453 10.875 859 HG13 VAL 11 HG13 VAL 11 -8.825 -9.018 12.014 860 HG21 VAL 11 HG21 VAL 11 -7.843 -7.375 8.750 861 HG22 VAL 11 HG22 VAL 11 -8.267 -7.034 10.430 862 HG23 VAL 11 HG23 VAL 11 -9.510 -7.574 9.301 863 H ILE 12 H ILE 12 -5.662 -11.101 8.778 864 HA ILE 12 HA ILE 12 -4.103 -9.346 7.068 865 HB ILE 12 HB ILE 12 -4.560 -12.358 6.775 866 HG12 ILE 12 HG12 ILE 12 -3.676 -11.920 9.056 867 HG13 ILE 12 HG13 ILE 12 -2.505 -12.775 8.067 868 HG21 ILE 12 HG21 ILE 12 -3.611 -11.235 4.803 869 HG22 ILE 12 HG22 ILE 12 -2.449 -12.338 5.534 870 HG23 ILE 12 HG23 ILE 12 -2.288 -10.599 5.787 871 HD11 ILE 12 HD11 ILE 12 -1.441 -11.110 9.450 872 HD12 ILE 12 HD12 ILE 12 -2.457 -9.842 8.768 873 HD13 ILE 12 HD13 ILE 12 -1.275 -10.671 7.751 874 H LEU 13 H LEU 13 -5.733 -8.145 6.074 875 HA LEU 13 HA LEU 13 -8.013 -9.494 4.849 876 HB2 LEU 13 HB2 LEU 13 -7.982 -7.210 6.207 877 HB3 LEU 13 HB3 LEU 13 -7.547 -6.510 4.661 878 HG LEU 13 HG LEU 13 -10.085 -8.120 5.198 879 HD11 LEU 13 HD11 LEU 13 -11.275 -5.990 5.063 880 HD12 LEU 13 HD12 LEU 13 -9.741 -5.133 4.919 881 HD13 LEU 13 HD13 LEU 13 -10.124 -6.014 6.397 882 HD21 LEU 13 HD21 LEU 13 -9.307 -6.551 2.715 883 HD22 LEU 13 HD22 LEU 13 -10.874 -7.311 3.010 884 HD23 LEU 13 HD23 LEU 13 -9.431 -8.307 2.850 885 H GLU 14 H GLU 14 -7.530 -10.428 3.016 886 HA GLU 14 HA GLU 14 -5.534 -9.434 1.150 887 HB2 GLU 14 HB2 GLU 14 -7.384 -11.790 0.646 888 HB3 GLU 14 HB3 GLU 14 -5.746 -11.531 0.065 889 HG2 GLU 14 HG2 GLU 14 -4.944 -11.882 2.429 890 HG3 GLU 14 HG3 GLU 14 -6.598 -12.301 2.866 891 H LEU 15 H LEU 15 -6.029 -8.347 -0.714 892 HA LEU 15 HA LEU 15 -8.537 -8.843 -2.049 893 HB2 LEU 15 HB2 LEU 15 -8.864 -6.272 -2.429 894 HB3 LEU 15 HB3 LEU 15 -9.459 -7.032 -0.969 895 HG LEU 15 HG LEU 15 -7.188 -6.193 0.095 896 HD11 LEU 15 HD11 LEU 15 -7.402 -4.264 -2.227 897 HD12 LEU 15 HD12 LEU 15 -6.097 -5.411 -1.920 898 HD13 LEU 15 HD13 LEU 15 -6.362 -4.070 -0.813 899 HD21 LEU 15 HD21 LEU 15 -8.252 -4.104 0.792 900 HD22 LEU 15 HD22 LEU 15 -9.392 -5.447 0.811 901 HD23 LEU 15 HD23 LEU 15 -9.446 -4.267 -0.500 902 H THR 16 H THR 16 -7.910 -9.482 -3.915 903 HA THR 16 HA THR 16 -5.455 -8.542 -5.166 904 HB THR 16 HB THR 16 -7.473 -10.604 -6.168 905 HG1 THR 16 HG1 THR 16 -6.296 -12.102 -5.114 906 HG21 THR 16 HG21 THR 16 -4.585 -10.081 -6.987 907 HG22 THR 16 HG22 THR 16 -6.008 -9.609 -7.925 908 HG23 THR 16 HG23 THR 16 -5.652 -11.320 -7.656 909 H VAL 17 H VAL 17 -5.727 -6.559 -6.049 910 HA VAL 17 HA VAL 17 -8.218 -5.965 -7.535 911 HB VAL 17 HB VAL 17 -7.960 -3.685 -7.093 912 HG11 VAL 17 HG11 VAL 17 -7.054 -5.111 -4.567 913 HG12 VAL 17 HG12 VAL 17 -8.722 -4.889 -5.116 914 HG13 VAL 17 HG13 VAL 17 -7.768 -3.489 -4.621 915 HG21 VAL 17 HG21 VAL 17 -5.108 -4.128 -6.144 916 HG22 VAL 17 HG22 VAL 17 -5.966 -2.588 -6.063 917 HG23 VAL 17 HG23 VAL 17 -5.605 -3.316 -7.628 918 H ARG 18 H ARG 18 -8.107 -5.623 -9.673 919 HA ARG 18 HA ARG 18 -5.596 -5.837 -11.087 920 HB2 ARG 18 HB2 ARG 18 -7.006 -5.653 -13.149 921 HB3 ARG 18 HB3 ARG 18 -7.426 -6.991 -12.090 922 HG2 ARG 18 HG2 ARG 18 -9.348 -5.658 -11.222 923 HG3 ARG 18 HG3 ARG 18 -8.943 -4.379 -12.374 924 HD2 ARG 18 HD2 ARG 18 -9.736 -7.227 -13.059 925 HD3 ARG 18 HD3 ARG 18 -10.747 -5.795 -13.243 926 HE ARG 18 HE ARG 18 -8.208 -5.775 -14.690 927 HH11 ARG 18 HH11 ARG 18 -11.661 -6.449 -14.910 928 HH12 ARG 18 HH12 ARG 18 -11.682 -6.351 -16.643 929 HH21 ARG 18 HH21 ARG 18 -8.252 -5.657 -16.946 930 HH22 ARG 18 HH22 ARG 18 -9.746 -5.901 -17.802 931 H ASN 19 H ASN 19 -4.516 -4.234 -12.123 932 HA ASN 19 HA ASN 19 -4.686 -1.743 -10.716 933 HB2 ASN 19 HB2 ASN 19 -2.664 -2.706 -12.782 934 HB3 ASN 19 HB3 ASN 19 -2.510 -1.226 -11.837 935 HD21 ASN 19 HD21 ASN 19 -0.611 -1.866 -10.809 936 HD22 ASN 19 HD22 ASN 19 -0.542 -3.139 -9.642 937 H HIS 20 H HIS 20 -6.735 -1.074 -11.635 938 HA HIS 20 HA HIS 20 -6.633 0.386 -14.176 939 HB2 HIS 20 HB2 HIS 20 -8.732 0.606 -11.960 940 HB3 HIS 20 HB3 HIS 20 -8.889 1.181 -13.611 941 HD1 HIS 20 HD1 HIS 20 -8.620 -1.021 -15.415 942 HD2 HIS 20 HD2 HIS 20 -10.110 -1.669 -11.591 943 HE1 HIS 20 HE1 HIS 20 -9.946 -3.151 -15.553 944 HE2 HIS 20 HE2 HIS 20 -11.010 -3.386 -13.288 945 HA PRO 21 HA PRO 21 -4.859 4.212 -12.630 946 HB2 PRO 21 HB2 PRO 21 -7.310 5.687 -13.592 947 HB3 PRO 21 HB3 PRO 21 -5.593 6.001 -13.934 948 HG2 PRO 21 HG2 PRO 21 -7.113 4.873 -15.786 949 HG3 PRO 21 HG3 PRO 21 -5.451 4.293 -15.527 950 HD2 PRO 21 HD2 PRO 21 -8.044 3.045 -14.638 951 HD3 PRO 21 HD3 PRO 21 -6.574 2.268 -15.274 952 H GLY 22 H GLY 22 -4.888 3.972 -10.412 953 HA2 GLY 22 HA2 GLY 22 -5.165 5.188 -8.425 954 HA3 GLY 22 HA3 GLY 22 -6.714 5.777 -8.990 955 H VAL 23 H VAL 23 -6.026 2.326 -9.098 956 HA VAL 23 HA VAL 23 -8.200 1.714 -7.334 957 HB VAL 23 HB VAL 23 -7.560 -0.658 -7.570 958 HG11 VAL 23 HG11 VAL 23 -8.946 0.398 -9.277 959 HG12 VAL 23 HG12 VAL 23 -7.895 -0.817 -10.007 960 HG13 VAL 23 HG13 VAL 23 -7.508 0.897 -10.174 961 HG21 VAL 23 HG21 VAL 23 -5.157 0.339 -9.158 962 HG22 VAL 23 HG22 VAL 23 -5.659 -1.351 -8.975 963 HG23 VAL 23 HG23 VAL 23 -5.097 -0.438 -7.570 964 H MET 24 H MET 24 -4.760 2.050 -6.852 965 HA MET 24 HA MET 24 -4.496 0.939 -4.271 966 HB2 MET 24 HB2 MET 24 -3.004 3.419 -5.239 967 HB3 MET 24 HB3 MET 24 -2.471 2.256 -4.036 968 HG2 MET 24 HG2 MET 24 -1.172 1.826 -5.962 969 HG3 MET 24 HG3 MET 24 -2.381 0.543 -5.931 970 HE1 MET 24 HE1 MET 24 -1.335 3.980 -7.614 971 HE2 MET 24 HE2 MET 24 -2.967 4.314 -7.029 972 HE3 MET 24 HE3 MET 24 -2.658 4.210 -8.760 973 H THR 25 H THR 25 -5.602 4.081 -5.434 974 HA THR 25 HA THR 25 -5.841 5.399 -2.918 975 HB THR 25 HB THR 25 -7.337 6.139 -5.472 976 HG1 THR 25 HG1 THR 25 -5.147 7.468 -5.529 977 HG21 THR 25 HG21 THR 25 -6.994 8.458 -4.677 978 HG22 THR 25 HG22 THR 25 -6.163 7.858 -3.242 979 HG23 THR 25 HG23 THR 25 -7.881 7.516 -3.476 980 H HIS 26 H HIS 26 -7.997 3.388 -4.865 981 HA HIS 26 HA HIS 26 -10.473 3.852 -3.612 982 HB2 HIS 26 HB2 HIS 26 -9.356 1.359 -4.962 983 HB3 HIS 26 HB3 HIS 26 -10.971 1.379 -4.268 984 HD1 HIS 26 HD1 HIS 26 -11.981 0.942 -6.584 985 HD2 HIS 26 HD2 HIS 26 -9.849 4.496 -6.333 986 HE1 HIS 26 HE1 HIS 26 -12.582 2.232 -8.649 987 HE2 HIS 26 HE2 HIS 26 -11.423 4.444 -8.375 988 H VAL 27 H VAL 27 -8.134 1.204 -2.979 989 HA VAL 27 HA VAL 27 -9.562 0.132 -0.800 990 HB VAL 27 HB VAL 27 -7.629 -1.320 -0.395 991 HG11 VAL 27 HG11 VAL 27 -7.438 -2.345 -2.652 992 HG12 VAL 27 HG12 VAL 27 -8.121 -0.884 -3.371 993 HG13 VAL 27 HG13 VAL 27 -9.097 -1.874 -2.282 994 HG21 VAL 27 HG21 VAL 27 -5.778 0.306 -0.623 995 HG22 VAL 27 HG22 VAL 27 -6.059 0.401 -2.361 996 HG23 VAL 27 HG23 VAL 27 -5.503 -1.113 -1.641 997 H CYS 28 H CYS 28 -6.734 2.311 -0.884 998 HA CYS 28 HA CYS 28 -6.308 2.484 1.901 999 HB2 CYS 28 HB2 CYS 28 -5.556 4.360 -0.372 1000 HB3 CYS 28 HB3 CYS 28 -4.958 4.530 1.279 1001 HG CYS 28 HG CYS 28 -3.822 2.652 -1.156 1002 H GLY 29 H GLY 29 -8.343 4.315 -0.327 1003 HA2 GLY 29 HA2 GLY 29 -9.152 6.392 1.446 1004 HA3 GLY 29 HA3 GLY 29 -9.970 5.897 -0.032 1005 H LEU 30 H LEU 30 -10.376 3.162 0.743 1006 HA LEU 30 HA LEU 30 -12.877 3.477 2.123 1007 HB2 LEU 30 HB2 LEU 30 -11.481 1.093 0.887 1008 HB3 LEU 30 HB3 LEU 30 -13.042 0.964 1.692 1009 HG LEU 30 HG LEU 30 -12.513 2.804 -0.686 1010 HD11 LEU 30 HD11 LEU 30 -13.908 0.121 -0.710 1011 HD12 LEU 30 HD12 LEU 30 -12.317 0.472 -1.393 1012 HD13 LEU 30 HD13 LEU 30 -13.753 1.238 -2.070 1013 HD21 LEU 30 HD21 LEU 30 -14.952 3.026 -0.799 1014 HD22 LEU 30 HD22 LEU 30 -14.338 3.577 0.757 1015 HD23 LEU 30 HD23 LEU 30 -15.131 2.000 0.628 1016 H PHE 31 H PHE 31 -9.691 2.260 3.029 1017 HA PHE 31 HA PHE 31 -10.596 1.313 5.626 1018 HB2 PHE 31 HB2 PHE 31 -7.828 1.677 4.428 1019 HB3 PHE 31 HB3 PHE 31 -8.070 1.176 6.104 1020 HD1 PHE 31 HD2 PHE 31 -9.482 -0.920 6.557 1021 HD2 PHE 31 HD1 PHE 31 -7.947 0.036 2.685 1022 HE1 PHE 31 HE2 PHE 31 -9.835 -3.244 5.829 1023 HE2 PHE 31 HE1 PHE 31 -8.320 -2.280 1.960 1024 HZ PHE 31 HZ PHE 31 -9.258 -3.922 3.531 1025 H ALA 32 H ALA 32 -9.170 4.258 4.330 1026 HA ALA 32 HA ALA 32 -8.664 5.627 6.746 1027 HB1 ALA 32 HB1 ALA 32 -9.417 6.778 4.034 1028 HB2 ALA 32 HB2 ALA 32 -7.787 6.372 4.571 1029 HB3 ALA 32 HB3 ALA 32 -8.673 7.669 5.371 1030 H ARG 33 H ARG 33 -11.533 5.677 4.604 1031 HA ARG 33 HA ARG 33 -13.065 7.396 6.351 1032 HB2 ARG 33 HB2 ARG 33 -14.812 7.282 4.689 1033 HB3 ARG 33 HB3 ARG 33 -13.279 7.418 3.837 1034 HG2 ARG 33 HG2 ARG 33 -13.332 4.948 3.433 1035 HG3 ARG 33 HG3 ARG 33 -14.919 4.886 4.199 1036 HD2 ARG 33 HD2 ARG 33 -14.235 6.468 1.696 1037 HD3 ARG 33 HD3 ARG 33 -15.067 4.911 1.729 1038 HE ARG 33 HE ARG 33 -16.718 6.296 3.240 1039 HH11 ARG 33 HH11 ARG 33 -15.176 7.363 0.256 1040 HH12 ARG 33 HH12 ARG 33 -16.480 8.427 -0.171 1041 HH21 ARG 33 HH21 ARG 33 -18.425 7.673 2.644 1042 HH22 ARG 33 HH22 ARG 33 -18.318 8.601 1.180 1043 H ARG 34 H ARG 34 -12.423 4.077 6.400 1044 HA ARG 34 HA ARG 34 -14.869 2.962 7.301 1045 HB2 ARG 34 HB2 ARG 34 -12.967 1.563 6.535 1046 HB3 ARG 34 HB3 ARG 34 -11.991 2.114 7.889 1047 HG2 ARG 34 HG2 ARG 34 -13.656 1.012 9.439 1048 HG3 ARG 34 HG3 ARG 34 -14.459 0.348 8.013 1049 HD2 ARG 34 HD2 ARG 34 -12.920 -1.288 9.067 1050 HD3 ARG 34 HD3 ARG 34 -12.421 -0.891 7.414 1051 HE ARG 34 HE ARG 34 -10.532 0.184 8.244 1052 HH11 ARG 34 HH11 ARG 34 -12.603 -0.732 10.929 1053 HH12 ARG 34 HH12 ARG 34 -11.381 -0.435 12.123 1054 HH21 ARG 34 HH21 ARG 34 -8.945 0.591 9.855 1055 HH22 ARG 34 HH22 ARG 34 -9.340 0.304 11.523 1056 H ALA 35 H ALA 35 -11.938 3.805 9.171 1057 HA ALA 35 HA ALA 35 -13.182 5.349 11.172 1058 HB1 ALA 35 HB1 ALA 35 -13.086 3.797 13.105 1059 HB2 ALA 35 HB2 ALA 35 -12.629 2.474 12.026 1060 HB3 ALA 35 HB3 ALA 35 -14.218 3.222 11.879 1061 H PHE 36 H PHE 36 -10.674 2.838 10.874 1062 HA PHE 36 HA PHE 36 -8.608 4.727 11.859 1063 HB2 PHE 36 HB2 PHE 36 -9.211 3.114 13.635 1064 HB3 PHE 36 HB3 PHE 36 -8.970 1.768 12.533 1065 HD1 PHE 36 HD1 PHE 36 -7.099 4.647 14.078 1066 HD2 PHE 36 HD2 PHE 36 -6.887 0.654 12.544 1067 HE1 PHE 36 HE1 PHE 36 -4.755 4.477 14.807 1068 HE2 PHE 36 HE2 PHE 36 -4.544 0.499 13.280 1069 HZ PHE 36 HZ PHE 36 -3.479 2.408 14.414 1070 H ASN 37 H ASN 37 -6.444 4.190 11.157 1071 HA ASN 37 HA ASN 37 -6.216 3.719 8.358 1072 HB2 ASN 37 HB2 ASN 37 -4.039 3.953 10.490 1073 HB3 ASN 37 HB3 ASN 37 -3.784 4.093 8.752 1074 HD21 ASN 37 HD21 ASN 37 -3.413 5.980 11.076 1075 HD22 ASN 37 HD22 ASN 37 -4.230 7.418 10.589 1076 H VAL 38 H VAL 38 -4.247 2.275 7.631 1077 HA VAL 38 HA VAL 38 -4.467 -0.450 8.752 1078 HB VAL 38 HB VAL 38 -3.086 0.476 6.179 1079 HG11 VAL 38 HG11 VAL 38 -2.134 -1.620 7.050 1080 HG12 VAL 38 HG12 VAL 38 -3.049 -1.923 5.572 1081 HG13 VAL 38 HG13 VAL 38 -3.745 -2.336 7.142 1082 HG21 VAL 38 HG21 VAL 38 -5.511 0.833 6.018 1083 HG22 VAL 38 HG22 VAL 38 -5.809 -0.836 6.512 1084 HG23 VAL 38 HG23 VAL 38 -5.013 -0.501 4.973 1085 H GLU 39 H GLU 39 -2.600 -1.516 9.520 1086 HA GLU 39 HA GLU 39 -0.463 0.200 10.513 1087 HB2 GLU 39 HB2 GLU 39 -1.666 -1.533 11.935 1088 HB3 GLU 39 HB3 GLU 39 -0.925 -2.789 10.949 1089 HG2 GLU 39 HG2 GLU 39 0.274 -2.534 13.047 1090 HG3 GLU 39 HG3 GLU 39 1.304 -2.062 11.697 1091 H GLY 40 H GLY 40 -0.801 -2.800 8.561 1092 HA2 GLY 40 HA2 GLY 40 1.841 -2.277 7.282 1093 HA3 GLY 40 HA3 GLY 40 1.415 -3.872 7.889 1094 H ILE 41 H ILE 41 1.915 -2.622 5.105 1095 HA ILE 41 HA ILE 41 -0.446 -3.795 3.727 1096 HB ILE 41 HB ILE 41 1.119 -1.334 2.784 1097 HG12 ILE 41 HG12 ILE 41 -1.723 -1.428 3.899 1098 HG13 ILE 41 HG13 ILE 41 -0.323 -0.799 4.755 1099 HG21 ILE 41 HG21 ILE 41 0.258 -2.669 0.908 1100 HG22 ILE 41 HG22 ILE 41 -0.577 -1.119 1.016 1101 HG23 ILE 41 HG23 ILE 41 -1.371 -2.589 1.586 1102 HD11 ILE 41 HD11 ILE 41 -1.535 0.345 2.239 1103 HD12 ILE 41 HD12 ILE 41 -0.094 0.963 3.051 1104 HD13 ILE 41 HD13 ILE 41 -1.653 1.002 3.871 1105 H LEU 42 H LEU 42 0.058 -5.007 1.872 1106 HA LEU 42 HA LEU 42 2.758 -4.990 0.773 1107 HB2 LEU 42 HB2 LEU 42 3.013 -6.717 2.464 1108 HB3 LEU 42 HB3 LEU 42 1.512 -7.494 1.980 1109 HG LEU 42 HG LEU 42 2.535 -8.157 -0.185 1110 HD11 LEU 42 HD11 LEU 42 4.929 -7.903 -0.605 1111 HD12 LEU 42 HD12 LEU 42 5.085 -6.914 0.851 1112 HD13 LEU 42 HD13 LEU 42 4.107 -6.345 -0.504 1113 HD21 LEU 42 HD21 LEU 42 4.179 -9.007 2.206 1114 HD22 LEU 42 HD22 LEU 42 4.080 -9.857 0.659 1115 HD23 LEU 42 HD23 LEU 42 2.649 -9.712 1.678 1116 H CYS 43 H CYS 43 2.003 -4.301 -1.176 1117 HA CYS 43 HA CYS 43 -0.019 -5.810 -2.655 1118 HB2 CYS 43 HB2 CYS 43 0.024 -3.361 -2.891 1119 HB3 CYS 43 HB3 CYS 43 1.691 -3.419 -3.450 1120 HG CYS 43 HG CYS 43 1.220 -4.165 -5.931 1121 H LEU 44 H LEU 44 0.768 -7.751 -3.183 1122 HA LEU 44 HA LEU 44 3.457 -8.186 -4.228 1123 HB2 LEU 44 HB2 LEU 44 2.176 -9.763 -2.636 1124 HB3 LEU 44 HB3 LEU 44 1.179 -10.189 -4.012 1125 HG LEU 44 HG LEU 44 3.325 -10.959 -5.182 1126 HD11 LEU 44 HD11 LEU 44 5.267 -11.469 -3.764 1127 HD12 LEU 44 HD12 LEU 44 4.486 -10.678 -2.392 1128 HD13 LEU 44 HD13 LEU 44 4.941 -9.736 -3.814 1129 HD21 LEU 44 HD21 LEU 44 3.391 -13.122 -3.981 1130 HD22 LEU 44 HD22 LEU 44 1.743 -12.566 -4.245 1131 HD23 LEU 44 HD23 LEU 44 2.479 -12.408 -2.649 1132 HA PRO 45 HA PRO 45 1.419 -7.191 -8.204 1133 HB2 PRO 45 HB2 PRO 45 3.708 -6.998 -9.730 1134 HB3 PRO 45 HB3 PRO 45 3.150 -5.709 -8.650 1135 HG2 PRO 45 HG2 PRO 45 5.291 -7.750 -8.189 1136 HG3 PRO 45 HG3 PRO 45 5.277 -6.020 -7.781 1137 HD2 PRO 45 HD2 PRO 45 4.772 -7.976 -5.939 1138 HD3 PRO 45 HD3 PRO 45 4.059 -6.348 -5.837 1139 H ILE 46 H ILE 46 0.385 -8.781 -9.204 1140 HA ILE 46 HA ILE 46 1.319 -11.494 -9.261 1141 HB ILE 46 HB ILE 46 -1.189 -10.224 -10.425 1142 HG12 ILE 46 HG12 ILE 46 -1.128 -10.078 -7.974 1143 HG13 ILE 46 HG13 ILE 46 -2.348 -11.245 -8.464 1144 HG21 ILE 46 HG21 ILE 46 -0.546 -13.181 -10.159 1145 HG22 ILE 46 HG22 ILE 46 -0.722 -12.274 -11.665 1146 HG23 ILE 46 HG23 ILE 46 -2.117 -12.513 -10.615 1147 HD11 ILE 46 HD11 ILE 46 -1.142 -12.024 -6.524 1148 HD12 ILE 46 HD12 ILE 46 0.397 -11.880 -7.370 1149 HD13 ILE 46 HD13 ILE 46 -0.792 -13.076 -7.896 1150 H GLN 47 H GLN 47 2.742 -12.161 -10.683 1151 HA GLN 47 HA GLN 47 3.496 -10.958 -13.115 1152 HB2 GLN 47 HB2 GLN 47 4.845 -13.070 -13.447 1153 HB3 GLN 47 HB3 GLN 47 5.082 -12.278 -11.900 1154 HG2 GLN 47 HG2 GLN 47 3.564 -13.913 -10.821 1155 HG3 GLN 47 HG3 GLN 47 3.354 -14.723 -12.371 1156 HE21 GLN 47 HE21 GLN 47 5.604 -14.050 -9.766 1157 HE22 GLN 47 HE22 GLN 47 6.724 -15.309 -10.153 1158 H ASP 48 H ASP 48 0.991 -13.199 -12.426 1159 HA ASP 48 HA ASP 48 0.846 -14.637 -14.840 1160 HB2 ASP 48 HB2 ASP 48 -0.157 -15.658 -12.975 1161 HB3 ASP 48 HB3 ASP 48 -0.994 -14.195 -12.486 1162 H SER 49 H SER 49 -0.815 -11.658 -13.779 1163 HA SER 49 HA SER 49 -1.405 -10.827 -16.470 1164 HB2 SER 49 HB2 SER 49 -3.951 -10.779 -16.060 1165 HB3 SER 49 HB3 SER 49 -3.247 -12.366 -16.362 1166 HG SER 49 HG SER 49 -3.936 -12.956 -14.505 1167 H ASP 50 H ASP 50 -3.213 -8.866 -16.191 1168 HA ASP 50 HA ASP 50 -1.738 -6.870 -14.754 1169 HB2 ASP 50 HB2 ASP 50 -3.438 -5.277 -15.680 1170 HB3 ASP 50 HB3 ASP 50 -2.682 -6.278 -16.905 1171 H LYS 51 H LYS 51 -1.972 -7.810 -12.617 1172 HA LYS 51 HA LYS 51 -3.855 -6.358 -11.057 1173 HB2 LYS 51 HB2 LYS 51 -4.931 -8.274 -9.893 1174 HB3 LYS 51 HB3 LYS 51 -5.377 -8.196 -11.592 1175 HG2 LYS 51 HG2 LYS 51 -3.824 -10.052 -12.094 1176 HG3 LYS 51 HG3 LYS 51 -3.349 -10.108 -10.392 1177 HD2 LYS 51 HD2 LYS 51 -5.761 -10.583 -9.804 1178 HD3 LYS 51 HD3 LYS 51 -6.111 -10.697 -11.527 1179 HE2 LYS 51 HE2 LYS 51 -4.081 -12.448 -10.105 1180 HE3 LYS 51 HE3 LYS 51 -5.765 -12.903 -10.350 1181 HZ1 LYS 51 HZ1 LYS 51 -5.419 -12.758 -12.728 1182 HZ2 LYS 51 HZ2 LYS 51 -4.337 -13.856 -12.036 1183 HZ3 LYS 51 HZ3 LYS 51 -3.808 -12.317 -12.496 1184 H SER 52 H SER 52 -3.557 -6.768 -8.739 1185 HA SER 52 HA SER 52 -0.992 -7.899 -7.903 1186 HB2 SER 52 HB2 SER 52 -1.861 -5.024 -7.308 1187 HB3 SER 52 HB3 SER 52 -0.414 -5.820 -6.700 1188 HG SER 52 HG SER 52 -0.990 -5.284 -9.424 1189 H HIS 53 H HIS 53 -1.100 -8.657 -5.790 1190 HA HIS 53 HA HIS 53 -3.796 -8.745 -4.551 1191 HB2 HIS 53 HB2 HIS 53 -2.726 -10.886 -5.370 1192 HB3 HIS 53 HB3 HIS 53 -1.408 -10.644 -4.237 1193 HD1 HIS 53 HD1 HIS 53 -2.800 -13.210 -4.072 1194 HD2 HIS 53 HD2 HIS 53 -4.182 -9.918 -1.941 1195 HE1 HIS 53 HE1 HIS 53 -4.118 -14.153 -2.168 1196 HE2 HIS 53 HE2 HIS 53 -4.675 -12.169 -0.755 1197 H ILE 54 H ILE 54 -3.953 -7.284 -2.917 1198 HA ILE 54 HA ILE 54 -1.555 -6.484 -1.403 1199 HB ILE 54 HB ILE 54 -4.271 -5.082 -1.418 1200 HG12 ILE 54 HG12 ILE 54 -2.972 -3.274 -2.783 1201 HG13 ILE 54 HG13 ILE 54 -1.808 -4.544 -3.124 1202 HG21 ILE 54 HG21 ILE 54 -3.045 -3.190 -0.402 1203 HG22 ILE 54 HG22 ILE 54 -1.566 -4.152 -0.393 1204 HG23 ILE 54 HG23 ILE 54 -2.942 -4.642 0.598 1205 HD11 ILE 54 HD11 ILE 54 -4.722 -4.582 -3.870 1206 HD12 ILE 54 HD12 ILE 54 -3.533 -5.830 -4.252 1207 HD13 ILE 54 HD13 ILE 54 -3.371 -4.216 -4.943 1208 H TRP 55 H TRP 55 -1.373 -6.877 0.783 1209 HA TRP 55 HA TRP 55 -3.718 -7.977 2.243 1210 HB2 TRP 55 HB2 TRP 55 -0.732 -8.321 2.778 1211 HB3 TRP 55 HB3 TRP 55 -2.005 -8.884 3.864 1212 HD1 TRP 55 HD1 TRP 55 -3.455 -10.979 3.071 1213 HE1 TRP 55 HE1 TRP 55 -3.047 -12.812 1.331 1214 HE3 TRP 55 HE3 TRP 55 0.304 -8.780 0.500 1215 HZ2 TRP 55 HZ2 TRP 55 -1.359 -13.272 -0.862 1216 HZ3 TRP 55 HZ3 TRP 55 1.272 -9.964 -1.402 1217 HH2 TRP 55 HH2 TRP 55 0.466 -12.171 -2.085 1218 H LEU 56 H LEU 56 -4.553 -6.775 3.798 1219 HA LEU 56 HA LEU 56 -3.142 -4.362 4.754 1220 HB2 LEU 56 HB2 LEU 56 -6.139 -4.894 4.537 1221 HB3 LEU 56 HB3 LEU 56 -5.437 -3.485 5.310 1222 HG LEU 56 HG LEU 56 -6.181 -2.776 3.163 1223 HD11 LEU 56 HD11 LEU 56 -4.171 -1.982 2.036 1224 HD12 LEU 56 HD12 LEU 56 -3.185 -3.126 2.950 1225 HD13 LEU 56 HD13 LEU 56 -4.034 -1.825 3.787 1226 HD21 LEU 56 HD21 LEU 56 -5.572 -3.813 1.034 1227 HD22 LEU 56 HD22 LEU 56 -6.438 -4.941 2.071 1228 HD23 LEU 56 HD23 LEU 56 -4.689 -5.083 1.887 1229 H LEU 57 H LEU 57 -2.281 -4.832 6.618 1230 HA LEU 57 HA LEU 57 -3.438 -6.625 8.587 1231 HB2 LEU 57 HB2 LEU 57 -0.821 -5.104 8.374 1232 HB3 LEU 57 HB3 LEU 57 -1.316 -5.821 9.895 1233 HG LEU 57 HG LEU 57 -1.169 -8.061 8.993 1234 HD11 LEU 57 HD11 LEU 57 -0.563 -6.854 6.281 1235 HD12 LEU 57 HD12 LEU 57 -2.018 -7.747 6.742 1236 HD13 LEU 57 HD13 LEU 57 -0.460 -8.570 6.697 1237 HD21 LEU 57 HD21 LEU 57 0.894 -7.069 9.816 1238 HD22 LEU 57 HD22 LEU 57 1.258 -6.422 8.214 1239 HD23 LEU 57 HD23 LEU 57 1.238 -8.170 8.480 1240 H VAL 58 H VAL 58 -5.217 -5.597 9.333 1241 HA VAL 58 HA VAL 58 -4.791 -3.251 11.075 1242 HB VAL 58 HB VAL 58 -5.900 -2.460 8.952 1243 HG11 VAL 58 HG11 VAL 58 -8.214 -3.098 8.391 1244 HG12 VAL 58 HG12 VAL 58 -8.193 -4.307 9.680 1245 HG13 VAL 58 HG13 VAL 58 -7.114 -4.477 8.293 1246 HG21 VAL 58 HG21 VAL 58 -7.696 -2.310 11.402 1247 HG22 VAL 58 HG22 VAL 58 -7.764 -1.223 10.012 1248 HG23 VAL 58 HG23 VAL 58 -6.332 -1.246 11.041 1249 H ASN 59 H ASN 59 -6.019 -3.436 13.037 1250 HA ASN 59 HA ASN 59 -6.992 -5.959 13.793 1251 HB2 ASN 59 HB2 ASN 59 -7.916 -4.941 15.783 1252 HB3 ASN 59 HB3 ASN 59 -6.339 -4.258 15.465 1253 HD21 ASN 59 HD21 ASN 59 -7.207 -2.302 13.448 1254 HD22 ASN 59 HD22 ASN 59 -8.137 -1.123 14.284 1255 H ASP 60 H ASP 60 -9.047 -6.779 14.025 1256 HA ASP 60 HA ASP 60 -10.914 -6.244 11.985 1257 HB2 ASP 60 HB2 ASP 60 -10.545 -8.492 12.942 1258 HB3 ASP 60 HB3 ASP 60 -11.160 -7.958 14.489 1259 H ASP 61 H ASP 61 -13.103 -5.643 12.221 1260 HA ASP 61 HA ASP 61 -13.726 -3.653 14.315 1261 HB2 ASP 61 HB2 ASP 61 -12.728 -2.603 12.214 1262 HB3 ASP 61 HB3 ASP 61 -14.078 -3.251 11.306 1263 H GLN 62 H GLN 62 -16.028 -3.334 14.580 1264 HA GLN 62 HA GLN 62 -17.797 -5.499 14.027 1265 HB2 GLN 62 HB2 GLN 62 -18.406 -2.616 14.841 1266 HB3 GLN 62 HB3 GLN 62 -19.601 -3.913 14.801 1267 HG2 GLN 62 HG2 GLN 62 -18.316 -5.154 16.512 1268 HG3 GLN 62 HG3 GLN 62 -17.128 -3.853 16.555 1269 HE21 GLN 62 HE21 GLN 62 -18.759 -1.637 16.539 1270 HE22 GLN 62 HE22 GLN 62 -19.672 -1.584 17.999 1271 H ARG 63 H ARG 63 -16.953 -2.577 12.343 1272 HA ARG 63 HA ARG 63 -18.990 -2.718 10.306 1273 HB2 ARG 63 HB2 ARG 63 -18.022 -0.581 11.029 1274 HB3 ARG 63 HB3 ARG 63 -16.423 -1.105 10.523 1275 HG2 ARG 63 HG2 ARG 63 -17.237 -1.151 8.150 1276 HG3 ARG 63 HG3 ARG 63 -18.794 -0.538 8.710 1277 HD2 ARG 63 HD2 ARG 63 -16.130 0.891 9.006 1278 HD3 ARG 63 HD3 ARG 63 -17.363 1.265 7.805 1279 HE ARG 63 HE ARG 63 -18.756 2.138 9.498 1280 HH11 ARG 63 HH11 ARG 63 -15.638 1.171 10.823 1281 HH12 ARG 63 HH12 ARG 63 -15.832 2.116 12.261 1282 HH21 ARG 63 HH21 ARG 63 -18.980 3.361 11.387 1283 HH22 ARG 63 HH22 ARG 63 -17.718 3.351 12.580 1284 H LEU 64 H LEU 64 -15.901 -4.186 10.798 1285 HA LEU 64 HA LEU 64 -14.447 -3.956 8.528 1286 HB2 LEU 64 HB2 LEU 64 -14.168 -5.339 10.845 1287 HB3 LEU 64 HB3 LEU 64 -14.445 -6.692 9.785 1288 HG LEU 64 HG LEU 64 -12.027 -6.176 10.320 1289 HD11 LEU 64 HD11 LEU 64 -12.683 -6.109 7.379 1290 HD12 LEU 64 HD12 LEU 64 -12.579 -7.546 8.398 1291 HD13 LEU 64 HD13 LEU 64 -11.141 -6.571 8.109 1292 HD21 LEU 64 HD21 LEU 64 -12.429 -3.733 8.564 1293 HD22 LEU 64 HD22 LEU 64 -10.879 -4.331 9.167 1294 HD23 LEU 64 HD23 LEU 64 -12.092 -3.736 10.296 1295 H GLU 65 H GLU 65 -16.701 -6.726 9.047 1296 HA GLU 65 HA GLU 65 -16.323 -7.920 6.497 1297 HB2 GLU 65 HB2 GLU 65 -18.609 -8.206 8.488 1298 HB3 GLU 65 HB3 GLU 65 -18.387 -9.243 7.080 1299 HG2 GLU 65 HG2 GLU 65 -16.272 -10.054 7.972 1300 HG3 GLU 65 HG3 GLU 65 -16.407 -8.972 9.352 1301 H GLN 66 H GLN 66 -18.669 -5.599 7.688 1302 HA GLN 66 HA GLN 66 -20.428 -5.623 5.418 1303 HB2 GLN 66 HB2 GLN 66 -20.036 -3.607 7.675 1304 HB3 GLN 66 HB3 GLN 66 -21.233 -3.384 6.408 1305 HG2 GLN 66 HG2 GLN 66 -22.262 -4.261 8.438 1306 HG3 GLN 66 HG3 GLN 66 -22.403 -5.417 7.118 1307 HE21 GLN 66 HE21 GLN 66 -20.786 -4.723 10.143 1308 HE22 GLN 66 HE22 GLN 66 -20.283 -6.339 10.473 1309 H MET 67 H MET 67 -17.575 -3.802 6.348 1310 HA MET 67 HA MET 67 -17.651 -1.917 4.179 1311 HB2 MET 67 HB2 MET 67 -16.514 -1.579 6.475 1312 HB3 MET 67 HB3 MET 67 -15.215 -2.614 5.886 1313 HG2 MET 67 HG2 MET 67 -14.683 -0.218 5.634 1314 HG3 MET 67 HG3 MET 67 -14.762 -1.030 4.063 1315 HE1 MET 67 HE1 MET 67 -14.988 1.345 2.806 1316 HE2 MET 67 HE2 MET 67 -14.909 2.193 4.351 1317 HE3 MET 67 HE3 MET 67 -16.210 2.548 3.217 1318 H ILE 68 H ILE 68 -16.230 -5.062 4.813 1319 HA ILE 68 HA ILE 68 -14.591 -5.357 2.523 1320 HB ILE 68 HB ILE 68 -15.960 -7.360 4.359 1321 HG12 ILE 68 HG12 ILE 68 -13.013 -6.772 3.845 1322 HG13 ILE 68 HG13 ILE 68 -13.953 -6.122 5.184 1323 HG21 ILE 68 HG21 ILE 68 -14.237 -8.129 1.973 1324 HG22 ILE 68 HG22 ILE 68 -15.956 -8.475 2.170 1325 HG23 ILE 68 HG23 ILE 68 -14.776 -9.232 3.239 1326 HD11 ILE 68 HD11 ILE 68 -13.329 -9.024 4.702 1327 HD12 ILE 68 HD12 ILE 68 -14.293 -8.383 6.036 1328 HD13 ILE 68 HD13 ILE 68 -12.586 -7.965 5.898 1329 H SER 69 H SER 69 -18.019 -6.086 3.142 1330 HA SER 69 HA SER 69 -18.629 -7.198 0.610 1331 HB2 SER 69 HB2 SER 69 -20.045 -7.463 2.661 1332 HB3 SER 69 HB3 SER 69 -20.507 -5.766 2.539 1333 HG SER 69 HG SER 69 -20.972 -7.740 0.539 1334 H GLN 70 H GLN 70 -18.450 -3.903 1.795 1335 HA GLN 70 HA GLN 70 -19.827 -2.607 -0.333 1336 HB2 GLN 70 HB2 GLN 70 -19.675 -1.633 1.895 1337 HB3 GLN 70 HB3 GLN 70 -17.925 -1.664 1.856 1338 HG2 GLN 70 HG2 GLN 70 -19.522 0.059 -0.051 1339 HG3 GLN 70 HG3 GLN 70 -19.119 0.597 1.573 1340 HE21 GLN 70 HE21 GLN 70 -16.462 -0.697 1.568 1341 HE22 GLN 70 HE22 GLN 70 -15.478 0.265 0.530 1342 H ILE 71 H ILE 71 -16.374 -3.275 0.386 1343 HA ILE 71 HA ILE 71 -15.462 -1.962 -2.041 1344 HB ILE 71 HB ILE 71 -14.039 -1.760 -0.099 1345 HG12 ILE 71 HG12 ILE 71 -12.733 -3.494 -2.234 1346 HG13 ILE 71 HG13 ILE 71 -12.880 -1.742 -2.256 1347 HG21 ILE 71 HG21 ILE 71 -13.643 -4.758 -0.090 1348 HG22 ILE 71 HG22 ILE 71 -14.609 -3.844 1.067 1349 HG23 ILE 71 HG23 ILE 71 -12.868 -3.585 0.984 1350 HD11 ILE 71 HD11 ILE 71 -11.240 -3.371 -0.328 1351 HD12 ILE 71 HD12 ILE 71 -11.386 -1.609 -0.320 1352 HD13 ILE 71 HD13 ILE 71 -10.642 -2.429 -1.692 1353 H ASP 72 H ASP 72 -16.303 -5.169 -1.065 1354 HA ASP 72 HA ASP 72 -15.019 -6.796 -2.942 1355 HB2 ASP 72 HB2 ASP 72 -16.167 -7.852 -1.117 1356 HB3 ASP 72 HB3 ASP 72 -17.677 -7.047 -1.481 1357 H LYS 73 H LYS 73 -18.046 -4.972 -3.170 1358 HA LYS 73 HA LYS 73 -18.770 -6.069 -5.738 1359 HB2 LYS 73 HB2 LYS 73 -20.711 -4.519 -5.605 1360 HB3 LYS 73 HB3 LYS 73 -20.539 -5.556 -4.195 1361 HG2 LYS 73 HG2 LYS 73 -19.499 -3.665 -2.952 1362 HG3 LYS 73 HG3 LYS 73 -19.765 -2.625 -4.358 1363 HD2 LYS 73 HD2 LYS 73 -21.512 -2.298 -2.636 1364 HD3 LYS 73 HD3 LYS 73 -22.201 -2.921 -4.138 1365 HE2 LYS 73 HE2 LYS 73 -22.332 -5.164 -3.193 1366 HE3 LYS 73 HE3 LYS 73 -21.510 -4.637 -1.730 1367 HZ1 LYS 73 HZ1 LYS 73 -24.189 -3.758 -2.662 1368 HZ2 LYS 73 HZ2 LYS 73 -23.402 -3.159 -1.295 1369 HZ3 LYS 73 HZ3 LYS 73 -23.862 -4.783 -1.359 1370 H LEU 74 H LEU 74 -16.336 -4.062 -5.154 1371 HA LEU 74 HA LEU 74 -16.683 -2.177 -7.348 1372 HB2 LEU 74 HB2 LEU 74 -14.508 -2.748 -5.328 1373 HB3 LEU 74 HB3 LEU 74 -14.066 -1.923 -6.806 1374 HG LEU 74 HG LEU 74 -14.440 -0.326 -4.971 1375 HD11 LEU 74 HD11 LEU 74 -14.865 0.433 -7.257 1376 HD12 LEU 74 HD12 LEU 74 -15.950 1.232 -6.121 1377 HD13 LEU 74 HD13 LEU 74 -16.551 -0.081 -7.139 1378 HD21 LEU 74 HD21 LEU 74 -16.110 -1.575 -3.675 1379 HD22 LEU 74 HD22 LEU 74 -17.316 -1.298 -4.929 1380 HD23 LEU 74 HD23 LEU 74 -16.665 0.064 -4.012 1381 H GLU 75 H GLU 75 -15.454 -2.220 -9.260 1382 HA GLU 75 HA GLU 75 -15.116 -4.866 -10.409 1383 HB2 GLU 75 HB2 GLU 75 -14.862 -2.102 -11.665 1384 HB3 GLU 75 HB3 GLU 75 -14.869 -3.626 -12.555 1385 HG2 GLU 75 HG2 GLU 75 -17.170 -4.074 -11.774 1386 HG3 GLU 75 HG3 GLU 75 -17.161 -2.556 -10.875 1387 H ASP 76 H ASP 76 -13.049 -2.422 -9.119 1388 HA ASP 76 HA ASP 76 -10.605 -3.299 -10.346 1389 HB2 ASP 76 HB2 ASP 76 -9.514 -2.066 -8.396 1390 HB3 ASP 76 HB3 ASP 76 -10.521 -1.113 -9.467 1391 H VAL 77 H VAL 77 -12.052 -3.891 -7.116 1392 HA VAL 77 HA VAL 77 -10.262 -5.924 -6.319 1393 HB VAL 77 HB VAL 77 -13.121 -5.310 -5.439 1394 HG11 VAL 77 HG11 VAL 77 -12.731 -6.752 -3.463 1395 HG12 VAL 77 HG12 VAL 77 -11.183 -7.267 -4.139 1396 HG13 VAL 77 HG13 VAL 77 -12.687 -7.691 -4.958 1397 HG21 VAL 77 HG21 VAL 77 -11.445 -3.570 -4.933 1398 HG22 VAL 77 HG22 VAL 77 -10.438 -4.771 -4.115 1399 HG23 VAL 77 HG23 VAL 77 -12.019 -4.350 -3.456 1400 H VAL 78 H VAL 78 -9.919 -7.538 -7.712 1401 HA VAL 78 HA VAL 78 -11.919 -9.027 -9.123 1402 HB VAL 78 HB VAL 78 -9.106 -10.005 -8.423 1403 HG11 VAL 78 HG11 VAL 78 -10.909 -10.675 -10.784 1404 HG12 VAL 78 HG12 VAL 78 -10.595 -11.717 -9.391 1405 HG13 VAL 78 HG13 VAL 78 -9.286 -11.311 -10.501 1406 HG21 VAL 78 HG21 VAL 78 -8.292 -8.979 -10.509 1407 HG22 VAL 78 HG22 VAL 78 -8.910 -7.753 -9.399 1408 HG23 VAL 78 HG23 VAL 78 -9.880 -8.252 -10.788 1409 H LYS 79 H LYS 79 -10.017 -9.523 -6.174 1410 HA LYS 79 HA LYS 79 -11.972 -11.480 -5.135 1411 HB2 LYS 79 HB2 LYS 79 -8.935 -11.775 -5.185 1412 HB3 LYS 79 HB3 LYS 79 -9.973 -12.749 -4.147 1413 HG2 LYS 79 HG2 LYS 79 -11.069 -13.729 -6.086 1414 HG3 LYS 79 HG3 LYS 79 -10.155 -12.678 -7.170 1415 HD2 LYS 79 HD2 LYS 79 -8.067 -13.785 -6.575 1416 HD3 LYS 79 HD3 LYS 79 -8.876 -14.736 -5.324 1417 HE2 LYS 79 HE2 LYS 79 -9.437 -14.931 -8.306 1418 HE3 LYS 79 HE3 LYS 79 -8.449 -16.056 -7.371 1419 HZ1 LYS 79 HZ1 LYS 79 -10.405 -16.573 -6.025 1420 HZ2 LYS 79 HZ2 LYS 79 -10.656 -16.924 -7.659 1421 HZ3 LYS 79 HZ3 LYS 79 -11.347 -15.541 -6.978 1422 H VAL 80 H VAL 80 -12.496 -11.136 -3.013 1423 HA VAL 80 HA VAL 80 -10.615 -9.597 -1.317 1424 HB VAL 80 HB VAL 80 -12.823 -8.324 -1.906 1425 HG11 VAL 80 HG11 VAL 80 -14.784 -8.791 -0.500 1426 HG12 VAL 80 HG12 VAL 80 -14.004 -10.246 0.120 1427 HG13 VAL 80 HG13 VAL 80 -14.427 -10.133 -1.590 1428 HG21 VAL 80 HG21 VAL 80 -11.282 -7.561 -0.151 1429 HG22 VAL 80 HG22 VAL 80 -12.039 -8.645 1.018 1430 HG23 VAL 80 HG23 VAL 80 -12.958 -7.297 0.342 1431 H GLN 81 H GLN 81 -10.267 -10.446 0.678 1432 HA GLN 81 HA GLN 81 -11.485 -12.897 1.644 1433 HB2 GLN 81 HB2 GLN 81 -8.579 -12.811 0.693 1434 HB3 GLN 81 HB3 GLN 81 -9.260 -14.114 1.655 1435 HG2 GLN 81 HG2 GLN 81 -10.676 -14.817 -0.164 1436 HG3 GLN 81 HG3 GLN 81 -10.296 -13.373 -1.096 1437 HE21 GLN 81 HE21 GLN 81 -7.848 -15.261 0.619 1438 HE22 GLN 81 HE22 GLN 81 -7.074 -15.861 -0.801 1439 H ARG 82 H ARG 82 -10.737 -13.356 3.841 1440 HA ARG 82 HA ARG 82 -8.861 -11.515 5.094 1441 HB2 ARG 82 HB2 ARG 82 -10.606 -10.969 6.932 1442 HB3 ARG 82 HB3 ARG 82 -10.718 -10.116 5.406 1443 HG2 ARG 82 HG2 ARG 82 -12.944 -10.621 5.889 1444 HG3 ARG 82 HG3 ARG 82 -12.489 -11.870 4.739 1445 HD2 ARG 82 HD2 ARG 82 -12.142 -13.430 6.660 1446 HD3 ARG 82 HD3 ARG 82 -12.731 -12.168 7.750 1447 HE ARG 82 HE ARG 82 -14.341 -13.364 5.564 1448 HH11 ARG 82 HH11 ARG 82 -14.140 -12.146 8.855 1449 HH12 ARG 82 HH12 ARG 82 -15.824 -12.418 9.171 1450 HH21 ARG 82 HH21 ARG 82 -16.534 -13.668 5.989 1451 HH22 ARG 82 HH22 ARG 82 -17.174 -13.277 7.557 1452 H ASN 83 H ASN 83 -7.819 -12.411 6.788 1453 HA ASN 83 HA ASN 83 -8.729 -14.937 8.001 1454 HB2 ASN 83 HB2 ASN 83 -6.134 -14.564 6.434 1455 HB3 ASN 83 HB3 ASN 83 -6.328 -15.845 7.621 1456 HD21 ASN 83 HD21 ASN 83 -7.764 -17.560 7.165 1457 HD22 ASN 83 HD22 ASN 83 -8.305 -17.887 5.560 1458 H GLN 84 H GLN 84 -8.260 -14.971 10.156 1459 HA GLN 84 HA GLN 84 -6.820 -12.685 11.287 1460 HB2 GLN 84 HB2 GLN 84 -8.403 -14.914 12.651 1461 HB3 GLN 84 HB3 GLN 84 -7.706 -13.515 13.469 1462 HG2 GLN 84 HG2 GLN 84 -9.154 -12.018 12.157 1463 HG3 GLN 84 HG3 GLN 84 -9.857 -13.404 11.329 1464 HE21 GLN 84 HE21 GLN 84 -11.173 -11.360 12.930 1465 HE22 GLN 84 HE22 GLN 84 -11.983 -12.193 14.209 1466 H SER 85 H SER 85 -4.718 -13.098 10.837 1467 HA SER 85 HA SER 85 -3.390 -15.348 12.219 1468 HB2 SER 85 HB2 SER 85 -3.573 -15.882 9.781 1469 HB3 SER 85 HB3 SER 85 -2.741 -14.380 9.390 1470 HG SER 85 HG SER 85 -1.277 -16.075 9.389 1471 H ASP 86 H ASP 86 -1.001 -14.928 12.344 1472 HA ASP 86 HA ASP 86 -0.571 -12.381 13.636 1473 HB2 ASP 86 HB2 ASP 86 1.629 -13.331 14.264 1474 HB3 ASP 86 HB3 ASP 86 0.329 -14.463 14.621 1475 HA PRO 87 HA PRO 87 0.899 -9.812 10.501 1476 HB2 PRO 87 HB2 PRO 87 3.322 -8.736 11.467 1477 HB3 PRO 87 HB3 PRO 87 1.697 -8.197 11.930 1478 HG2 PRO 87 HG2 PRO 87 3.504 -10.129 13.351 1479 HG3 PRO 87 HG3 PRO 87 2.514 -8.809 14.020 1480 HD2 PRO 87 HD2 PRO 87 1.650 -11.316 14.202 1481 HD3 PRO 87 HD3 PRO 87 0.501 -10.022 13.786 1482 H THR 88 H THR 88 3.329 -12.244 11.403 1483 HA THR 88 HA THR 88 5.262 -11.618 9.396 1484 HB THR 88 HB THR 88 6.374 -13.703 9.953 1485 HG1 THR 88 HG1 THR 88 4.767 -14.809 11.767 1486 HG21 THR 88 HG21 THR 88 6.599 -13.494 12.401 1487 HG22 THR 88 HG22 THR 88 5.123 -12.531 12.470 1488 HG23 THR 88 HG23 THR 88 6.550 -11.899 11.643 1489 H MET 89 H MET 89 2.237 -13.094 9.095 1490 HA MET 89 HA MET 89 2.293 -14.785 6.955 1491 HB2 MET 89 HB2 MET 89 0.217 -14.134 8.046 1492 HB3 MET 89 HB3 MET 89 0.415 -12.458 7.548 1493 HG2 MET 89 HG2 MET 89 -1.304 -13.512 6.219 1494 HG3 MET 89 HG3 MET 89 0.075 -13.138 5.188 1495 HE1 MET 89 HE1 MET 89 -1.418 -16.406 3.602 1496 HE2 MET 89 HE2 MET 89 -0.976 -14.724 3.309 1497 HE3 MET 89 HE3 MET 89 -2.330 -15.111 4.375 1498 H PHE 90 H PHE 90 2.672 -11.235 6.899 1499 HA PHE 90 HA PHE 90 2.628 -10.850 4.112 1500 HB2 PHE 90 HB2 PHE 90 3.086 -8.610 4.536 1501 HB3 PHE 90 HB3 PHE 90 2.560 -9.090 6.139 1502 HD1 PHE 90 HD2 PHE 90 4.345 -9.526 7.941 1503 HD2 PHE 90 HD1 PHE 90 5.291 -7.778 4.158 1504 HE1 PHE 90 HE2 PHE 90 6.485 -8.725 8.849 1505 HE2 PHE 90 HE1 PHE 90 7.437 -6.980 5.072 1506 HZ PHE 90 HZ PHE 90 8.029 -7.454 7.414 1507 H ASN 91 H ASN 91 5.257 -11.606 6.331 1508 HA ASN 91 HA ASN 91 7.405 -11.375 4.467 1509 HB2 ASN 91 HB2 ASN 91 7.918 -11.121 6.798 1510 HB3 ASN 91 HB3 ASN 91 7.128 -12.638 7.219 1511 HD21 ASN 91 HD21 ASN 91 9.920 -11.263 5.569 1512 HD22 ASN 91 HD22 ASN 91 10.924 -12.656 5.755 1513 H LYS 92 H LYS 92 5.389 -14.023 5.636 1514 HA LYS 92 HA LYS 92 6.859 -16.204 4.641 1515 HB2 LYS 92 HB2 LYS 92 5.129 -16.350 6.425 1516 HB3 LYS 92 HB3 LYS 92 3.876 -16.002 5.237 1517 HG2 LYS 92 HG2 LYS 92 3.893 -18.375 5.702 1518 HG3 LYS 92 HG3 LYS 92 4.452 -18.112 4.048 1519 HD2 LYS 92 HD2 LYS 92 6.799 -18.397 4.803 1520 HD3 LYS 92 HD3 LYS 92 6.234 -18.656 6.457 1521 HE2 LYS 92 HE2 LYS 92 5.001 -20.674 5.699 1522 HE3 LYS 92 HE3 LYS 92 5.614 -20.421 4.061 1523 HZ1 LYS 92 HZ1 LYS 92 6.924 -22.050 5.249 1524 HZ2 LYS 92 HZ2 LYS 92 7.267 -20.938 6.473 1525 HZ3 LYS 92 HZ3 LYS 92 7.861 -20.688 4.911 1526 H ILE 93 H ILE 93 4.192 -14.326 3.180 1527 HA ILE 93 HA ILE 93 4.098 -15.933 0.760 1528 HB ILE 93 HB ILE 93 2.487 -14.209 -0.067 1529 HG12 ILE 93 HG12 ILE 93 3.525 -12.706 2.310 1530 HG13 ILE 93 HG13 ILE 93 2.947 -12.102 0.769 1531 HG21 ILE 93 HG21 ILE 93 1.860 -15.218 2.724 1532 HG22 ILE 93 HG22 ILE 93 1.675 -16.135 1.226 1533 HG23 ILE 93 HG23 ILE 93 0.680 -14.707 1.514 1534 HD11 ILE 93 HD11 ILE 93 1.570 -11.301 2.545 1535 HD12 ILE 93 HD12 ILE 93 1.266 -12.939 3.123 1536 HD13 ILE 93 HD13 ILE 93 0.636 -12.424 1.559 1537 H ALA 94 H ALA 94 5.742 -13.026 1.831 1538 HA ALA 94 HA ALA 94 6.356 -11.840 -0.660 1539 HB1 ALA 94 HB1 ALA 94 7.895 -11.648 1.954 1540 HB2 ALA 94 HB2 ALA 94 6.535 -10.630 1.474 1541 HB3 ALA 94 HB3 ALA 94 8.050 -10.553 0.575 1542 H VAL 95 H VAL 95 7.939 -14.433 1.157 1543 HA VAL 95 HA VAL 95 10.369 -14.424 -0.391 1544 HB VAL 95 HB VAL 95 10.984 -16.487 0.766 1545 HG11 VAL 95 HG11 VAL 95 11.318 -14.357 1.947 1546 HG12 VAL 95 HG12 VAL 95 10.967 -15.653 3.092 1547 HG13 VAL 95 HG13 VAL 95 9.712 -14.483 2.672 1548 HG21 VAL 95 HG21 VAL 95 8.814 -17.651 0.761 1549 HG22 VAL 95 HG22 VAL 95 8.177 -16.504 1.940 1550 HG23 VAL 95 HG23 VAL 95 9.489 -17.593 2.392 1551 H PHE 96 H PHE 96 7.245 -15.865 -0.827 1552 HA PHE 96 HA PHE 96 8.157 -17.768 -2.853 1553 HB2 PHE 96 HB2 PHE 96 5.358 -17.109 -1.824 1554 HB3 PHE 96 HB3 PHE 96 5.709 -18.344 -3.032 1555 HD1 PHE 96 HD2 PHE 96 7.763 -19.994 -2.207 1556 HD2 PHE 96 HD1 PHE 96 4.987 -17.966 0.331 1557 HE1 PHE 96 HE2 PHE 96 8.156 -21.651 -0.433 1558 HE2 PHE 96 HE1 PHE 96 5.390 -19.627 2.101 1559 HZ PHE 96 HZ PHE 96 6.974 -21.471 1.719 1560 H PHE 97 H PHE 97 6.571 -14.632 -2.622 1561 HA PHE 97 HA PHE 97 5.976 -13.014 -4.074 1562 HB2 PHE 97 HB2 PHE 97 8.333 -13.230 -4.872 1563 HB3 PHE 97 HB3 PHE 97 7.828 -14.430 -6.050 1564 HD1 PHE 97 HD2 PHE 97 7.136 -10.863 -5.059 1565 HD2 PHE 97 HD1 PHE 97 7.345 -13.698 -8.261 1566 HE1 PHE 97 HE2 PHE 97 6.711 -9.069 -6.688 1567 HE2 PHE 97 HE1 PHE 97 6.917 -11.893 -9.882 1568 HZ PHE 97 HZ PHE 97 6.601 -9.579 -9.095 1569 H GLN 98 H GLN 98 4.666 -15.800 -4.092 1570 HA GLN 98 HA GLN 98 2.940 -15.498 -6.454 1571 HB2 GLN 98 HB2 GLN 98 4.359 -18.066 -5.597 1572 HB3 GLN 98 HB3 GLN 98 3.074 -18.002 -6.801 1573 HG2 GLN 98 HG2 GLN 98 4.442 -16.752 -8.327 1574 HG3 GLN 98 HG3 GLN 98 5.668 -16.462 -7.092 1575 HE21 GLN 98 HE21 GLN 98 7.081 -18.148 -6.511 1576 HE22 GLN 98 HE22 GLN 98 7.294 -19.544 -7.513 Start of MODEL 6 1 H1 GLY 1 H1 GLY 1 10.562 5.108 -18.221 2 H2 GLY 1 H2 GLY 1 10.506 4.129 -19.598 3 H3 GLY 1 H3 GLY 1 10.358 3.436 -18.066 4 HA2 GLY 1 HA3 GLY 1 8.284 4.631 -17.715 5 HA3 GLY 1 HA2 GLY 1 8.428 5.287 -19.336 6 H SER 2 H SER 2 8.049 2.308 -17.482 7 HA SER 2 HA SER 2 6.921 0.917 -19.845 8 HB2 SER 2 HB2 SER 2 8.213 -0.231 -17.323 9 HB3 SER 2 HB3 SER 2 7.507 -1.191 -18.629 10 HG SER 2 HG SER 2 9.454 0.727 -19.257 11 H MET 3 H MET 3 4.827 0.396 -19.769 12 HA MET 3 HA MET 3 3.169 1.118 -17.515 13 HB2 MET 3 HB2 MET 3 2.423 1.515 -19.865 14 HB3 MET 3 HB3 MET 3 2.388 -0.221 -20.144 15 HG2 MET 3 HG2 MET 3 0.616 -0.456 -18.446 16 HG3 MET 3 HG3 MET 3 0.658 1.285 -18.158 17 HE1 MET 3 HE1 MET 3 -2.763 0.757 -20.006 18 HE2 MET 3 HE2 MET 3 -1.978 1.423 -18.573 19 HE3 MET 3 HE3 MET 3 -2.006 -0.324 -18.837 20 H GLN 4 H GLN 4 4.499 -1.819 -18.899 21 HA GLN 4 HA GLN 4 2.928 -3.610 -17.222 22 HB2 GLN 4 HB2 GLN 4 5.227 -4.149 -19.150 23 HB3 GLN 4 HB3 GLN 4 4.355 -5.405 -18.274 24 HG2 GLN 4 HG2 GLN 4 3.208 -3.520 -20.357 25 HG3 GLN 4 HG3 GLN 4 3.509 -5.248 -20.548 26 HE21 GLN 4 HE21 GLN 4 1.007 -3.717 -20.835 27 HE22 GLN 4 HE22 GLN 4 -0.121 -4.437 -19.741 28 H ASN 5 H ASN 5 4.030 -5.251 -15.893 29 HA ASN 5 HA ASN 5 5.615 -4.136 -13.842 30 HB2 ASN 5 HB2 ASN 5 5.724 -6.518 -12.974 31 HB3 ASN 5 HB3 ASN 5 4.095 -5.946 -13.304 32 HD21 ASN 5 HD21 ASN 5 6.610 -8.155 -14.298 33 HD22 ASN 5 HD22 ASN 5 5.632 -9.106 -15.357 34 H THR 6 H THR 6 7.689 -3.635 -13.966 35 HA THR 6 HA THR 6 9.625 -5.290 -15.470 36 HB THR 6 HB THR 6 9.377 -2.255 -15.812 37 HG1 THR 6 HG1 THR 6 7.668 -3.281 -16.888 38 HG21 THR 6 HG21 THR 6 11.088 -4.280 -17.310 39 HG22 THR 6 HG22 THR 6 11.685 -3.114 -16.125 40 HG23 THR 6 HG23 THR 6 10.990 -2.551 -17.646 41 H THR 7 H THR 7 10.852 -5.887 -13.707 42 HA THR 7 HA THR 7 11.224 -4.173 -11.419 43 HB THR 7 HB THR 7 12.463 -6.922 -11.923 44 HG1 THR 7 HG1 THR 7 9.885 -6.100 -11.156 45 HG21 THR 7 HG21 THR 7 11.888 -5.427 -9.327 46 HG22 THR 7 HG22 THR 7 13.488 -5.741 -10.001 47 HG23 THR 7 HG23 THR 7 12.492 -7.085 -9.438 48 H HIS 8 H HIS 8 12.276 -2.537 -12.852 49 HA HIS 8 HA HIS 8 14.825 -2.008 -11.980 50 HB2 HIS 8 HB2 HIS 8 16.283 -2.094 -13.954 51 HB3 HIS 8 HB3 HIS 8 15.666 -3.703 -13.624 52 HD1 HIS 8 HD1 HIS 8 15.273 -0.847 -16.075 53 HD2 HIS 8 HD2 HIS 8 14.344 -4.890 -15.761 54 HE1 HIS 8 HE1 HIS 8 14.486 -1.539 -18.353 55 HE2 HIS 8 HE2 HIS 8 14.109 -4.015 -18.181 56 H ASP 9 H ASP 9 12.414 -1.548 -14.493 57 HA ASP 9 HA ASP 9 13.012 1.246 -15.009 58 HB2 ASP 9 HB2 ASP 9 12.038 -0.377 -16.717 59 HB3 ASP 9 HB3 ASP 9 10.524 -0.305 -15.820 60 H ASN 10 H ASN 10 10.784 -0.632 -13.040 61 HA ASN 10 HA ASN 10 9.500 1.653 -11.860 62 HB2 ASN 10 HB2 ASN 10 8.597 0.061 -10.223 63 HB3 ASN 10 HB3 ASN 10 8.443 -0.620 -11.838 64 HD21 ASN 10 HD21 ASN 10 8.373 -2.102 -9.416 65 HD22 ASN 10 HD22 ASN 10 9.695 -3.205 -9.457 66 H VAL 11 H VAL 11 9.881 2.340 -9.660 67 HA VAL 11 HA VAL 11 12.638 1.978 -8.657 68 HB VAL 11 HB VAL 11 12.684 4.373 -7.969 69 HG11 VAL 11 HG11 VAL 11 12.272 4.008 -10.960 70 HG12 VAL 11 HG12 VAL 11 13.769 3.717 -10.072 71 HG13 VAL 11 HG13 VAL 11 13.122 5.354 -10.191 72 HG21 VAL 11 HG21 VAL 11 11.050 6.009 -8.880 73 HG22 VAL 11 HG22 VAL 11 10.263 4.836 -7.825 74 HG23 VAL 11 HG23 VAL 11 10.108 4.687 -9.570 75 H ILE 12 H ILE 12 12.833 1.980 -6.471 76 HA ILE 12 HA ILE 12 10.454 1.302 -4.932 77 HB ILE 12 HB ILE 12 13.390 1.241 -4.085 78 HG12 ILE 12 HG12 ILE 12 12.954 -0.207 -6.110 79 HG13 ILE 12 HG13 ILE 12 13.568 -1.064 -4.706 80 HG21 ILE 12 HG21 ILE 12 12.658 -0.396 -2.420 81 HG22 ILE 12 HG22 ILE 12 10.993 -0.218 -2.972 82 HG23 ILE 12 HG23 ILE 12 11.823 1.147 -2.220 83 HD11 ILE 12 HD11 ILE 12 10.715 -1.029 -5.668 84 HD12 ILE 12 HD12 ILE 12 11.302 -1.888 -4.242 85 HD13 ILE 12 HD13 ILE 12 11.875 -2.342 -5.847 86 H LEU 13 H LEU 13 9.461 3.301 -4.451 87 HA LEU 13 HA LEU 13 11.057 5.564 -3.520 88 HB2 LEU 13 HB2 LEU 13 8.052 5.271 -3.944 89 HB3 LEU 13 HB3 LEU 13 8.822 6.744 -3.367 90 HG LEU 13 HG LEU 13 9.206 5.464 -6.102 91 HD11 LEU 13 HD11 LEU 13 8.164 7.508 -6.968 92 HD12 LEU 13 HD12 LEU 13 7.910 8.094 -5.321 93 HD13 LEU 13 HD13 LEU 13 7.077 6.641 -5.883 94 HD21 LEU 13 HD21 LEU 13 11.335 6.411 -5.353 95 HD22 LEU 13 HD22 LEU 13 10.548 7.945 -4.969 96 HD23 LEU 13 HD23 LEU 13 10.646 7.394 -6.644 97 H GLU 14 H GLU 14 11.858 5.130 -1.555 98 HA GLU 14 HA GLU 14 10.255 3.951 0.570 99 HB2 GLU 14 HB2 GLU 14 12.701 3.363 0.173 100 HB3 GLU 14 HB3 GLU 14 13.136 4.992 0.645 101 HG2 GLU 14 HG2 GLU 14 11.757 2.995 2.476 102 HG3 GLU 14 HG3 GLU 14 13.498 3.229 2.406 103 H LEU 15 H LEU 15 8.720 5.492 1.019 104 HA LEU 15 HA LEU 15 9.748 8.028 2.190 105 HB2 LEU 15 HB2 LEU 15 7.228 8.732 1.878 106 HB3 LEU 15 HB3 LEU 15 8.369 8.814 0.553 107 HG LEU 15 HG LEU 15 7.390 6.414 -0.064 108 HD11 LEU 15 HD11 LEU 15 5.079 7.583 1.495 109 HD12 LEU 15 HD12 LEU 15 5.975 6.113 1.876 110 HD13 LEU 15 HD13 LEU 15 4.995 6.187 0.414 111 HD21 LEU 15 HD21 LEU 15 5.756 7.477 -1.550 112 HD22 LEU 15 HD22 LEU 15 7.290 8.339 -1.522 113 HD23 LEU 15 HD23 LEU 15 5.904 8.986 -0.640 114 H THR 16 H THR 16 9.795 8.039 4.288 115 HA THR 16 HA THR 16 8.387 6.103 5.928 116 HB THR 16 HB THR 16 10.071 8.468 6.888 117 HG1 THR 16 HG1 THR 16 10.976 6.554 5.384 118 HG21 THR 16 HG21 THR 16 10.430 7.088 8.893 119 HG22 THR 16 HG22 THR 16 9.449 5.793 8.204 120 HG23 THR 16 HG23 THR 16 8.700 7.338 8.622 121 H VAL 17 H VAL 17 6.266 6.582 6.313 122 HA VAL 17 HA VAL 17 5.550 9.360 7.053 123 HB VAL 17 HB VAL 17 3.469 9.218 6.051 124 HG11 VAL 17 HG11 VAL 17 3.694 8.283 3.762 125 HG12 VAL 17 HG12 VAL 17 5.158 7.423 4.271 126 HG13 VAL 17 HG13 VAL 17 5.121 9.193 4.269 127 HG21 VAL 17 HG21 VAL 17 3.558 6.180 6.099 128 HG22 VAL 17 HG22 VAL 17 2.252 7.131 5.391 129 HG23 VAL 17 HG23 VAL 17 2.573 7.224 7.121 130 H ARG 18 H ARG 18 4.250 9.601 8.864 131 HA ARG 18 HA ARG 18 4.131 7.317 10.728 132 HB2 ARG 18 HB2 ARG 18 3.675 9.077 12.458 133 HB3 ARG 18 HB3 ARG 18 5.240 9.209 11.669 134 HG2 ARG 18 HG2 ARG 18 4.290 11.035 10.223 135 HG3 ARG 18 HG3 ARG 18 2.809 10.963 11.189 136 HD2 ARG 18 HD2 ARG 18 5.597 11.598 12.217 137 HD3 ARG 18 HD3 ARG 18 4.294 12.761 11.980 138 HE ARG 18 HE ARG 18 3.348 10.774 13.712 139 HH11 ARG 18 HH11 ARG 18 5.810 13.294 13.762 140 HH12 ARG 18 HH12 ARG 18 5.747 13.481 15.488 141 HH21 ARG 18 HH21 ARG 18 3.311 10.994 15.973 142 HH22 ARG 18 HH22 ARG 18 4.328 12.173 16.742 143 H ASN 19 H ASN 19 2.180 6.752 11.748 144 HA ASN 19 HA ASN 19 0.090 6.563 9.836 145 HB2 ASN 19 HB2 ASN 19 0.843 4.692 11.336 146 HB3 ASN 19 HB3 ASN 19 0.119 5.527 12.703 147 HD21 ASN 19 HD21 ASN 19 -0.432 2.874 11.332 148 HD22 ASN 19 HD22 ASN 19 -2.130 2.888 11.035 149 H HIS 20 H HIS 20 -0.548 8.690 9.603 150 HA HIS 20 HA HIS 20 -2.463 9.778 11.596 151 HB2 HIS 20 HB2 HIS 20 -1.034 11.120 9.256 152 HB3 HIS 20 HB3 HIS 20 -2.288 11.905 10.191 153 HD1 HIS 20 HD1 HIS 20 0.085 13.486 10.146 154 HD2 HIS 20 HD2 HIS 20 -0.209 10.330 12.830 155 HE1 HIS 20 HE1 HIS 20 1.688 14.022 11.998 156 HE2 HIS 20 HE2 HIS 20 1.347 12.192 13.683 157 HA PRO 21 HA PRO 21 -6.154 8.837 9.206 158 HB2 PRO 21 HB2 PRO 21 -7.060 11.438 8.376 159 HB3 PRO 21 HB3 PRO 21 -7.536 10.554 9.838 160 HG2 PRO 21 HG2 PRO 21 -5.425 12.648 9.505 161 HG3 PRO 21 HG3 PRO 21 -6.543 12.379 10.863 162 HD2 PRO 21 HD2 PRO 21 -4.010 11.655 11.118 163 HD3 PRO 21 HD3 PRO 21 -5.281 10.551 11.701 164 H GLY 22 H GLY 22 -5.457 7.725 7.444 165 HA2 GLY 22 HA2 GLY 22 -5.446 7.170 5.230 166 HA3 GLY 22 HA3 GLY 22 -6.202 8.720 4.914 167 H VAL 23 H VAL 23 -2.991 8.243 6.329 168 HA VAL 23 HA VAL 23 -1.788 9.944 4.343 169 HB VAL 23 HB VAL 23 0.345 9.570 5.556 170 HG11 VAL 23 HG11 VAL 23 -1.185 11.355 6.217 171 HG12 VAL 23 HG12 VAL 23 -0.392 10.682 7.641 172 HG13 VAL 23 HG13 VAL 23 -2.065 10.249 7.278 173 HG21 VAL 23 HG21 VAL 23 0.014 7.234 6.296 174 HG22 VAL 23 HG22 VAL 23 -1.293 7.745 7.367 175 HG23 VAL 23 HG23 VAL 23 0.364 8.286 7.671 176 H MET 24 H MET 24 -1.989 6.485 4.795 177 HA MET 24 HA MET 24 -0.144 5.735 2.758 178 HB2 MET 24 HB2 MET 24 -2.635 4.240 3.682 179 HB3 MET 24 HB3 MET 24 -1.288 3.550 2.782 180 HG2 MET 24 HG2 MET 24 -1.048 2.859 5.047 181 HG3 MET 24 HG3 MET 24 0.182 4.098 4.771 182 HE1 MET 24 HE1 MET 24 0.588 4.579 7.335 183 HE2 MET 24 HE2 MET 24 -0.516 3.258 7.723 184 HE3 MET 24 HE3 MET 24 -0.710 4.829 8.502 185 H THR 25 H THR 25 -3.543 6.715 2.771 186 HA THR 25 HA THR 25 -4.128 6.280 0.019 187 HB THR 25 HB THR 25 -5.463 8.340 1.840 188 HG1 THR 25 HG1 THR 25 -6.916 6.470 2.255 189 HG21 THR 25 HG21 THR 25 -6.203 8.435 -0.533 190 HG22 THR 25 HG22 THR 25 -7.495 7.847 0.516 191 HG23 THR 25 HG23 THR 25 -6.586 6.710 -0.481 192 H HIS 26 H HIS 26 -2.671 8.967 1.838 193 HA HIS 26 HA HIS 26 -2.696 10.976 -0.142 194 HB2 HIS 26 HB2 HIS 26 -0.626 10.529 2.055 195 HB3 HIS 26 HB3 HIS 26 -0.711 11.976 1.062 196 HD1 HIS 26 HD1 HIS 26 -0.855 12.124 4.108 197 HD2 HIS 26 HD2 HIS 26 -4.199 11.981 1.629 198 HE1 HIS 26 HE1 HIS 26 -2.741 13.106 5.451 199 HE2 HIS 26 HE2 HIS 26 -4.768 12.866 3.984 200 H VAL 27 H VAL 27 -0.170 8.610 0.721 201 HA VAL 27 HA VAL 27 1.719 9.548 -1.166 202 HB VAL 27 HB VAL 27 3.118 7.661 -0.515 203 HG11 VAL 27 HG11 VAL 27 2.965 9.530 1.064 204 HG12 VAL 27 HG12 VAL 27 3.192 8.020 1.941 205 HG13 VAL 27 HG13 VAL 27 1.596 8.774 1.877 206 HG21 VAL 27 HG21 VAL 27 2.352 5.873 1.030 207 HG22 VAL 27 HG22 VAL 27 1.499 5.812 -0.513 208 HG23 VAL 27 HG23 VAL 27 0.697 6.481 0.909 209 H CYS 28 H CYS 28 -0.537 6.791 -1.237 210 HA CYS 28 HA CYS 28 0.299 5.672 -3.704 211 HB2 CYS 28 HB2 CYS 28 -1.012 4.395 -2.060 212 HB3 CYS 28 HB3 CYS 28 -2.388 5.478 -2.278 213 HG CYS 28 HG CYS 28 -2.835 4.755 -4.921 214 H GLY 29 H GLY 29 -2.271 7.962 -2.806 215 HA2 GLY 29 HA2 GLY 29 -3.399 8.303 -5.391 216 HA3 GLY 29 HA3 GLY 29 -3.633 9.354 -4.005 217 H LEU 30 H LEU 30 -0.685 9.777 -3.786 218 HA LEU 30 HA LEU 30 -0.554 12.226 -5.219 219 HB2 LEU 30 HB2 LEU 30 0.571 11.402 -2.946 220 HB3 LEU 30 HB3 LEU 30 1.884 10.907 -3.987 221 HG LEU 30 HG LEU 30 2.245 13.111 -2.876 222 HD11 LEU 30 HD11 LEU 30 3.061 14.362 -4.779 223 HD12 LEU 30 HD12 LEU 30 2.106 13.364 -5.880 224 HD13 LEU 30 HD13 LEU 30 3.426 12.646 -4.954 225 HD21 LEU 30 HD21 LEU 30 1.010 15.107 -3.558 226 HD22 LEU 30 HD22 LEU 30 -0.071 13.922 -2.824 227 HD23 LEU 30 HD23 LEU 30 -0.051 14.127 -4.578 228 H PHE 31 H PHE 31 1.190 9.111 -5.556 229 HA PHE 31 HA PHE 31 2.461 9.994 -8.041 230 HB2 PHE 31 HB2 PHE 31 2.605 7.301 -6.640 231 HB3 PHE 31 HB3 PHE 31 3.608 7.815 -8.005 232 HD1 PHE 31 HD2 PHE 31 4.788 10.210 -7.659 233 HD2 PHE 31 HD1 PHE 31 3.528 7.642 -4.484 234 HE1 PHE 31 HE2 PHE 31 6.292 11.376 -6.109 235 HE2 PHE 31 HE1 PHE 31 5.022 8.828 -2.943 236 HZ PHE 31 HZ PHE 31 6.413 10.691 -3.747 237 H ALA 32 H ALA 32 -0.359 8.114 -7.217 238 HA ALA 32 HA ALA 32 -0.836 6.867 -9.722 239 HB1 ALA 32 HB1 ALA 32 -2.016 6.225 -7.658 240 HB2 ALA 32 HB2 ALA 32 -3.161 6.630 -8.938 241 HB3 ALA 32 HB3 ALA 32 -2.842 7.785 -7.634 242 H ARG 33 H ARG 33 -1.652 10.088 -8.462 243 HA ARG 33 HA ARG 33 -3.361 10.838 -10.660 244 HB2 ARG 33 HB2 ARG 33 -3.550 12.998 -9.583 245 HB3 ARG 33 HB3 ARG 33 -3.618 11.755 -8.337 246 HG2 ARG 33 HG2 ARG 33 -1.219 12.195 -7.814 247 HG3 ARG 33 HG3 ARG 33 -1.221 13.498 -9.003 248 HD2 ARG 33 HD2 ARG 33 -3.000 13.386 -6.542 249 HD3 ARG 33 HD3 ARG 33 -1.494 14.302 -6.660 250 HE ARG 33 HE ARG 33 -2.979 15.192 -8.773 251 HH11 ARG 33 HH11 ARG 33 -3.578 15.079 -5.301 252 HH12 ARG 33 HH12 ARG 33 -4.606 16.479 -5.319 253 HH21 ARG 33 HH21 ARG 33 -4.302 17.019 -8.782 254 HH22 ARG 33 HH22 ARG 33 -5.018 17.585 -7.301 255 H ARG 34 H ARG 34 -0.003 10.570 -10.470 256 HA ARG 34 HA ARG 34 0.866 12.824 -11.973 257 HB2 ARG 34 HB2 ARG 34 2.234 11.047 -10.562 258 HB3 ARG 34 HB3 ARG 34 2.228 10.088 -12.028 259 HG2 ARG 34 HG2 ARG 34 3.408 12.885 -11.830 260 HG3 ARG 34 HG3 ARG 34 4.329 11.407 -11.589 261 HD2 ARG 34 HD2 ARG 34 4.817 12.039 -13.797 262 HD3 ARG 34 HD3 ARG 34 3.604 10.769 -13.981 263 HE ARG 34 HE ARG 34 2.241 13.198 -13.933 264 HH11 ARG 34 HH11 ARG 34 4.612 11.661 -16.045 265 HH12 ARG 34 HH12 ARG 34 4.041 12.483 -17.463 266 HH21 ARG 34 HH21 ARG 34 1.473 14.205 -15.814 267 HH22 ARG 34 HH22 ARG 34 2.271 13.917 -17.332 268 H ALA 35 H ALA 35 0.443 9.406 -12.972 269 HA ALA 35 HA ALA 35 -0.915 9.865 -15.410 270 HB1 ALA 35 HB1 ALA 35 1.205 10.915 -16.132 271 HB2 ALA 35 HB2 ALA 35 0.904 9.432 -17.040 272 HB3 ALA 35 HB3 ALA 35 2.090 9.443 -15.728 273 H PHE 36 H PHE 36 1.650 7.880 -13.945 274 HA PHE 36 HA PHE 36 0.282 5.392 -14.782 275 HB2 PHE 36 HB2 PHE 36 2.652 5.691 -15.543 276 HB3 PHE 36 HB3 PHE 36 3.165 5.819 -13.864 277 HD1 PHE 36 HD1 PHE 36 1.036 3.439 -15.880 278 HD2 PHE 36 HD2 PHE 36 4.243 3.876 -13.087 279 HE1 PHE 36 HE1 PHE 36 1.322 0.999 -15.810 280 HE2 PHE 36 HE2 PHE 36 4.520 1.436 -13.024 281 HZ PHE 36 HZ PHE 36 3.061 -0.005 -14.383 282 H ASN 37 H ASN 37 -0.123 3.786 -13.262 283 HA ASN 37 HA ASN 37 -0.631 4.604 -10.530 284 HB2 ASN 37 HB2 ASN 37 -1.009 1.913 -11.913 285 HB3 ASN 37 HB3 ASN 37 -1.614 2.318 -10.307 286 HD21 ASN 37 HD21 ASN 37 -2.908 1.589 -12.932 287 HD22 ASN 37 HD22 ASN 37 -4.116 2.802 -13.158 288 H VAL 38 H VAL 38 -0.097 2.808 -8.814 289 HA VAL 38 HA VAL 38 2.792 2.409 -8.805 290 HB VAL 38 HB VAL 38 0.803 1.679 -6.602 291 HG11 VAL 38 HG11 VAL 38 3.807 2.154 -6.501 292 HG12 VAL 38 HG12 VAL 38 3.004 0.585 -6.399 293 HG13 VAL 38 HG13 VAL 38 2.775 1.777 -5.118 294 HG21 VAL 38 HG21 VAL 38 1.373 3.836 -5.518 295 HG22 VAL 38 HG22 VAL 38 0.595 4.094 -7.081 296 HG23 VAL 38 HG23 VAL 38 2.342 4.293 -6.923 297 H GLU 39 H GLU 39 3.613 0.620 -9.652 298 HA GLU 39 HA GLU 39 2.348 -1.732 -10.458 299 HB2 GLU 39 HB2 GLU 39 4.612 -0.998 -11.229 300 HB3 GLU 39 HB3 GLU 39 5.266 -1.322 -9.629 301 HG2 GLU 39 HG2 GLU 39 4.572 -3.765 -9.984 302 HG3 GLU 39 HG3 GLU 39 4.260 -3.336 -11.664 303 H GLY 40 H GLY 40 4.214 -1.071 -7.454 304 HA2 GLY 40 HA2 GLY 40 2.779 -3.226 -6.023 305 HA3 GLY 40 HA3 GLY 40 4.516 -3.430 -6.206 306 H ILE 41 H ILE 41 3.004 -3.128 -3.723 307 HA ILE 41 HA ILE 41 4.222 -0.648 -2.617 308 HB ILE 41 HB ILE 41 1.437 -1.695 -1.869 309 HG12 ILE 41 HG12 ILE 41 2.174 0.776 -3.495 310 HG13 ILE 41 HG13 ILE 41 1.373 -0.664 -4.108 311 HG21 ILE 41 HG21 ILE 41 1.199 0.356 -0.513 312 HG22 ILE 41 HG22 ILE 41 2.843 0.834 -0.940 313 HG23 ILE 41 HG23 ILE 41 2.572 -0.610 0.034 314 HD11 ILE 41 HD11 ILE 41 -0.196 1.141 -3.818 315 HD12 ILE 41 HD12 ILE 41 0.234 1.294 -2.115 316 HD13 ILE 41 HD13 ILE 41 -0.570 -0.167 -2.697 317 H LEU 42 H LEU 42 5.043 -0.874 -0.501 318 HA LEU 42 HA LEU 42 4.171 -3.120 1.144 319 HB2 LEU 42 HB2 LEU 42 6.107 -4.102 0.066 320 HB3 LEU 42 HB3 LEU 42 7.093 -2.692 0.408 321 HG LEU 42 HG LEU 42 7.231 -3.252 2.771 322 HD11 LEU 42 HD11 LEU 42 4.972 -4.018 3.191 323 HD12 LEU 42 HD12 LEU 42 6.136 -5.208 3.771 324 HD13 LEU 42 HD13 LEU 42 5.260 -5.491 2.262 325 HD21 LEU 42 HD21 LEU 42 7.623 -5.773 1.132 326 HD22 LEU 42 HD22 LEU 42 8.375 -5.412 2.692 327 HD23 LEU 42 HD23 LEU 42 8.770 -4.439 1.278 328 H CYS 43 H CYS 43 3.286 -1.855 2.687 329 HA CYS 43 HA CYS 43 4.821 0.292 3.980 330 HB2 CYS 43 HB2 CYS 43 2.446 0.734 3.507 331 HB3 CYS 43 HB3 CYS 43 1.968 -0.686 4.424 332 HG CYS 43 HG CYS 43 3.637 1.881 5.921 333 H LEU 44 H LEU 44 6.305 -0.514 5.330 334 HA LEU 44 HA LEU 44 5.765 -2.845 7.063 335 HB2 LEU 44 HB2 LEU 44 7.827 -2.686 5.533 336 HB3 LEU 44 HB3 LEU 44 8.400 -1.403 6.577 337 HG LEU 44 HG LEU 44 8.415 -3.089 8.493 338 HD11 LEU 44 HD11 LEU 44 7.964 -5.094 6.260 339 HD12 LEU 44 HD12 LEU 44 6.840 -4.728 7.576 340 HD13 LEU 44 HD13 LEU 44 8.395 -5.480 7.931 341 HD21 LEU 44 HD21 LEU 44 10.476 -2.464 7.309 342 HD22 LEU 44 HD22 LEU 44 10.186 -3.724 6.108 343 HD23 LEU 44 HD23 LEU 44 10.512 -4.160 7.789 344 HA PRO 45 HA PRO 45 5.154 0.659 9.985 345 HB2 PRO 45 HB2 PRO 45 3.667 -0.677 11.863 346 HB3 PRO 45 HB3 PRO 45 2.980 -0.120 10.324 347 HG2 PRO 45 HG2 PRO 45 3.884 -2.877 11.085 348 HG3 PRO 45 HG3 PRO 45 2.446 -2.379 10.166 349 HD2 PRO 45 HD2 PRO 45 4.750 -3.321 8.977 350 HD3 PRO 45 HD3 PRO 45 3.613 -2.213 8.173 351 H ILE 46 H ILE 46 6.938 1.209 11.102 352 HA ILE 46 HA ILE 46 8.560 -0.654 12.582 353 HB ILE 46 HB ILE 46 8.632 2.399 12.579 354 HG12 ILE 46 HG12 ILE 46 10.854 2.022 11.322 355 HG13 ILE 46 HG13 ILE 46 10.361 0.350 11.124 356 HG21 ILE 46 HG21 ILE 46 10.614 0.465 13.845 357 HG22 ILE 46 HG22 ILE 46 9.522 1.551 14.708 358 HG23 ILE 46 HG23 ILE 46 10.826 2.215 13.723 359 HD11 ILE 46 HD11 ILE 46 8.417 1.101 9.832 360 HD12 ILE 46 HD12 ILE 46 9.947 1.619 9.126 361 HD13 ILE 46 HD13 ILE 46 8.957 2.771 10.022 362 H GLN 47 H GLN 47 7.728 -1.535 14.353 363 HA GLN 47 HA GLN 47 5.565 -0.649 15.894 364 HB2 GLN 47 HB2 GLN 47 6.220 -2.480 17.455 365 HB3 GLN 47 HB3 GLN 47 6.204 -2.988 15.776 366 HG2 GLN 47 HG2 GLN 47 8.646 -2.850 15.666 367 HG3 GLN 47 HG3 GLN 47 8.700 -2.255 17.327 368 HE21 GLN 47 HE21 GLN 47 9.955 -3.951 18.067 369 HE22 GLN 47 HE22 GLN 47 9.377 -5.573 18.200 370 H ASP 48 H ASP 48 8.870 0.250 16.078 371 HA ASP 48 HA ASP 48 9.165 0.709 18.851 372 HB2 ASP 48 HB2 ASP 48 11.087 0.290 17.447 373 HB3 ASP 48 HB3 ASP 48 10.723 1.666 16.421 374 H SER 49 H SER 49 8.204 2.863 16.166 375 HA SER 49 HA SER 49 7.407 4.992 18.010 376 HB2 SER 49 HB2 SER 49 9.707 5.366 16.034 377 HB3 SER 49 HB3 SER 49 8.853 6.706 16.791 378 HG SER 49 HG SER 49 10.223 4.650 18.181 379 H ASP 50 H ASP 50 6.798 7.033 16.566 380 HA ASP 50 HA ASP 50 4.717 6.284 14.745 381 HB2 ASP 50 HB2 ASP 50 5.863 9.013 15.500 382 HB3 ASP 50 HB3 ASP 50 4.486 8.806 14.425 383 H LYS 51 H LYS 51 6.045 5.093 13.216 384 HA LYS 51 HA LYS 51 6.652 6.621 10.884 385 HB2 LYS 51 HB2 LYS 51 9.054 5.833 10.668 386 HB3 LYS 51 HB3 LYS 51 8.789 7.022 11.936 387 HG2 LYS 51 HG2 LYS 51 8.768 5.159 13.616 388 HG3 LYS 51 HG3 LYS 51 9.160 4.041 12.311 389 HD2 LYS 51 HD2 LYS 51 11.190 4.610 13.534 390 HD3 LYS 51 HD3 LYS 51 11.283 5.273 11.902 391 HE2 LYS 51 HE2 LYS 51 10.703 7.504 12.756 392 HE3 LYS 51 HE3 LYS 51 10.508 6.851 14.384 393 HZ1 LYS 51 HZ1 LYS 51 12.638 7.896 14.163 394 HZ2 LYS 51 HZ2 LYS 51 13.033 6.949 12.823 395 HZ3 LYS 51 HZ3 LYS 51 12.865 6.232 14.342 396 H SER 52 H SER 52 6.708 5.363 9.056 397 HA SER 52 HA SER 52 6.791 2.462 9.109 398 HB2 SER 52 HB2 SER 52 4.367 2.963 9.548 399 HB3 SER 52 HB3 SER 52 4.311 3.945 8.081 400 HG SER 52 HG SER 52 3.756 1.464 8.181 401 H HIS 53 H HIS 53 7.870 1.843 7.256 402 HA HIS 53 HA HIS 53 8.464 3.914 5.229 403 HB2 HIS 53 HB2 HIS 53 9.605 1.085 5.484 404 HB3 HIS 53 HB3 HIS 53 10.200 2.356 4.427 405 HD1 HIS 53 HD1 HIS 53 11.412 0.692 7.125 406 HD2 HIS 53 HD2 HIS 53 10.734 4.734 6.520 407 HE1 HIS 53 HE1 HIS 53 12.990 1.883 8.664 408 HE2 HIS 53 HE2 HIS 53 12.724 4.309 8.090 409 H ILE 54 H ILE 54 7.062 4.013 3.555 410 HA ILE 54 HA ILE 54 5.775 1.548 2.528 411 HB ILE 54 HB ILE 54 5.008 4.445 1.903 412 HG12 ILE 54 HG12 ILE 54 2.852 3.878 3.188 413 HG13 ILE 54 HG13 ILE 54 3.689 2.461 3.802 414 HG21 ILE 54 HG21 ILE 54 4.491 2.921 0.058 415 HG22 ILE 54 HG22 ILE 54 3.003 3.470 0.827 416 HG23 ILE 54 HG23 ILE 54 3.621 1.849 1.159 417 HD11 ILE 54 HD11 ILE 54 4.530 5.313 4.242 418 HD12 ILE 54 HD12 ILE 54 5.300 3.876 4.919 419 HD13 ILE 54 HD13 ILE 54 3.654 4.300 5.388 420 H TRP 55 H TRP 55 7.071 0.663 1.011 421 HA TRP 55 HA TRP 55 8.650 2.283 -0.838 422 HB2 TRP 55 HB2 TRP 55 8.385 -0.740 -0.517 423 HB3 TRP 55 HB3 TRP 55 9.481 0.055 -1.647 424 HD1 TRP 55 HD1 TRP 55 11.592 1.412 -0.541 425 HE1 TRP 55 HE1 TRP 55 12.816 1.090 1.684 426 HE3 TRP 55 HE3 TRP 55 8.095 -1.323 1.885 427 HZ2 TRP 55 HZ2 TRP 55 12.338 -0.128 4.178 428 HZ3 TRP 55 HZ3 TRP 55 8.523 -2.008 4.182 429 HH2 TRP 55 HH2 TRP 55 10.605 -1.424 5.324 430 H LEU 56 H LEU 56 7.535 3.159 -2.459 431 HA LEU 56 HA LEU 56 5.299 1.741 -3.744 432 HB2 LEU 56 HB2 LEU 56 6.190 4.649 -3.881 433 HB3 LEU 56 HB3 LEU 56 4.838 3.989 -4.794 434 HG LEU 56 HG LEU 56 4.991 4.082 -1.746 435 HD11 LEU 56 HD11 LEU 56 4.764 6.326 -2.692 436 HD12 LEU 56 HD12 LEU 56 3.290 5.830 -1.867 437 HD13 LEU 56 HD13 LEU 56 3.362 5.807 -3.632 438 HD21 LEU 56 HD21 LEU 56 2.702 3.265 -3.570 439 HD22 LEU 56 HD22 LEU 56 2.618 3.425 -1.812 440 HD23 LEU 56 HD23 LEU 56 3.650 2.193 -2.532 441 H LEU 57 H LEU 57 5.859 0.544 -5.401 442 HA LEU 57 HA LEU 57 8.168 1.032 -7.094 443 HB2 LEU 57 HB2 LEU 57 6.137 -1.233 -6.975 444 HB3 LEU 57 HB3 LEU 57 7.334 -1.110 -8.254 445 HG LEU 57 HG LEU 57 9.151 -1.310 -6.554 446 HD11 LEU 57 HD11 LEU 57 8.664 -2.062 -4.275 447 HD12 LEU 57 HD12 LEU 57 6.934 -1.832 -4.561 448 HD13 LEU 57 HD13 LEU 57 8.026 -0.445 -4.578 449 HD21 LEU 57 HD21 LEU 57 7.148 -3.582 -6.550 450 HD22 LEU 57 HD22 LEU 57 8.868 -3.708 -6.157 451 HD23 LEU 57 HD23 LEU 57 8.367 -3.266 -7.790 452 H VAL 58 H VAL 58 7.892 2.516 -8.575 453 HA VAL 58 HA VAL 58 5.692 2.364 -10.539 454 HB VAL 58 HB VAL 58 4.898 3.944 -8.756 455 HG11 VAL 58 HG11 VAL 58 7.299 5.647 -9.442 456 HG12 VAL 58 HG12 VAL 58 7.028 4.779 -7.928 457 HG13 VAL 58 HG13 VAL 58 5.968 6.118 -8.376 458 HG21 VAL 58 HG21 VAL 58 5.483 5.350 -11.388 459 HG22 VAL 58 HG22 VAL 58 4.262 5.839 -10.209 460 HG23 VAL 58 HG23 VAL 58 4.100 4.301 -11.056 461 H ASN 59 H ASN 59 6.370 3.337 -12.599 462 HA ASN 59 HA ASN 59 9.188 3.450 -13.012 463 HB2 ASN 59 HB2 ASN 59 8.746 4.055 -15.297 464 HB3 ASN 59 HB3 ASN 59 7.571 2.848 -14.824 465 HD21 ASN 59 HD21 ASN 59 5.926 5.000 -13.370 466 HD22 ASN 59 HD22 ASN 59 5.122 5.828 -14.651 467 H ASP 60 H ASP 60 10.604 5.140 -12.894 468 HA ASP 60 HA ASP 60 9.827 7.603 -11.690 469 HB2 ASP 60 HB2 ASP 60 12.075 6.558 -11.323 470 HB3 ASP 60 HB3 ASP 60 12.502 6.939 -12.990 471 H ASP 61 H ASP 61 9.532 9.581 -12.558 472 HA ASP 61 HA ASP 61 9.622 9.988 -15.469 473 HB2 ASP 61 HB2 ASP 61 7.373 9.061 -14.919 474 HB3 ASP 61 HB3 ASP 61 7.143 10.300 -13.697 475 H GLN 62 H GLN 62 9.539 12.263 -15.999 476 HA GLN 62 HA GLN 62 11.135 13.954 -14.480 477 HB2 GLN 62 HB2 GLN 62 9.049 14.769 -16.556 478 HB3 GLN 62 HB3 GLN 62 10.399 15.764 -16.021 479 HG2 GLN 62 HG2 GLN 62 10.699 13.105 -17.446 480 HG3 GLN 62 HG3 GLN 62 10.737 14.669 -18.254 481 HE21 GLN 62 HE21 GLN 62 12.540 16.034 -17.918 482 HE22 GLN 62 HE22 GLN 62 14.034 15.432 -17.302 483 H ARG 63 H ARG 63 7.609 13.830 -14.680 484 HA ARG 63 HA ARG 63 7.182 16.044 -12.849 485 HB2 ARG 63 HB2 ARG 63 5.232 14.188 -14.276 486 HB3 ARG 63 HB3 ARG 63 4.713 15.404 -13.117 487 HG2 ARG 63 HG2 ARG 63 4.390 16.355 -15.277 488 HG3 ARG 63 HG3 ARG 63 5.799 17.158 -14.585 489 HD2 ARG 63 HD2 ARG 63 7.242 15.540 -15.921 490 HD3 ARG 63 HD3 ARG 63 5.760 14.997 -16.716 491 HE ARG 63 HE ARG 63 5.943 17.793 -16.919 492 HH11 ARG 63 HH11 ARG 63 7.532 14.929 -18.207 493 HH12 ARG 63 HH12 ARG 63 8.019 15.718 -19.676 494 HH21 ARG 63 HH21 ARG 63 6.591 18.814 -18.809 495 HH22 ARG 63 HH22 ARG 63 7.481 17.934 -20.017 496 H LEU 64 H LEU 64 7.276 12.531 -12.720 497 HA LEU 64 HA LEU 64 6.011 12.086 -10.246 498 HB2 LEU 64 HB2 LEU 64 6.841 10.325 -11.912 499 HB3 LEU 64 HB3 LEU 64 8.445 10.571 -11.252 500 HG LEU 64 HG LEU 64 7.102 10.010 -8.925 501 HD11 LEU 64 HD11 LEU 64 5.494 8.213 -9.254 502 HD12 LEU 64 HD12 LEU 64 5.622 8.378 -11.006 503 HD13 LEU 64 HD13 LEU 64 4.935 9.691 -10.040 504 HD21 LEU 64 HD21 LEU 64 9.136 8.877 -9.712 505 HD22 LEU 64 HD22 LEU 64 8.161 7.882 -10.797 506 HD23 LEU 64 HD23 LEU 64 7.957 7.743 -9.049 507 H GLU 65 H GLU 65 9.396 12.867 -11.060 508 HA GLU 65 HA GLU 65 10.581 12.782 -8.526 509 HB2 GLU 65 HB2 GLU 65 11.260 14.652 -10.838 510 HB3 GLU 65 HB3 GLU 65 12.332 14.244 -9.496 511 HG2 GLU 65 HG2 GLU 65 12.415 11.913 -10.243 512 HG3 GLU 65 HG3 GLU 65 11.287 12.272 -11.548 513 H GLN 66 H GLN 66 8.978 15.440 -10.208 514 HA GLN 66 HA GLN 66 9.395 17.530 -8.351 515 HB2 GLN 66 HB2 GLN 66 7.052 17.152 -10.269 516 HB3 GLN 66 HB3 GLN 66 7.564 18.677 -9.545 517 HG2 GLN 66 HG2 GLN 66 9.593 18.708 -10.838 518 HG3 GLN 66 HG3 GLN 66 9.338 17.047 -11.382 519 HE21 GLN 66 HE21 GLN 66 9.402 17.599 -13.564 520 HE22 GLN 66 HE22 GLN 66 8.136 18.480 -14.343 521 H MET 67 H MET 67 6.934 15.048 -8.670 522 HA MET 67 HA MET 67 5.219 15.987 -6.567 523 HB2 MET 67 HB2 MET 67 5.296 13.439 -8.223 524 HB3 MET 67 HB3 MET 67 4.116 13.690 -6.947 525 HG2 MET 67 HG2 MET 67 3.347 15.760 -8.120 526 HG3 MET 67 HG3 MET 67 4.447 15.362 -9.443 527 HE1 MET 67 HE1 MET 67 2.294 15.515 -11.115 528 HE2 MET 67 HE2 MET 67 1.270 15.872 -9.721 529 HE3 MET 67 HE3 MET 67 0.819 14.589 -10.842 530 H ILE 68 H ILE 68 7.918 13.707 -6.748 531 HA ILE 68 HA ILE 68 7.668 12.537 -4.163 532 HB ILE 68 HB ILE 68 10.198 13.018 -5.830 533 HG12 ILE 68 HG12 ILE 68 8.615 10.421 -5.564 534 HG13 ILE 68 HG13 ILE 68 8.389 11.553 -6.885 535 HG21 ILE 68 HG21 ILE 68 11.266 11.244 -4.458 536 HG22 ILE 68 HG22 ILE 68 9.820 11.157 -3.449 537 HG23 ILE 68 HG23 ILE 68 10.792 12.629 -3.470 538 HD11 ILE 68 HD11 ILE 68 9.784 9.722 -7.571 539 HD12 ILE 68 HD12 ILE 68 10.919 10.043 -6.261 540 HD13 ILE 68 HD13 ILE 68 10.719 11.216 -7.566 541 H SER 69 H SER 69 9.248 15.438 -5.416 542 HA SER 69 HA SER 69 10.460 16.325 -3.002 543 HB2 SER 69 HB2 SER 69 9.706 17.928 -5.483 544 HB3 SER 69 HB3 SER 69 10.879 18.404 -4.249 545 HG SER 69 HG SER 69 11.165 15.964 -5.637 546 H GLN 70 H GLN 70 7.310 16.847 -4.499 547 HA GLN 70 HA GLN 70 6.449 19.066 -2.911 548 HB2 GLN 70 HB2 GLN 70 5.617 18.425 -5.222 549 HB3 GLN 70 HB3 GLN 70 4.803 17.041 -4.522 550 HG2 GLN 70 HG2 GLN 70 4.136 19.894 -3.736 551 HG3 GLN 70 HG3 GLN 70 3.375 19.087 -5.100 552 HE21 GLN 70 HE21 GLN 70 1.972 17.292 -4.665 553 HE22 GLN 70 HE22 GLN 70 1.237 17.090 -3.114 554 H ILE 71 H ILE 71 5.682 15.564 -2.855 555 HA ILE 71 HA ILE 71 3.982 15.656 -0.586 556 HB ILE 71 HB ILE 71 3.938 13.801 -2.266 557 HG12 ILE 71 HG12 ILE 71 4.312 13.001 0.650 558 HG13 ILE 71 HG13 ILE 71 2.807 13.448 -0.140 559 HG21 ILE 71 HG21 ILE 71 6.477 12.789 -0.942 560 HG22 ILE 71 HG22 ILE 71 6.371 13.485 -2.558 561 HG23 ILE 71 HG23 ILE 71 5.550 11.966 -2.203 562 HD11 ILE 71 HD11 ILE 71 2.887 11.097 0.220 563 HD12 ILE 71 HD12 ILE 71 4.431 10.966 -0.622 564 HD13 ILE 71 HD13 ILE 71 2.969 11.414 -1.513 565 H ASP 72 H ASP 72 7.446 15.337 -0.977 566 HA ASP 72 HA ASP 72 8.224 14.443 1.540 567 HB2 ASP 72 HB2 ASP 72 9.909 14.468 -0.076 568 HB3 ASP 72 HB3 ASP 72 9.553 16.079 -0.619 569 H LYS 73 H LYS 73 7.184 17.641 0.511 570 HA LYS 73 HA LYS 73 8.192 19.066 2.797 571 HB2 LYS 73 HB2 LYS 73 6.001 20.054 0.928 572 HB3 LYS 73 HB3 LYS 73 7.129 21.013 1.877 573 HG2 LYS 73 HG2 LYS 73 7.740 19.368 -0.591 574 HG3 LYS 73 HG3 LYS 73 7.740 21.124 -0.465 575 HD2 LYS 73 HD2 LYS 73 9.682 19.284 1.001 576 HD3 LYS 73 HD3 LYS 73 10.035 20.089 -0.527 577 HE2 LYS 73 HE2 LYS 73 9.845 22.275 0.538 578 HE3 LYS 73 HE3 LYS 73 9.360 21.516 2.053 579 HZ1 LYS 73 HZ1 LYS 73 11.718 22.151 2.023 580 HZ2 LYS 73 HZ2 LYS 73 11.985 21.110 0.716 581 HZ3 LYS 73 HZ3 LYS 73 11.521 20.482 2.213 582 H LEU 74 H LEU 74 5.561 16.979 2.455 583 HA LEU 74 HA LEU 74 3.687 18.240 4.264 584 HB2 LEU 74 HB2 LEU 74 3.823 15.375 3.230 585 HB3 LEU 74 HB3 LEU 74 2.462 16.082 4.094 586 HG LEU 74 HG LEU 74 3.443 16.890 1.336 587 HD11 LEU 74 HD11 LEU 74 2.259 14.745 1.330 588 HD12 LEU 74 HD12 LEU 74 1.318 15.990 0.515 589 HD13 LEU 74 HD13 LEU 74 0.879 15.484 2.150 590 HD21 LEU 74 HD21 LEU 74 1.136 18.012 2.938 591 HD22 LEU 74 HD22 LEU 74 1.510 18.404 1.257 592 HD23 LEU 74 HD23 LEU 74 2.640 18.843 2.534 593 H GLU 75 H GLU 75 3.155 17.495 6.367 594 HA GLU 75 HA GLU 75 5.495 16.876 7.976 595 HB2 GLU 75 HB2 GLU 75 2.627 17.465 8.825 596 HB3 GLU 75 HB3 GLU 75 4.011 17.367 9.913 597 HG2 GLU 75 HG2 GLU 75 5.025 19.323 8.800 598 HG3 GLU 75 HG3 GLU 75 3.647 19.415 7.703 599 H ASP 76 H ASP 76 2.569 15.178 6.975 600 HA ASP 76 HA ASP 76 2.743 12.982 8.779 601 HB2 ASP 76 HB2 ASP 76 1.260 11.782 7.241 602 HB3 ASP 76 HB3 ASP 76 0.687 13.416 7.510 603 H VAL 77 H VAL 77 4.068 13.541 5.521 604 HA VAL 77 HA VAL 77 5.786 11.271 5.508 605 HB VAL 77 HB VAL 77 5.711 13.890 3.941 606 HG11 VAL 77 HG11 VAL 77 7.939 11.815 3.738 607 HG12 VAL 77 HG12 VAL 77 8.121 13.475 4.301 608 HG13 VAL 77 HG13 VAL 77 7.685 13.161 2.625 609 HG21 VAL 77 HG21 VAL 77 5.468 12.359 2.001 610 HG22 VAL 77 HG22 VAL 77 4.210 12.067 3.210 611 HG23 VAL 77 HG23 VAL 77 5.587 10.964 3.079 612 H VAL 78 H VAL 78 7.200 10.956 7.051 613 HA VAL 78 HA VAL 78 8.668 13.008 8.472 614 HB VAL 78 HB VAL 78 9.211 9.999 8.552 615 HG11 VAL 78 HG11 VAL 78 10.907 11.408 9.673 616 HG12 VAL 78 HG12 VAL 78 10.016 10.431 10.843 617 HG13 VAL 78 HG13 VAL 78 9.643 12.148 10.666 618 HG21 VAL 78 HG21 VAL 78 6.799 10.316 8.939 619 HG22 VAL 78 HG22 VAL 78 7.141 11.493 10.210 620 HG23 VAL 78 HG23 VAL 78 7.609 9.804 10.422 621 H LYS 79 H LYS 79 9.267 10.629 5.911 622 HA LYS 79 HA LYS 79 11.721 11.959 5.005 623 HB2 LYS 79 HB2 LYS 79 11.648 8.949 5.540 624 HB3 LYS 79 HB3 LYS 79 12.983 9.830 4.809 625 HG2 LYS 79 HG2 LYS 79 13.484 10.928 6.907 626 HG3 LYS 79 HG3 LYS 79 12.029 10.254 7.649 627 HD2 LYS 79 HD2 LYS 79 12.969 7.955 7.352 628 HD3 LYS 79 HD3 LYS 79 14.436 8.663 6.670 629 HE2 LYS 79 HE2 LYS 79 13.407 9.113 9.493 630 HE3 LYS 79 HE3 LYS 79 14.734 8.045 9.039 631 HZ1 LYS 79 HZ1 LYS 79 15.593 10.111 9.837 632 HZ2 LYS 79 HZ2 LYS 79 14.659 10.993 8.744 633 HZ3 LYS 79 HZ3 LYS 79 15.909 10.007 8.179 634 H VAL 80 H VAL 80 12.174 11.520 2.787 635 HA VAL 80 HA VAL 80 10.626 9.429 1.379 636 HB VAL 80 HB VAL 80 10.437 10.799 -0.671 637 HG11 VAL 80 HG11 VAL 80 9.254 12.292 1.654 638 HG12 VAL 80 HG12 VAL 80 8.547 10.892 0.845 639 HG13 VAL 80 HG13 VAL 80 8.742 12.411 -0.032 640 HG21 VAL 80 HG21 VAL 80 11.057 13.154 -0.758 641 HG22 VAL 80 HG22 VAL 80 12.458 12.151 -0.380 642 HG23 VAL 80 HG23 VAL 80 11.660 13.064 0.900 643 H GLN 81 H GLN 81 11.847 8.412 -0.327 644 HA GLN 81 HA GLN 81 14.618 9.147 -0.820 645 HB2 GLN 81 HB2 GLN 81 14.807 7.849 1.275 646 HB3 GLN 81 HB3 GLN 81 13.883 6.526 0.578 647 HG2 GLN 81 HG2 GLN 81 15.686 6.055 -0.996 648 HG3 GLN 81 HG3 GLN 81 16.597 7.445 -0.409 649 HE21 GLN 81 HE21 GLN 81 14.850 5.236 1.741 650 HE22 GLN 81 HE22 GLN 81 16.265 4.527 2.425 651 H ARG 82 H ARG 82 15.457 8.099 -2.696 652 HA ARG 82 HA ARG 82 13.408 6.837 -4.436 653 HB2 ARG 82 HB2 ARG 82 15.601 8.816 -5.208 654 HB3 ARG 82 HB3 ARG 82 14.486 8.038 -6.328 655 HG2 ARG 82 HG2 ARG 82 12.592 9.202 -5.330 656 HG3 ARG 82 HG3 ARG 82 13.636 9.918 -4.098 657 HD2 ARG 82 HD2 ARG 82 13.079 11.493 -5.952 658 HD3 ARG 82 HD3 ARG 82 14.818 11.209 -5.789 659 HE ARG 82 HE ARG 82 13.690 9.397 -7.648 660 HH11 ARG 82 HH11 ARG 82 14.635 12.772 -7.430 661 HH12 ARG 82 HH12 ARG 82 14.910 12.912 -9.139 662 HH21 ARG 82 HH21 ARG 82 14.028 9.589 -9.858 663 HH22 ARG 82 HH22 ARG 82 14.565 11.103 -10.520 664 H ASN 83 H ASN 83 14.128 4.744 -3.967 665 HA ASN 83 HA ASN 83 16.918 3.974 -4.531 666 HB2 ASN 83 HB2 ASN 83 14.618 2.291 -3.433 667 HB3 ASN 83 HB3 ASN 83 16.300 1.790 -3.542 668 HD21 ASN 83 HD21 ASN 83 17.818 2.700 -2.062 669 HD22 ASN 83 HD22 ASN 83 17.284 3.461 -0.603 670 H GLN 84 H GLN 84 17.392 2.317 -6.070 671 HA GLN 84 HA GLN 84 15.480 1.996 -8.281 672 HB2 GLN 84 HB2 GLN 84 18.409 1.214 -7.956 673 HB3 GLN 84 HB3 GLN 84 17.443 0.660 -9.318 674 HG2 GLN 84 HG2 GLN 84 18.762 2.580 -9.987 675 HG3 GLN 84 HG3 GLN 84 17.054 2.995 -10.007 676 HE21 GLN 84 HE21 GLN 84 16.285 4.550 -8.536 677 HE22 GLN 84 HE22 GLN 84 17.341 5.556 -7.614 678 H SER 85 H SER 85 14.915 -0.164 -9.092 679 HA SER 85 HA SER 85 13.983 -1.696 -6.831 680 HB2 SER 85 HB2 SER 85 12.473 -1.047 -8.677 681 HB3 SER 85 HB3 SER 85 13.364 -2.107 -9.749 682 HG SER 85 HG SER 85 11.336 -2.837 -8.496 683 H ASP 86 H ASP 86 13.947 -4.028 -6.743 684 HA ASP 86 HA ASP 86 16.301 -5.424 -7.772 685 HB2 ASP 86 HB2 ASP 86 16.997 -4.013 -5.741 686 HB3 ASP 86 HB3 ASP 86 15.893 -4.971 -4.769 687 HA PRO 87 HA PRO 87 13.212 -8.761 -7.528 688 HB2 PRO 87 HB2 PRO 87 15.604 -10.589 -7.312 689 HB3 PRO 87 HB3 PRO 87 14.256 -10.620 -8.473 690 HG2 PRO 87 HG2 PRO 87 16.635 -9.758 -9.259 691 HG3 PRO 87 HG3 PRO 87 15.163 -8.911 -9.790 692 HD2 PRO 87 HD2 PRO 87 17.098 -8.128 -7.606 693 HD3 PRO 87 HD3 PRO 87 16.347 -7.116 -8.865 694 H THR 88 H THR 88 15.949 -8.843 -5.242 695 HA THR 88 HA THR 88 14.545 -10.587 -3.350 696 HB THR 88 HB THR 88 16.599 -10.671 -2.071 697 HG1 THR 88 HG1 THR 88 17.754 -8.717 -3.777 698 HG21 THR 88 HG21 THR 88 16.658 -12.040 -4.131 699 HG22 THR 88 HG22 THR 88 18.268 -11.433 -3.733 700 HG23 THR 88 HG23 THR 88 17.332 -10.675 -5.024 701 H MET 89 H MET 89 14.282 -7.379 -3.974 702 HA MET 89 HA MET 89 14.970 -5.985 -1.685 703 HB2 MET 89 HB2 MET 89 14.278 -5.083 -4.007 704 HB3 MET 89 HB3 MET 89 12.611 -5.202 -3.453 705 HG2 MET 89 HG2 MET 89 14.764 -3.548 -2.106 706 HG3 MET 89 HG3 MET 89 13.589 -2.920 -3.257 707 HE1 MET 89 HE1 MET 89 13.461 -1.159 -0.983 708 HE2 MET 89 HE2 MET 89 14.324 -2.276 0.077 709 HE3 MET 89 HE3 MET 89 12.724 -1.689 0.528 710 H PHE 90 H PHE 90 11.678 -7.221 -2.520 711 HA PHE 90 HA PHE 90 10.265 -6.346 -0.301 712 HB2 PHE 90 HB2 PHE 90 9.856 -8.798 -2.053 713 HB3 PHE 90 HB3 PHE 90 8.739 -8.409 -0.752 714 HD1 PHE 90 HD1 PHE 90 7.322 -6.364 -0.872 715 HD2 PHE 90 HD2 PHE 90 9.838 -7.514 -4.148 716 HE1 PHE 90 HE1 PHE 90 6.050 -4.883 -2.372 717 HE2 PHE 90 HE2 PHE 90 8.554 -6.025 -5.634 718 HZ PHE 90 HZ PHE 90 6.662 -4.716 -4.748 719 H ASN 91 H ASN 91 11.997 -9.438 -0.661 720 HA ASN 91 HA ASN 91 11.327 -10.522 1.891 721 HB2 ASN 91 HB2 ASN 91 12.037 -11.921 -0.034 722 HB3 ASN 91 HB3 ASN 91 13.634 -11.187 0.000 723 HD21 ASN 91 HD21 ASN 91 15.081 -11.784 1.685 724 HD22 ASN 91 HD22 ASN 91 14.827 -13.194 2.647 725 H LYS 92 H LYS 92 14.023 -8.649 0.620 726 HA LYS 92 HA LYS 92 15.965 -8.851 2.555 727 HB2 LYS 92 HB2 LYS 92 16.184 -7.702 0.343 728 HB3 LYS 92 HB3 LYS 92 15.269 -6.339 0.975 729 HG2 LYS 92 HG2 LYS 92 17.087 -5.987 2.676 730 HG3 LYS 92 HG3 LYS 92 18.005 -7.280 1.892 731 HD2 LYS 92 HD2 LYS 92 17.866 -5.930 -0.267 732 HD3 LYS 92 HD3 LYS 92 17.180 -4.609 0.685 733 HE2 LYS 92 HE2 LYS 92 19.543 -4.201 0.388 734 HE3 LYS 92 HE3 LYS 92 19.282 -4.623 2.081 735 HZ1 LYS 92 HZ1 LYS 92 21.212 -5.750 1.171 736 HZ2 LYS 92 HZ2 LYS 92 20.273 -6.454 -0.042 737 HZ3 LYS 92 HZ3 LYS 92 20.022 -6.883 1.571 738 H ILE 93 H ILE 93 13.478 -6.238 2.433 739 HA ILE 93 HA ILE 93 14.263 -5.349 5.098 740 HB ILE 93 HB ILE 93 12.743 -3.516 4.921 741 HG12 ILE 93 HG12 ILE 93 10.831 -4.773 3.798 742 HG13 ILE 93 HG13 ILE 93 11.114 -3.152 3.214 743 HG21 ILE 93 HG21 ILE 93 13.595 -2.377 2.891 744 HG22 ILE 93 HG22 ILE 93 14.183 -3.924 2.276 745 HG23 ILE 93 HG23 ILE 93 14.867 -3.245 3.755 746 HD11 ILE 93 HD11 ILE 93 11.841 -5.700 1.838 747 HD12 ILE 93 HD12 ILE 93 12.259 -4.086 1.263 748 HD13 ILE 93 HD13 ILE 93 10.573 -4.558 1.407 749 H ALA 94 H ALA 94 11.713 -7.351 3.750 750 HA ALA 94 HA ALA 94 9.750 -7.187 5.733 751 HB1 ALA 94 HB1 ALA 94 10.556 -9.647 4.150 752 HB2 ALA 94 HB2 ALA 94 9.433 -8.392 3.618 753 HB3 ALA 94 HB3 ALA 94 9.016 -9.419 4.992 754 H VAL 95 H VAL 95 12.705 -9.175 5.672 755 HA VAL 95 HA VAL 95 12.170 -10.502 8.171 756 HB VAL 95 HB VAL 95 14.392 -11.455 8.010 757 HG11 VAL 95 HG11 VAL 95 13.146 -11.291 5.239 758 HG12 VAL 95 HG12 VAL 95 12.697 -12.422 6.517 759 HG13 VAL 95 HG13 VAL 95 14.297 -12.519 5.782 760 HG21 VAL 95 HG21 VAL 95 15.678 -9.452 7.394 761 HG22 VAL 95 HG22 VAL 95 14.967 -9.469 5.779 762 HG23 VAL 95 HG23 VAL 95 16.034 -10.781 6.288 763 H PHE 96 H PHE 96 13.612 -7.444 7.309 764 HA PHE 96 HA PHE 96 15.007 -6.979 9.793 765 HB2 PHE 96 HB2 PHE 96 14.197 -5.037 7.575 766 HB3 PHE 96 HB3 PHE 96 15.208 -4.606 8.953 767 HD1 PHE 96 HD1 PHE 96 16.680 -7.491 8.775 768 HD2 PHE 96 HD2 PHE 96 15.999 -4.255 6.046 769 HE1 PHE 96 HE1 PHE 96 18.696 -8.113 7.518 770 HE2 PHE 96 HE2 PHE 96 18.019 -4.901 4.794 771 HZ PHE 96 HZ PHE 96 19.368 -6.824 5.530 772 H PHE 97 H PHE 97 11.783 -6.495 8.609 773 HA PHE 97 HA PHE 97 9.837 -5.807 9.418 774 HB2 PHE 97 HB2 PHE 97 9.190 -6.517 11.671 775 HB3 PHE 97 HB3 PHE 97 10.122 -7.752 10.853 776 HD1 PHE 97 HD1 PHE 97 10.271 -5.169 13.546 777 HD2 PHE 97 HD2 PHE 97 12.155 -8.610 11.831 778 HE1 PHE 97 HE1 PHE 97 11.740 -5.351 15.510 779 HE2 PHE 97 HE2 PHE 97 13.623 -8.776 13.803 780 HZ PHE 97 HZ PHE 97 13.414 -7.148 15.638 781 H GLN 98 H GLN 98 12.277 -3.782 9.905 782 HA GLN 98 HA GLN 98 10.530 -1.652 10.888 783 HB2 GLN 98 HB2 GLN 98 13.345 -2.146 11.981 784 HB3 GLN 98 HB3 GLN 98 12.411 -0.681 12.264 785 HG2 GLN 98 HG2 GLN 98 10.715 -1.999 13.478 786 HG3 GLN 98 HG3 GLN 98 11.649 -3.465 13.191 787 HE21 GLN 98 HE21 GLN 98 13.668 -3.715 14.258 788 HE22 GLN 98 HE22 GLN 98 14.028 -2.836 15.702 789 H1 GLY 1 H1 GLY 1 -9.840 -4.393 19.524 790 H2 GLY 1 H2 GLY 1 -8.685 -4.511 18.299 791 H3 GLY 1 H3 GLY 1 -10.329 -4.531 17.910 792 HA2 GLY 1 HA3 GLY 1 -9.338 -2.404 17.403 793 HA3 GLY 1 HA2 GLY 1 -10.584 -2.282 18.628 794 H SER 2 H SER 2 -7.066 -2.872 18.429 795 HA SER 2 HA SER 2 -6.625 -0.908 20.592 796 HB2 SER 2 HB2 SER 2 -4.297 -1.883 20.669 797 HB3 SER 2 HB3 SER 2 -5.550 -3.063 21.047 798 HG SER 2 HG SER 2 -4.348 -2.757 18.491 799 H MET 3 H MET 3 -5.900 1.050 20.033 800 HA MET 3 HA MET 3 -5.271 1.907 17.396 801 HB2 MET 3 HB2 MET 3 -6.066 3.484 19.137 802 HB3 MET 3 HB3 MET 3 -4.615 3.198 20.086 803 HG2 MET 3 HG2 MET 3 -3.264 4.197 18.227 804 HG3 MET 3 HG3 MET 3 -4.773 4.591 17.398 805 HE1 MET 3 HE1 MET 3 -3.813 7.175 17.332 806 HE2 MET 3 HE2 MET 3 -2.393 6.646 18.238 807 HE3 MET 3 HE3 MET 3 -3.332 8.031 18.796 808 H GLN 4 H GLN 4 -3.369 0.746 20.110 809 HA GLN 4 HA GLN 4 -0.753 1.031 19.095 810 HB2 GLN 4 HB2 GLN 4 -1.917 -1.129 20.909 811 HB3 GLN 4 HB3 GLN 4 -0.197 -0.877 20.636 812 HG2 GLN 4 HG2 GLN 4 -2.103 1.067 21.961 813 HG3 GLN 4 HG3 GLN 4 -0.891 0.078 22.772 814 HE21 GLN 4 HE21 GLN 4 -1.176 2.966 22.809 815 HE22 GLN 4 HE22 GLN 4 0.296 3.621 22.179 816 H ASN 5 H ASN 5 0.277 -0.031 17.460 817 HA ASN 5 HA ASN 5 -1.032 -1.901 15.763 818 HB2 ASN 5 HB2 ASN 5 1.116 -2.006 14.541 819 HB3 ASN 5 HB3 ASN 5 0.683 -0.344 14.898 820 HD21 ASN 5 HD21 ASN 5 2.949 -2.888 15.452 821 HD22 ASN 5 HD22 ASN 5 4.109 -1.954 16.321 822 H THR 6 H THR 6 -1.165 -4.104 15.949 823 HA THR 6 HA THR 6 0.646 -5.622 17.701 824 HB THR 6 HB THR 6 -2.352 -5.776 18.284 825 HG1 THR 6 HG1 THR 6 -1.902 -3.688 18.855 826 HG21 THR 6 HG21 THR 6 0.082 -6.462 19.972 827 HG22 THR 6 HG22 THR 6 -0.908 -7.632 19.091 828 HG23 THR 6 HG23 THR 6 -1.603 -6.709 20.426 829 H THR 7 H THR 7 1.022 -7.558 16.713 830 HA THR 7 HA THR 7 -0.394 -8.263 14.300 831 HB THR 7 HB THR 7 1.895 -9.775 15.643 832 HG1 THR 7 HG1 THR 7 1.916 -7.534 13.888 833 HG21 THR 7 HG21 THR 7 2.450 -10.505 13.346 834 HG22 THR 7 HG22 THR 7 1.055 -9.626 12.716 835 HG23 THR 7 HG23 THR 7 0.816 -11.015 13.778 836 H HIS 8 H HIS 8 -2.424 -8.604 15.541 837 HA HIS 8 HA HIS 8 -3.293 -11.230 15.440 838 HB2 HIS 8 HB2 HIS 8 -3.501 -12.090 17.622 839 HB3 HIS 8 HB3 HIS 8 -1.977 -11.232 17.789 840 HD1 HIS 8 HD1 HIS 8 -5.591 -11.110 18.838 841 HD2 HIS 8 HD2 HIS 8 -2.062 -9.051 19.608 842 HE1 HIS 8 HE1 HIS 8 -6.101 -9.583 20.767 843 HE2 HIS 8 HE2 HIS 8 -4.002 -8.249 21.110 844 H ASP 9 H ASP 9 -3.629 -8.003 16.735 845 HA ASP 9 HA ASP 9 -6.530 -8.027 16.984 846 HB2 ASP 9 HB2 ASP 9 -4.933 -6.697 18.476 847 HB3 ASP 9 HB3 ASP 9 -4.625 -5.641 17.100 848 H ASN 10 H ASN 10 -4.059 -6.844 14.819 849 HA ASN 10 HA ASN 10 -5.837 -5.724 12.860 850 HB2 ASN 10 HB2 ASN 10 -3.797 -5.511 11.492 851 HB3 ASN 10 HB3 ASN 10 -3.481 -4.957 13.133 852 HD21 ASN 10 HD21 ASN 10 -1.495 -5.767 11.262 853 HD22 ASN 10 HD22 ASN 10 -0.680 -7.125 11.943 854 H VAL 11 H VAL 11 -6.098 -6.635 10.704 855 HA VAL 11 HA VAL 11 -5.960 -9.590 10.533 856 HB VAL 11 HB VAL 11 -8.106 -9.601 9.269 857 HG11 VAL 11 HG11 VAL 11 -8.365 -8.422 12.059 858 HG12 VAL 11 HG12 VAL 11 -8.137 -10.125 11.660 859 HG13 VAL 11 HG13 VAL 11 -9.627 -9.305 11.191 860 HG21 VAL 11 HG21 VAL 11 -9.631 -7.641 9.282 861 HG22 VAL 11 HG22 VAL 11 -8.134 -7.281 8.420 862 HG23 VAL 11 HG23 VAL 11 -8.376 -6.664 10.048 863 H ILE 12 H ILE 12 -5.512 -10.392 8.519 864 HA ILE 12 HA ILE 12 -4.110 -8.595 6.701 865 HB ILE 12 HB ILE 12 -4.338 -11.638 6.610 866 HG12 ILE 12 HG12 ILE 12 -3.342 -10.817 8.785 867 HG13 ILE 12 HG13 ILE 12 -2.299 -11.870 7.843 868 HG21 ILE 12 HG21 ILE 12 -2.269 -11.544 5.311 869 HG22 ILE 12 HG22 ILE 12 -2.291 -9.783 5.395 870 HG23 ILE 12 HG23 ILE 12 -3.566 -10.640 4.523 871 HD11 ILE 12 HD11 ILE 12 -2.087 -8.872 8.060 872 HD12 ILE 12 HD12 ILE 12 -1.032 -9.904 7.090 873 HD13 ILE 12 HD13 ILE 12 -1.056 -10.065 8.845 874 H LEU 13 H LEU 13 -5.748 -7.564 5.487 875 HA LEU 13 HA LEU 13 -7.974 -9.105 4.390 876 HB2 LEU 13 HB2 LEU 13 -7.283 -6.144 4.164 877 HB3 LEU 13 HB3 LEU 13 -8.692 -6.882 3.413 878 HG LEU 13 HG LEU 13 -8.157 -6.645 6.401 879 HD11 LEU 13 HD11 LEU 13 -10.146 -5.207 6.424 880 HD12 LEU 13 HD12 LEU 13 -10.284 -5.348 4.669 881 HD13 LEU 13 HD13 LEU 13 -8.883 -4.546 5.386 882 HD21 LEU 13 HD21 LEU 13 -9.251 -8.789 5.953 883 HD22 LEU 13 HD22 LEU 13 -10.502 -7.983 5.004 884 HD23 LEU 13 HD23 LEU 13 -10.372 -7.680 6.738 885 H GLU 14 H GLU 14 -7.232 -10.444 2.857 886 HA GLU 14 HA GLU 14 -5.352 -9.595 0.803 887 HB2 GLU 14 HB2 GLU 14 -5.284 -11.891 1.902 888 HB3 GLU 14 HB3 GLU 14 -6.813 -12.268 1.134 889 HG2 GLU 14 HG2 GLU 14 -4.249 -11.643 -0.377 890 HG3 GLU 14 HG3 GLU 14 -4.782 -13.268 0.029 891 H LEU 15 H LEU 15 -6.474 -8.095 -0.388 892 HA LEU 15 HA LEU 15 -8.804 -9.131 -1.911 893 HB2 LEU 15 HB2 LEU 15 -9.131 -6.560 -2.395 894 HB3 LEU 15 HB3 LEU 15 -9.706 -7.287 -0.912 895 HG LEU 15 HG LEU 15 -7.383 -6.430 0.074 896 HD11 LEU 15 HD11 LEU 15 -7.758 -4.515 -2.235 897 HD12 LEU 15 HD12 LEU 15 -6.411 -5.626 -1.992 898 HD13 LEU 15 HD13 LEU 15 -6.655 -4.288 -0.874 899 HD21 LEU 15 HD21 LEU 15 -8.470 -4.356 0.798 900 HD22 LEU 15 HD22 LEU 15 -9.548 -5.745 0.905 901 HD23 LEU 15 HD23 LEU 15 -9.732 -4.588 -0.418 902 H THR 16 H THR 16 -8.341 -9.736 -3.867 903 HA THR 16 HA THR 16 -5.872 -9.024 -5.215 904 HB THR 16 HB THR 16 -8.197 -10.654 -6.349 905 HG1 THR 16 HG1 THR 16 -6.851 -11.310 -4.222 906 HG21 THR 16 HG21 THR 16 -6.469 -11.676 -7.770 907 HG22 THR 16 HG22 THR 16 -5.224 -10.681 -7.012 908 HG23 THR 16 HG23 THR 16 -6.486 -9.922 -7.991 909 H VAL 17 H VAL 17 -5.884 -7.053 -6.211 910 HA VAL 17 HA VAL 17 -8.260 -6.282 -7.802 911 HB VAL 17 HB VAL 17 -8.006 -4.035 -7.314 912 HG11 VAL 17 HG11 VAL 17 -7.673 -3.734 -4.871 913 HG12 VAL 17 HG12 VAL 17 -6.978 -5.362 -4.778 914 HG13 VAL 17 HG13 VAL 17 -8.669 -5.142 -5.254 915 HG21 VAL 17 HG21 VAL 17 -5.097 -4.444 -6.535 916 HG22 VAL 17 HG22 VAL 17 -5.954 -2.906 -6.428 917 HG23 VAL 17 HG23 VAL 17 -5.700 -3.668 -7.997 918 H ARG 18 H ARG 18 -7.863 -5.499 -9.867 919 HA ARG 18 HA ARG 18 -5.222 -6.118 -11.035 920 HB2 ARG 18 HB2 ARG 18 -6.435 -5.964 -13.230 921 HB3 ARG 18 HB3 ARG 18 -6.999 -7.243 -12.164 922 HG2 ARG 18 HG2 ARG 18 -8.932 -5.767 -11.513 923 HG3 ARG 18 HG3 ARG 18 -8.399 -4.612 -12.743 924 HD2 ARG 18 HD2 ARG 18 -9.238 -7.498 -13.224 925 HD3 ARG 18 HD3 ARG 18 -10.186 -6.063 -13.620 926 HE ARG 18 HE ARG 18 -7.725 -5.817 -14.920 927 HH11 ARG 18 HH11 ARG 18 -10.503 -7.973 -15.095 928 HH12 ARG 18 HH12 ARG 18 -10.248 -8.347 -16.767 929 HH21 ARG 18 HH21 ARG 18 -7.387 -6.353 -17.109 930 HH22 ARG 18 HH22 ARG 18 -8.493 -7.433 -17.904 931 H ASN 19 H ASN 19 -4.111 -4.580 -12.274 932 HA ASN 19 HA ASN 19 -4.035 -2.081 -10.937 933 HB2 ASN 19 HB2 ASN 19 -2.015 -3.388 -11.668 934 HB3 ASN 19 HB3 ASN 19 -2.377 -2.972 -13.335 935 HD21 ASN 19 HD21 ASN 19 -0.058 -2.341 -11.469 936 HD22 ASN 19 HD22 ASN 19 0.138 -0.634 -11.589 937 H HIS 20 H HIS 20 -6.024 -1.195 -11.435 938 HA HIS 20 HA HIS 20 -6.295 0.210 -14.036 939 HB2 HIS 20 HB2 HIS 20 -8.347 -0.366 -11.846 940 HB3 HIS 20 HB3 HIS 20 -8.677 0.645 -13.240 941 HD1 HIS 20 HD1 HIS 20 -10.604 -1.429 -13.073 942 HD2 HIS 20 HD2 HIS 20 -6.882 -2.243 -14.731 943 HE1 HIS 20 HE1 HIS 20 -10.939 -3.426 -14.549 944 HE2 HIS 20 HE2 HIS 20 -8.754 -3.700 -15.739 945 HA PRO 21 HA PRO 21 -5.292 4.269 -12.405 946 HB2 PRO 21 HB2 PRO 21 -7.788 5.670 -12.531 947 HB3 PRO 21 HB3 PRO 21 -6.544 5.601 -13.794 948 HG2 PRO 21 HG2 PRO 21 -9.009 3.925 -13.481 949 HG3 PRO 21 HG3 PRO 21 -8.280 4.591 -14.961 950 HD2 PRO 21 HD2 PRO 21 -7.962 2.024 -14.426 951 HD3 PRO 21 HD3 PRO 21 -6.558 2.960 -14.998 952 H GLY 22 H GLY 22 -4.757 4.025 -10.305 953 HA2 GLY 22 HA2 GLY 22 -4.755 4.537 -8.085 954 HA3 GLY 22 HA3 GLY 22 -6.189 5.497 -8.391 955 H VAL 23 H VAL 23 -5.923 1.987 -8.812 956 HA VAL 23 HA VAL 23 -8.217 1.545 -7.129 957 HB VAL 23 HB VAL 23 -7.935 -0.865 -7.660 958 HG11 VAL 23 HG11 VAL 23 -9.242 0.602 -9.112 959 HG12 VAL 23 HG12 VAL 23 -8.403 -0.612 -10.078 960 HG13 VAL 23 HG13 VAL 23 -7.792 1.044 -10.020 961 HG21 VAL 23 HG21 VAL 23 -5.471 -0.988 -7.817 962 HG22 VAL 23 HG22 VAL 23 -5.499 0.030 -9.259 963 HG23 VAL 23 HG23 VAL 23 -6.225 -1.582 -9.300 964 H MET 24 H MET 24 -4.765 1.265 -6.686 965 HA MET 24 HA MET 24 -4.816 -0.030 -4.150 966 HB2 MET 24 HB2 MET 24 -2.755 1.951 -5.211 967 HB3 MET 24 HB3 MET 24 -2.524 0.836 -3.869 968 HG2 MET 24 HG2 MET 24 -1.387 -0.087 -5.743 969 HG3 MET 24 HG3 MET 24 -2.848 -1.055 -5.524 970 HE1 MET 24 HE1 MET 24 -2.786 -2.094 -7.951 971 HE2 MET 24 HE2 MET 24 -1.244 -1.279 -8.225 972 HE3 MET 24 HE3 MET 24 -2.539 -1.144 -9.415 973 H THR 25 H THR 25 -5.201 3.317 -5.222 974 HA THR 25 HA THR 25 -5.305 4.574 -2.666 975 HB THR 25 HB THR 25 -6.646 5.577 -5.221 976 HG1 THR 25 HG1 THR 25 -4.563 6.622 -5.567 977 HG21 THR 25 HG21 THR 25 -7.139 6.932 -3.196 978 HG22 THR 25 HG22 THR 25 -6.128 7.825 -4.335 979 HG23 THR 25 HG23 THR 25 -5.407 7.106 -2.894 980 H HIS 26 H HIS 26 -7.717 2.975 -4.735 981 HA HIS 26 HA HIS 26 -10.095 3.729 -3.403 982 HB2 HIS 26 HB2 HIS 26 -9.513 1.104 -4.857 983 HB3 HIS 26 HB3 HIS 26 -11.113 1.625 -4.349 984 HD1 HIS 26 HD1 HIS 26 -10.485 0.943 -7.269 985 HD2 HIS 26 HD2 HIS 26 -10.361 4.796 -5.694 986 HE1 HIS 26 HE1 HIS 26 -10.756 2.491 -9.230 987 HE2 HIS 26 HE2 HIS 26 -10.570 4.800 -8.258 988 H VAL 27 H VAL 27 -8.030 0.839 -3.032 989 HA VAL 27 HA VAL 27 -9.669 -0.386 -1.073 990 HB VAL 27 HB VAL 27 -7.954 -2.098 -0.874 991 HG11 VAL 27 HG11 VAL 27 -9.364 -2.174 -2.876 992 HG12 VAL 27 HG12 VAL 27 -7.754 -2.785 -3.247 993 HG13 VAL 27 HG13 VAL 27 -8.221 -1.160 -3.757 994 HG21 VAL 27 HG21 VAL 27 -5.757 -1.958 -2.023 995 HG22 VAL 27 HG22 VAL 27 -5.913 -0.738 -0.757 996 HG23 VAL 27 HG23 VAL 27 -6.093 -0.277 -2.451 997 H CYS 28 H CYS 28 -6.697 1.555 -0.815 998 HA CYS 28 HA CYS 28 -6.317 1.249 1.986 999 HB2 CYS 28 HB2 CYS 28 -4.494 1.953 0.502 1000 HB3 CYS 28 HB3 CYS 28 -5.356 3.440 0.101 1001 HG CYS 28 HG CYS 28 -5.201 4.507 2.650 1002 H GLY 29 H GLY 29 -7.893 3.712 -0.035 1003 HA2 GLY 29 HA2 GLY 29 -8.608 5.516 2.036 1004 HA3 GLY 29 HA3 GLY 29 -9.277 5.475 0.415 1005 H LEU 30 H LEU 30 -10.114 2.632 0.805 1006 HA LEU 30 HA LEU 30 -12.814 3.153 1.508 1007 HB2 LEU 30 HB2 LEU 30 -11.680 1.377 -0.122 1008 HB3 LEU 30 HB3 LEU 30 -11.670 0.352 1.293 1009 HG LEU 30 HG LEU 30 -13.578 -0.077 -0.257 1010 HD11 LEU 30 HD11 LEU 30 -15.360 -0.217 1.374 1011 HD12 LEU 30 HD12 LEU 30 -14.502 0.893 2.447 1012 HD13 LEU 30 HD13 LEU 30 -13.819 -0.693 2.084 1013 HD21 LEU 30 HD21 LEU 30 -15.445 1.491 -0.448 1014 HD22 LEU 30 HD22 LEU 30 -13.958 2.206 -1.068 1015 HD23 LEU 30 HD23 LEU 30 -14.568 2.684 0.518 1016 H PHE 31 H PHE 31 -10.225 1.296 3.107 1017 HA PHE 31 HA PHE 31 -11.848 0.804 5.475 1018 HB2 PHE 31 HB2 PHE 31 -8.965 0.030 4.886 1019 HB3 PHE 31 HB3 PHE 31 -9.929 -0.531 6.262 1020 HD1 PHE 31 HD2 PHE 31 -12.350 -1.503 5.561 1021 HD2 PHE 31 HD1 PHE 31 -8.932 -1.406 2.999 1022 HE1 PHE 31 HE2 PHE 31 -13.351 -3.243 4.148 1023 HE2 PHE 31 HE1 PHE 31 -9.952 -3.132 1.586 1024 HZ PHE 31 HZ PHE 31 -12.158 -4.062 2.158 1025 H ALA 32 H ALA 32 -9.360 3.063 4.516 1026 HA ALA 32 HA ALA 32 -8.665 4.093 7.062 1027 HB1 ALA 32 HB1 ALA 32 -7.383 4.599 5.022 1028 HB2 ALA 32 HB2 ALA 32 -7.878 6.083 5.839 1029 HB3 ALA 32 HB3 ALA 32 -8.737 5.539 4.390 1030 H ARG 33 H ARG 33 -11.336 4.853 4.832 1031 HA ARG 33 HA ARG 33 -12.264 7.161 6.292 1032 HB2 ARG 33 HB2 ARG 33 -14.062 7.280 4.673 1033 HB3 ARG 33 HB3 ARG 33 -12.575 6.887 3.818 1034 HG2 ARG 33 HG2 ARG 33 -13.275 4.497 3.768 1035 HG3 ARG 33 HG3 ARG 33 -14.801 4.948 4.532 1036 HD2 ARG 33 HD2 ARG 33 -13.819 5.977 1.843 1037 HD3 ARG 33 HD3 ARG 33 -14.991 4.672 2.064 1038 HE ARG 33 HE ARG 33 -16.073 6.766 3.452 1039 HH11 ARG 33 HH11 ARG 33 -15.052 6.395 0.099 1040 HH12 ARG 33 HH12 ARG 33 -16.207 7.544 -0.496 1041 HH21 ARG 33 HH21 ARG 33 -17.581 8.250 2.648 1042 HH22 ARG 33 HH22 ARG 33 -17.638 8.596 0.945 1043 H ARG 34 H ARG 34 -12.538 3.866 6.968 1044 HA ARG 34 HA ARG 34 -15.181 3.675 7.999 1045 HB2 ARG 34 HB2 ARG 34 -13.384 1.804 7.468 1046 HB3 ARG 34 HB3 ARG 34 -12.800 2.107 9.090 1047 HG2 ARG 34 HG2 ARG 34 -15.633 1.210 8.442 1048 HG3 ARG 34 HG3 ARG 34 -14.314 0.113 8.828 1049 HD2 ARG 34 HD2 ARG 34 -15.514 0.308 10.838 1050 HD3 ARG 34 HD3 ARG 34 -14.133 1.384 11.063 1051 HE ARG 34 HE ARG 34 -16.209 2.946 10.069 1052 HH11 ARG 34 HH11 ARG 34 -15.650 1.047 12.993 1053 HH12 ARG 34 HH12 ARG 34 -16.667 2.057 13.972 1054 HH21 ARG 34 HH21 ARG 34 -17.497 4.273 11.397 1055 HH22 ARG 34 HH22 ARG 34 -17.708 3.873 13.071 1056 H ALA 35 H ALA 35 -12.056 4.000 9.721 1057 HA ALA 35 HA ALA 35 -12.817 6.011 11.560 1058 HB1 ALA 35 HB1 ALA 35 -14.342 4.285 12.476 1059 HB2 ALA 35 HB2 ALA 35 -13.072 4.673 13.639 1060 HB3 ALA 35 HB3 ALA 35 -12.985 3.180 12.694 1061 H PHE 36 H PHE 36 -11.015 2.946 11.343 1062 HA PHE 36 HA PHE 36 -8.590 4.235 12.447 1063 HB2 PHE 36 HB2 PHE 36 -9.456 2.203 13.637 1064 HB3 PHE 36 HB3 PHE 36 -9.262 1.267 12.160 1065 HD1 PHE 36 HD1 PHE 36 -7.114 3.609 14.222 1066 HD2 PHE 36 HD2 PHE 36 -7.388 -0.154 12.195 1067 HE1 PHE 36 HE1 PHE 36 -4.811 3.059 14.905 1068 HE2 PHE 36 HE2 PHE 36 -5.090 -0.689 12.879 1069 HZ PHE 36 HZ PHE 36 -3.798 0.913 14.234 1070 H ASN 37 H ASN 37 -6.626 4.022 11.363 1071 HA ASN 37 HA ASN 37 -6.710 3.872 8.470 1072 HB2 ASN 37 HB2 ASN 37 -4.381 4.343 10.382 1073 HB3 ASN 37 HB3 ASN 37 -4.314 4.547 8.632 1074 HD21 ASN 37 HD21 ASN 37 -4.041 6.404 11.026 1075 HD22 ASN 37 HD22 ASN 37 -5.063 7.737 10.624 1076 H VAL 38 H VAL 38 -4.667 2.720 7.468 1077 HA VAL 38 HA VAL 38 -4.776 -0.093 8.235 1078 HB VAL 38 HB VAL 38 -3.238 1.147 5.903 1079 HG11 VAL 38 HG11 VAL 38 -4.171 -1.709 6.386 1080 HG12 VAL 38 HG12 VAL 38 -2.509 -1.128 6.518 1081 HG13 VAL 38 HG13 VAL 38 -3.319 -1.132 4.950 1082 HG21 VAL 38 HG21 VAL 38 -5.155 0.536 4.455 1083 HG22 VAL 38 HG22 VAL 38 -5.627 1.726 5.672 1084 HG23 VAL 38 HG23 VAL 38 -6.074 0.030 5.877 1085 H GLU 39 H GLU 39 -3.381 -0.843 9.675 1086 HA GLU 39 HA GLU 39 -1.112 0.347 10.767 1087 HB2 GLU 39 HB2 GLU 39 -2.364 -1.549 11.801 1088 HB3 GLU 39 HB3 GLU 39 -1.789 -2.627 10.534 1089 HG2 GLU 39 HG2 GLU 39 0.579 -2.122 11.356 1090 HG3 GLU 39 HG3 GLU 39 -0.166 -1.328 12.740 1091 H GLY 40 H GLY 40 -1.308 -2.166 8.208 1092 HA2 GLY 40 HA2 GLY 40 1.299 -1.382 7.100 1093 HA3 GLY 40 HA3 GLY 40 1.178 -3.018 7.741 1094 H ILE 41 H ILE 41 1.670 -2.219 4.978 1095 HA ILE 41 HA ILE 41 -0.662 -3.437 3.593 1096 HB ILE 41 HB ILE 41 0.971 -1.075 2.509 1097 HG12 ILE 41 HG12 ILE 41 -1.895 -1.091 3.549 1098 HG13 ILE 41 HG13 ILE 41 -0.521 -0.311 4.321 1099 HG21 ILE 41 HG21 ILE 41 -0.646 -1.004 0.646 1100 HG22 ILE 41 HG22 ILE 41 -1.476 -2.416 1.305 1101 HG23 ILE 41 HG23 ILE 41 0.178 -2.565 0.710 1102 HD11 ILE 41 HD11 ILE 41 -1.915 1.306 3.206 1103 HD12 ILE 41 HD12 ILE 41 -1.746 0.455 1.672 1104 HD13 ILE 41 HD13 ILE 41 -0.341 1.226 2.417 1105 H LEU 42 H LEU 42 -0.094 -4.813 1.856 1106 HA LEU 42 HA LEU 42 2.579 -4.654 0.711 1107 HB2 LEU 42 HB2 LEU 42 2.946 -6.318 2.436 1108 HB3 LEU 42 HB3 LEU 42 1.508 -7.210 1.972 1109 HG LEU 42 HG LEU 42 2.567 -8.035 -0.055 1110 HD11 LEU 42 HD11 LEU 42 3.774 -6.058 -0.773 1111 HD12 LEU 42 HD12 LEU 42 4.854 -7.451 -0.729 1112 HD13 LEU 42 HD13 LEU 42 4.925 -6.237 0.555 1113 HD21 LEU 42 HD21 LEU 42 4.542 -8.222 2.238 1114 HD22 LEU 42 HD22 LEU 42 4.429 -9.327 0.861 1115 HD23 LEU 42 HD23 LEU 42 3.106 -9.227 2.018 1116 H CYS 43 H CYS 43 1.865 -4.089 -1.271 1117 HA CYS 43 HA CYS 43 -0.152 -5.682 -2.694 1118 HB2 CYS 43 HB2 CYS 43 -0.287 -3.233 -2.922 1119 HB3 CYS 43 HB3 CYS 43 1.365 -3.168 -3.515 1120 HG CYS 43 HG CYS 43 -1.027 -4.910 -5.205 1121 H LEU 44 H LEU 44 0.684 -7.545 -3.396 1122 HA LEU 44 HA LEU 44 3.407 -7.737 -4.526 1123 HB2 LEU 44 HB2 LEU 44 2.556 -9.285 -2.656 1124 HB3 LEU 44 HB3 LEU 44 1.466 -9.977 -3.839 1125 HG LEU 44 HG LEU 44 3.518 -10.685 -5.183 1126 HD11 LEU 44 HD11 LEU 44 5.005 -9.865 -2.668 1127 HD12 LEU 44 HD12 LEU 44 5.147 -9.105 -4.258 1128 HD13 LEU 44 HD13 LEU 44 5.684 -10.767 -4.028 1129 HD21 LEU 44 HD21 LEU 44 2.297 -12.276 -3.761 1130 HD22 LEU 44 HD22 LEU 44 3.274 -11.806 -2.368 1131 HD23 LEU 44 HD23 LEU 44 4.027 -12.617 -3.745 1132 HA PRO 45 HA PRO 45 0.820 -7.580 -8.329 1133 HB2 PRO 45 HB2 PRO 45 2.777 -6.789 -10.078 1134 HB3 PRO 45 HB3 PRO 45 2.004 -5.664 -8.943 1135 HG2 PRO 45 HG2 PRO 45 4.672 -7.014 -8.719 1136 HG3 PRO 45 HG3 PRO 45 4.224 -5.341 -8.326 1137 HD2 PRO 45 HD2 PRO 45 4.471 -7.325 -6.427 1138 HD3 PRO 45 HD3 PRO 45 3.414 -5.906 -6.231 1139 H ILE 46 H ILE 46 0.257 -9.531 -9.105 1140 HA ILE 46 HA ILE 46 2.115 -11.670 -9.616 1141 HB ILE 46 HB ILE 46 -0.829 -11.423 -10.388 1142 HG12 ILE 46 HG12 ILE 46 -1.107 -13.265 -8.598 1143 HG13 ILE 46 HG13 ILE 46 0.533 -12.897 -8.089 1144 HG21 ILE 46 HG21 ILE 46 0.975 -13.859 -10.622 1145 HG22 ILE 46 HG22 ILE 46 0.308 -12.924 -11.963 1146 HG23 ILE 46 HG23 ILE 46 -0.768 -13.843 -10.909 1147 HD11 ILE 46 HD11 ILE 46 -0.181 -10.614 -7.536 1148 HD12 ILE 46 HD12 ILE 46 -1.086 -11.843 -6.654 1149 HD13 ILE 46 HD13 ILE 46 -1.826 -11.026 -8.030 1150 H GLN 47 H GLN 47 3.503 -11.431 -11.234 1151 HA GLN 47 HA GLN 47 3.363 -9.696 -13.425 1152 HB2 GLN 47 HB2 GLN 47 5.372 -10.923 -14.242 1153 HB3 GLN 47 HB3 GLN 47 5.474 -10.517 -12.539 1154 HG2 GLN 47 HG2 GLN 47 4.892 -12.819 -11.918 1155 HG3 GLN 47 HG3 GLN 47 4.724 -13.243 -13.620 1156 HE21 GLN 47 HE21 GLN 47 6.306 -14.831 -13.547 1157 HE22 GLN 47 HE22 GLN 47 7.990 -14.478 -13.359 1158 H ASP 48 H ASP 48 2.008 -12.831 -13.044 1159 HA ASP 48 HA ASP 48 2.136 -13.807 -15.690 1160 HB2 ASP 48 HB2 ASP 48 1.913 -15.339 -13.850 1161 HB3 ASP 48 HB3 ASP 48 0.444 -14.563 -13.281 1162 H SER 49 H SER 49 -0.391 -11.935 -13.979 1163 HA SER 49 HA SER 49 -1.856 -11.437 -16.456 1164 HB2 SER 49 HB2 SER 49 -3.084 -13.088 -14.198 1165 HB3 SER 49 HB3 SER 49 -4.037 -12.322 -15.466 1166 HG SER 49 HG SER 49 -1.971 -14.221 -15.897 1167 H ASP 50 H ASP 50 -4.055 -10.251 -15.808 1168 HA ASP 50 HA ASP 50 -3.422 -7.860 -14.366 1169 HB2 ASP 50 HB2 ASP 50 -6.071 -8.894 -15.488 1170 HB3 ASP 50 HB3 ASP 50 -5.878 -7.301 -14.769 1171 H LYS 51 H LYS 51 -2.832 -8.858 -12.314 1172 HA LYS 51 HA LYS 51 -4.934 -8.658 -10.392 1173 HB2 LYS 51 HB2 LYS 51 -4.639 -10.982 -9.425 1174 HB3 LYS 51 HB3 LYS 51 -5.439 -10.941 -10.990 1175 HG2 LYS 51 HG2 LYS 51 -3.271 -11.573 -12.071 1176 HG3 LYS 51 HG3 LYS 51 -2.559 -11.711 -10.464 1177 HD2 LYS 51 HD2 LYS 51 -3.177 -13.930 -11.272 1178 HD3 LYS 51 HD3 LYS 51 -4.202 -13.501 -9.902 1179 HE2 LYS 51 HE2 LYS 51 -6.042 -12.932 -11.431 1180 HE3 LYS 51 HE3 LYS 51 -5.012 -13.267 -12.827 1181 HZ1 LYS 51 HZ1 LYS 51 -6.449 -15.123 -12.388 1182 HZ2 LYS 51 HZ2 LYS 51 -5.911 -15.245 -10.796 1183 HZ3 LYS 51 HZ3 LYS 51 -4.853 -15.578 -12.074 1184 H SER 52 H SER 52 -4.162 -8.335 -8.345 1185 HA SER 52 HA SER 52 -1.387 -8.731 -7.597 1186 HB2 SER 52 HB2 SER 52 -1.363 -6.481 -8.716 1187 HB3 SER 52 HB3 SER 52 -2.635 -5.931 -7.622 1188 HG SER 52 HG SER 52 -0.138 -5.679 -7.186 1189 H HIS 53 H HIS 53 -1.402 -9.325 -5.454 1190 HA HIS 53 HA HIS 53 -3.945 -9.140 -3.961 1191 HB2 HIS 53 HB2 HIS 53 -1.355 -10.579 -3.191 1192 HB3 HIS 53 HB3 HIS 53 -2.914 -10.742 -2.396 1193 HD1 HIS 53 HD1 HIS 53 -0.894 -12.788 -4.236 1194 HD2 HIS 53 HD2 HIS 53 -4.819 -11.591 -4.804 1195 HE1 HIS 53 HE1 HIS 53 -1.957 -14.584 -5.622 1196 HE2 HIS 53 HE2 HIS 53 -4.381 -13.944 -5.733 1197 H ILE 54 H ILE 54 -4.192 -7.337 -2.748 1198 HA ILE 54 HA ILE 54 -1.847 -6.081 -1.439 1199 HB ILE 54 HB ILE 54 -4.641 -4.885 -1.802 1200 HG12 ILE 54 HG12 ILE 54 -3.443 -3.223 -3.360 1201 HG13 ILE 54 HG13 ILE 54 -2.083 -4.335 -3.363 1202 HG21 ILE 54 HG21 ILE 54 -3.519 -4.050 0.207 1203 HG22 ILE 54 HG22 ILE 54 -3.620 -2.774 -1.008 1204 HG23 ILE 54 HG23 ILE 54 -2.093 -3.621 -0.745 1205 HD11 ILE 54 HD11 ILE 54 -4.857 -4.965 -4.335 1206 HD12 ILE 54 HD12 ILE 54 -3.453 -6.032 -4.408 1207 HD13 ILE 54 HD13 ILE 54 -3.475 -4.537 -5.343 1208 H TRP 55 H TRP 55 -1.565 -7.002 0.519 1209 HA TRP 55 HA TRP 55 -3.809 -7.856 2.186 1210 HB2 TRP 55 HB2 TRP 55 -0.793 -7.997 2.622 1211 HB3 TRP 55 HB3 TRP 55 -1.995 -8.662 3.728 1212 HD1 TRP 55 HD1 TRP 55 -3.393 -10.846 2.829 1213 HE1 TRP 55 HE1 TRP 55 -2.779 -12.649 1.117 1214 HE3 TRP 55 HE3 TRP 55 0.365 -8.424 0.461 1215 HZ2 TRP 55 HZ2 TRP 55 -0.959 -12.984 -1.006 1216 HZ3 TRP 55 HZ3 TRP 55 1.477 -9.521 -1.409 1217 HH2 TRP 55 HH2 TRP 55 0.834 -11.763 -2.144 1218 H LEU 56 H LEU 56 -4.838 -6.257 3.209 1219 HA LEU 56 HA LEU 56 -3.399 -3.914 4.259 1220 HB2 LEU 56 HB2 LEU 56 -6.365 -4.439 3.823 1221 HB3 LEU 56 HB3 LEU 56 -5.722 -2.965 4.536 1222 HG LEU 56 HG LEU 56 -5.131 -3.921 1.699 1223 HD11 LEU 56 HD11 LEU 56 -7.464 -3.220 1.934 1224 HD12 LEU 56 HD12 LEU 56 -6.552 -2.082 0.949 1225 HD13 LEU 56 HD13 LEU 56 -6.948 -1.678 2.623 1226 HD21 LEU 56 HD21 LEU 56 -4.388 -1.324 3.089 1227 HD22 LEU 56 HD22 LEU 56 -4.120 -1.697 1.382 1228 HD23 LEU 56 HD23 LEU 56 -3.280 -2.619 2.624 1229 H LEU 57 H LEU 57 -2.742 -4.103 6.270 1230 HA LEU 57 HA LEU 57 -3.983 -5.834 8.249 1231 HB2 LEU 57 HB2 LEU 57 -1.452 -4.143 8.264 1232 HB3 LEU 57 HB3 LEU 57 -2.054 -4.936 9.710 1233 HG LEU 57 HG LEU 57 -1.775 -7.154 8.593 1234 HD11 LEU 57 HD11 LEU 57 -0.459 -7.378 6.539 1235 HD12 LEU 57 HD12 LEU 57 -0.455 -5.621 6.341 1236 HD13 LEU 57 HD13 LEU 57 -1.972 -6.518 6.249 1237 HD21 LEU 57 HD21 LEU 57 0.740 -5.472 8.709 1238 HD22 LEU 57 HD22 LEU 57 0.661 -7.236 8.777 1239 HD23 LEU 57 HD23 LEU 57 -0.044 -6.274 10.073 1240 H VAL 58 H VAL 58 -5.708 -5.023 9.222 1241 HA VAL 58 HA VAL 58 -5.644 -2.407 10.561 1242 HB VAL 58 HB VAL 58 -6.605 -1.965 8.287 1243 HG11 VAL 58 HG11 VAL 58 -8.806 -3.900 9.027 1244 HG12 VAL 58 HG12 VAL 58 -7.578 -4.134 7.779 1245 HG13 VAL 58 HG13 VAL 58 -8.784 -2.856 7.598 1246 HG21 VAL 58 HG21 VAL 58 -8.657 -1.668 10.510 1247 HG22 VAL 58 HG22 VAL 58 -8.650 -0.767 8.990 1248 HG23 VAL 58 HG23 VAL 58 -7.341 -0.543 10.151 1249 H ASN 59 H ASN 59 -7.147 -2.401 12.387 1250 HA ASN 59 HA ASN 59 -7.830 -4.966 13.404 1251 HB2 ASN 59 HB2 ASN 59 -8.849 -3.861 15.276 1252 HB3 ASN 59 HB3 ASN 59 -7.405 -2.965 14.856 1253 HD21 ASN 59 HD21 ASN 59 -8.792 -1.574 12.570 1254 HD22 ASN 59 HD22 ASN 59 -9.804 -0.404 13.324 1255 H ASP 60 H ASP 60 -9.635 -6.193 13.138 1256 HA ASP 60 HA ASP 60 -11.594 -5.541 11.180 1257 HB2 ASP 60 HB2 ASP 60 -10.841 -7.887 11.669 1258 HB3 ASP 60 HB3 ASP 60 -11.690 -7.814 13.210 1259 H ASP 61 H ASP 61 -13.637 -4.792 11.404 1260 HA ASP 61 HA ASP 61 -14.730 -4.126 14.057 1261 HB2 ASP 61 HB2 ASP 61 -13.378 -2.162 13.325 1262 HB3 ASP 61 HB3 ASP 61 -14.229 -2.128 11.788 1263 H GLN 62 H GLN 62 -17.008 -3.607 13.909 1264 HA GLN 62 HA GLN 62 -18.552 -5.376 12.429 1265 HB2 GLN 62 HB2 GLN 62 -19.432 -2.729 13.668 1266 HB3 GLN 62 HB3 GLN 62 -20.502 -4.056 13.232 1267 HG2 GLN 62 HG2 GLN 62 -18.314 -4.249 15.322 1268 HG3 GLN 62 HG3 GLN 62 -19.999 -3.883 15.681 1269 HE21 GLN 62 HE21 GLN 62 -21.562 -5.531 15.422 1270 HE22 GLN 62 HE22 GLN 62 -21.122 -7.200 15.361 1271 H ARG 63 H ARG 63 -17.874 -1.964 11.822 1272 HA ARG 63 HA ARG 63 -19.518 -1.812 9.434 1273 HB2 ARG 63 HB2 ARG 63 -17.739 0.237 10.814 1274 HB3 ARG 63 HB3 ARG 63 -18.537 0.559 9.279 1275 HG2 ARG 63 HG2 ARG 63 -19.897 1.542 10.973 1276 HG3 ARG 63 HG3 ARG 63 -20.749 0.101 10.416 1277 HD2 ARG 63 HD2 ARG 63 -19.771 -1.117 12.427 1278 HD3 ARG 63 HD3 ARG 63 -19.190 0.452 12.996 1279 HE ARG 63 HE ARG 63 -21.958 0.606 12.462 1280 HH11 ARG 63 HH11 ARG 63 -19.746 -0.811 14.802 1281 HH12 ARG 63 HH12 ARG 63 -20.910 -0.806 16.087 1282 HH21 ARG 63 HH21 ARG 63 -23.481 0.572 14.141 1283 HH22 ARG 63 HH22 ARG 63 -23.034 -0.020 15.710 1284 H LEU 64 H LEU 64 -16.145 -2.311 10.264 1285 HA LEU 64 HA LEU 64 -14.925 -1.785 7.782 1286 HB2 LEU 64 HB2 LEU 64 -13.760 -2.332 10.000 1287 HB3 LEU 64 HB3 LEU 64 -14.119 -4.018 9.681 1288 HG LEU 64 HG LEU 64 -12.822 -3.414 7.343 1289 HD11 LEU 64 HD11 LEU 64 -10.909 -1.967 7.737 1290 HD12 LEU 64 HD12 LEU 64 -11.485 -1.596 9.364 1291 HD13 LEU 64 HD13 LEU 64 -12.413 -1.071 7.953 1292 HD21 LEU 64 HD21 LEU 64 -12.247 -5.263 8.851 1293 HD22 LEU 64 HD22 LEU 64 -11.381 -4.139 9.903 1294 HD23 LEU 64 HD23 LEU 64 -10.813 -4.425 8.255 1295 H GLU 65 H GLU 65 -16.443 -4.725 9.109 1296 HA GLU 65 HA GLU 65 -15.970 -6.548 7.037 1297 HB2 GLU 65 HB2 GLU 65 -18.391 -6.401 8.893 1298 HB3 GLU 65 HB3 GLU 65 -17.889 -7.823 7.973 1299 HG2 GLU 65 HG2 GLU 65 -15.828 -7.976 9.275 1300 HG3 GLU 65 HG3 GLU 65 -16.240 -6.503 10.149 1301 H GLN 66 H GLN 66 -18.660 -4.314 7.553 1302 HA GLN 66 HA GLN 66 -20.300 -4.969 5.352 1303 HB2 GLN 66 HB2 GLN 66 -19.953 -2.255 6.705 1304 HB3 GLN 66 HB3 GLN 66 -21.339 -2.753 5.732 1305 HG2 GLN 66 HG2 GLN 66 -22.019 -4.360 7.390 1306 HG3 GLN 66 HG3 GLN 66 -20.520 -4.147 8.295 1307 HE21 GLN 66 HE21 GLN 66 -21.498 -3.535 10.199 1308 HE22 GLN 66 HE22 GLN 66 -22.366 -2.052 10.394 1309 H MET 67 H MET 67 -17.579 -2.780 5.730 1310 HA MET 67 HA MET 67 -17.687 -1.621 3.111 1311 HB2 MET 67 HB2 MET 67 -15.638 -1.527 5.356 1312 HB3 MET 67 HB3 MET 67 -15.389 -0.705 3.824 1313 HG2 MET 67 HG2 MET 67 -17.521 0.548 4.208 1314 HG3 MET 67 HG3 MET 67 -17.611 -0.189 5.809 1315 HE1 MET 67 HE1 MET 67 -17.797 2.346 6.801 1316 HE2 MET 67 HE2 MET 67 -17.646 2.979 5.159 1317 HE3 MET 67 HE3 MET 67 -16.603 3.592 6.441 1318 H ILE 68 H ILE 68 -16.002 -4.396 4.520 1319 HA ILE 68 HA ILE 68 -14.241 -4.975 2.357 1320 HB ILE 68 HB ILE 68 -15.508 -6.900 4.381 1321 HG12 ILE 68 HG12 ILE 68 -12.696 -5.711 4.449 1322 HG13 ILE 68 HG13 ILE 68 -14.049 -5.029 5.331 1323 HG21 ILE 68 HG21 ILE 68 -13.660 -8.462 3.820 1324 HG22 ILE 68 HG22 ILE 68 -13.109 -7.354 2.562 1325 HG23 ILE 68 HG23 ILE 68 -14.682 -8.139 2.418 1326 HD11 ILE 68 HD11 ILE 68 -12.678 -6.360 6.786 1327 HD12 ILE 68 HD12 ILE 68 -12.871 -7.767 5.742 1328 HD13 ILE 68 HD13 ILE 68 -14.263 -7.110 6.606 1329 H SER 69 H SER 69 -17.578 -5.833 3.115 1330 HA SER 69 HA SER 69 -18.071 -7.570 0.917 1331 HB2 SER 69 HB2 SER 69 -20.059 -5.995 2.608 1332 HB3 SER 69 HB3 SER 69 -20.414 -7.427 1.636 1333 HG SER 69 HG SER 69 -18.410 -7.612 3.587 1334 H GLN 70 H GLN 70 -18.391 -4.091 1.431 1335 HA GLN 70 HA GLN 70 -19.994 -3.460 -0.851 1336 HB2 GLN 70 HB2 GLN 70 -19.745 -2.104 1.281 1337 HB3 GLN 70 HB3 GLN 70 -18.129 -1.656 0.779 1338 HG2 GLN 70 HG2 GLN 70 -20.593 -0.953 -0.844 1339 HG3 GLN 70 HG3 GLN 70 -19.998 0.071 0.452 1340 HE21 GLN 70 HE21 GLN 70 -17.911 1.075 0.175 1341 HE22 GLN 70 HE22 GLN 70 -17.286 1.363 -1.409 1342 H ILE 71 H ILE 71 -16.501 -3.109 -0.154 1343 HA ILE 71 HA ILE 71 -15.777 -2.081 -2.696 1344 HB ILE 71 HB ILE 71 -14.387 -1.781 -0.638 1345 HG12 ILE 71 HG12 ILE 71 -13.005 -3.004 -3.063 1346 HG13 ILE 71 HG13 ILE 71 -13.366 -1.305 -2.793 1347 HG21 ILE 71 HG21 ILE 71 -13.543 -4.675 -1.006 1348 HG22 ILE 71 HG22 ILE 71 -14.568 -4.061 0.292 1349 HG23 ILE 71 HG23 ILE 71 -12.889 -3.533 0.175 1350 HD11 ILE 71 HD11 ILE 71 -11.044 -1.719 -2.487 1351 HD12 ILE 71 HD12 ILE 71 -11.369 -2.985 -1.303 1352 HD13 ILE 71 HD13 ILE 71 -11.760 -1.300 -0.931 1353 H ASP 72 H ASP 72 -16.168 -5.312 -1.446 1354 HA ASP 72 HA ASP 72 -14.859 -6.841 -3.371 1355 HB2 ASP 72 HB2 ASP 72 -15.521 -7.996 -1.456 1356 HB3 ASP 72 HB3 ASP 72 -17.125 -7.334 -1.447 1357 H LYS 73 H LYS 73 -17.983 -5.236 -3.485 1358 HA LYS 73 HA LYS 73 -18.999 -6.660 -5.771 1359 HB2 LYS 73 HB2 LYS 73 -20.022 -3.969 -4.787 1360 HB3 LYS 73 HB3 LYS 73 -20.908 -5.213 -5.660 1361 HG2 LYS 73 HG2 LYS 73 -19.988 -5.300 -2.774 1362 HG3 LYS 73 HG3 LYS 73 -21.646 -5.155 -3.352 1363 HD2 LYS 73 HD2 LYS 73 -19.864 -7.587 -3.806 1364 HD3 LYS 73 HD3 LYS 73 -21.044 -7.447 -2.503 1365 HE2 LYS 73 HE2 LYS 73 -22.868 -7.307 -4.124 1366 HE3 LYS 73 HE3 LYS 73 -21.709 -7.320 -5.454 1367 HZ1 LYS 73 HZ1 LYS 73 -22.736 -9.507 -5.037 1368 HZ2 LYS 73 HZ2 LYS 73 -22.047 -9.526 -3.494 1369 HZ3 LYS 73 HZ3 LYS 73 -21.054 -9.544 -4.857 1370 H LEU 74 H LEU 74 -16.609 -4.312 -5.512 1371 HA LEU 74 HA LEU 74 -17.104 -2.842 -7.963 1372 HB2 LEU 74 HB2 LEU 74 -14.605 -2.998 -6.215 1373 HB3 LEU 74 HB3 LEU 74 -14.865 -1.850 -7.522 1374 HG LEU 74 HG LEU 74 -16.448 -1.978 -4.931 1375 HD11 LEU 74 HD11 LEU 74 -14.200 -1.061 -4.597 1376 HD12 LEU 74 HD12 LEU 74 -15.430 0.183 -4.394 1377 HD13 LEU 74 HD13 LEU 74 -14.476 0.121 -5.878 1378 HD21 LEU 74 HD21 LEU 74 -16.734 -0.069 -7.258 1379 HD22 LEU 74 HD22 LEU 74 -17.566 0.069 -5.705 1380 HD23 LEU 74 HD23 LEU 74 -17.891 -1.305 -6.758 1381 H GLU 75 H GLU 75 -15.829 -2.976 -9.850 1382 HA GLU 75 HA GLU 75 -15.263 -5.699 -10.670 1383 HB2 GLU 75 HB2 GLU 75 -15.164 -3.099 -12.252 1384 HB3 GLU 75 HB3 GLU 75 -15.055 -4.718 -12.945 1385 HG2 GLU 75 HG2 GLU 75 -17.350 -5.209 -12.222 1386 HG3 GLU 75 HG3 GLU 75 -17.459 -3.627 -11.447 1387 H ASP 76 H ASP 76 -13.377 -2.808 -9.945 1388 HA ASP 76 HA ASP 76 -10.880 -3.675 -11.016 1389 HB2 ASP 76 HB2 ASP 76 -9.836 -1.972 -9.573 1390 HB3 ASP 76 HB3 ASP 76 -11.215 -1.324 -10.440 1391 H VAL 77 H VAL 77 -12.396 -4.029 -7.820 1392 HA VAL 77 HA VAL 77 -10.509 -5.899 -6.803 1393 HB VAL 77 HB VAL 77 -13.369 -5.147 -6.054 1394 HG11 VAL 77 HG11 VAL 77 -11.813 -7.458 -4.811 1395 HG12 VAL 77 HG12 VAL 77 -13.308 -7.600 -5.738 1396 HG13 VAL 77 HG13 VAL 77 -13.314 -6.775 -4.179 1397 HG21 VAL 77 HG21 VAL 77 -12.306 -4.563 -3.887 1398 HG22 VAL 77 HG22 VAL 77 -11.531 -3.714 -5.231 1399 HG23 VAL 77 HG23 VAL 77 -10.744 -5.119 -4.499 1400 H VAL 78 H VAL 78 -10.070 -7.679 -7.855 1401 HA VAL 78 HA VAL 78 -11.941 -9.274 -9.378 1402 HB VAL 78 HB VAL 78 -9.129 -10.102 -8.508 1403 HG11 VAL 78 HG11 VAL 78 -10.485 -11.893 -9.531 1404 HG12 VAL 78 HG12 VAL 78 -9.137 -11.442 -10.579 1405 HG13 VAL 78 HG13 VAL 78 -10.768 -10.878 -10.951 1406 HG21 VAL 78 HG21 VAL 78 -8.950 -7.867 -9.517 1407 HG22 VAL 78 HG22 VAL 78 -9.844 -8.415 -10.938 1408 HG23 VAL 78 HG23 VAL 78 -8.251 -9.088 -10.584 1409 H LYS 79 H LYS 79 -10.364 -9.394 -6.206 1410 HA LYS 79 HA LYS 79 -12.246 -11.379 -5.141 1411 HB2 LYS 79 HB2 LYS 79 -9.222 -11.748 -4.866 1412 HB3 LYS 79 HB3 LYS 79 -10.451 -12.740 -4.096 1413 HG2 LYS 79 HG2 LYS 79 -11.108 -13.685 -6.227 1414 HG3 LYS 79 HG3 LYS 79 -10.046 -12.566 -7.089 1415 HD2 LYS 79 HD2 LYS 79 -8.069 -13.609 -5.951 1416 HD3 LYS 79 HD3 LYS 79 -9.156 -14.759 -5.166 1417 HE2 LYS 79 HE2 LYS 79 -8.753 -14.490 -8.166 1418 HE3 LYS 79 HE3 LYS 79 -8.041 -15.741 -7.144 1419 HZ1 LYS 79 HZ1 LYS 79 -10.000 -16.569 -8.238 1420 HZ2 LYS 79 HZ2 LYS 79 -10.934 -15.307 -7.625 1421 HZ3 LYS 79 HZ3 LYS 79 -10.296 -16.468 -6.577 1422 H VAL 80 H VAL 80 -12.400 -11.276 -2.841 1423 HA VAL 80 HA VAL 80 -10.479 -9.619 -1.327 1424 HB VAL 80 HB VAL 80 -12.239 -8.751 0.185 1425 HG11 VAL 80 HG11 VAL 80 -12.916 -8.065 -2.662 1426 HG12 VAL 80 HG12 VAL 80 -11.654 -7.321 -1.682 1427 HG13 VAL 80 HG13 VAL 80 -13.349 -7.123 -1.233 1428 HG21 VAL 80 HG21 VAL 80 -14.619 -9.068 -0.232 1429 HG22 VAL 80 HG22 VAL 80 -13.809 -10.617 0.009 1430 HG23 VAL 80 HG23 VAL 80 -14.245 -10.096 -1.619 1431 H GLN 81 H GLN 81 -10.117 -10.429 0.827 1432 HA GLN 81 HA GLN 81 -11.395 -12.877 1.737 1433 HB2 GLN 81 HB2 GLN 81 -9.693 -13.752 0.177 1434 HB3 GLN 81 HB3 GLN 81 -8.438 -12.798 0.954 1435 HG2 GLN 81 HG2 GLN 81 -8.613 -14.145 2.976 1436 HG3 GLN 81 HG3 GLN 81 -9.974 -15.036 2.302 1437 HE21 GLN 81 HE21 GLN 81 -7.081 -14.179 0.431 1438 HE22 GLN 81 HE22 GLN 81 -6.502 -15.797 0.285 1439 H ARG 82 H ARG 82 -10.954 -13.274 3.965 1440 HA ARG 82 HA ARG 82 -9.784 -10.982 5.449 1441 HB2 ARG 82 HB2 ARG 82 -12.234 -12.661 6.170 1442 HB3 ARG 82 HB3 ARG 82 -11.544 -11.380 7.166 1443 HG2 ARG 82 HG2 ARG 82 -12.119 -9.701 5.500 1444 HG3 ARG 82 HG3 ARG 82 -12.697 -10.947 4.388 1445 HD2 ARG 82 HD2 ARG 82 -14.546 -9.775 5.572 1446 HD3 ARG 82 HD3 ARG 82 -14.516 -11.513 5.912 1447 HE ARG 82 HE ARG 82 -13.020 -10.068 7.850 1448 HH11 ARG 82 HH11 ARG 82 -16.366 -10.797 7.013 1449 HH12 ARG 82 HH12 ARG 82 -16.917 -10.593 8.643 1450 HH21 ARG 82 HH21 ARG 82 -13.768 -9.818 9.952 1451 HH22 ARG 82 HH22 ARG 82 -15.450 -10.040 10.301 1452 H ASN 83 H ASN 83 -7.797 -12.003 5.747 1453 HA ASN 83 HA ASN 83 -7.653 -14.614 7.117 1454 HB2 ASN 83 HB2 ASN 83 -5.385 -12.885 6.021 1455 HB3 ASN 83 HB3 ASN 83 -5.238 -14.534 6.613 1456 HD21 ASN 83 HD21 ASN 83 -6.041 -16.246 5.298 1457 HD22 ASN 83 HD22 ASN 83 -6.356 -16.010 3.615 1458 H GLN 84 H GLN 84 -6.497 -14.827 9.109 1459 HA GLN 84 HA GLN 84 -6.381 -12.438 10.817 1460 HB2 GLN 84 HB2 GLN 84 -6.055 -15.413 11.406 1461 HB3 GLN 84 HB3 GLN 84 -5.663 -14.181 12.598 1462 HG2 GLN 84 HG2 GLN 84 -7.879 -15.067 13.032 1463 HG3 GLN 84 HG3 GLN 84 -7.989 -13.375 12.560 1464 HE21 GLN 84 HE21 GLN 84 -9.037 -12.846 10.615 1465 HE22 GLN 84 HE22 GLN 84 -9.975 -13.989 9.723 1466 H SER 85 H SER 85 -4.393 -11.915 12.014 1467 HA SER 85 HA SER 85 -2.253 -11.778 10.086 1468 HB2 SER 85 HB2 SER 85 -3.077 -9.766 11.287 1469 HB3 SER 85 HB3 SER 85 -2.433 -10.424 12.777 1470 HG SER 85 HG SER 85 -1.129 -8.885 11.344 1471 H ASP 86 H ASP 86 0.001 -11.990 10.632 1472 HA ASP 86 HA ASP 86 0.702 -14.129 12.498 1473 HB2 ASP 86 HB2 ASP 86 -0.305 -15.192 10.398 1474 HB3 ASP 86 HB3 ASP 86 1.001 -14.476 9.468 1475 HA PRO 87 HA PRO 87 4.468 -11.580 12.461 1476 HB2 PRO 87 HB2 PRO 87 5.841 -14.139 13.294 1477 HB3 PRO 87 HB3 PRO 87 5.863 -12.537 14.067 1478 HG2 PRO 87 HG2 PRO 87 4.424 -14.472 15.152 1479 HG3 PRO 87 HG3 PRO 87 3.757 -12.824 15.056 1480 HD2 PRO 87 HD2 PRO 87 3.160 -15.200 13.285 1481 HD3 PRO 87 HD3 PRO 87 2.036 -14.018 14.003 1482 H THR 88 H THR 88 4.608 -14.816 10.965 1483 HA THR 88 HA THR 88 6.971 -14.147 9.380 1484 HB THR 88 HB THR 88 7.003 -16.465 8.651 1485 HG1 THR 88 HG1 THR 88 4.539 -16.911 9.993 1486 HG21 THR 88 HG21 THR 88 7.830 -16.115 10.956 1487 HG22 THR 88 HG22 THR 88 7.081 -17.704 10.789 1488 HG23 THR 88 HG23 THR 88 6.207 -16.394 11.586 1489 H MET 89 H MET 89 3.819 -13.352 9.011 1490 HA MET 89 HA MET 89 2.885 -14.517 6.669 1491 HB2 MET 89 HB2 MET 89 1.585 -13.150 8.431 1492 HB3 MET 89 HB3 MET 89 2.099 -11.710 7.561 1493 HG2 MET 89 HG2 MET 89 0.484 -13.973 6.354 1494 HG3 MET 89 HG3 MET 89 -0.201 -12.481 6.991 1495 HE1 MET 89 HE1 MET 89 -1.341 -12.778 4.363 1496 HE2 MET 89 HE2 MET 89 -0.168 -14.003 3.872 1497 HE3 MET 89 HE3 MET 89 -0.360 -12.531 2.920 1498 H PHE 90 H PHE 90 4.437 -11.273 7.011 1499 HA PHE 90 HA PHE 90 4.317 -10.431 4.363 1500 HB2 PHE 90 HB2 PHE 90 6.343 -9.801 6.543 1501 HB3 PHE 90 HB3 PHE 90 6.444 -9.048 4.958 1502 HD1 PHE 90 HD1 PHE 90 4.700 -7.453 4.199 1503 HD2 PHE 90 HD2 PHE 90 4.631 -9.101 8.156 1504 HE1 PHE 90 HE1 PHE 90 3.143 -5.685 4.911 1505 HE2 PHE 90 HE2 PHE 90 3.072 -7.325 8.853 1506 HZ PHE 90 HZ PHE 90 2.333 -5.620 7.233 1507 H ASN 91 H ASN 91 6.894 -12.324 5.922 1508 HA ASN 91 HA ASN 91 8.647 -12.462 3.672 1509 HB2 ASN 91 HB2 ASN 91 9.420 -12.785 6.008 1510 HB3 ASN 91 HB3 ASN 91 8.451 -14.243 6.145 1511 HD21 ASN 91 HD21 ASN 91 9.167 -16.148 5.063 1512 HD22 ASN 91 HD22 ASN 91 10.793 -16.312 4.499 1513 H LYS 92 H LYS 92 6.031 -14.447 4.890 1514 HA LYS 92 HA LYS 92 6.426 -16.895 3.662 1515 HB2 LYS 92 HB2 LYS 92 4.781 -16.381 5.473 1516 HB3 LYS 92 HB3 LYS 92 3.765 -15.552 4.302 1517 HG2 LYS 92 HG2 LYS 92 3.495 -17.729 3.082 1518 HG3 LYS 92 HG3 LYS 92 4.423 -18.514 4.369 1519 HD2 LYS 92 HD2 LYS 92 2.686 -17.630 6.019 1520 HD3 LYS 92 HD3 LYS 92 1.729 -17.116 4.627 1521 HE2 LYS 92 HE2 LYS 92 0.885 -19.240 5.415 1522 HE3 LYS 92 HE3 LYS 92 1.676 -19.506 3.860 1523 HZ1 LYS 92 HZ1 LYS 92 2.286 -21.218 5.409 1524 HZ2 LYS 92 HZ2 LYS 92 2.826 -20.082 6.540 1525 HZ3 LYS 92 HZ3 LYS 92 3.644 -20.275 5.074 1526 H ILE 93 H ILE 93 4.308 -14.240 2.467 1527 HA ILE 93 HA ILE 93 3.922 -15.615 -0.067 1528 HB ILE 93 HB ILE 93 2.375 -13.909 -0.727 1529 HG12 ILE 93 HG12 ILE 93 3.661 -11.918 0.223 1530 HG13 ILE 93 HG13 ILE 93 1.925 -11.857 0.410 1531 HG21 ILE 93 HG21 ILE 93 0.684 -14.072 1.074 1532 HG22 ILE 93 HG22 ILE 93 1.929 -14.633 2.192 1533 HG23 ILE 93 HG23 ILE 93 1.497 -15.613 0.789 1534 HD11 ILE 93 HD11 ILE 93 3.936 -12.461 2.535 1535 HD12 ILE 93 HD12 ILE 93 2.187 -12.548 2.751 1536 HD13 ILE 93 HD13 ILE 93 2.949 -11.014 2.351 1537 H ALA 94 H ALA 94 5.982 -13.060 1.134 1538 HA ALA 94 HA ALA 94 6.590 -11.651 -1.207 1539 HB1 ALA 94 HB1 ALA 94 8.437 -12.259 1.124 1540 HB2 ALA 94 HB2 ALA 94 7.300 -10.913 1.023 1541 HB3 ALA 94 HB3 ALA 94 8.678 -10.982 -0.076 1542 H VAL 95 H VAL 95 7.989 -14.666 0.058 1543 HA VAL 95 HA VAL 95 9.935 -14.967 -2.040 1544 HB VAL 95 HB VAL 95 10.419 -17.161 -1.114 1545 HG11 VAL 95 HG11 VAL 95 9.881 -15.187 1.138 1546 HG12 VAL 95 HG12 VAL 95 11.320 -15.232 0.117 1547 HG13 VAL 95 HG13 VAL 95 10.982 -16.569 1.217 1548 HG21 VAL 95 HG21 VAL 95 8.142 -18.002 -0.740 1549 HG22 VAL 95 HG22 VAL 95 7.920 -16.873 0.598 1550 HG23 VAL 95 HG23 VAL 95 9.107 -18.174 0.728 1551 H PHE 96 H PHE 96 6.564 -15.780 -1.710 1552 HA PHE 96 HA PHE 96 6.453 -17.752 -3.816 1553 HB2 PHE 96 HB2 PHE 96 4.216 -16.184 -2.452 1554 HB3 PHE 96 HB3 PHE 96 3.955 -17.481 -3.616 1555 HD1 PHE 96 HD1 PHE 96 6.430 -19.123 -2.327 1556 HD2 PHE 96 HD2 PHE 96 2.804 -17.416 -0.813 1557 HE1 PHE 96 HE1 PHE 96 6.399 -20.779 -0.517 1558 HE2 PHE 96 HE2 PHE 96 2.793 -19.079 1.002 1559 HZ PHE 96 HZ PHE 96 4.586 -20.759 1.149 1560 H PHE 97 H PHE 97 6.196 -14.283 -3.593 1561 HA PHE 97 HA PHE 97 5.874 -12.570 -4.990 1562 HB2 PHE 97 HB2 PHE 97 7.213 -12.558 -7.061 1563 HB3 PHE 97 HB3 PHE 97 8.102 -13.217 -5.705 1564 HD1 PHE 97 HD1 PHE 97 6.373 -14.115 -8.888 1565 HD2 PHE 97 HD2 PHE 97 9.014 -15.456 -5.795 1566 HE1 PHE 97 HE1 PHE 97 6.947 -16.095 -10.229 1567 HE2 PHE 97 HE2 PHE 97 9.574 -17.436 -7.148 1568 HZ PHE 97 HZ PHE 97 8.540 -17.755 -9.359 1569 H GLN 98 H GLN 98 3.756 -14.744 -5.154 1570 HA GLN 98 HA GLN 98 2.284 -13.726 -7.482 1571 HB2 GLN 98 HB2 GLN 98 2.653 -16.689 -6.811 1572 HB3 GLN 98 HB3 GLN 98 1.514 -16.076 -8.004 1573 HG2 GLN 98 HG2 GLN 98 3.277 -15.352 -9.449 1574 HG3 GLN 98 HG3 GLN 98 4.494 -15.599 -8.200 1575 HE21 GLN 98 HE21 GLN 98 5.171 -17.701 -7.731 1576 HE22 GLN 98 HE22 GLN 98 4.894 -19.023 -8.814 Start of MODEL 7 1 H1 GLY 1 H1 GLY 1 -0.491 -1.670 -18.871 2 H2 GLY 1 H2 GLY 1 -1.169 -3.155 -18.448 3 H3 GLY 1 H3 GLY 1 -1.460 -2.499 -19.978 4 HA2 GLY 1 HA3 GLY 1 0.145 -4.271 -20.127 5 HA3 GLY 1 HA2 GLY 1 0.858 -2.722 -20.555 6 H SER 2 H SER 2 0.180 -4.360 -17.436 7 HA SER 2 HA SER 2 2.745 -3.737 -16.295 8 HB2 SER 2 HB2 SER 2 0.817 -4.005 -14.802 9 HB3 SER 2 HB3 SER 2 0.531 -5.643 -15.393 10 HG SER 2 HG SER 2 1.864 -5.103 -13.309 11 H MET 3 H MET 3 4.483 -4.658 -17.191 12 HA MET 3 HA MET 3 4.402 -7.411 -18.271 13 HB2 MET 3 HB2 MET 3 6.405 -5.142 -18.712 14 HB3 MET 3 HB3 MET 3 6.494 -6.730 -19.470 15 HG2 MET 3 HG2 MET 3 4.279 -6.280 -20.547 16 HG3 MET 3 HG3 MET 3 4.339 -4.650 -19.874 17 HE1 MET 3 HE1 MET 3 7.214 -6.268 -23.119 18 HE2 MET 3 HE2 MET 3 5.838 -7.164 -22.476 19 HE3 MET 3 HE3 MET 3 7.258 -6.884 -21.467 20 H GLN 4 H GLN 4 7.207 -7.875 -18.138 21 HA GLN 4 HA GLN 4 7.651 -9.153 -15.789 22 HB2 GLN 4 HB2 GLN 4 10.073 -9.180 -16.348 23 HB3 GLN 4 HB3 GLN 4 9.067 -9.545 -17.738 24 HG2 GLN 4 HG2 GLN 4 10.298 -6.824 -17.226 25 HG3 GLN 4 HG3 GLN 4 11.063 -8.069 -18.200 26 HE21 GLN 4 HE21 GLN 4 10.043 -5.325 -18.840 27 HE22 GLN 4 HE22 GLN 4 9.022 -5.550 -20.214 28 H ASN 5 H ASN 5 7.271 -8.268 -13.861 29 HA ASN 5 HA ASN 5 7.973 -5.563 -13.105 30 HB2 ASN 5 HB2 ASN 5 7.047 -7.770 -11.222 31 HB3 ASN 5 HB3 ASN 5 6.881 -6.027 -11.000 32 HD21 ASN 5 HD21 ASN 5 5.284 -4.918 -12.274 33 HD22 ASN 5 HD22 ASN 5 3.943 -5.778 -12.945 34 H THR 6 H THR 6 9.672 -8.472 -13.158 35 HA THR 6 HA THR 6 11.277 -8.281 -10.795 36 HB THR 6 HB THR 6 12.585 -10.140 -11.927 37 HG1 THR 6 HG1 THR 6 12.173 -9.418 -14.104 38 HG21 THR 6 HG21 THR 6 9.554 -10.501 -11.932 39 HG22 THR 6 HG22 THR 6 10.614 -10.702 -10.534 40 HG23 THR 6 HG23 THR 6 10.750 -11.801 -11.905 41 H THR 7 H THR 7 11.363 -6.490 -13.619 42 HA THR 7 HA THR 7 14.165 -5.994 -13.933 43 HB THR 7 HB THR 7 13.360 -3.938 -15.200 44 HG1 THR 7 HG1 THR 7 11.116 -4.436 -13.820 45 HG21 THR 7 HG21 THR 7 12.020 -6.549 -15.987 46 HG22 THR 7 HG22 THR 7 13.673 -6.073 -16.386 47 HG23 THR 7 HG23 THR 7 12.310 -5.174 -17.055 48 H HIS 8 H HIS 8 14.984 -3.657 -13.680 49 HA HIS 8 HA HIS 8 14.074 -2.389 -11.161 50 HB2 HIS 8 HB2 HIS 8 16.301 -1.345 -11.008 51 HB3 HIS 8 HB3 HIS 8 16.435 -3.096 -11.094 52 HD1 HIS 8 HD1 HIS 8 17.046 0.010 -13.156 53 HD2 HIS 8 HD2 HIS 8 17.911 -4.056 -13.261 54 HE1 HIS 8 HE1 HIS 8 18.699 -0.282 -15.018 55 HE2 HIS 8 HE2 HIS 8 19.109 -2.757 -15.145 56 H ASP 9 H ASP 9 13.139 -2.148 -14.106 57 HA ASP 9 HA ASP 9 13.421 0.573 -14.886 58 HB2 ASP 9 HB2 ASP 9 12.593 -1.182 -16.437 59 HB3 ASP 9 HB3 ASP 9 11.150 -1.395 -15.450 60 H ASN 10 H ASN 10 11.136 -1.157 -12.826 61 HA ASN 10 HA ASN 10 9.871 1.246 -11.829 62 HB2 ASN 10 HB2 ASN 10 8.791 -0.248 -10.163 63 HB3 ASN 10 HB3 ASN 10 8.575 -0.844 -11.803 64 HD21 ASN 10 HD21 ASN 10 8.626 -2.175 -9.052 65 HD22 ASN 10 HD22 ASN 10 9.708 -3.505 -9.258 66 H VAL 11 H VAL 11 10.109 1.949 -9.606 67 HA VAL 11 HA VAL 11 12.778 1.499 -8.429 68 HB VAL 11 HB VAL 11 12.777 3.916 -7.683 69 HG11 VAL 11 HG11 VAL 11 14.139 3.222 -9.600 70 HG12 VAL 11 HG12 VAL 11 13.530 4.859 -9.840 71 HG13 VAL 11 HG13 VAL 11 12.785 3.506 -10.698 72 HG21 VAL 11 HG21 VAL 11 10.489 4.272 -9.672 73 HG22 VAL 11 HG22 VAL 11 11.308 5.561 -8.787 74 HG23 VAL 11 HG23 VAL 11 10.337 4.372 -7.917 75 H ILE 12 H ILE 12 12.851 1.678 -6.205 76 HA ILE 12 HA ILE 12 10.313 1.021 -4.850 77 HB ILE 12 HB ILE 12 13.145 0.469 -3.826 78 HG12 ILE 12 HG12 ILE 12 12.844 -0.600 -6.083 79 HG13 ILE 12 HG13 ILE 12 13.122 -1.748 -4.785 80 HG21 ILE 12 HG21 ILE 12 12.076 -1.299 -2.516 81 HG22 ILE 12 HG22 ILE 12 10.508 -0.900 -3.221 82 HG23 ILE 12 HG23 ILE 12 11.331 0.264 -2.185 83 HD11 ILE 12 HD11 ILE 12 10.721 -2.275 -4.769 84 HD12 ILE 12 HD12 ILE 12 11.472 -2.566 -6.336 85 HD13 ILE 12 HD13 ILE 12 10.478 -1.131 -6.093 86 H LEU 13 H LEU 13 9.642 3.149 -4.409 87 HA LEU 13 HA LEU 13 11.485 5.113 -3.284 88 HB2 LEU 13 HB2 LEU 13 8.530 5.339 -4.011 89 HB3 LEU 13 HB3 LEU 13 9.550 6.676 -3.496 90 HG LEU 13 HG LEU 13 9.945 5.065 -6.049 91 HD11 LEU 13 HD11 LEU 13 8.868 7.879 -5.698 92 HD12 LEU 13 HD12 LEU 13 7.946 6.454 -6.179 93 HD13 LEU 13 HD13 LEU 13 9.206 7.077 -7.237 94 HD21 LEU 13 HD21 LEU 13 11.427 7.524 -5.055 95 HD22 LEU 13 HD22 LEU 13 11.623 6.771 -6.640 96 HD23 LEU 13 HD23 LEU 13 12.078 5.888 -5.187 97 H GLU 14 H GLU 14 11.916 4.567 -1.178 98 HA GLU 14 HA GLU 14 9.759 3.834 0.638 99 HB2 GLU 14 HB2 GLU 14 11.599 3.688 2.361 100 HB3 GLU 14 HB3 GLU 14 11.727 2.589 1.013 101 HG2 GLU 14 HG2 GLU 14 13.541 3.764 0.057 102 HG3 GLU 14 HG3 GLU 14 13.270 5.173 1.084 103 H LEU 15 H LEU 15 8.606 5.342 1.585 104 HA LEU 15 HA LEU 15 10.011 7.673 2.719 105 HB2 LEU 15 HB2 LEU 15 7.558 8.715 2.638 106 HB3 LEU 15 HB3 LEU 15 8.661 8.820 1.286 107 HG LEU 15 HG LEU 15 7.410 6.636 0.438 108 HD11 LEU 15 HD11 LEU 15 5.235 7.826 2.172 109 HD12 LEU 15 HD12 LEU 15 6.036 6.273 2.424 110 HD13 LEU 15 HD13 LEU 15 5.048 6.527 0.988 111 HD21 LEU 15 HD21 LEU 15 5.857 8.015 -0.862 112 HD22 LEU 15 HD22 LEU 15 7.456 8.747 -0.780 113 HD23 LEU 15 HD23 LEU 15 6.147 9.383 0.219 114 H THR 16 H THR 16 10.189 7.562 4.782 115 HA THR 16 HA THR 16 8.570 5.786 6.425 116 HB THR 16 HB THR 16 10.801 7.730 7.226 117 HG1 THR 16 HG1 THR 16 11.732 6.081 6.090 118 HG21 THR 16 HG21 THR 16 9.256 7.276 9.109 119 HG22 THR 16 HG22 THR 16 10.829 6.515 9.380 120 HG23 THR 16 HG23 THR 16 9.455 5.537 8.859 121 H VAL 17 H VAL 17 6.579 6.584 6.632 122 HA VAL 17 HA VAL 17 6.140 9.424 7.293 123 HB VAL 17 HB VAL 17 3.906 9.213 6.603 124 HG11 VAL 17 HG11 VAL 17 5.510 7.526 4.657 125 HG12 VAL 17 HG12 VAL 17 5.443 9.289 4.712 126 HG13 VAL 17 HG13 VAL 17 4.000 8.371 4.282 127 HG21 VAL 17 HG21 VAL 17 2.769 7.046 6.008 128 HG22 VAL 17 HG22 VAL 17 3.193 7.181 7.713 129 HG23 VAL 17 HG23 VAL 17 4.177 6.187 6.642 130 H ARG 18 H ARG 18 4.931 9.941 9.108 131 HA ARG 18 HA ARG 18 4.476 7.867 11.153 132 HB2 ARG 18 HB2 ARG 18 3.583 9.901 12.467 133 HB3 ARG 18 HB3 ARG 18 5.309 9.811 12.147 134 HG2 ARG 18 HG2 ARG 18 4.933 11.383 10.185 135 HG3 ARG 18 HG3 ARG 18 3.266 11.573 10.733 136 HD2 ARG 18 HD2 ARG 18 5.733 12.234 12.377 137 HD3 ARG 18 HD3 ARG 18 4.761 13.414 11.495 138 HE ARG 18 HE ARG 18 3.476 11.736 13.547 139 HH11 ARG 18 HH11 ARG 18 4.601 14.942 12.604 140 HH12 ARG 18 HH12 ARG 18 3.717 15.745 13.862 141 HH21 ARG 18 HH21 ARG 18 2.310 12.793 15.153 142 HH22 ARG 18 HH22 ARG 18 2.414 14.518 15.316 143 H ASN 19 H ASN 19 2.314 7.432 11.972 144 HA ASN 19 HA ASN 19 0.446 7.149 9.814 145 HB2 ASN 19 HB2 ASN 19 0.247 6.339 12.751 146 HB3 ASN 19 HB3 ASN 19 -1.063 6.071 11.606 147 HD21 ASN 19 HD21 ASN 19 -1.043 3.832 11.454 148 HD22 ASN 19 HD22 ASN 19 0.324 2.904 10.942 149 H HIS 20 H HIS 20 0.236 9.358 9.336 150 HA HIS 20 HA HIS 20 -1.316 11.203 10.956 151 HB2 HIS 20 HB2 HIS 20 0.580 11.964 9.511 152 HB3 HIS 20 HB3 HIS 20 -0.219 11.314 8.089 153 HD1 HIS 20 HD1 HIS 20 -0.189 14.260 10.373 154 HD2 HIS 20 HD2 HIS 20 -2.276 12.945 7.028 155 HE1 HIS 20 HE1 HIS 20 -1.428 16.263 9.516 156 HE2 HIS 20 HE2 HIS 20 -2.562 15.481 7.415 157 HA PRO 21 HA PRO 21 -5.547 10.155 9.631 158 HB2 PRO 21 HB2 PRO 21 -5.486 13.063 8.728 159 HB3 PRO 21 HB3 PRO 21 -6.796 12.169 9.536 160 HG2 PRO 21 HG2 PRO 21 -5.215 13.750 10.969 161 HG3 PRO 21 HG3 PRO 21 -5.720 12.169 11.609 162 HD2 PRO 21 HD2 PRO 21 -3.043 13.012 10.599 163 HD3 PRO 21 HD3 PRO 21 -3.459 11.740 11.770 164 H GLY 22 H GLY 22 -5.167 8.731 7.979 165 HA2 GLY 22 HA2 GLY 22 -5.361 7.852 5.890 166 HA3 GLY 22 HA3 GLY 22 -6.121 9.359 5.420 167 H VAL 23 H VAL 23 -2.749 8.388 6.327 168 HA VAL 23 HA VAL 23 -1.391 10.106 4.587 169 HB VAL 23 HB VAL 23 -0.429 7.308 5.380 170 HG11 VAL 23 HG11 VAL 23 1.137 9.735 4.413 171 HG12 VAL 23 HG12 VAL 23 0.886 8.229 3.527 172 HG13 VAL 23 HG13 VAL 23 1.854 8.231 4.998 173 HG21 VAL 23 HG21 VAL 23 0.786 8.402 7.226 174 HG22 VAL 23 HG22 VAL 23 -0.960 8.605 7.385 175 HG23 VAL 23 HG23 VAL 23 0.033 9.946 6.809 176 H MET 24 H MET 24 -2.706 6.892 3.998 177 HA MET 24 HA MET 24 -1.245 6.335 1.652 178 HB2 MET 24 HB2 MET 24 -3.740 5.070 2.811 179 HB3 MET 24 HB3 MET 24 -2.937 4.458 1.365 180 HG2 MET 24 HG2 MET 24 -1.751 4.643 4.144 181 HG3 MET 24 HG3 MET 24 -2.222 3.177 3.288 182 HE1 MET 24 HE1 MET 24 0.525 3.225 0.345 183 HE2 MET 24 HE2 MET 24 -1.019 4.072 0.260 184 HE3 MET 24 HE3 MET 24 -0.946 2.436 0.914 185 H THR 25 H THR 25 -4.347 7.982 2.091 186 HA THR 25 HA THR 25 -5.044 7.959 -0.709 187 HB THR 25 HB THR 25 -6.630 9.842 -0.048 188 HG1 THR 25 HG1 THR 25 -6.750 10.373 2.135 189 HG21 THR 25 HG21 THR 25 -6.775 7.324 1.658 190 HG22 THR 25 HG22 THR 25 -7.364 7.477 0.000 191 HG23 THR 25 HG23 THR 25 -8.119 8.409 1.295 192 H HIS 26 H HIS 26 -3.069 9.991 1.368 193 HA HIS 26 HA HIS 26 -2.723 12.198 -0.408 194 HB2 HIS 26 HB2 HIS 26 -0.878 11.237 1.834 195 HB3 HIS 26 HB3 HIS 26 -0.746 12.788 1.015 196 HD1 HIS 26 HD1 HIS 26 -0.968 13.739 3.509 197 HD2 HIS 26 HD2 HIS 26 -4.370 11.910 2.012 198 HE1 HIS 26 HE1 HIS 26 -2.830 14.451 5.027 199 HE2 HIS 26 HE2 HIS 26 -4.839 13.211 4.181 200 H VAL 27 H VAL 27 -0.721 9.305 0.322 201 HA VAL 27 HA VAL 27 1.340 9.937 -1.503 202 HB VAL 27 HB VAL 27 2.303 7.764 -1.125 203 HG11 VAL 27 HG11 VAL 27 1.007 8.694 1.465 204 HG12 VAL 27 HG12 VAL 27 2.491 9.329 0.754 205 HG13 VAL 27 HG13 VAL 27 2.439 7.666 1.336 206 HG21 VAL 27 HG21 VAL 27 -0.306 6.833 0.117 207 HG22 VAL 27 HG22 VAL 27 1.201 5.915 0.088 208 HG23 VAL 27 HG23 VAL 27 0.367 6.292 -1.420 209 H CYS 28 H CYS 28 -1.434 7.712 -1.782 210 HA CYS 28 HA CYS 28 -0.926 6.792 -4.394 211 HB2 CYS 28 HB2 CYS 28 -3.526 6.943 -2.819 212 HB3 CYS 28 HB3 CYS 28 -3.319 6.025 -4.310 213 HG CYS 28 HG CYS 28 -1.599 5.453 -1.403 214 H GLY 29 H GLY 29 -2.536 9.674 -3.164 215 HA2 GLY 29 HA2 GLY 29 -3.760 10.693 -5.462 216 HA3 GLY 29 HA3 GLY 29 -3.067 11.658 -4.164 217 H LEU 30 H LEU 30 -0.385 11.142 -4.303 218 HA LEU 30 HA LEU 30 0.465 12.818 -6.433 219 HB2 LEU 30 HB2 LEU 30 1.940 11.252 -4.328 220 HB3 LEU 30 HB3 LEU 30 2.860 11.918 -5.663 221 HG LEU 30 HG LEU 30 3.015 13.458 -3.827 222 HD11 LEU 30 HD11 LEU 30 1.106 14.633 -5.872 223 HD12 LEU 30 HD12 LEU 30 2.855 14.492 -6.040 224 HD13 LEU 30 HD13 LEU 30 2.178 15.538 -4.797 225 HD21 LEU 30 HD21 LEU 30 -0.016 13.553 -3.696 226 HD22 LEU 30 HD22 LEU 30 1.097 14.540 -2.744 227 HD23 LEU 30 HD23 LEU 30 1.059 12.793 -2.518 228 H PHE 31 H PHE 31 0.625 9.294 -6.078 229 HA PHE 31 HA PHE 31 2.223 8.929 -8.474 230 HB2 PHE 31 HB2 PHE 31 0.817 6.942 -6.648 231 HB3 PHE 31 HB3 PHE 31 1.801 6.463 -8.032 232 HD1 PHE 31 HD2 PHE 31 1.901 7.985 -4.665 233 HD2 PHE 31 HD1 PHE 31 4.244 6.659 -7.964 234 HE1 PHE 31 HE2 PHE 31 3.925 8.196 -3.292 235 HE2 PHE 31 HE1 PHE 31 6.265 6.865 -6.589 236 HZ PHE 31 HZ PHE 31 6.120 7.636 -4.259 237 H ALA 32 H ALA 32 -1.211 8.896 -7.744 238 HA ALA 32 HA ALA 32 -2.072 7.658 -10.197 239 HB1 ALA 32 HB1 ALA 32 -3.665 9.358 -8.246 240 HB2 ALA 32 HB2 ALA 32 -3.467 7.605 -8.165 241 HB3 ALA 32 HB3 ALA 32 -4.335 8.329 -9.520 242 H ARG 33 H ARG 33 -1.492 10.989 -9.149 243 HA ARG 33 HA ARG 33 -2.818 12.218 -11.426 244 HB2 ARG 33 HB2 ARG 33 -2.166 14.347 -10.439 245 HB3 ARG 33 HB3 ARG 33 -2.788 13.287 -9.176 246 HG2 ARG 33 HG2 ARG 33 -0.449 12.743 -8.518 247 HG3 ARG 33 HG3 ARG 33 0.135 13.878 -9.732 248 HD2 ARG 33 HD2 ARG 33 -1.627 14.612 -7.372 249 HD3 ARG 33 HD3 ARG 33 0.124 14.845 -7.453 250 HE ARG 33 HE ARG 33 -1.295 16.071 -9.633 251 HH11 ARG 33 HH11 ARG 33 -0.189 16.602 -6.337 252 HH12 ARG 33 HH12 ARG 33 -0.221 18.327 -6.490 253 HH21 ARG 33 HH21 ARG 33 -1.358 18.307 -9.809 254 HH22 ARG 33 HH22 ARG 33 -0.885 19.302 -8.463 255 H ARG 34 H ARG 34 0.225 10.773 -11.059 256 HA ARG 34 HA ARG 34 1.853 12.409 -12.710 257 HB2 ARG 34 HB2 ARG 34 2.929 10.724 -11.352 258 HB3 ARG 34 HB3 ARG 34 1.878 9.454 -11.967 259 HG2 ARG 34 HG2 ARG 34 3.024 9.971 -14.280 260 HG3 ARG 34 HG3 ARG 34 4.275 10.734 -13.297 261 HD2 ARG 34 HD2 ARG 34 4.860 8.694 -12.255 262 HD3 ARG 34 HD3 ARG 34 3.341 7.913 -12.726 263 HE ARG 34 HE ARG 34 4.987 8.720 -14.947 264 HH11 ARG 34 HH11 ARG 34 4.334 6.147 -12.663 265 HH12 ARG 34 HH12 ARG 34 5.027 4.913 -13.665 266 HH21 ARG 34 HH21 ARG 34 5.940 7.107 -16.241 267 HH22 ARG 34 HH22 ARG 34 5.940 5.461 -15.696 268 H ALA 35 H ALA 35 0.447 9.242 -13.489 269 HA ALA 35 HA ALA 35 -1.053 9.779 -15.753 270 HB1 ALA 35 HB1 ALA 35 0.435 9.066 -17.621 271 HB2 ALA 35 HB2 ALA 35 1.807 9.009 -16.507 272 HB3 ALA 35 HB3 ALA 35 1.021 10.545 -16.860 273 H PHE 36 H PHE 36 1.544 7.594 -14.754 274 HA PHE 36 HA PHE 36 -0.191 5.228 -15.051 275 HB2 PHE 36 HB2 PHE 36 2.014 5.138 -16.199 276 HB3 PHE 36 HB3 PHE 36 2.833 5.440 -14.674 277 HD1 PHE 36 HD1 PHE 36 0.408 2.987 -16.207 278 HD2 PHE 36 HD2 PHE 36 3.678 3.559 -13.502 279 HE1 PHE 36 HE1 PHE 36 0.531 0.557 -15.824 280 HE2 PHE 36 HE2 PHE 36 3.789 1.129 -13.127 281 HZ PHE 36 HZ PHE 36 2.220 -0.375 -14.287 282 H ASN 37 H ASN 37 -0.720 4.008 -13.307 283 HA ASN 37 HA ASN 37 -0.628 5.212 -10.692 284 HB2 ASN 37 HB2 ASN 37 -1.764 2.558 -11.674 285 HB3 ASN 37 HB3 ASN 37 -1.985 3.181 -10.042 286 HD21 ASN 37 HD21 ASN 37 -2.386 5.959 -10.821 287 HD22 ASN 37 HD22 ASN 37 -3.933 6.030 -11.583 288 H VAL 38 H VAL 38 -0.395 3.225 -8.898 289 HA VAL 38 HA VAL 38 2.438 2.636 -8.869 290 HB VAL 38 HB VAL 38 0.335 1.808 -6.806 291 HG11 VAL 38 HG11 VAL 38 2.291 1.698 -5.273 292 HG12 VAL 38 HG12 VAL 38 3.358 2.059 -6.630 293 HG13 VAL 38 HG13 VAL 38 2.423 0.561 -6.618 294 HG21 VAL 38 HG21 VAL 38 2.045 4.324 -6.828 295 HG22 VAL 38 HG22 VAL 38 0.990 3.805 -5.510 296 HG23 VAL 38 HG23 VAL 38 0.297 4.259 -7.069 297 H GLU 39 H GLU 39 3.358 0.681 -9.131 298 HA GLU 39 HA GLU 39 1.886 -1.543 -10.243 299 HB2 GLU 39 HB2 GLU 39 4.205 -0.729 -10.990 300 HB3 GLU 39 HB3 GLU 39 4.840 -1.391 -9.486 301 HG2 GLU 39 HG2 GLU 39 5.245 -2.960 -11.267 302 HG3 GLU 39 HG3 GLU 39 4.031 -3.639 -10.184 303 H GLY 40 H GLY 40 3.821 -0.867 -7.312 304 HA2 GLY 40 HA2 GLY 40 2.432 -2.954 -5.780 305 HA3 GLY 40 HA3 GLY 40 4.165 -3.163 -6.008 306 H ILE 41 H ILE 41 2.735 -2.765 -3.494 307 HA ILE 41 HA ILE 41 4.117 -0.365 -2.455 308 HB ILE 41 HB ILE 41 1.213 -1.135 -1.798 309 HG12 ILE 41 HG12 ILE 41 2.373 1.302 -3.206 310 HG13 ILE 41 HG13 ILE 41 1.357 0.060 -3.921 311 HG21 ILE 41 HG21 ILE 41 1.133 0.806 -0.275 312 HG22 ILE 41 HG22 ILE 41 2.840 1.127 -0.580 313 HG23 ILE 41 HG23 ILE 41 2.361 -0.351 0.252 314 HD11 ILE 41 HD11 ILE 41 0.085 2.039 -3.581 315 HD12 ILE 41 HD12 ILE 41 0.537 2.110 -1.878 316 HD13 ILE 41 HD13 ILE 41 -0.492 0.800 -2.466 317 H LEU 42 H LEU 42 4.828 -0.597 -0.294 318 HA LEU 42 HA LEU 42 3.989 -2.889 1.277 319 HB2 LEU 42 HB2 LEU 42 5.932 -3.821 0.141 320 HB3 LEU 42 HB3 LEU 42 6.924 -2.441 0.588 321 HG LEU 42 HG LEU 42 6.996 -3.130 2.914 322 HD11 LEU 42 HD11 LEU 42 4.996 -5.319 2.265 323 HD12 LEU 42 HD12 LEU 42 4.684 -3.876 3.230 324 HD13 LEU 42 HD13 LEU 42 5.818 -5.090 3.812 325 HD21 LEU 42 HD21 LEU 42 8.081 -5.326 2.751 326 HD22 LEU 42 HD22 LEU 42 8.552 -4.287 1.410 327 HD23 LEU 42 HD23 LEU 42 7.371 -5.573 1.152 328 H CYS 43 H CYS 43 2.977 -1.415 2.533 329 HA CYS 43 HA CYS 43 4.417 0.666 3.982 330 HB2 CYS 43 HB2 CYS 43 2.107 1.096 3.268 331 HB3 CYS 43 HB3 CYS 43 1.538 -0.352 4.086 332 HG CYS 43 HG CYS 43 2.855 2.333 5.744 333 H LEU 44 H LEU 44 5.891 -0.357 5.254 334 HA LEU 44 HA LEU 44 5.234 -2.732 6.840 335 HB2 LEU 44 HB2 LEU 44 7.354 -2.414 5.434 336 HB3 LEU 44 HB3 LEU 44 7.872 -1.248 6.634 337 HG LEU 44 HG LEU 44 7.791 -3.118 8.363 338 HD11 LEU 44 HD11 LEU 44 7.469 -4.892 5.924 339 HD12 LEU 44 HD12 LEU 44 6.264 -4.646 7.194 340 HD13 LEU 44 HD13 LEU 44 7.791 -5.437 7.575 341 HD21 LEU 44 HD21 LEU 44 9.920 -4.115 7.661 342 HD22 LEU 44 HD22 LEU 44 9.907 -2.383 7.342 343 HD23 LEU 44 HD23 LEU 44 9.677 -3.524 6.015 344 HA PRO 45 HA PRO 45 4.235 0.390 10.019 345 HB2 PRO 45 HB2 PRO 45 3.180 -1.339 11.891 346 HB3 PRO 45 HB3 PRO 45 2.288 -0.799 10.460 347 HG2 PRO 45 HG2 PRO 45 3.752 -3.378 10.892 348 HG3 PRO 45 HG3 PRO 45 2.162 -3.099 10.144 349 HD2 PRO 45 HD2 PRO 45 4.403 -3.501 8.662 350 HD3 PRO 45 HD3 PRO 45 3.082 -2.447 8.111 351 H ILE 46 H ILE 46 5.878 1.257 11.097 352 HA ILE 46 HA ILE 46 8.119 -0.176 12.144 353 HB ILE 46 HB ILE 46 7.285 2.739 12.495 354 HG12 ILE 46 HG12 ILE 46 7.724 2.194 10.139 355 HG13 ILE 46 HG13 ILE 46 9.005 3.229 10.751 356 HG21 ILE 46 HG21 ILE 46 9.617 3.199 13.176 357 HG22 ILE 46 HG22 ILE 46 9.963 1.469 13.160 358 HG23 ILE 46 HG23 ILE 46 8.797 2.126 14.312 359 HD11 ILE 46 HD11 ILE 46 9.914 1.520 9.320 360 HD12 ILE 46 HD12 ILE 46 9.167 0.249 10.284 361 HD13 ILE 46 HD13 ILE 46 10.458 1.235 10.973 362 H GLN 47 H GLN 47 7.949 -1.376 13.917 363 HA GLN 47 HA GLN 47 6.043 -1.362 15.927 364 HB2 GLN 47 HB2 GLN 47 7.329 -3.330 15.701 365 HB3 GLN 47 HB3 GLN 47 8.855 -2.459 15.721 366 HG2 GLN 47 HG2 GLN 47 8.642 -3.730 17.768 367 HG3 GLN 47 HG3 GLN 47 8.564 -1.998 18.128 368 HE21 GLN 47 HE21 GLN 47 7.495 -2.292 20.097 369 HE22 GLN 47 HE22 GLN 47 5.856 -2.834 20.207 370 H ASP 48 H ASP 48 9.116 0.314 15.786 371 HA ASP 48 HA ASP 48 9.649 1.026 18.370 372 HB2 ASP 48 HB2 ASP 48 11.314 1.413 16.760 373 HB3 ASP 48 HB3 ASP 48 10.221 2.265 15.691 374 H SER 49 H SER 49 7.375 2.674 16.182 375 HA SER 49 HA SER 49 6.179 4.251 18.289 376 HB2 SER 49 HB2 SER 49 7.904 5.664 16.204 377 HB3 SER 49 HB3 SER 49 6.735 6.491 17.226 378 HG SER 49 HG SER 49 9.058 5.082 18.055 379 H ASP 50 H ASP 50 4.771 6.125 17.015 380 HA ASP 50 HA ASP 50 3.007 4.796 15.164 381 HB2 ASP 50 HB2 ASP 50 3.134 7.628 16.283 382 HB3 ASP 50 HB3 ASP 50 2.002 7.222 14.994 383 H LYS 51 H LYS 51 4.623 4.255 13.605 384 HA LYS 51 HA LYS 51 4.892 6.183 11.453 385 HB2 LYS 51 HB2 LYS 51 7.297 4.826 12.761 386 HB3 LYS 51 HB3 LYS 51 7.358 5.501 11.137 387 HG2 LYS 51 HG2 LYS 51 6.965 7.746 12.001 388 HG3 LYS 51 HG3 LYS 51 6.743 7.115 13.633 389 HD2 LYS 51 HD2 LYS 51 9.324 7.007 12.017 390 HD3 LYS 51 HD3 LYS 51 8.987 8.097 13.362 391 HE2 LYS 51 HE2 LYS 51 8.711 6.060 14.835 392 HE3 LYS 51 HE3 LYS 51 9.277 5.077 13.485 393 HZ1 LYS 51 HZ1 LYS 51 11.345 6.359 13.514 394 HZ2 LYS 51 HZ2 LYS 51 11.082 5.561 14.978 395 HZ3 LYS 51 HZ3 LYS 51 10.801 7.225 14.856 396 H SER 52 H SER 52 5.769 5.079 9.524 397 HA SER 52 HA SER 52 5.775 2.223 9.323 398 HB2 SER 52 HB2 SER 52 3.311 2.765 9.130 399 HB3 SER 52 HB3 SER 52 3.673 3.796 7.743 400 HG SER 52 HG SER 52 3.198 1.230 7.710 401 H HIS 53 H HIS 53 6.635 1.599 7.230 402 HA HIS 53 HA HIS 53 8.126 3.775 5.849 403 HB2 HIS 53 HB2 HIS 53 9.424 2.218 7.496 404 HB3 HIS 53 HB3 HIS 53 9.168 0.937 6.321 405 HD1 HIS 53 HD1 HIS 53 11.906 1.075 6.513 406 HD2 HIS 53 HD2 HIS 53 10.027 4.136 4.445 407 HE1 HIS 53 HE1 HIS 53 13.721 2.210 5.224 408 HE2 HIS 53 HE2 HIS 53 12.593 4.169 4.145 409 H ILE 54 H ILE 54 7.110 3.928 3.898 410 HA ILE 54 HA ILE 54 5.835 1.530 2.742 411 HB ILE 54 HB ILE 54 5.239 4.437 1.997 412 HG12 ILE 54 HG12 ILE 54 3.014 4.024 3.248 413 HG13 ILE 54 HG13 ILE 54 3.797 2.641 3.995 414 HG21 ILE 54 HG21 ILE 54 3.733 1.867 1.384 415 HG22 ILE 54 HG22 ILE 54 4.688 2.811 0.238 416 HG23 ILE 54 HG23 ILE 54 3.215 3.493 0.930 417 HD11 ILE 54 HD11 ILE 54 4.667 5.505 4.244 418 HD12 ILE 54 HD12 ILE 54 5.420 4.117 5.032 419 HD13 ILE 54 HD13 ILE 54 3.768 4.575 5.442 420 H TRP 55 H TRP 55 6.994 0.597 1.170 421 HA TRP 55 HA TRP 55 8.739 2.132 -0.625 422 HB2 TRP 55 HB2 TRP 55 8.241 -0.857 -0.255 423 HB3 TRP 55 HB3 TRP 55 9.301 -0.201 -1.498 424 HD1 TRP 55 HD1 TRP 55 11.650 0.885 -0.658 425 HE1 TRP 55 HE1 TRP 55 13.002 0.614 1.508 426 HE3 TRP 55 HE3 TRP 55 8.069 -1.237 2.226 427 HZ2 TRP 55 HZ2 TRP 55 12.593 -0.410 4.111 428 HZ3 TRP 55 HZ3 TRP 55 8.623 -1.833 4.519 429 HH2 TRP 55 HH2 TRP 55 10.832 -1.429 5.465 430 H LEU 56 H LEU 56 7.818 3.014 -2.375 431 HA LEU 56 HA LEU 56 5.382 1.883 -3.584 432 HB2 LEU 56 HB2 LEU 56 6.703 4.612 -3.926 433 HB3 LEU 56 HB3 LEU 56 5.311 4.082 -4.850 434 HG LEU 56 HG LEU 56 4.478 5.532 -3.167 435 HD11 LEU 56 HD11 LEU 56 3.077 3.590 -3.527 436 HD12 LEU 56 HD12 LEU 56 2.943 4.162 -1.867 437 HD13 LEU 56 HD13 LEU 56 3.897 2.720 -2.226 438 HD21 LEU 56 HD21 LEU 56 4.889 5.308 -0.757 439 HD22 LEU 56 HD22 LEU 56 6.379 5.593 -1.653 440 HD23 LEU 56 HD23 LEU 56 6.005 3.971 -1.066 441 H LEU 57 H LEU 57 5.798 0.507 -5.146 442 HA LEU 57 HA LEU 57 8.094 0.597 -6.920 443 HB2 LEU 57 HB2 LEU 57 5.744 -1.310 -6.646 444 HB3 LEU 57 HB3 LEU 57 6.872 -1.426 -7.983 445 HG LEU 57 HG LEU 57 8.698 -1.955 -6.449 446 HD11 LEU 57 HD11 LEU 57 6.686 -1.741 -4.197 447 HD12 LEU 57 HD12 LEU 57 8.083 -0.694 -4.477 448 HD13 LEU 57 HD13 LEU 57 8.327 -2.388 -4.056 449 HD21 LEU 57 HD21 LEU 57 7.378 -3.779 -7.374 450 HD22 LEU 57 HD22 LEU 57 6.261 -3.695 -6.006 451 HD23 LEU 57 HD23 LEU 57 7.941 -4.173 -5.752 452 H VAL 58 H VAL 58 7.958 2.080 -8.444 453 HA VAL 58 HA VAL 58 5.743 2.080 -10.367 454 HB VAL 58 HB VAL 58 5.124 3.770 -8.609 455 HG11 VAL 58 HG11 VAL 58 7.661 5.214 -9.395 456 HG12 VAL 58 HG12 VAL 58 7.323 4.446 -7.843 457 HG13 VAL 58 HG13 VAL 58 6.394 5.859 -8.344 458 HG21 VAL 58 HG21 VAL 58 4.613 5.647 -10.127 459 HG22 VAL 58 HG22 VAL 58 4.314 4.094 -10.906 460 HG23 VAL 58 HG23 VAL 58 5.768 5.013 -11.306 461 H ASN 59 H ASN 59 6.559 2.705 -12.470 462 HA ASN 59 HA ASN 59 9.428 2.747 -12.706 463 HB2 ASN 59 HB2 ASN 59 9.096 3.011 -15.131 464 HB3 ASN 59 HB3 ASN 59 8.143 1.693 -14.475 465 HD21 ASN 59 HD21 ASN 59 7.876 3.442 -16.916 466 HD22 ASN 59 HD22 ASN 59 6.235 3.962 -16.867 467 H ASP 60 H ASP 60 10.571 4.417 -12.117 468 HA ASP 60 HA ASP 60 9.966 6.977 -11.567 469 HB2 ASP 60 HB2 ASP 60 12.135 5.941 -11.037 470 HB3 ASP 60 HB3 ASP 60 12.607 6.037 -12.733 471 H ASP 61 H ASP 61 9.740 8.889 -12.579 472 HA ASP 61 HA ASP 61 9.782 9.059 -15.500 473 HB2 ASP 61 HB2 ASP 61 7.622 8.060 -14.961 474 HB3 ASP 61 HB3 ASP 61 7.315 9.272 -13.730 475 H GLN 62 H GLN 62 9.592 11.267 -16.217 476 HA GLN 62 HA GLN 62 11.124 13.081 -14.699 477 HB2 GLN 62 HB2 GLN 62 9.373 13.686 -17.118 478 HB3 GLN 62 HB3 GLN 62 10.697 14.684 -16.529 479 HG2 GLN 62 HG2 GLN 62 10.994 11.868 -17.621 480 HG3 GLN 62 HG3 GLN 62 11.299 13.345 -18.532 481 HE21 GLN 62 HE21 GLN 62 13.118 11.136 -17.873 482 HE22 GLN 62 HE22 GLN 62 14.451 11.854 -17.039 483 H ARG 63 H ARG 63 7.642 12.790 -15.162 484 HA ARG 63 HA ARG 63 6.956 15.241 -13.735 485 HB2 ARG 63 HB2 ARG 63 5.572 14.304 -15.638 486 HB3 ARG 63 HB3 ARG 63 5.124 12.954 -14.601 487 HG2 ARG 63 HG2 ARG 63 4.037 14.552 -13.028 488 HG3 ARG 63 HG3 ARG 63 4.465 15.881 -14.107 489 HD2 ARG 63 HD2 ARG 63 3.099 14.786 -15.912 490 HD3 ARG 63 HD3 ARG 63 2.601 13.563 -14.736 491 HE ARG 63 HE ARG 63 2.015 16.103 -13.683 492 HH11 ARG 63 HH11 ARG 63 0.882 14.023 -16.290 493 HH12 ARG 63 HH12 ARG 63 -0.718 14.695 -16.280 494 HH21 ARG 63 HH21 ARG 63 -0.090 16.966 -13.712 495 HH22 ARG 63 HH22 ARG 63 -1.261 16.350 -14.833 496 H LEU 64 H LEU 64 7.207 11.791 -13.125 497 HA LEU 64 HA LEU 64 5.882 11.565 -10.659 498 HB2 LEU 64 HB2 LEU 64 6.654 9.631 -12.012 499 HB3 LEU 64 HB3 LEU 64 8.318 10.038 -11.634 500 HG LEU 64 HG LEU 64 7.593 9.693 -9.122 501 HD11 LEU 64 HD11 LEU 64 5.176 9.558 -9.509 502 HD12 LEU 64 HD12 LEU 64 5.809 8.096 -8.755 503 HD13 LEU 64 HD13 LEU 64 5.412 8.093 -10.472 504 HD21 LEU 64 HD21 LEU 64 8.145 7.335 -9.215 505 HD22 LEU 64 HD22 LEU 64 9.176 8.248 -10.314 506 HD23 LEU 64 HD23 LEU 64 7.829 7.298 -10.952 507 H GLU 65 H GLU 65 9.232 12.481 -11.423 508 HA GLU 65 HA GLU 65 10.289 12.509 -8.810 509 HB2 GLU 65 HB2 GLU 65 11.111 14.150 -11.235 510 HB3 GLU 65 HB3 GLU 65 12.085 13.932 -9.780 511 HG2 GLU 65 HG2 GLU 65 12.190 11.505 -10.209 512 HG3 GLU 65 HG3 GLU 65 11.217 11.717 -11.658 513 H GLN 66 H GLN 66 8.521 14.952 -10.624 514 HA GLN 66 HA GLN 66 8.770 17.094 -8.766 515 HB2 GLN 66 HB2 GLN 66 8.009 17.446 -11.098 516 HB3 GLN 66 HB3 GLN 66 6.553 16.510 -10.779 517 HG2 GLN 66 HG2 GLN 66 6.086 18.925 -10.770 518 HG3 GLN 66 HG3 GLN 66 5.770 18.207 -9.190 519 HE21 GLN 66 HE21 GLN 66 6.020 20.110 -8.027 520 HE22 GLN 66 HE22 GLN 66 7.525 20.945 -7.874 521 H MET 67 H MET 67 6.549 14.367 -9.083 522 HA MET 67 HA MET 67 4.756 15.114 -6.982 523 HB2 MET 67 HB2 MET 67 5.228 12.326 -8.130 524 HB3 MET 67 HB3 MET 67 3.827 12.855 -7.203 525 HG2 MET 67 HG2 MET 67 4.603 13.784 -9.974 526 HG3 MET 67 HG3 MET 67 3.256 12.726 -9.549 527 HE1 MET 67 HE1 MET 67 3.115 15.461 -11.343 528 HE2 MET 67 HE2 MET 67 1.604 16.143 -10.742 529 HE3 MET 67 HE3 MET 67 1.717 14.416 -11.069 530 H ILE 68 H ILE 68 7.769 13.271 -7.124 531 HA ILE 68 HA ILE 68 7.740 12.169 -4.483 532 HB ILE 68 HB ILE 68 10.140 12.797 -6.288 533 HG12 ILE 68 HG12 ILE 68 8.736 10.110 -5.878 534 HG13 ILE 68 HG13 ILE 68 8.488 11.154 -7.270 535 HG21 ILE 68 HG21 ILE 68 11.419 11.176 -4.903 536 HG22 ILE 68 HG22 ILE 68 10.033 11.004 -3.825 537 HG23 ILE 68 HG23 ILE 68 10.867 12.552 -3.947 538 HD11 ILE 68 HD11 ILE 68 11.083 9.815 -6.502 539 HD12 ILE 68 HD12 ILE 68 10.853 10.890 -7.884 540 HD13 ILE 68 HD13 ILE 68 9.997 9.351 -7.812 541 H SER 69 H SER 69 9.046 15.131 -5.920 542 HA SER 69 HA SER 69 10.298 16.206 -3.612 543 HB2 SER 69 HB2 SER 69 10.786 16.935 -5.966 544 HB3 SER 69 HB3 SER 69 9.197 17.696 -6.034 545 HG SER 69 HG SER 69 9.845 19.065 -4.357 546 H GLN 70 H GLN 70 7.061 16.489 -5.004 547 HA GLN 70 HA GLN 70 6.075 18.549 -3.317 548 HB2 GLN 70 HB2 GLN 70 5.177 17.679 -5.627 549 HB3 GLN 70 HB3 GLN 70 4.315 16.474 -4.689 550 HG2 GLN 70 HG2 GLN 70 3.991 19.471 -4.337 551 HG3 GLN 70 HG3 GLN 70 2.958 18.482 -5.355 552 HE21 GLN 70 HE21 GLN 70 2.787 16.256 -3.456 553 HE22 GLN 70 HE22 GLN 70 1.788 16.806 -2.167 554 H ILE 71 H ILE 71 5.817 14.975 -3.228 555 HA ILE 71 HA ILE 71 4.009 14.869 -1.036 556 HB ILE 71 HB ILE 71 4.271 13.045 -2.747 557 HG12 ILE 71 HG12 ILE 71 4.518 12.183 0.168 558 HG13 ILE 71 HG13 ILE 71 3.028 12.595 -0.676 559 HG21 ILE 71 HG21 ILE 71 6.774 12.269 -1.216 560 HG22 ILE 71 HG22 ILE 71 6.728 12.942 -2.844 561 HG23 ILE 71 HG23 ILE 71 6.031 11.353 -2.534 562 HD11 ILE 71 HD11 ILE 71 4.814 10.254 -1.305 563 HD12 ILE 71 HD12 ILE 71 3.297 10.659 -2.120 564 HD13 ILE 71 HD13 ILE 71 3.297 10.212 -0.417 565 H ASP 72 H ASP 72 7.511 14.888 -1.248 566 HA ASP 72 HA ASP 72 8.194 13.836 1.255 567 HB2 ASP 72 HB2 ASP 72 9.883 14.081 -0.460 568 HB3 ASP 72 HB3 ASP 72 9.651 15.825 -0.525 569 H LYS 73 H LYS 73 7.289 17.117 0.311 570 HA LYS 73 HA LYS 73 7.925 18.217 2.949 571 HB2 LYS 73 HB2 LYS 73 7.300 20.419 1.908 572 HB3 LYS 73 HB3 LYS 73 8.624 19.578 1.117 573 HG2 LYS 73 HG2 LYS 73 6.942 18.740 -0.601 574 HG3 LYS 73 HG3 LYS 73 5.771 19.846 0.131 575 HD2 LYS 73 HD2 LYS 73 6.791 20.863 -1.856 576 HD3 LYS 73 HD3 LYS 73 7.257 21.763 -0.410 577 HE2 LYS 73 HE2 LYS 73 9.447 20.700 -0.404 578 HE3 LYS 73 HE3 LYS 73 8.981 19.647 -1.738 579 HZ1 LYS 73 HZ1 LYS 73 9.234 22.600 -1.865 580 HZ2 LYS 73 HZ2 LYS 73 8.784 21.597 -3.146 581 HZ3 LYS 73 HZ3 LYS 73 10.335 21.483 -2.491 582 H LEU 74 H LEU 74 5.467 16.383 2.115 583 HA LEU 74 HA LEU 74 3.311 17.797 3.485 584 HB2 LEU 74 HB2 LEU 74 3.629 15.014 2.322 585 HB3 LEU 74 HB3 LEU 74 2.387 15.268 3.531 586 HG LEU 74 HG LEU 74 1.483 15.378 1.228 587 HD11 LEU 74 HD11 LEU 74 0.329 16.614 3.002 588 HD12 LEU 74 HD12 LEU 74 0.182 17.447 1.456 589 HD13 LEU 74 HD13 LEU 74 1.313 18.043 2.674 590 HD21 LEU 74 HD21 LEU 74 2.009 17.232 -0.278 591 HD22 LEU 74 HD22 LEU 74 3.457 16.294 0.078 592 HD23 LEU 74 HD23 LEU 74 3.206 17.851 0.865 593 H GLU 75 H GLU 75 2.526 17.222 5.549 594 HA GLU 75 HA GLU 75 4.458 16.817 7.591 595 HB2 GLU 75 HB2 GLU 75 1.424 16.633 7.792 596 HB3 GLU 75 HB3 GLU 75 2.536 16.843 9.144 597 HG2 GLU 75 HG2 GLU 75 3.202 19.049 8.292 598 HG3 GLU 75 HG3 GLU 75 2.156 18.835 6.890 599 H ASP 76 H ASP 76 2.656 14.598 5.722 600 HA ASP 76 HA ASP 76 2.512 12.343 7.438 601 HB2 ASP 76 HB2 ASP 76 2.710 12.393 4.382 602 HB3 ASP 76 HB3 ASP 76 2.066 11.087 5.370 603 H VAL 77 H VAL 77 4.769 13.216 4.807 604 HA VAL 77 HA VAL 77 6.473 10.934 5.235 605 HB VAL 77 HB VAL 77 6.697 13.322 3.334 606 HG11 VAL 77 HG11 VAL 77 8.553 12.126 2.204 607 HG12 VAL 77 HG12 VAL 77 8.531 10.889 3.465 608 HG13 VAL 77 HG13 VAL 77 8.982 12.547 3.865 609 HG21 VAL 77 HG21 VAL 77 4.890 11.697 2.821 610 HG22 VAL 77 HG22 VAL 77 6.083 10.392 2.776 611 HG23 VAL 77 HG23 VAL 77 6.149 11.691 1.582 612 H VAL 78 H VAL 78 7.771 10.901 6.923 613 HA VAL 78 HA VAL 78 8.989 13.204 8.154 614 HB VAL 78 HB VAL 78 9.686 10.258 8.579 615 HG11 VAL 78 HG11 VAL 78 10.113 12.638 10.426 616 HG12 VAL 78 HG12 VAL 78 11.371 11.800 9.507 617 HG13 VAL 78 HG13 VAL 78 10.505 10.955 10.791 618 HG21 VAL 78 HG21 VAL 78 7.600 11.904 10.065 619 HG22 VAL 78 HG22 VAL 78 8.085 10.250 10.457 620 HG23 VAL 78 HG23 VAL 78 7.272 10.591 8.928 621 H LYS 79 H LYS 79 10.097 10.469 6.149 622 HA LYS 79 HA LYS 79 12.210 12.102 4.919 623 HB2 LYS 79 HB2 LYS 79 12.764 9.429 6.304 624 HB3 LYS 79 HB3 LYS 79 13.858 10.150 5.129 625 HG2 LYS 79 HG2 LYS 79 14.191 12.092 6.603 626 HG3 LYS 79 HG3 LYS 79 13.073 11.395 7.777 627 HD2 LYS 79 HD2 LYS 79 14.597 9.486 8.129 628 HD3 LYS 79 HD3 LYS 79 15.696 10.120 6.897 629 HE2 LYS 79 HE2 LYS 79 16.520 10.642 9.149 630 HE3 LYS 79 HE3 LYS 79 16.104 12.124 8.289 631 HZ1 LYS 79 HZ1 LYS 79 14.391 10.762 10.296 632 HZ2 LYS 79 HZ2 LYS 79 14.024 12.204 9.498 633 HZ3 LYS 79 HZ3 LYS 79 15.323 12.142 10.578 634 H VAL 80 H VAL 80 12.768 11.360 2.802 635 HA VAL 80 HA VAL 80 11.405 8.934 1.774 636 HB VAL 80 HB VAL 80 10.265 11.098 0.967 637 HG11 VAL 80 HG11 VAL 80 12.263 12.489 0.655 638 HG12 VAL 80 HG12 VAL 80 11.310 12.401 -0.826 639 HG13 VAL 80 HG13 VAL 80 12.793 11.453 -0.673 640 HG21 VAL 80 HG21 VAL 80 9.938 8.969 -0.218 641 HG22 VAL 80 HG22 VAL 80 11.391 9.251 -1.179 642 HG23 VAL 80 HG23 VAL 80 9.989 10.308 -1.368 643 H GLN 81 H GLN 81 12.583 7.816 0.131 644 HA GLN 81 HA GLN 81 15.236 8.651 -0.677 645 HB2 GLN 81 HB2 GLN 81 15.691 7.621 1.525 646 HB3 GLN 81 HB3 GLN 81 14.829 6.164 1.048 647 HG2 GLN 81 HG2 GLN 81 16.542 5.722 -0.683 648 HG3 GLN 81 HG3 GLN 81 17.409 7.179 -0.197 649 HE21 GLN 81 HE21 GLN 81 16.541 3.912 0.724 650 HE22 GLN 81 HE22 GLN 81 17.713 3.749 1.985 651 H ARG 82 H ARG 82 16.008 7.395 -2.456 652 HA ARG 82 HA ARG 82 13.837 6.058 -3.973 653 HB2 ARG 82 HB2 ARG 82 16.196 7.695 -5.028 654 HB3 ARG 82 HB3 ARG 82 14.869 7.040 -5.987 655 HG2 ARG 82 HG2 ARG 82 13.273 8.533 -4.915 656 HG3 ARG 82 HG3 ARG 82 14.500 9.094 -3.778 657 HD2 ARG 82 HD2 ARG 82 14.151 10.773 -5.482 658 HD3 ARG 82 HD3 ARG 82 15.764 10.086 -5.676 659 HE ARG 82 HE ARG 82 14.245 8.616 -7.390 660 HH11 ARG 82 HH11 ARG 82 14.720 12.084 -7.008 661 HH12 ARG 82 HH12 ARG 82 14.454 12.420 -8.689 662 HH21 ARG 82 HH21 ARG 82 13.898 9.082 -9.595 663 HH22 ARG 82 HH22 ARG 82 13.988 10.723 -10.148 664 H ASN 83 H ASN 83 14.251 3.930 -3.679 665 HA ASN 83 HA ASN 83 16.978 2.815 -3.816 666 HB2 ASN 83 HB2 ASN 83 14.348 1.509 -2.963 667 HB3 ASN 83 HB3 ASN 83 15.918 0.711 -2.955 668 HD21 ASN 83 HD21 ASN 83 15.649 0.304 -0.730 669 HD22 ASN 83 HD22 ASN 83 15.858 1.542 0.456 670 H GLN 84 H GLN 84 17.406 0.938 -5.110 671 HA GLN 84 HA GLN 84 16.118 0.868 -7.730 672 HB2 GLN 84 HB2 GLN 84 18.602 0.772 -7.497 673 HB3 GLN 84 HB3 GLN 84 18.463 -0.720 -6.570 674 HG2 GLN 84 HG2 GLN 84 17.407 -1.788 -8.606 675 HG3 GLN 84 HG3 GLN 84 17.786 -0.318 -9.502 676 HE21 GLN 84 HE21 GLN 84 19.095 -3.155 -7.953 677 HE22 GLN 84 HE22 GLN 84 20.679 -3.044 -8.644 678 H SER 85 H SER 85 15.101 -1.055 -8.607 679 HA SER 85 HA SER 85 13.757 -2.715 -6.647 680 HB2 SER 85 HB2 SER 85 12.462 -1.777 -8.480 681 HB3 SER 85 HB3 SER 85 13.477 -2.579 -9.659 682 HG SER 85 HG SER 85 12.091 -4.133 -9.509 683 H ASP 86 H ASP 86 14.508 -4.515 -5.930 684 HA ASP 86 HA ASP 86 16.071 -6.378 -7.595 685 HB2 ASP 86 HB2 ASP 86 16.763 -5.500 -4.742 686 HB3 ASP 86 HB3 ASP 86 17.536 -6.842 -5.582 687 HA PRO 87 HA PRO 87 12.835 -9.193 -6.204 688 HB2 PRO 87 HB2 PRO 87 14.991 -11.291 -6.515 689 HB3 PRO 87 HB3 PRO 87 13.344 -11.248 -7.189 690 HG2 PRO 87 HG2 PRO 87 15.394 -10.711 -8.764 691 HG3 PRO 87 HG3 PRO 87 13.915 -9.728 -8.876 692 HD2 PRO 87 HD2 PRO 87 16.534 -9.053 -7.542 693 HD3 PRO 87 HD3 PRO 87 15.479 -8.027 -8.541 694 H THR 88 H THR 88 16.073 -9.669 -4.727 695 HA THR 88 HA THR 88 15.069 -11.115 -2.436 696 HB THR 88 HB THR 88 17.409 -10.913 -1.564 697 HG1 THR 88 HG1 THR 88 18.457 -9.224 -2.296 698 HG21 THR 88 HG21 THR 88 18.535 -12.235 -3.332 699 HG22 THR 88 HG22 THR 88 17.266 -11.797 -4.477 700 HG23 THR 88 HG23 THR 88 16.881 -12.801 -3.077 701 H MET 89 H MET 89 15.324 -7.784 -3.204 702 HA MET 89 HA MET 89 15.795 -6.620 -0.685 703 HB2 MET 89 HB2 MET 89 15.917 -5.420 -2.872 704 HB3 MET 89 HB3 MET 89 14.166 -5.496 -3.007 705 HG2 MET 89 HG2 MET 89 15.600 -4.087 -0.747 706 HG3 MET 89 HG3 MET 89 15.121 -3.290 -2.244 707 HE1 MET 89 HE1 MET 89 13.886 -1.494 -0.633 708 HE2 MET 89 HE2 MET 89 14.320 -2.442 0.792 709 HE3 MET 89 HE3 MET 89 12.647 -1.949 0.535 710 H PHE 90 H PHE 90 12.761 -7.442 -2.357 711 HA PHE 90 HA PHE 90 10.796 -6.702 -0.595 712 HB2 PHE 90 HB2 PHE 90 10.933 -9.284 -2.221 713 HB3 PHE 90 HB3 PHE 90 9.460 -8.644 -1.500 714 HD1 PHE 90 HD2 PHE 90 12.050 -8.022 -4.107 715 HD2 PHE 90 HD1 PHE 90 8.220 -6.888 -2.578 716 HE1 PHE 90 HE2 PHE 90 11.633 -6.701 -6.138 717 HE2 PHE 90 HE1 PHE 90 7.815 -5.575 -4.609 718 HZ PHE 90 HZ PHE 90 9.515 -5.476 -6.391 719 H ASN 91 H ASN 91 12.579 -9.787 -0.551 720 HA ASN 91 HA ASN 91 11.199 -10.888 1.702 721 HB2 ASN 91 HB2 ASN 91 12.259 -12.263 -0.088 722 HB3 ASN 91 HB3 ASN 91 13.848 -11.713 0.423 723 HD21 ASN 91 HD21 ASN 91 11.033 -13.593 1.396 724 HD22 ASN 91 HD22 ASN 91 11.862 -14.569 2.555 725 H LYS 92 H LYS 92 14.110 -9.011 1.230 726 HA LYS 92 HA LYS 92 15.508 -9.360 3.606 727 HB2 LYS 92 HB2 LYS 92 16.433 -8.221 1.630 728 HB3 LYS 92 HB3 LYS 92 15.331 -6.871 1.862 729 HG2 LYS 92 HG2 LYS 92 16.447 -6.342 4.012 730 HG3 LYS 92 HG3 LYS 92 17.561 -7.689 3.749 731 HD2 LYS 92 HD2 LYS 92 18.402 -6.594 1.689 732 HD3 LYS 92 HD3 LYS 92 17.277 -5.255 1.941 733 HE2 LYS 92 HE2 LYS 92 19.559 -4.678 2.670 734 HE3 LYS 92 HE3 LYS 92 18.438 -4.663 4.033 735 HZ1 LYS 92 HZ1 LYS 92 19.243 -6.835 4.686 736 HZ2 LYS 92 HZ2 LYS 92 20.534 -5.755 4.564 737 HZ3 LYS 92 HZ3 LYS 92 20.276 -6.897 3.350 738 H ILE 93 H ILE 93 13.267 -6.612 2.872 739 HA ILE 93 HA ILE 93 13.436 -5.729 5.632 740 HB ILE 93 HB ILE 93 12.076 -3.850 5.115 741 HG12 ILE 93 HG12 ILE 93 10.338 -5.086 3.694 742 HG13 ILE 93 HG13 ILE 93 10.765 -3.477 3.150 743 HG21 ILE 93 HG21 ILE 93 13.317 -2.810 3.237 744 HG22 ILE 93 HG22 ILE 93 13.942 -4.394 2.774 745 HG23 ILE 93 HG23 ILE 93 14.382 -3.693 4.334 746 HD11 ILE 93 HD11 ILE 93 10.489 -4.996 1.305 747 HD12 ILE 93 HD12 ILE 93 11.744 -6.052 1.952 748 HD13 ILE 93 HD13 ILE 93 12.154 -4.427 1.397 749 H ALA 94 H ALA 94 11.211 -7.677 3.762 750 HA ALA 94 HA ALA 94 8.929 -7.639 5.375 751 HB1 ALA 94 HB1 ALA 94 8.421 -9.851 4.425 752 HB2 ALA 94 HB2 ALA 94 10.088 -9.988 3.849 753 HB3 ALA 94 HB3 ALA 94 9.027 -8.743 3.191 754 H VAL 95 H VAL 95 11.900 -9.617 5.743 755 HA VAL 95 HA VAL 95 10.912 -10.877 8.190 756 HB VAL 95 HB VAL 95 12.314 -12.158 6.573 757 HG11 VAL 95 HG11 VAL 95 14.754 -11.838 6.452 758 HG12 VAL 95 HG12 VAL 95 14.614 -10.388 7.450 759 HG13 VAL 95 HG13 VAL 95 13.877 -10.429 5.847 760 HG21 VAL 95 HG21 VAL 95 12.145 -12.929 8.897 761 HG22 VAL 95 HG22 VAL 95 13.545 -11.952 9.344 762 HG23 VAL 95 HG23 VAL 95 13.734 -13.309 8.232 763 H PHE 96 H PHE 96 12.884 -8.126 7.329 764 HA PHE 96 HA PHE 96 14.310 -7.904 9.818 765 HB2 PHE 96 HB2 PHE 96 15.124 -7.069 7.560 766 HB3 PHE 96 HB3 PHE 96 13.955 -5.761 7.680 767 HD1 PHE 96 HD2 PHE 96 16.586 -7.322 9.894 768 HD2 PHE 96 HD1 PHE 96 14.912 -3.707 8.332 769 HE1 PHE 96 HE2 PHE 96 18.265 -6.009 11.119 770 HE2 PHE 96 HE1 PHE 96 16.598 -2.403 9.562 771 HZ PHE 96 HZ PHE 96 18.277 -3.550 10.955 772 H PHE 97 H PHE 97 11.331 -6.596 8.512 773 HA PHE 97 HA PHE 97 9.636 -5.324 9.261 774 HB2 PHE 97 HB2 PHE 97 10.548 -6.496 11.907 775 HB3 PHE 97 HB3 PHE 97 9.097 -5.516 11.764 776 HD1 PHE 97 HD2 PHE 97 7.248 -6.296 10.176 777 HD2 PHE 97 HD1 PHE 97 10.460 -8.840 11.405 778 HE1 PHE 97 HE2 PHE 97 5.927 -8.273 9.568 779 HE2 PHE 97 HE1 PHE 97 9.129 -10.813 10.792 780 HZ PHE 97 HZ PHE 97 6.861 -10.527 9.880 781 H GLN 98 H GLN 98 11.843 -3.870 8.693 782 HA GLN 98 HA GLN 98 11.216 -1.397 9.996 783 HB2 GLN 98 HB2 GLN 98 12.866 -2.291 11.606 784 HB3 GLN 98 HB3 GLN 98 14.028 -2.542 10.312 785 HG2 GLN 98 HG2 GLN 98 14.280 -0.157 9.992 786 HG3 GLN 98 HG3 GLN 98 12.968 0.188 11.119 787 HE21 GLN 98 HE21 GLN 98 15.762 1.073 11.189 788 HE22 GLN 98 HE22 GLN 98 16.389 0.544 12.708 789 H1 GLY 1 H1 GLY 1 -2.525 6.305 16.237 790 H2 GLY 1 H2 GLY 1 -2.938 4.694 15.926 791 H3 GLY 1 H3 GLY 1 -1.314 5.147 16.019 792 HA2 GLY 1 HA3 GLY 1 -1.560 5.684 18.353 793 HA3 GLY 1 HA2 GLY 1 -3.256 5.217 18.256 794 H SER 2 H SER 2 0.040 3.957 17.613 795 HA SER 2 HA SER 2 -0.857 1.258 18.451 796 HB2 SER 2 HB2 SER 2 -0.766 1.421 15.951 797 HB3 SER 2 HB3 SER 2 0.943 1.841 16.061 798 HG SER 2 HG SER 2 0.258 -0.472 15.716 799 H MET 3 H MET 3 0.594 0.050 19.551 800 HA MET 3 HA MET 3 3.407 0.916 19.864 801 HB2 MET 3 HB2 MET 3 1.591 -0.124 22.094 802 HB3 MET 3 HB3 MET 3 3.324 0.112 22.249 803 HG2 MET 3 HG2 MET 3 3.040 2.529 21.927 804 HG3 MET 3 HG3 MET 3 1.300 2.303 21.731 805 HE1 MET 3 HE1 MET 3 3.580 1.583 25.699 806 HE2 MET 3 HE2 MET 3 4.339 2.212 24.244 807 HE3 MET 3 HE3 MET 3 3.789 0.535 24.292 808 H GLN 4 H GLN 4 1.332 -1.364 18.738 809 HA GLN 4 HA GLN 4 3.276 -3.449 18.508 810 HB2 GLN 4 HB2 GLN 4 1.765 -5.233 19.548 811 HB3 GLN 4 HB3 GLN 4 2.587 -4.166 20.677 812 HG2 GLN 4 HG2 GLN 4 0.495 -2.857 20.953 813 HG3 GLN 4 HG3 GLN 4 -0.334 -3.972 19.865 814 HE21 GLN 4 HE21 GLN 4 -0.872 -3.355 22.692 815 HE22 GLN 4 HE22 GLN 4 -0.798 -4.866 23.525 816 H ASN 5 H ASN 5 3.078 -3.520 16.407 817 HA ASN 5 HA ASN 5 0.604 -2.890 15.016 818 HB2 ASN 5 HB2 ASN 5 3.362 -3.529 13.879 819 HB3 ASN 5 HB3 ASN 5 2.048 -2.675 13.070 820 HD21 ASN 5 HD21 ASN 5 1.898 -0.447 13.371 821 HD22 ASN 5 HD22 ASN 5 2.962 0.452 14.389 822 H THR 6 H THR 6 3.058 -5.482 14.753 823 HA THR 6 HA THR 6 1.254 -7.283 13.365 824 HB THR 6 HB THR 6 3.223 -8.847 13.346 825 HG1 THR 6 HG1 THR 6 4.124 -7.099 15.234 826 HG21 THR 6 HG21 THR 6 3.880 -6.027 12.410 827 HG22 THR 6 HG22 THR 6 2.976 -7.233 11.492 828 HG23 THR 6 HG23 THR 6 4.679 -7.506 11.863 829 H THR 7 H THR 7 -0.316 -7.434 15.033 830 HA THR 7 HA THR 7 0.286 -9.304 17.261 831 HB THR 7 HB THR 7 -1.999 -8.583 18.091 832 HG1 THR 7 HG1 THR 7 -1.928 -6.413 16.286 833 HG21 THR 7 HG21 THR 7 -0.063 -6.279 17.651 834 HG22 THR 7 HG22 THR 7 0.008 -7.440 18.978 835 HG23 THR 7 HG23 THR 7 -1.354 -6.324 18.857 836 H HIS 8 H HIS 8 -2.318 -10.485 17.460 837 HA HIS 8 HA HIS 8 -2.965 -11.389 14.690 838 HB2 HIS 8 HB2 HIS 8 -3.854 -13.418 15.498 839 HB3 HIS 8 HB3 HIS 8 -2.405 -13.197 16.463 840 HD1 HIS 8 HD1 HIS 8 -6.137 -13.270 16.678 841 HD2 HIS 8 HD2 HIS 8 -2.883 -12.875 19.237 842 HE1 HIS 8 HE1 HIS 8 -7.051 -13.609 18.987 843 HE2 HIS 8 HE2 HIS 8 -5.098 -13.210 20.524 844 H ASP 9 H ASP 9 -3.780 -9.162 16.915 845 HA ASP 9 HA ASP 9 -6.638 -9.115 16.802 846 HB2 ASP 9 HB2 ASP 9 -5.322 -8.028 18.624 847 HB3 ASP 9 HB3 ASP 9 -4.634 -6.898 17.463 848 H ASN 10 H ASN 10 -3.986 -7.592 14.962 849 HA ASN 10 HA ASN 10 -5.770 -6.385 13.026 850 HB2 ASN 10 HB2 ASN 10 -3.761 -5.886 11.680 851 HB3 ASN 10 HB3 ASN 10 -3.534 -5.369 13.345 852 HD21 ASN 10 HD21 ASN 10 -1.615 -6.169 11.121 853 HD22 ASN 10 HD22 ASN 10 -0.580 -7.334 11.861 854 H VAL 11 H VAL 11 -5.884 -7.078 10.798 855 HA VAL 11 HA VAL 11 -5.634 -9.988 10.385 856 HB VAL 11 HB VAL 11 -7.752 -9.907 9.004 857 HG11 VAL 11 HG11 VAL 11 -7.803 -10.823 11.277 858 HG12 VAL 11 HG12 VAL 11 -9.318 -9.999 10.911 859 HG13 VAL 11 HG13 VAL 11 -8.119 -9.218 11.943 860 HG21 VAL 11 HG21 VAL 11 -8.193 -7.176 10.291 861 HG22 VAL 11 HG22 VAL 11 -9.346 -8.045 9.276 862 HG23 VAL 11 HG23 VAL 11 -7.834 -7.454 8.587 863 H ILE 12 H ILE 12 -5.259 -10.589 8.270 864 HA ILE 12 HA ILE 12 -3.879 -8.549 6.644 865 HB ILE 12 HB ILE 12 -3.574 -11.589 6.443 866 HG12 ILE 12 HG12 ILE 12 -3.053 -10.844 8.787 867 HG13 ILE 12 HG13 ILE 12 -1.683 -11.551 7.950 868 HG21 ILE 12 HG21 ILE 12 -1.386 -11.072 5.478 869 HG22 ILE 12 HG22 ILE 12 -1.681 -9.345 5.689 870 HG23 ILE 12 HG23 ILE 12 -2.675 -10.279 4.573 871 HD11 ILE 12 HD11 ILE 12 -0.783 -9.297 7.565 872 HD12 ILE 12 HD12 ILE 12 -1.014 -9.653 9.274 873 HD13 ILE 12 HD13 ILE 12 -2.162 -8.615 8.433 874 H LEU 13 H LEU 13 -5.698 -7.793 5.495 875 HA LEU 13 HA LEU 13 -7.602 -9.654 4.297 876 HB2 LEU 13 HB2 LEU 13 -7.511 -6.603 4.275 877 HB3 LEU 13 HB3 LEU 13 -8.829 -7.580 3.642 878 HG LEU 13 HG LEU 13 -7.982 -7.481 6.563 879 HD11 LEU 13 HD11 LEU 13 -10.407 -6.248 5.223 880 HD12 LEU 13 HD12 LEU 13 -9.011 -5.384 5.872 881 HD13 LEU 13 HD13 LEU 13 -10.073 -6.270 6.960 882 HD21 LEU 13 HD21 LEU 13 -10.328 -8.908 5.269 883 HD22 LEU 13 HD22 LEU 13 -10.031 -8.775 7.004 884 HD23 LEU 13 HD23 LEU 13 -8.904 -9.667 5.988 885 H GLU 14 H GLU 14 -6.644 -10.657 2.566 886 HA GLU 14 HA GLU 14 -5.136 -9.112 0.606 887 HB2 GLU 14 HB2 GLU 14 -4.881 -11.332 -0.571 888 HB3 GLU 14 HB3 GLU 14 -4.182 -11.229 1.024 889 HG2 GLU 14 HG2 GLU 14 -5.818 -12.621 1.985 890 HG3 GLU 14 HG3 GLU 14 -6.899 -12.445 0.602 891 H LEU 15 H LEU 15 -6.145 -8.099 -0.959 892 HA LEU 15 HA LEU 15 -8.334 -9.495 -2.355 893 HB2 LEU 15 HB2 LEU 15 -8.943 -7.007 -3.097 894 HB3 LEU 15 HB3 LEU 15 -9.558 -7.718 -1.624 895 HG LEU 15 HG LEU 15 -7.472 -6.521 -0.493 896 HD11 LEU 15 HD11 LEU 15 -7.828 -4.746 -2.916 897 HD12 LEU 15 HD12 LEU 15 -6.413 -5.735 -2.548 898 HD13 LEU 15 HD13 LEU 15 -6.846 -4.398 -1.488 899 HD21 LEU 15 HD21 LEU 15 -8.852 -4.559 0.005 900 HD22 LEU 15 HD22 LEU 15 -9.796 -6.046 0.071 901 HD23 LEU 15 HD23 LEU 15 -9.942 -4.972 -1.324 902 H THR 16 H THR 16 -7.754 -10.197 -4.212 903 HA THR 16 HA THR 16 -5.387 -9.236 -5.609 904 HB THR 16 HB THR 16 -7.414 -11.392 -6.408 905 HG1 THR 16 HG1 THR 16 -6.276 -12.190 -4.709 906 HG21 THR 16 HG21 THR 16 -6.271 -10.428 -8.386 907 HG22 THR 16 HG22 THR 16 -5.733 -12.086 -8.086 908 HG23 THR 16 HG23 THR 16 -4.702 -10.728 -7.629 909 H VAL 17 H VAL 17 -5.773 -7.291 -6.455 910 HA VAL 17 HA VAL 17 -8.251 -6.750 -7.958 911 HB VAL 17 HB VAL 17 -7.848 -4.448 -7.738 912 HG11 VAL 17 HG11 VAL 17 -6.974 -5.669 -5.101 913 HG12 VAL 17 HG12 VAL 17 -8.636 -5.439 -5.652 914 HG13 VAL 17 HG13 VAL 17 -7.623 -4.035 -5.311 915 HG21 VAL 17 HG21 VAL 17 -5.732 -3.427 -6.827 916 HG22 VAL 17 HG22 VAL 17 -5.516 -4.253 -8.369 917 HG23 VAL 17 HG23 VAL 17 -4.991 -5.030 -6.876 918 H ARG 18 H ARG 18 -8.098 -5.993 -10.066 919 HA ARG 18 HA ARG 18 -5.540 -6.284 -11.498 920 HB2 ARG 18 HB2 ARG 18 -7.002 -5.542 -13.487 921 HB3 ARG 18 HB3 ARG 18 -7.290 -7.133 -12.798 922 HG2 ARG 18 HG2 ARG 18 -9.209 -6.114 -11.480 923 HG3 ARG 18 HG3 ARG 18 -8.968 -4.623 -12.394 924 HD2 ARG 18 HD2 ARG 18 -9.602 -7.326 -13.616 925 HD3 ARG 18 HD3 ARG 18 -10.793 -6.065 -13.297 926 HE ARG 18 HE ARG 18 -8.493 -5.430 -15.022 927 HH11 ARG 18 HH11 ARG 18 -11.954 -6.026 -14.780 928 HH12 ARG 18 HH12 ARG 18 -12.290 -5.399 -16.364 929 HH21 ARG 18 HH21 ARG 18 -8.943 -4.635 -17.086 930 HH22 ARG 18 HH22 ARG 18 -10.573 -4.607 -17.673 931 H ASN 19 H ASN 19 -4.577 -4.458 -12.613 932 HA ASN 19 HA ASN 19 -4.530 -2.134 -10.943 933 HB2 ASN 19 HB2 ASN 19 -3.026 -2.776 -13.516 934 HB3 ASN 19 HB3 ASN 19 -2.820 -1.260 -12.643 935 HD21 ASN 19 HD21 ASN 19 -0.689 -1.555 -11.988 936 HD22 ASN 19 HD22 ASN 19 -0.163 -2.818 -10.933 937 H HIS 20 H HIS 20 -6.692 -1.566 -11.116 938 HA HIS 20 HA HIS 20 -7.833 -0.320 -13.475 939 HB2 HIS 20 HB2 HIS 20 -9.219 -1.699 -11.921 940 HB3 HIS 20 HB3 HIS 20 -8.809 -0.633 -10.586 941 HD1 HIS 20 HD1 HIS 20 -11.046 -0.935 -13.548 942 HD2 HIS 20 HD2 HIS 20 -10.301 1.779 -10.494 943 HE1 HIS 20 HE1 HIS 20 -12.984 0.653 -13.569 944 HE2 HIS 20 HE2 HIS 20 -12.538 2.257 -11.690 945 HA PRO 21 HA PRO 21 -6.465 3.980 -12.883 946 HB2 PRO 21 HB2 PRO 21 -9.477 4.428 -12.841 947 HB3 PRO 21 HB3 PRO 21 -8.211 5.396 -13.631 948 HG2 PRO 21 HG2 PRO 21 -9.619 3.669 -15.071 949 HG3 PRO 21 HG3 PRO 21 -7.866 3.835 -15.334 950 HD2 PRO 21 HD2 PRO 21 -9.363 1.601 -14.039 951 HD3 PRO 21 HD3 PRO 21 -7.789 1.576 -14.868 952 H GLY 22 H GLY 22 -5.583 3.911 -10.858 953 HA2 GLY 22 HA2 GLY 22 -5.217 4.521 -8.705 954 HA3 GLY 22 HA3 GLY 22 -6.650 5.522 -8.838 955 H VAL 23 H VAL 23 -6.030 1.952 -8.691 956 HA VAL 23 HA VAL 23 -8.320 1.247 -7.248 957 HB VAL 23 HB VAL 23 -5.607 -0.153 -7.005 958 HG11 VAL 23 HG11 VAL 23 -8.420 -1.172 -6.431 959 HG12 VAL 23 HG12 VAL 23 -7.156 -0.857 -5.241 960 HG13 VAL 23 HG13 VAL 23 -6.957 -2.162 -6.408 961 HG21 VAL 23 HG21 VAL 23 -6.398 -1.684 -8.770 962 HG22 VAL 23 HG22 VAL 23 -6.267 -0.024 -9.357 963 HG23 VAL 23 HG23 VAL 23 -7.852 -0.700 -8.974 964 H MET 24 H MET 24 -5.177 2.333 -6.088 965 HA MET 24 HA MET 24 -5.464 1.461 -3.423 966 HB2 MET 24 HB2 MET 24 -3.552 3.432 -4.698 967 HB3 MET 24 HB3 MET 24 -3.456 2.960 -3.002 968 HG2 MET 24 HG2 MET 24 -3.160 1.134 -5.396 969 HG3 MET 24 HG3 MET 24 -1.886 1.655 -4.295 970 HE1 MET 24 HE1 MET 24 -3.111 -0.224 -0.947 971 HE2 MET 24 HE2 MET 24 -3.685 1.366 -1.441 972 HE3 MET 24 HE3 MET 24 -1.975 0.966 -1.580 973 H THR 25 H THR 25 -6.402 4.502 -4.964 974 HA THR 25 HA THR 25 -6.946 5.881 -2.490 975 HB THR 25 HB THR 25 -8.312 7.439 -3.974 976 HG1 THR 25 HG1 THR 25 -8.290 7.070 -6.178 977 HG21 THR 25 HG21 THR 25 -5.465 6.889 -4.892 978 HG22 THR 25 HG22 THR 25 -5.925 7.887 -3.509 979 HG23 THR 25 HG23 THR 25 -6.365 8.386 -5.144 980 H HIS 26 H HIS 26 -8.719 3.673 -4.572 981 HA HIS 26 HA HIS 26 -11.318 4.030 -3.445 982 HB2 HIS 26 HB2 HIS 26 -10.163 1.588 -4.880 983 HB3 HIS 26 HB3 HIS 26 -11.867 1.828 -4.510 984 HD1 HIS 26 HD1 HIS 26 -12.086 1.489 -7.163 985 HD2 HIS 26 HD2 HIS 26 -10.222 4.988 -5.968 986 HE1 HIS 26 HE1 HIS 26 -12.107 2.973 -9.178 987 HE2 HIS 26 HE2 HIS 26 -10.791 4.985 -8.472 988 H VAL 27 H VAL 27 -8.711 1.613 -2.894 989 HA VAL 27 HA VAL 27 -10.107 0.156 -0.918 990 HB VAL 27 HB VAL 27 -8.101 -1.092 -0.454 991 HG11 VAL 27 HG11 VAL 27 -8.134 -0.408 -3.417 992 HG12 VAL 27 HG12 VAL 27 -9.159 -1.592 -2.607 993 HG13 VAL 27 HG13 VAL 27 -7.419 -1.857 -2.699 994 HG21 VAL 27 HG21 VAL 27 -6.470 1.008 -1.923 995 HG22 VAL 27 HG22 VAL 27 -5.853 -0.530 -1.313 996 HG23 VAL 27 HG23 VAL 27 -6.445 0.692 -0.188 997 H CYS 28 H CYS 28 -7.585 2.665 -0.634 998 HA CYS 28 HA CYS 28 -7.426 2.731 2.175 999 HB2 CYS 28 HB2 CYS 28 -6.756 4.863 0.106 1000 HB3 CYS 28 HB3 CYS 28 -6.287 4.946 1.803 1001 HG CYS 28 HG CYS 28 -5.295 2.497 -0.374 1002 H GLY 29 H GLY 29 -9.626 4.262 -0.108 1003 HA2 GLY 29 HA2 GLY 29 -10.958 6.128 1.494 1004 HA3 GLY 29 HA3 GLY 29 -11.683 5.220 0.172 1005 H LEU 30 H LEU 30 -11.634 2.629 1.062 1006 HA LEU 30 HA LEU 30 -13.916 2.519 2.744 1007 HB2 LEU 30 HB2 LEU 30 -12.133 0.419 1.528 1008 HB3 LEU 30 HB3 LEU 30 -13.251 -0.073 2.788 1009 HG LEU 30 HG LEU 30 -14.293 -0.533 0.678 1010 HD11 LEU 30 HD11 LEU 30 -15.608 1.947 1.831 1011 HD12 LEU 30 HD12 LEU 30 -15.806 0.294 2.414 1012 HD13 LEU 30 HD13 LEU 30 -16.380 0.729 0.809 1013 HD21 LEU 30 HD21 LEU 30 -13.843 2.352 -0.143 1014 HD22 LEU 30 HD22 LEU 30 -14.734 1.137 -1.064 1015 HD23 LEU 30 HD23 LEU 30 -13.005 0.939 -0.791 1016 H PHE 31 H PHE 31 -10.496 1.932 3.431 1017 HA PHE 31 HA PHE 31 -10.983 0.939 6.108 1018 HB2 PHE 31 HB2 PHE 31 -8.413 1.642 4.636 1019 HB3 PHE 31 HB3 PHE 31 -8.447 0.990 6.275 1020 HD1 PHE 31 HD2 PHE 31 -9.102 0.210 2.723 1021 HD2 PHE 31 HD1 PHE 31 -9.023 -1.359 6.681 1022 HE1 PHE 31 HE2 PHE 31 -9.306 -2.060 1.811 1023 HE2 PHE 31 HE1 PHE 31 -9.222 -3.627 5.768 1024 HZ PHE 31 HZ PHE 31 -9.368 -3.990 3.341 1025 H ALA 32 H ALA 32 -10.210 4.054 4.696 1026 HA ALA 32 HA ALA 32 -9.483 5.370 7.149 1027 HB1 ALA 32 HB1 ALA 32 -10.345 6.572 4.497 1028 HB2 ALA 32 HB2 ALA 32 -8.690 6.173 4.963 1029 HB3 ALA 32 HB3 ALA 32 -9.565 7.435 5.831 1030 H ARG 33 H ARG 33 -12.501 4.925 5.333 1031 HA ARG 33 HA ARG 33 -14.016 6.885 6.848 1032 HB2 ARG 33 HB2 ARG 33 -15.914 6.231 5.473 1033 HB3 ARG 33 HB3 ARG 33 -14.491 6.396 4.449 1034 HG2 ARG 33 HG2 ARG 33 -14.207 3.921 4.495 1035 HG3 ARG 33 HG3 ARG 33 -15.687 3.790 5.439 1036 HD2 ARG 33 HD2 ARG 33 -15.504 4.958 2.644 1037 HD3 ARG 33 HD3 ARG 33 -16.050 3.321 3.035 1038 HE ARG 33 HE ARG 33 -17.515 5.354 4.425 1039 HH11 ARG 33 HH11 ARG 33 -17.388 3.564 1.402 1040 HH12 ARG 33 HH12 ARG 33 -19.062 3.839 1.042 1041 HH21 ARG 33 HH21 ARG 33 -19.677 5.727 3.934 1042 HH22 ARG 33 HH22 ARG 33 -20.367 5.069 2.485 1043 H ARG 34 H ARG 34 -13.060 3.717 7.567 1044 HA ARG 34 HA ARG 34 -15.295 2.729 9.011 1045 HB2 ARG 34 HB2 ARG 34 -13.514 1.192 8.440 1046 HB3 ARG 34 HB3 ARG 34 -12.289 2.239 9.147 1047 HG2 ARG 34 HG2 ARG 34 -13.526 1.753 11.412 1048 HG3 ARG 34 HG3 ARG 34 -14.226 0.385 10.548 1049 HD2 ARG 34 HD2 ARG 34 -12.124 -0.656 10.256 1050 HD3 ARG 34 HD3 ARG 34 -11.234 0.843 10.576 1051 HE ARG 34 HE ARG 34 -12.810 -0.092 12.794 1052 HH11 ARG 34 HH11 ARG 34 -9.687 -0.306 11.228 1053 HH12 ARG 34 HH12 ARG 34 -8.872 -0.843 12.662 1054 HH21 ARG 34 HH21 ARG 34 -11.752 -0.825 14.659 1055 HH22 ARG 34 HH22 ARG 34 -10.048 -1.138 14.609 1056 H ALA 35 H ALA 35 -12.232 3.964 10.317 1057 HA ALA 35 HA ALA 35 -13.041 6.049 11.930 1058 HB1 ALA 35 HB1 ALA 35 -13.117 5.063 14.208 1059 HB2 ALA 35 HB2 ALA 35 -13.011 3.443 13.510 1060 HB3 ALA 35 HB3 ALA 35 -14.425 4.446 13.198 1061 H PHE 36 H PHE 36 -11.146 3.068 12.215 1062 HA PHE 36 HA PHE 36 -8.667 4.577 12.774 1063 HB2 PHE 36 HB2 PHE 36 -9.214 2.723 14.342 1064 HB3 PHE 36 HB3 PHE 36 -9.283 1.588 13.002 1065 HD1 PHE 36 HD1 PHE 36 -6.886 4.040 14.575 1066 HD2 PHE 36 HD2 PHE 36 -7.349 0.271 12.604 1067 HE1 PHE 36 HE1 PHE 36 -4.492 3.572 14.893 1068 HE2 PHE 36 HE2 PHE 36 -4.953 -0.187 12.927 1069 HZ PHE 36 HZ PHE 36 -3.522 1.460 14.071 1070 H ASN 37 H ASN 37 -6.977 4.524 11.351 1071 HA ASN 37 HA ASN 37 -7.505 3.885 8.590 1072 HB2 ASN 37 HB2 ASN 37 -5.034 4.985 9.995 1073 HB3 ASN 37 HB3 ASN 37 -5.165 4.805 8.249 1074 HD21 ASN 37 HD21 ASN 37 -7.989 5.659 8.139 1075 HD22 ASN 37 HD22 ASN 37 -7.969 7.362 8.411 1076 H VAL 38 H VAL 38 -5.179 3.018 7.527 1077 HA VAL 38 HA VAL 38 -5.076 0.230 8.283 1078 HB VAL 38 HB VAL 38 -3.462 1.639 6.104 1079 HG11 VAL 38 HG11 VAL 38 -3.280 -0.637 5.129 1080 HG12 VAL 38 HG12 VAL 38 -4.126 -1.294 6.531 1081 HG13 VAL 38 HG13 VAL 38 -2.544 -0.532 6.732 1082 HG21 VAL 38 HG21 VAL 38 -6.146 0.235 5.818 1083 HG22 VAL 38 HG22 VAL 38 -5.165 0.866 4.493 1084 HG23 VAL 38 HG23 VAL 38 -5.865 1.973 5.675 1085 H GLU 39 H GLU 39 -3.420 -0.809 9.230 1086 HA GLU 39 HA GLU 39 -1.330 0.660 10.589 1087 HB2 GLU 39 HB2 GLU 39 -2.672 -1.298 11.556 1088 HB3 GLU 39 HB3 GLU 39 -1.781 -2.359 10.470 1089 HG2 GLU 39 HG2 GLU 39 -0.776 -2.472 12.647 1090 HG3 GLU 39 HG3 GLU 39 0.338 -1.613 11.581 1091 H GLY 40 H GLY 40 -1.569 -1.857 8.060 1092 HA2 GLY 40 HA2 GLY 40 1.033 -1.126 6.910 1093 HA3 GLY 40 HA3 GLY 40 0.888 -2.758 7.555 1094 H ILE 41 H ILE 41 1.354 -1.955 4.778 1095 HA ILE 41 HA ILE 41 -0.922 -3.321 3.457 1096 HB ILE 41 HB ILE 41 0.439 -0.770 2.410 1097 HG12 ILE 41 HG12 ILE 41 -2.425 -1.287 3.303 1098 HG13 ILE 41 HG13 ILE 41 -1.249 -0.258 4.105 1099 HG21 ILE 41 HG21 ILE 41 -1.038 -0.898 0.436 1100 HG22 ILE 41 HG22 ILE 41 -1.695 -2.428 1.015 1101 HG23 ILE 41 HG23 ILE 41 -0.003 -2.326 0.532 1102 HD11 ILE 41 HD11 ILE 41 -2.837 1.089 2.956 1103 HD12 ILE 41 HD12 ILE 41 -2.564 0.228 1.442 1104 HD13 ILE 41 HD13 ILE 41 -1.284 1.231 2.131 1105 H LEU 42 H LEU 42 -0.305 -4.594 1.665 1106 HA LEU 42 HA LEU 42 2.399 -4.417 0.617 1107 HB2 LEU 42 HB2 LEU 42 2.696 -6.087 2.367 1108 HB3 LEU 42 HB3 LEU 42 1.323 -7.017 1.789 1109 HG LEU 42 HG LEU 42 2.531 -7.746 -0.186 1110 HD11 LEU 42 HD11 LEU 42 4.795 -5.878 0.587 1111 HD12 LEU 42 HD12 LEU 42 3.701 -5.678 -0.783 1112 HD13 LEU 42 HD13 LEU 42 4.818 -7.040 -0.745 1113 HD21 LEU 42 HD21 LEU 42 4.414 -8.968 0.804 1114 HD22 LEU 42 HD22 LEU 42 3.017 -8.980 1.876 1115 HD23 LEU 42 HD23 LEU 42 4.378 -7.907 2.216 1116 H CYS 43 H CYS 43 1.443 -3.616 -1.184 1117 HA CYS 43 HA CYS 43 -0.422 -5.173 -2.795 1118 HB2 CYS 43 HB2 CYS 43 -0.635 -2.728 -2.759 1119 HB3 CYS 43 HB3 CYS 43 1.043 -2.528 -3.237 1120 HG CYS 43 HG CYS 43 -1.325 -3.936 -5.260 1121 H LEU 44 H LEU 44 0.616 -7.012 -3.419 1122 HA LEU 44 HA LEU 44 3.395 -7.007 -4.363 1123 HB2 LEU 44 HB2 LEU 44 2.397 -8.660 -2.682 1124 HB3 LEU 44 HB3 LEU 44 1.498 -9.347 -4.018 1125 HG LEU 44 HG LEU 44 3.725 -9.895 -5.126 1126 HD11 LEU 44 HD11 LEU 44 4.867 -9.139 -2.420 1127 HD12 LEU 44 HD12 LEU 44 5.141 -8.275 -3.938 1128 HD13 LEU 44 HD13 LEU 44 5.744 -9.919 -3.742 1129 HD21 LEU 44 HD21 LEU 44 4.150 -11.863 -3.726 1130 HD22 LEU 44 HD22 LEU 44 2.420 -11.593 -3.908 1131 HD23 LEU 44 HD23 LEU 44 3.226 -11.147 -2.402 1132 HA PRO 45 HA PRO 45 1.391 -6.534 -8.447 1133 HB2 PRO 45 HB2 PRO 45 3.703 -6.234 -9.944 1134 HB3 PRO 45 HB3 PRO 45 2.977 -4.929 -8.988 1135 HG2 PRO 45 HG2 PRO 45 5.291 -6.696 -8.289 1136 HG3 PRO 45 HG3 PRO 45 5.093 -4.947 -8.036 1137 HD2 PRO 45 HD2 PRO 45 4.724 -6.749 -6.032 1138 HD3 PRO 45 HD3 PRO 45 3.803 -5.230 -6.122 1139 H ILE 46 H ILE 46 0.539 -8.289 -9.322 1140 HA ILE 46 HA ILE 46 1.771 -10.865 -9.418 1141 HB ILE 46 HB ILE 46 -0.779 -9.836 -10.745 1142 HG12 ILE 46 HG12 ILE 46 -0.921 -9.696 -8.300 1143 HG13 ILE 46 HG13 ILE 46 -1.963 -10.992 -8.867 1144 HG21 ILE 46 HG21 ILE 46 -1.457 -12.204 -10.986 1145 HG22 ILE 46 HG22 ILE 46 0.132 -12.715 -10.410 1146 HG23 ILE 46 HG23 ILE 46 -0.013 -11.829 -11.931 1147 HD11 ILE 46 HD11 ILE 46 -0.832 -11.650 -6.855 1148 HD12 ILE 46 HD12 ILE 46 0.740 -11.293 -7.565 1149 HD13 ILE 46 HD13 ILE 46 -0.232 -12.625 -8.196 1150 H GLN 47 H GLN 47 3.391 -11.260 -10.761 1151 HA GLN 47 HA GLN 47 4.198 -9.956 -13.069 1152 HB2 GLN 47 HB2 GLN 47 5.797 -11.346 -11.999 1153 HB3 GLN 47 HB3 GLN 47 4.707 -12.725 -11.941 1154 HG2 GLN 47 HG2 GLN 47 6.450 -13.191 -13.542 1155 HG3 GLN 47 HG3 GLN 47 4.916 -12.976 -14.403 1156 HE21 GLN 47 HE21 GLN 47 5.862 -12.419 -16.370 1157 HE22 GLN 47 HE22 GLN 47 6.728 -10.947 -16.625 1158 H ASP 48 H ASP 48 2.021 -12.667 -12.699 1159 HA ASP 48 HA ASP 48 1.908 -13.789 -15.198 1160 HB2 ASP 48 HB2 ASP 48 0.882 -14.980 -13.469 1161 HB3 ASP 48 HB3 ASP 48 -0.003 -13.584 -12.892 1162 H SER 49 H SER 49 0.164 -10.876 -14.124 1163 HA SER 49 HA SER 49 -0.624 -10.116 -16.807 1164 HB2 SER 49 HB2 SER 49 -2.783 -11.055 -14.858 1165 HB3 SER 49 HB3 SER 49 -3.114 -10.133 -16.319 1166 HG SER 49 HG SER 49 -1.976 -12.727 -16.146 1167 H ASP 50 H ASP 50 -2.473 -8.205 -16.473 1168 HA ASP 50 HA ASP 50 -1.383 -6.182 -14.736 1169 HB2 ASP 50 HB2 ASP 50 -3.823 -6.302 -16.561 1170 HB3 ASP 50 HB3 ASP 50 -3.623 -4.953 -15.448 1171 H LYS 51 H LYS 51 -1.512 -7.410 -12.774 1172 HA LYS 51 HA LYS 51 -3.922 -6.925 -11.233 1173 HB2 LYS 51 HB2 LYS 51 -2.719 -9.715 -11.554 1174 HB3 LYS 51 HB3 LYS 51 -3.764 -9.286 -10.206 1175 HG2 LYS 51 HG2 LYS 51 -5.640 -8.901 -11.715 1176 HG3 LYS 51 HG3 LYS 51 -4.608 -9.161 -13.122 1177 HD2 LYS 51 HD2 LYS 51 -5.334 -11.254 -11.028 1178 HD3 LYS 51 HD3 LYS 51 -5.979 -11.157 -12.668 1179 HE2 LYS 51 HE2 LYS 51 -3.629 -11.475 -13.530 1180 HE3 LYS 51 HE3 LYS 51 -3.108 -11.754 -11.870 1181 HZ1 LYS 51 HZ1 LYS 51 -4.642 -13.639 -11.775 1182 HZ2 LYS 51 HZ2 LYS 51 -3.480 -13.829 -12.986 1183 HZ3 LYS 51 HZ3 LYS 51 -5.059 -13.386 -13.395 1184 H SER 52 H SER 52 -3.487 -7.398 -8.928 1185 HA SER 52 HA SER 52 -0.813 -7.645 -7.942 1186 HB2 SER 52 HB2 SER 52 -0.969 -5.169 -8.452 1187 HB3 SER 52 HB3 SER 52 -2.345 -5.059 -7.349 1188 HG SER 52 HG SER 52 0.180 -4.855 -6.729 1189 H HIS 53 H HIS 53 -0.870 -7.999 -5.623 1190 HA HIS 53 HA HIS 53 -3.531 -8.880 -4.615 1191 HB2 HIS 53 HB2 HIS 53 -1.844 -10.692 -5.451 1192 HB3 HIS 53 HB3 HIS 53 -0.867 -10.280 -4.049 1193 HD1 HIS 53 HD1 HIS 53 -1.403 -12.974 -3.726 1194 HD2 HIS 53 HD2 HIS 53 -4.505 -10.313 -2.968 1195 HE1 HIS 53 HE1 HIS 53 -3.108 -14.279 -2.422 1196 HE2 HIS 53 HE2 HIS 53 -5.039 -12.700 -2.151 1197 H ILE 54 H ILE 54 -3.991 -7.384 -3.054 1198 HA ILE 54 HA ILE 54 -1.773 -6.114 -1.576 1199 HB ILE 54 HB ILE 54 -4.633 -5.052 -1.813 1200 HG12 ILE 54 HG12 ILE 54 -3.565 -3.271 -3.352 1201 HG13 ILE 54 HG13 ILE 54 -2.191 -4.355 -3.497 1202 HG21 ILE 54 HG21 ILE 54 -2.077 -3.713 -0.854 1203 HG22 ILE 54 HG22 ILE 54 -3.418 -4.243 0.165 1204 HG23 ILE 54 HG23 ILE 54 -3.654 -2.931 -0.991 1205 HD11 ILE 54 HD11 ILE 54 -5.009 -4.965 -4.338 1206 HD12 ILE 54 HD12 ILE 54 -3.613 -6.027 -4.527 1207 HD13 ILE 54 HD13 ILE 54 -3.678 -4.495 -5.395 1208 H TRP 55 H TRP 55 -1.459 -6.924 0.406 1209 HA TRP 55 HA TRP 55 -3.652 -7.993 2.039 1210 HB2 TRP 55 HB2 TRP 55 -0.622 -7.912 2.413 1211 HB3 TRP 55 HB3 TRP 55 -1.729 -8.552 3.623 1212 HD1 TRP 55 HD1 TRP 55 -2.952 -10.911 3.041 1213 HE1 TRP 55 HE1 TRP 55 -2.392 -12.788 1.380 1214 HE3 TRP 55 HE3 TRP 55 0.381 -8.416 0.163 1215 HZ2 TRP 55 HZ2 TRP 55 -0.705 -13.155 -0.859 1216 HZ3 TRP 55 HZ3 TRP 55 1.421 -9.588 -1.697 1217 HH2 TRP 55 HH2 TRP 55 0.897 -11.910 -2.221 1218 H LEU 56 H LEU 56 -4.769 -6.572 3.236 1219 HA LEU 56 HA LEU 56 -3.578 -4.036 4.146 1220 HB2 LEU 56 HB2 LEU 56 -6.486 -4.946 3.999 1221 HB3 LEU 56 HB3 LEU 56 -5.980 -3.426 4.711 1222 HG LEU 56 HG LEU 56 -6.816 -2.902 2.554 1223 HD11 LEU 56 HD11 LEU 56 -4.812 -1.662 3.127 1224 HD12 LEU 56 HD12 LEU 56 -4.932 -1.893 1.386 1225 HD13 LEU 56 HD13 LEU 56 -3.801 -2.869 2.327 1226 HD21 LEU 56 HD21 LEU 56 -6.079 -3.930 0.449 1227 HD22 LEU 56 HD22 LEU 56 -6.817 -5.107 1.531 1228 HD23 LEU 56 HD23 LEU 56 -5.062 -5.061 1.350 1229 H LEU 57 H LEU 57 -2.713 -4.170 6.087 1230 HA LEU 57 HA LEU 57 -3.616 -5.931 8.216 1231 HB2 LEU 57 HB2 LEU 57 -1.343 -3.929 7.980 1232 HB3 LEU 57 HB3 LEU 57 -1.746 -4.684 9.511 1233 HG LEU 57 HG LEU 57 -1.165 -6.887 8.622 1234 HD11 LEU 57 HD11 LEU 57 -0.480 -5.505 6.014 1235 HD12 LEU 57 HD12 LEU 57 -1.780 -6.672 6.290 1236 HD13 LEU 57 HD13 LEU 57 -0.100 -7.183 6.424 1237 HD21 LEU 57 HD21 LEU 57 0.570 -5.566 9.709 1238 HD22 LEU 57 HD22 LEU 57 1.013 -4.832 8.163 1239 HD23 LEU 57 HD23 LEU 57 1.251 -6.561 8.424 1240 H VAL 58 H VAL 58 -5.386 -5.264 9.206 1241 HA VAL 58 HA VAL 58 -5.494 -2.655 10.526 1242 HB VAL 58 HB VAL 58 -6.574 -2.332 8.275 1243 HG11 VAL 58 HG11 VAL 58 -8.565 -4.427 9.160 1244 HG12 VAL 58 HG12 VAL 58 -7.394 -4.571 7.846 1245 HG13 VAL 58 HG13 VAL 58 -8.714 -3.407 7.724 1246 HG21 VAL 58 HG21 VAL 58 -8.654 -1.264 9.064 1247 HG22 VAL 58 HG22 VAL 58 -7.312 -0.938 10.159 1248 HG23 VAL 58 HG23 VAL 58 -8.529 -2.140 10.594 1249 H ASN 59 H ASN 59 -6.739 -2.844 12.490 1250 HA ASN 59 HA ASN 59 -7.318 -5.540 13.320 1251 HB2 ASN 59 HB2 ASN 59 -8.123 -4.580 15.441 1252 HB3 ASN 59 HB3 ASN 59 -6.537 -3.979 14.998 1253 HD21 ASN 59 HD21 ASN 59 -8.764 -2.916 16.738 1254 HD22 ASN 59 HD22 ASN 59 -8.938 -1.283 16.204 1255 H ASP 60 H ASP 60 -8.948 -6.622 12.554 1256 HA ASP 60 HA ASP 60 -11.156 -5.935 11.188 1257 HB2 ASP 60 HB2 ASP 60 -10.396 -8.257 11.465 1258 HB3 ASP 60 HB3 ASP 60 -10.975 -8.262 13.131 1259 H ASP 61 H ASP 61 -13.200 -5.260 11.551 1260 HA ASP 61 HA ASP 61 -14.078 -4.543 14.250 1261 HB2 ASP 61 HB2 ASP 61 -12.628 -2.713 13.552 1262 HB3 ASP 61 HB3 ASP 61 -13.437 -2.600 11.999 1263 H GLN 62 H GLN 62 -16.330 -3.948 14.278 1264 HA GLN 62 HA GLN 62 -17.958 -5.611 12.694 1265 HB2 GLN 62 HB2 GLN 62 -18.816 -3.239 14.409 1266 HB3 GLN 62 HB3 GLN 62 -19.866 -4.540 13.856 1267 HG2 GLN 62 HG2 GLN 62 -17.516 -4.868 15.746 1268 HG3 GLN 62 HG3 GLN 62 -19.208 -4.791 16.229 1269 HE21 GLN 62 HE21 GLN 62 -17.215 -6.926 16.611 1270 HE22 GLN 62 HE22 GLN 62 -17.908 -8.341 15.911 1271 H ARG 63 H ARG 63 -17.202 -2.183 12.445 1272 HA ARG 63 HA ARG 63 -19.089 -1.636 10.292 1273 HB2 ARG 63 HB2 ARG 63 -18.426 0.076 12.032 1274 HB3 ARG 63 HB3 ARG 63 -16.810 0.104 11.338 1275 HG2 ARG 63 HG2 ARG 63 -17.776 0.899 9.183 1276 HG3 ARG 63 HG3 ARG 63 -19.376 0.915 9.928 1277 HD2 ARG 63 HD2 ARG 63 -18.492 2.568 11.619 1278 HD3 ARG 63 HD3 ARG 63 -16.987 2.631 10.690 1279 HE ARG 63 HE ARG 63 -19.130 3.141 8.950 1280 HH11 ARG 63 HH11 ARG 63 -17.516 4.694 11.656 1281 HH12 ARG 63 HH12 ARG 63 -17.925 6.297 11.138 1282 HH21 ARG 63 HH21 ARG 63 -19.681 5.245 8.290 1283 HH22 ARG 63 HH22 ARG 63 -19.158 6.611 9.227 1284 H LEU 64 H LEU 64 -15.684 -2.378 10.723 1285 HA LEU 64 HA LEU 64 -14.645 -1.747 8.192 1286 HB2 LEU 64 HB2 LEU 64 -13.260 -2.354 10.167 1287 HB3 LEU 64 HB3 LEU 64 -13.832 -4.008 10.049 1288 HG LEU 64 HG LEU 64 -12.764 -3.974 7.643 1289 HD11 LEU 64 HD11 LEU 64 -12.338 -1.563 7.519 1290 HD12 LEU 64 HD12 LEU 64 -10.860 -2.508 7.351 1291 HD13 LEU 64 HD13 LEU 64 -11.209 -1.694 8.876 1292 HD21 LEU 64 HD21 LEU 64 -10.625 -4.718 8.501 1293 HD22 LEU 64 HD22 LEU 64 -11.935 -5.341 9.502 1294 HD23 LEU 64 HD23 LEU 64 -10.962 -3.980 10.069 1295 H GLU 65 H GLU 65 -16.263 -4.689 9.378 1296 HA GLU 65 HA GLU 65 -15.837 -6.366 7.151 1297 HB2 GLU 65 HB2 GLU 65 -18.132 -6.383 9.150 1298 HB3 GLU 65 HB3 GLU 65 -17.739 -7.704 8.048 1299 HG2 GLU 65 HG2 GLU 65 -15.531 -7.944 9.145 1300 HG3 GLU 65 HG3 GLU 65 -15.957 -6.655 10.265 1301 H GLN 66 H GLN 66 -18.299 -3.941 7.793 1302 HA GLN 66 HA GLN 66 -19.948 -4.431 5.521 1303 HB2 GLN 66 HB2 GLN 66 -20.710 -3.078 7.457 1304 HB3 GLN 66 HB3 GLN 66 -19.505 -1.849 7.087 1305 HG2 GLN 66 HG2 GLN 66 -21.738 -1.160 6.330 1306 HG3 GLN 66 HG3 GLN 66 -20.628 -1.339 4.969 1307 HE21 GLN 66 HE21 GLN 66 -22.163 -1.719 3.420 1308 HE22 GLN 66 HE22 GLN 66 -23.196 -3.100 3.385 1309 H MET 67 H MET 67 -17.041 -2.510 6.088 1310 HA MET 67 HA MET 67 -16.952 -1.230 3.528 1311 HB2 MET 67 HB2 MET 67 -14.646 -1.680 5.477 1312 HB3 MET 67 HB3 MET 67 -14.692 -0.511 4.161 1313 HG2 MET 67 HG2 MET 67 -16.384 -0.467 6.668 1314 HG3 MET 67 HG3 MET 67 -15.053 0.620 6.267 1315 HE1 MET 67 HE1 MET 67 -18.078 1.494 7.164 1316 HE2 MET 67 HE2 MET 67 -18.330 2.861 6.079 1317 HE3 MET 67 HE3 MET 67 -16.776 2.654 6.886 1318 H ILE 68 H ILE 68 -15.732 -4.283 4.822 1319 HA ILE 68 HA ILE 68 -14.021 -5.036 2.654 1320 HB ILE 68 HB ILE 68 -15.463 -6.822 4.689 1321 HG12 ILE 68 HG12 ILE 68 -12.562 -5.852 4.741 1322 HG13 ILE 68 HG13 ILE 68 -13.858 -5.155 5.702 1323 HG21 ILE 68 HG21 ILE 68 -13.790 -8.573 4.111 1324 HG22 ILE 68 HG22 ILE 68 -13.137 -7.528 2.848 1325 HG23 ILE 68 HG23 ILE 68 -14.785 -8.140 2.719 1326 HD11 ILE 68 HD11 ILE 68 -12.821 -7.981 5.915 1327 HD12 ILE 68 HD12 ILE 68 -14.148 -7.301 6.860 1328 HD13 ILE 68 HD13 ILE 68 -12.519 -6.652 7.036 1329 H SER 69 H SER 69 -17.420 -5.637 3.458 1330 HA SER 69 HA SER 69 -18.082 -7.314 1.267 1331 HB2 SER 69 HB2 SER 69 -19.439 -7.111 3.373 1332 HB3 SER 69 HB3 SER 69 -19.925 -5.493 2.873 1333 HG SER 69 HG SER 69 -20.917 -6.413 1.057 1334 H GLN 70 H GLN 70 -18.159 -3.817 1.787 1335 HA GLN 70 HA GLN 70 -19.554 -3.086 -0.581 1336 HB2 GLN 70 HB2 GLN 70 -19.157 -1.726 1.623 1337 HB3 GLN 70 HB3 GLN 70 -17.620 -1.265 0.917 1338 HG2 GLN 70 HG2 GLN 70 -20.323 -0.712 -0.350 1339 HG3 GLN 70 HG3 GLN 70 -19.461 0.427 0.668 1340 HE21 GLN 70 HE21 GLN 70 -16.829 -0.135 -0.495 1341 HE22 GLN 70 HE22 GLN 70 -16.843 0.564 -2.069 1342 H ILE 71 H ILE 71 -16.077 -3.227 0.279 1343 HA ILE 71 HA ILE 71 -15.137 -2.053 -2.139 1344 HB ILE 71 HB ILE 71 -13.858 -2.050 0.028 1345 HG12 ILE 71 HG12 ILE 71 -12.361 -3.113 -2.409 1346 HG13 ILE 71 HG13 ILE 71 -12.715 -1.424 -2.056 1347 HG21 ILE 71 HG21 ILE 71 -13.149 -4.925 -0.641 1348 HG22 ILE 71 HG22 ILE 71 -14.182 -4.400 0.685 1349 HG23 ILE 71 HG23 ILE 71 -12.475 -3.967 0.682 1350 HD11 ILE 71 HD11 ILE 71 -10.928 -3.219 -0.431 1351 HD12 ILE 71 HD12 ILE 71 -11.265 -1.513 -0.109 1352 HD13 ILE 71 HD13 ILE 71 -10.420 -1.988 -1.578 1353 H ASP 72 H ASP 72 -15.803 -5.359 -1.182 1354 HA ASP 72 HA ASP 72 -14.290 -6.769 -3.075 1355 HB2 ASP 72 HB2 ASP 72 -15.228 -7.916 -1.157 1356 HB3 ASP 72 HB3 ASP 72 -16.870 -7.507 -1.638 1357 H LYS 73 H LYS 73 -17.501 -5.315 -3.297 1358 HA LYS 73 HA LYS 73 -18.008 -6.461 -5.939 1359 HB2 LYS 73 HB2 LYS 73 -20.256 -5.371 -5.715 1360 HB3 LYS 73 HB3 LYS 73 -19.874 -6.533 -4.457 1361 HG2 LYS 73 HG2 LYS 73 -19.225 -4.560 -2.975 1362 HG3 LYS 73 HG3 LYS 73 -19.921 -3.514 -4.222 1363 HD2 LYS 73 HD2 LYS 73 -21.547 -3.915 -2.429 1364 HD3 LYS 73 HD3 LYS 73 -22.113 -4.642 -3.935 1365 HE2 LYS 73 HE2 LYS 73 -21.438 -6.856 -3.169 1366 HE3 LYS 73 HE3 LYS 73 -20.700 -6.172 -1.721 1367 HZ1 LYS 73 HZ1 LYS 73 -23.591 -6.107 -2.395 1368 HZ2 LYS 73 HZ2 LYS 73 -22.890 -5.429 -1.014 1369 HZ3 LYS 73 HZ3 LYS 73 -22.857 -7.102 -1.242 1370 H LEU 74 H LEU 74 -16.039 -4.080 -5.183 1371 HA LEU 74 HA LEU 74 -16.708 -2.204 -7.327 1372 HB2 LEU 74 HB2 LEU 74 -14.393 -2.494 -5.388 1373 HB3 LEU 74 HB3 LEU 74 -14.127 -1.580 -6.858 1374 HG LEU 74 HG LEU 74 -14.658 -0.110 -4.945 1375 HD11 LEU 74 HD11 LEU 74 -15.223 0.661 -7.197 1376 HD12 LEU 74 HD12 LEU 74 -16.375 1.278 -6.017 1377 HD13 LEU 74 HD13 LEU 74 -16.827 -0.068 -7.068 1378 HD21 LEU 74 HD21 LEU 74 -16.880 -0.049 -3.928 1379 HD22 LEU 74 HD22 LEU 74 -16.132 -1.626 -3.684 1380 HD23 LEU 74 HD23 LEU 74 -17.390 -1.431 -4.904 1381 H GLU 75 H GLU 75 -15.518 -2.021 -9.274 1382 HA GLU 75 HA GLU 75 -14.947 -4.441 -10.645 1383 HB2 GLU 75 HB2 GLU 75 -14.219 -1.594 -11.458 1384 HB3 GLU 75 HB3 GLU 75 -14.292 -2.989 -12.535 1385 HG2 GLU 75 HG2 GLU 75 -16.706 -3.168 -12.212 1386 HG3 GLU 75 HG3 GLU 75 -16.674 -1.852 -11.037 1387 H ASP 76 H ASP 76 -12.995 -2.475 -8.662 1388 HA ASP 76 HA ASP 76 -10.393 -2.990 -9.683 1389 HB2 ASP 76 HB2 ASP 76 -11.225 -2.409 -6.792 1390 HB3 ASP 76 HB3 ASP 76 -9.629 -2.169 -7.493 1391 H VAL 77 H VAL 77 -12.238 -4.402 -6.963 1392 HA VAL 77 HA VAL 77 -10.247 -6.392 -6.373 1393 HB VAL 77 HB VAL 77 -13.037 -5.889 -5.219 1394 HG11 VAL 77 HG11 VAL 77 -12.481 -7.518 -3.432 1395 HG12 VAL 77 HG12 VAL 77 -10.984 -7.934 -4.270 1396 HG13 VAL 77 HG13 VAL 77 -12.541 -8.299 -5.014 1397 HG21 VAL 77 HG21 VAL 77 -11.319 -4.183 -4.671 1398 HG22 VAL 77 HG22 VAL 77 -10.275 -5.449 -4.012 1399 HG23 VAL 77 HG23 VAL 77 -11.820 -5.086 -3.239 1400 H VAL 78 H VAL 78 -10.020 -8.098 -7.624 1401 HA VAL 78 HA VAL 78 -12.121 -9.323 -9.182 1402 HB VAL 78 HB VAL 78 -9.313 -10.397 -8.610 1403 HG11 VAL 78 HG11 VAL 78 -11.200 -11.028 -10.908 1404 HG12 VAL 78 HG12 VAL 78 -10.835 -12.095 -9.548 1405 HG13 VAL 78 HG13 VAL 78 -9.568 -11.666 -10.697 1406 HG21 VAL 78 HG21 VAL 78 -10.185 -8.600 -10.911 1407 HG22 VAL 78 HG22 VAL 78 -8.587 -9.329 -10.714 1408 HG23 VAL 78 HG23 VAL 78 -9.155 -8.126 -9.554 1409 H LYS 79 H LYS 79 -10.200 -10.175 -6.307 1410 HA LYS 79 HA LYS 79 -12.401 -11.724 -5.149 1411 HB2 LYS 79 HB2 LYS 79 -9.605 -12.887 -5.585 1412 HB3 LYS 79 HB3 LYS 79 -10.758 -13.564 -4.441 1413 HG2 LYS 79 HG2 LYS 79 -12.317 -14.051 -6.293 1414 HG3 LYS 79 HG3 LYS 79 -11.162 -13.368 -7.440 1415 HD2 LYS 79 HD2 LYS 79 -9.527 -15.129 -6.867 1416 HD3 LYS 79 HD3 LYS 79 -10.644 -15.795 -5.671 1417 HE2 LYS 79 HE2 LYS 79 -10.701 -17.109 -7.745 1418 HE3 LYS 79 HE3 LYS 79 -12.256 -16.319 -7.480 1419 HZ1 LYS 79 HZ1 LYS 79 -10.121 -15.330 -9.294 1420 HZ2 LYS 79 HZ2 LYS 79 -11.646 -14.632 -9.078 1421 HZ3 LYS 79 HZ3 LYS 79 -11.508 -16.161 -9.782 1422 H VAL 80 H VAL 80 -12.300 -11.787 -2.855 1423 HA VAL 80 HA VAL 80 -10.006 -10.469 -1.515 1424 HB VAL 80 HB VAL 80 -12.098 -8.964 -1.594 1425 HG11 VAL 80 HG11 VAL 80 -13.830 -10.666 -1.234 1426 HG12 VAL 80 HG12 VAL 80 -13.937 -9.381 -0.031 1427 HG13 VAL 80 HG13 VAL 80 -13.237 -10.941 0.406 1428 HG21 VAL 80 HG21 VAL 80 -10.293 -8.547 0.017 1429 HG22 VAL 80 HG22 VAL 80 -11.020 -9.677 1.161 1430 HG23 VAL 80 HG23 VAL 80 -11.859 -8.181 0.744 1431 H GLN 81 H GLN 81 -9.530 -11.314 0.585 1432 HA GLN 81 HA GLN 81 -10.974 -13.565 1.691 1433 HB2 GLN 81 HB2 GLN 81 -9.520 -14.687 0.030 1434 HB3 GLN 81 HB3 GLN 81 -8.102 -13.884 0.694 1435 HG2 GLN 81 HG2 GLN 81 -8.402 -15.115 2.818 1436 HG3 GLN 81 HG3 GLN 81 -9.821 -15.921 2.154 1437 HE21 GLN 81 HE21 GLN 81 -6.330 -15.677 1.998 1438 HE22 GLN 81 HE22 GLN 81 -6.071 -17.157 1.144 1439 H ARG 82 H ARG 82 -10.329 -13.984 3.871 1440 HA ARG 82 HA ARG 82 -9.061 -11.647 5.187 1441 HB2 ARG 82 HB2 ARG 82 -11.275 -13.478 6.241 1442 HB3 ARG 82 HB3 ARG 82 -10.658 -12.024 7.029 1443 HG2 ARG 82 HG2 ARG 82 -11.566 -10.606 5.278 1444 HG3 ARG 82 HG3 ARG 82 -12.015 -12.011 4.312 1445 HD2 ARG 82 HD2 ARG 82 -13.988 -11.093 5.355 1446 HD3 ARG 82 HD3 ARG 82 -13.641 -12.665 6.080 1447 HE ARG 82 HE ARG 82 -12.418 -10.929 7.766 1448 HH11 ARG 82 HH11 ARG 82 -15.716 -11.119 6.529 1449 HH12 ARG 82 HH12 ARG 82 -16.405 -10.397 7.951 1450 HH21 ARG 82 HH21 ARG 82 -13.336 -9.977 9.598 1451 HH22 ARG 82 HH22 ARG 82 -15.053 -9.751 9.687 1452 H ASN 83 H ASN 83 -7.039 -12.317 5.613 1453 HA ASN 83 HA ASN 83 -6.447 -15.031 6.602 1454 HB2 ASN 83 HB2 ASN 83 -4.589 -12.832 5.579 1455 HB3 ASN 83 HB3 ASN 83 -4.057 -14.408 6.150 1456 HD21 ASN 83 HD21 ASN 83 -3.073 -14.779 4.146 1457 HD22 ASN 83 HD22 ASN 83 -3.985 -15.167 2.725 1458 H GLN 84 H GLN 84 -5.046 -15.339 8.429 1459 HA GLN 84 HA GLN 84 -5.381 -13.437 10.623 1460 HB2 GLN 84 HB2 GLN 84 -5.671 -15.886 10.979 1461 HB3 GLN 84 HB3 GLN 84 -3.998 -16.162 10.503 1462 HG2 GLN 84 HG2 GLN 84 -3.306 -14.714 12.476 1463 HG3 GLN 84 HG3 GLN 84 -4.995 -14.725 12.984 1464 HE21 GLN 84 HE21 GLN 84 -2.076 -16.606 12.680 1465 HE22 GLN 84 HE22 GLN 84 -2.620 -17.957 13.616 1466 H SER 85 H SER 85 -3.622 -12.424 11.739 1467 HA SER 85 HA SER 85 -1.333 -11.797 10.085 1468 HB2 SER 85 HB2 SER 85 -2.495 -9.999 11.245 1469 HB3 SER 85 HB3 SER 85 -2.174 -10.744 12.799 1470 HG SER 85 HG SER 85 -0.442 -9.579 12.776 1471 H ASP 86 H ASP 86 0.415 -12.919 10.069 1472 HA ASP 86 HA ASP 86 1.547 -14.158 12.499 1473 HB2 ASP 86 HB2 ASP 86 1.311 -15.445 9.727 1474 HB3 ASP 86 HB3 ASP 86 2.273 -16.104 11.044 1475 HA PRO 87 HA PRO 87 5.111 -11.682 11.279 1476 HB2 PRO 87 HB2 PRO 87 6.723 -13.878 12.596 1477 HB3 PRO 87 HB3 PRO 87 6.746 -12.121 12.886 1478 HG2 PRO 87 HG2 PRO 87 5.551 -13.702 14.632 1479 HG3 PRO 87 HG3 PRO 87 4.789 -12.161 14.169 1480 HD2 PRO 87 HD2 PRO 87 4.108 -14.951 13.235 1481 HD3 PRO 87 HD3 PRO 87 3.024 -13.622 13.711 1482 H THR 88 H THR 88 5.410 -15.210 10.757 1483 HA THR 88 HA THR 88 7.522 -14.995 8.819 1484 HB THR 88 HB THR 88 7.100 -17.441 8.458 1485 HG1 THR 88 HG1 THR 88 5.221 -18.200 9.031 1486 HG21 THR 88 HG21 THR 88 7.754 -18.195 10.718 1487 HG22 THR 88 HG22 THR 88 7.277 -16.636 11.390 1488 HG23 THR 88 HG23 THR 88 8.638 -16.733 10.271 1489 H MET 89 H MET 89 4.100 -14.700 8.632 1490 HA MET 89 HA MET 89 3.541 -15.670 6.050 1491 HB2 MET 89 HB2 MET 89 1.839 -15.118 7.791 1492 HB3 MET 89 HB3 MET 89 2.163 -13.407 7.557 1493 HG2 MET 89 HG2 MET 89 1.138 -15.222 5.363 1494 HG3 MET 89 HG3 MET 89 0.089 -14.303 6.439 1495 HE1 MET 89 HE1 MET 89 -1.045 -13.329 4.177 1496 HE2 MET 89 HE2 MET 89 0.129 -14.205 3.190 1497 HE3 MET 89 HE3 MET 89 -0.124 -12.479 2.936 1498 H PHE 90 H PHE 90 4.414 -12.414 7.194 1499 HA PHE 90 HA PHE 90 4.456 -10.896 4.910 1500 HB2 PHE 90 HB2 PHE 90 6.484 -10.854 7.188 1501 HB3 PHE 90 HB3 PHE 90 6.291 -9.561 6.009 1502 HD1 PHE 90 HD2 PHE 90 4.602 -11.349 8.811 1503 HD2 PHE 90 HD1 PHE 90 4.562 -7.922 6.254 1504 HE1 PHE 90 HE2 PHE 90 2.896 -10.307 10.238 1505 HE2 PHE 90 HE1 PHE 90 2.861 -6.893 7.687 1506 HZ PHE 90 HZ PHE 90 2.025 -8.079 9.678 1507 H ASN 91 H ASN 91 7.108 -12.950 6.105 1508 HA ASN 91 HA ASN 91 8.947 -12.269 4.007 1509 HB2 ASN 91 HB2 ASN 91 9.663 -12.944 6.295 1510 HB3 ASN 91 HB3 ASN 91 9.008 -14.554 6.029 1511 HD21 ASN 91 HD21 ASN 91 11.493 -12.281 4.988 1512 HD22 ASN 91 HD22 ASN 91 12.582 -13.474 4.375 1513 H LYS 92 H LYS 92 6.527 -14.722 4.512 1514 HA LYS 92 HA LYS 92 7.276 -16.735 2.728 1515 HB2 LYS 92 HB2 LYS 92 5.562 -17.027 4.468 1516 HB3 LYS 92 HB3 LYS 92 4.499 -15.893 3.645 1517 HG2 LYS 92 HG2 LYS 92 4.339 -17.458 1.724 1518 HG3 LYS 92 HG3 LYS 92 5.372 -18.600 2.592 1519 HD2 LYS 92 HD2 LYS 92 3.681 -18.763 4.395 1520 HD3 LYS 92 HD3 LYS 92 2.650 -17.615 3.536 1521 HE2 LYS 92 HE2 LYS 92 1.902 -19.937 3.201 1522 HE3 LYS 92 HE3 LYS 92 2.408 -19.211 1.675 1523 HZ1 LYS 92 HZ1 LYS 92 4.500 -20.374 1.839 1524 HZ2 LYS 92 HZ2 LYS 92 3.230 -21.476 1.961 1525 HZ3 LYS 92 HZ3 LYS 92 4.076 -21.016 3.344 1526 H ILE 93 H ILE 93 4.823 -14.132 2.156 1527 HA ILE 93 HA ILE 93 4.605 -14.891 -0.630 1528 HB ILE 93 HB ILE 93 2.917 -13.246 -0.947 1529 HG12 ILE 93 HG12 ILE 93 4.064 -11.353 0.354 1530 HG13 ILE 93 HG13 ILE 93 2.320 -11.445 0.501 1531 HG21 ILE 93 HG21 ILE 93 1.266 -13.839 0.802 1532 HG22 ILE 93 HG22 ILE 93 2.563 -14.495 1.803 1533 HG23 ILE 93 HG23 ILE 93 2.185 -15.241 0.249 1534 HD11 ILE 93 HD11 ILE 93 3.359 -10.884 2.598 1535 HD12 ILE 93 HD12 ILE 93 4.308 -12.367 2.557 1536 HD13 ILE 93 HD13 ILE 93 2.551 -12.446 2.705 1537 H ALA 94 H ALA 94 6.418 -12.524 1.157 1538 HA ALA 94 HA ALA 94 7.125 -10.699 -0.846 1539 HB1 ALA 94 HB1 ALA 94 9.085 -10.195 0.557 1540 HB2 ALA 94 HB2 ALA 94 8.802 -11.670 1.488 1541 HB3 ALA 94 HB3 ALA 94 7.621 -10.359 1.530 1542 H VAL 95 H VAL 95 8.581 -13.856 -0.026 1543 HA VAL 95 HA VAL 95 10.580 -13.646 -2.156 1544 HB VAL 95 HB VAL 95 11.164 -14.708 0.027 1545 HG11 VAL 95 HG11 VAL 95 10.418 -16.990 0.582 1546 HG12 VAL 95 HG12 VAL 95 9.305 -16.958 -0.789 1547 HG13 VAL 95 HG13 VAL 95 9.074 -15.844 0.559 1548 HG21 VAL 95 HG21 VAL 95 12.509 -15.226 -1.961 1549 HG22 VAL 95 HG22 VAL 95 11.454 -16.585 -2.346 1550 HG23 VAL 95 HG23 VAL 95 12.438 -16.619 -0.881 1551 H PHE 96 H PHE 96 7.412 -15.037 -1.680 1552 HA PHE 96 HA PHE 96 7.561 -16.999 -3.789 1553 HB2 PHE 96 HB2 PHE 96 6.097 -17.127 -1.703 1554 HB3 PHE 96 HB3 PHE 96 5.056 -15.911 -2.433 1555 HD1 PHE 96 HD2 PHE 96 6.691 -19.128 -3.558 1556 HD2 PHE 96 HD1 PHE 96 3.081 -16.840 -3.317 1557 HE1 PHE 96 HE2 PHE 96 5.464 -20.932 -4.685 1558 HE2 PHE 96 HE1 PHE 96 1.864 -18.659 -4.442 1559 HZ PHE 96 HZ PHE 96 3.052 -20.705 -5.128 1560 H PHE 97 H PHE 97 6.471 -13.700 -3.486 1561 HA PHE 97 HA PHE 97 5.864 -12.044 -4.850 1562 HB2 PHE 97 HB2 PHE 97 8.184 -12.536 -5.663 1563 HB3 PHE 97 HB3 PHE 97 7.504 -13.545 -6.932 1564 HD1 PHE 97 HD1 PHE 97 7.121 -10.037 -5.593 1565 HD2 PHE 97 HD2 PHE 97 7.293 -12.539 -9.068 1566 HE1 PHE 97 HE1 PHE 97 6.940 -8.058 -7.039 1567 HE2 PHE 97 HE2 PHE 97 7.109 -10.546 -10.503 1568 HZ PHE 97 HZ PHE 97 6.932 -8.309 -9.487 1569 H GLN 98 H GLN 98 3.841 -13.819 -4.577 1570 HA GLN 98 HA GLN 98 2.105 -12.845 -6.566 1571 HB2 GLN 98 HB2 GLN 98 1.257 -15.021 -7.509 1572 HB3 GLN 98 HB3 GLN 98 2.899 -14.628 -8.000 1573 HG2 GLN 98 HG2 GLN 98 3.712 -16.183 -6.178 1574 HG3 GLN 98 HG3 GLN 98 2.043 -16.699 -5.973 1575 HE21 GLN 98 HE21 GLN 98 4.828 -16.788 -8.046 1576 HE22 GLN 98 HE22 GLN 98 4.258 -18.028 -9.102 Start of MODEL 8 1 H1 GLY 1 H1 GLY 1 1.954 -1.278 -18.378 2 H2 GLY 1 H2 GLY 1 0.349 -0.998 -17.935 3 H3 GLY 1 H3 GLY 1 0.708 -1.574 -19.478 4 HA2 GLY 1 HA3 GLY 1 -0.160 -3.341 -18.096 5 HA3 GLY 1 HA2 GLY 1 1.502 -3.650 -18.583 6 H SER 2 H SER 2 0.958 -5.124 -16.584 7 HA SER 2 HA SER 2 2.572 -4.165 -14.417 8 HB2 SER 2 HB2 SER 2 0.793 -4.627 -12.639 9 HB3 SER 2 HB3 SER 2 0.540 -3.166 -13.597 10 HG SER 2 HG SER 2 -0.662 -5.629 -14.318 11 H MET 3 H MET 3 3.808 -5.877 -15.117 12 HA MET 3 HA MET 3 3.129 -8.469 -13.910 13 HB2 MET 3 HB2 MET 3 4.276 -8.132 -16.736 14 HB3 MET 3 HB3 MET 3 4.225 -9.661 -15.866 15 HG2 MET 3 HG2 MET 3 1.838 -9.755 -15.981 16 HG3 MET 3 HG3 MET 3 1.725 -8.079 -16.510 17 HE1 MET 3 HE1 MET 3 3.231 -11.528 -19.203 18 HE2 MET 3 HE2 MET 3 2.579 -11.779 -17.586 19 HE3 MET 3 HE3 MET 3 4.142 -10.984 -17.795 20 H GLN 4 H GLN 4 4.694 -8.750 -12.414 21 HA GLN 4 HA GLN 4 6.788 -6.888 -12.145 22 HB2 GLN 4 HB2 GLN 4 7.521 -8.253 -10.162 23 HB3 GLN 4 HB3 GLN 4 5.851 -7.710 -10.126 24 HG2 GLN 4 HG2 GLN 4 4.983 -9.856 -10.308 25 HG3 GLN 4 HG3 GLN 4 6.390 -10.464 -11.180 26 HE21 GLN 4 HE21 GLN 4 5.121 -9.689 -8.004 27 HE22 GLN 4 HE22 GLN 4 6.300 -10.577 -7.108 28 H ASN 5 H ASN 5 8.008 -7.086 -14.085 29 HA ASN 5 HA ASN 5 9.935 -9.281 -14.265 30 HB2 ASN 5 HB2 ASN 5 9.652 -6.698 -15.867 31 HB3 ASN 5 HB3 ASN 5 10.940 -7.873 -16.128 32 HD21 ASN 5 HD21 ASN 5 10.334 -8.422 -18.203 33 HD22 ASN 5 HD22 ASN 5 8.872 -9.258 -18.582 34 H THR 6 H THR 6 11.240 -9.282 -12.564 35 HA THR 6 HA THR 6 11.911 -7.087 -10.944 36 HB THR 6 HB THR 6 11.897 -9.249 -9.925 37 HG1 THR 6 HG1 THR 6 14.637 -8.493 -10.074 38 HG21 THR 6 HG21 THR 6 13.397 -11.110 -10.486 39 HG22 THR 6 HG22 THR 6 14.113 -10.163 -11.792 40 HG23 THR 6 HG23 THR 6 12.424 -10.661 -11.891 41 H THR 7 H THR 7 12.852 -5.415 -12.030 42 HA THR 7 HA THR 7 15.565 -5.751 -13.178 43 HB THR 7 HB THR 7 14.909 -4.043 -14.939 44 HG1 THR 7 HG1 THR 7 12.238 -4.640 -14.141 45 HG21 THR 7 HG21 THR 7 14.969 -6.444 -15.558 46 HG22 THR 7 HG22 THR 7 13.689 -5.594 -16.428 47 HG23 THR 7 HG23 THR 7 13.289 -6.619 -15.047 48 H HIS 8 H HIS 8 16.338 -3.322 -13.677 49 HA HIS 8 HA HIS 8 16.239 -1.842 -11.142 50 HB2 HIS 8 HB2 HIS 8 18.410 -2.512 -12.436 51 HB3 HIS 8 HB3 HIS 8 17.997 -1.220 -13.557 52 HD1 HIS 8 HD1 HIS 8 19.178 -1.856 -10.059 53 HD2 HIS 8 HD2 HIS 8 18.504 1.391 -12.565 54 HE1 HIS 8 HE1 HIS 8 20.260 0.105 -8.931 55 HE2 HIS 8 HE2 HIS 8 19.904 2.038 -10.498 56 H ASP 9 H ASP 9 14.312 -1.915 -13.737 57 HA ASP 9 HA ASP 9 14.035 0.808 -14.592 58 HB2 ASP 9 HB2 ASP 9 13.267 -1.161 -15.941 59 HB3 ASP 9 HB3 ASP 9 12.025 -1.487 -14.740 60 H ASN 10 H ASN 10 12.498 -1.193 -12.104 61 HA ASN 10 HA ASN 10 10.685 0.905 -11.298 62 HB2 ASN 10 HB2 ASN 10 10.078 -0.575 -9.403 63 HB3 ASN 10 HB3 ASN 10 9.988 -1.422 -10.940 64 HD21 ASN 10 HD21 ASN 10 11.770 -1.132 -7.929 65 HD22 ASN 10 HD22 ASN 10 12.647 -2.610 -8.078 66 H VAL 11 H VAL 11 11.248 2.571 -10.107 67 HA VAL 11 HA VAL 11 13.622 2.636 -8.432 68 HB VAL 11 HB VAL 11 12.999 4.996 -7.953 69 HG11 VAL 11 HG11 VAL 11 12.920 4.342 -10.925 70 HG12 VAL 11 HG12 VAL 11 14.374 4.516 -9.938 71 HG13 VAL 11 HG13 VAL 11 13.334 5.912 -10.226 72 HG21 VAL 11 HG21 VAL 11 10.582 4.533 -9.756 73 HG22 VAL 11 HG22 VAL 11 11.064 6.081 -9.056 74 HG23 VAL 11 HG23 VAL 11 10.522 4.765 -8.008 75 H ILE 12 H ILE 12 13.535 2.956 -6.252 76 HA ILE 12 HA ILE 12 11.298 1.758 -4.796 77 HB ILE 12 HB ILE 12 14.087 2.415 -3.721 78 HG12 ILE 12 HG12 ILE 12 14.442 0.958 -5.664 79 HG13 ILE 12 HG13 ILE 12 14.795 0.082 -4.184 80 HG21 ILE 12 HG21 ILE 12 12.432 1.956 -1.988 81 HG22 ILE 12 HG22 ILE 12 13.636 0.667 -2.049 82 HG23 ILE 12 HG23 ILE 12 12.033 0.409 -2.745 83 HD11 ILE 12 HD11 ILE 12 13.664 -1.312 -5.782 84 HD12 ILE 12 HD12 ILE 12 12.311 -0.184 -5.865 85 HD13 ILE 12 HD13 ILE 12 12.639 -1.066 -4.368 86 H LEU 13 H LEU 13 9.864 3.518 -4.511 87 HA LEU 13 HA LEU 13 10.896 6.129 -3.689 88 HB2 LEU 13 HB2 LEU 13 8.010 5.202 -4.037 89 HB3 LEU 13 HB3 LEU 13 8.513 6.851 -3.689 90 HG LEU 13 HG LEU 13 8.921 5.294 -6.264 91 HD11 LEU 13 HD11 LEU 13 6.715 6.332 -5.940 92 HD12 LEU 13 HD12 LEU 13 7.607 7.089 -7.255 93 HD13 LEU 13 HD13 LEU 13 7.481 7.908 -5.692 94 HD21 LEU 13 HD21 LEU 13 10.121 7.257 -7.152 95 HD22 LEU 13 HD22 LEU 13 11.003 6.501 -5.828 96 HD23 LEU 13 HD23 LEU 13 10.109 7.998 -5.548 97 H GLU 14 H GLU 14 11.783 5.702 -1.682 98 HA GLU 14 HA GLU 14 10.200 4.422 0.403 99 HB2 GLU 14 HB2 GLU 14 12.716 3.982 0.003 100 HB3 GLU 14 HB3 GLU 14 13.016 5.573 0.677 101 HG2 GLU 14 HG2 GLU 14 11.607 3.343 2.185 102 HG3 GLU 14 HG3 GLU 14 13.340 3.618 2.258 103 H LEU 15 H LEU 15 8.644 5.769 1.026 104 HA LEU 15 HA LEU 15 9.478 8.322 2.242 105 HB2 LEU 15 HB2 LEU 15 7.006 8.997 1.948 106 HB3 LEU 15 HB3 LEU 15 8.059 9.034 0.552 107 HG LEU 15 HG LEU 15 7.037 6.646 0.032 108 HD11 LEU 15 HD11 LEU 15 4.695 6.379 0.715 109 HD12 LEU 15 HD12 LEU 15 4.843 7.776 1.786 110 HD13 LEU 15 HD13 LEU 15 5.794 6.323 2.090 111 HD21 LEU 15 HD21 LEU 15 6.778 8.576 -1.406 112 HD22 LEU 15 HD22 LEU 15 5.450 9.183 -0.409 113 HD23 LEU 15 HD23 LEU 15 5.269 7.671 -1.305 114 H THR 16 H THR 16 9.429 8.344 4.324 115 HA THR 16 HA THR 16 8.193 6.188 5.847 116 HB THR 16 HB THR 16 9.828 8.540 6.899 117 HG1 THR 16 HG1 THR 16 10.751 6.805 5.259 118 HG21 THR 16 HG21 THR 16 10.252 7.071 8.829 119 HG22 THR 16 HG22 THR 16 9.280 5.793 8.094 120 HG23 THR 16 HG23 THR 16 8.511 7.299 8.607 121 H VAL 17 H VAL 17 6.081 6.503 6.339 122 HA VAL 17 HA VAL 17 5.088 9.222 6.907 123 HB VAL 17 HB VAL 17 2.902 8.504 6.460 124 HG11 VAL 17 HG11 VAL 17 4.681 6.996 4.503 125 HG12 VAL 17 HG12 VAL 17 4.207 8.701 4.406 126 HG13 VAL 17 HG13 VAL 17 2.987 7.440 4.214 127 HG21 VAL 17 HG21 VAL 17 2.184 6.120 6.183 128 HG22 VAL 17 HG22 VAL 17 2.766 6.480 7.808 129 HG23 VAL 17 HG23 VAL 17 3.800 5.604 6.681 130 H ARG 18 H ARG 18 4.150 9.696 8.869 131 HA ARG 18 HA ARG 18 4.337 7.720 11.057 132 HB2 ARG 18 HB2 ARG 18 3.560 9.731 12.474 133 HB3 ARG 18 HB3 ARG 18 5.181 9.781 11.801 134 HG2 ARG 18 HG2 ARG 18 4.381 11.309 10.006 135 HG3 ARG 18 HG3 ARG 18 2.756 11.251 10.694 136 HD2 ARG 18 HD2 ARG 18 5.226 12.311 12.113 137 HD3 ARG 18 HD3 ARG 18 3.983 13.301 11.345 138 HE ARG 18 HE ARG 18 3.096 11.443 13.421 139 HH11 ARG 18 HH11 ARG 18 3.895 14.788 12.660 140 HH12 ARG 18 HH12 ARG 18 3.091 15.415 14.060 141 HH21 ARG 18 HH21 ARG 18 2.061 12.265 15.231 142 HH22 ARG 18 HH22 ARG 18 2.045 13.972 15.530 143 H ASN 19 H ASN 19 2.640 6.508 11.463 144 HA ASN 19 HA ASN 19 0.549 6.334 9.643 145 HB2 ASN 19 HB2 ASN 19 0.806 4.950 12.348 146 HB3 ASN 19 HB3 ASN 19 -0.341 4.498 11.088 147 HD21 ASN 19 HD21 ASN 19 0.490 2.440 10.724 148 HD22 ASN 19 HD22 ASN 19 2.058 2.143 10.061 149 H HIS 20 H HIS 20 -0.460 8.264 9.610 150 HA HIS 20 HA HIS 20 -2.427 8.929 11.713 151 HB2 HIS 20 HB2 HIS 20 -0.849 10.733 10.919 152 HB3 HIS 20 HB3 HIS 20 -1.465 10.541 9.285 153 HD1 HIS 20 HD1 HIS 20 -2.367 11.935 12.657 154 HD2 HIS 20 HD2 HIS 20 -3.926 11.801 8.804 155 HE1 HIS 20 HE1 HIS 20 -4.263 13.566 12.634 156 HE2 HIS 20 HE2 HIS 20 -5.029 13.630 10.245 157 HA PRO 21 HA PRO 21 -5.702 7.079 9.187 158 HB2 PRO 21 HB2 PRO 21 -7.343 9.518 9.916 159 HB3 PRO 21 HB3 PRO 21 -7.750 7.793 10.063 160 HG2 PRO 21 HG2 PRO 21 -7.085 9.178 12.223 161 HG3 PRO 21 HG3 PRO 21 -6.500 7.510 12.014 162 HD2 PRO 21 HD2 PRO 21 -4.996 10.094 11.650 163 HD3 PRO 21 HD3 PRO 21 -4.439 8.544 12.327 164 H GLY 22 H GLY 22 -4.882 7.258 7.120 165 HA2 GLY 22 HA2 GLY 22 -5.919 7.936 4.981 166 HA3 GLY 22 HA3 GLY 22 -5.775 9.601 5.510 167 H VAL 23 H VAL 23 -2.933 8.299 6.569 168 HA VAL 23 HA VAL 23 -1.294 9.642 4.782 169 HB VAL 23 HB VAL 23 0.629 8.205 5.603 170 HG11 VAL 23 HG11 VAL 23 -0.027 10.223 6.815 171 HG12 VAL 23 HG12 VAL 23 0.542 8.979 7.930 172 HG13 VAL 23 HG13 VAL 23 -1.187 9.295 7.765 173 HG21 VAL 23 HG21 VAL 23 0.261 6.558 7.393 174 HG22 VAL 23 HG22 VAL 23 -0.568 6.066 5.911 175 HG23 VAL 23 HG23 VAL 23 -1.490 6.766 7.243 176 H MET 24 H MET 24 -2.220 6.248 4.670 177 HA MET 24 HA MET 24 -0.718 5.422 2.448 178 HB2 MET 24 HB2 MET 24 -2.349 3.500 2.407 179 HB3 MET 24 HB3 MET 24 -1.607 3.796 3.972 180 HG2 MET 24 HG2 MET 24 -3.652 4.962 4.714 181 HG3 MET 24 HG3 MET 24 -4.403 4.610 3.154 182 HE1 MET 24 HE1 MET 24 -6.461 3.488 4.411 183 HE2 MET 24 HE2 MET 24 -5.695 3.874 5.952 184 HE3 MET 24 HE3 MET 24 -6.275 2.240 5.640 185 H THR 25 H THR 25 -3.935 6.907 2.686 186 HA THR 25 HA THR 25 -4.711 6.498 -0.028 187 HB THR 25 HB THR 25 -5.802 8.678 1.807 188 HG1 THR 25 HG1 THR 25 -7.308 6.727 2.285 189 HG21 THR 25 HG21 THR 25 -7.153 6.930 -0.297 190 HG22 THR 25 HG22 THR 25 -6.714 8.629 -0.512 191 HG23 THR 25 HG23 THR 25 -7.941 8.175 0.674 192 H HIS 26 H HIS 26 -3.040 9.045 1.727 193 HA HIS 26 HA HIS 26 -3.027 11.080 -0.233 194 HB2 HIS 26 HB2 HIS 26 -1.207 10.511 2.147 195 HB3 HIS 26 HB3 HIS 26 -0.942 11.901 1.098 196 HD1 HIS 26 HD1 HIS 26 -1.480 13.674 2.861 197 HD2 HIS 26 HD2 HIS 26 -4.542 10.899 2.428 198 HE1 HIS 26 HE1 HIS 26 -3.444 14.632 4.085 199 HE2 HIS 26 HE2 HIS 26 -5.233 12.890 3.904 200 H VAL 27 H VAL 27 -0.578 8.565 0.566 201 HA VAL 27 HA VAL 27 1.309 9.374 -1.381 202 HB VAL 27 HB VAL 27 2.573 7.373 -0.882 203 HG11 VAL 27 HG11 VAL 27 2.580 9.086 0.865 204 HG12 VAL 27 HG12 VAL 27 2.699 7.491 1.605 205 HG13 VAL 27 HG13 VAL 27 1.165 8.363 1.630 206 HG21 VAL 27 HG21 VAL 27 1.732 5.491 0.487 207 HG22 VAL 27 HG22 VAL 27 0.821 5.646 -1.017 208 HG23 VAL 27 HG23 VAL 27 0.121 6.215 0.498 209 H CYS 28 H CYS 28 -1.146 6.823 -1.429 210 HA CYS 28 HA CYS 28 -0.688 5.802 -3.996 211 HB2 CYS 28 HB2 CYS 28 -3.204 5.882 -2.289 212 HB3 CYS 28 HB3 CYS 28 -3.041 4.918 -3.756 213 HG CYS 28 HG CYS 28 -2.257 4.109 -0.717 214 H GLY 29 H GLY 29 -2.469 8.629 -2.888 215 HA2 GLY 29 HA2 GLY 29 -3.992 9.236 -5.167 216 HA3 GLY 29 HA3 GLY 29 -3.433 10.386 -3.963 217 H LEU 30 H LEU 30 -0.711 10.337 -4.210 218 HA LEU 30 HA LEU 30 -0.363 12.063 -6.446 219 HB2 LEU 30 HB2 LEU 30 1.575 10.957 -4.404 220 HB3 LEU 30 HB3 LEU 30 2.174 11.873 -5.776 221 HG LEU 30 HG LEU 30 2.021 13.394 -3.938 222 HD11 LEU 30 HD11 LEU 30 0.489 15.124 -4.736 223 HD12 LEU 30 HD12 LEU 30 -0.348 13.944 -5.749 224 HD13 LEU 30 HD13 LEU 30 1.336 14.355 -6.074 225 HD21 LEU 30 HD21 LEU 30 0.487 12.151 -2.494 226 HD22 LEU 30 HD22 LEU 30 -0.874 12.597 -3.528 227 HD23 LEU 30 HD23 LEU 30 0.012 13.840 -2.639 228 H PHE 31 H PHE 31 0.572 8.669 -5.954 229 HA PHE 31 HA PHE 31 2.157 8.617 -8.418 230 HB2 PHE 31 HB2 PHE 31 1.339 6.271 -6.661 231 HB3 PHE 31 HB3 PHE 31 2.647 6.303 -7.850 232 HD1 PHE 31 HD2 PHE 31 3.953 8.901 -7.318 233 HD2 PHE 31 HD1 PHE 31 2.426 6.014 -4.547 234 HE1 PHE 31 HE2 PHE 31 5.452 9.771 -5.583 235 HE2 PHE 31 HE1 PHE 31 3.931 6.909 -2.817 236 HZ PHE 31 HZ PHE 31 5.439 8.781 -3.337 237 H ALA 32 H ALA 32 -1.132 7.829 -7.541 238 HA ALA 32 HA ALA 32 -1.807 6.290 -9.866 239 HB1 ALA 32 HB1 ALA 32 -3.119 6.159 -7.794 240 HB2 ALA 32 HB2 ALA 32 -4.142 6.628 -9.154 241 HB3 ALA 32 HB3 ALA 32 -3.611 7.842 -7.979 242 H ARG 33 H ARG 33 -2.020 9.728 -9.009 243 HA ARG 33 HA ARG 33 -3.708 10.501 -11.189 244 HB2 ARG 33 HB2 ARG 33 -3.380 12.783 -10.399 245 HB3 ARG 33 HB3 ARG 33 -3.608 11.718 -9.013 246 HG2 ARG 33 HG2 ARG 33 -1.151 11.679 -8.666 247 HG3 ARG 33 HG3 ARG 33 -0.953 12.800 -10.011 248 HD2 ARG 33 HD2 ARG 33 -2.514 13.388 -7.476 249 HD3 ARG 33 HD3 ARG 33 -0.858 13.911 -7.798 250 HE ARG 33 HE ARG 33 -3.207 14.772 -9.389 251 HH11 ARG 33 HH11 ARG 33 -0.095 15.513 -7.929 252 HH12 ARG 33 HH12 ARG 33 -0.094 17.153 -8.484 253 HH21 ARG 33 HH21 ARG 33 -3.193 16.917 -10.103 254 HH22 ARG 33 HH22 ARG 33 -1.856 17.956 -9.722 255 H ARG 34 H ARG 34 -0.421 9.730 -11.165 256 HA ARG 34 HA ARG 34 0.696 11.606 -12.956 257 HB2 ARG 34 HB2 ARG 34 2.072 10.127 -11.568 258 HB3 ARG 34 HB3 ARG 34 1.383 8.700 -12.333 259 HG2 ARG 34 HG2 ARG 34 2.455 9.360 -14.481 260 HG3 ARG 34 HG3 ARG 34 3.184 10.751 -13.669 261 HD2 ARG 34 HD2 ARG 34 4.725 8.823 -13.892 262 HD3 ARG 34 HD3 ARG 34 4.461 9.305 -12.217 263 HE ARG 34 HE ARG 34 2.670 7.341 -12.438 264 HH11 ARG 34 HH11 ARG 34 6.014 7.407 -13.504 265 HH12 ARG 34 HH12 ARG 34 6.235 5.699 -13.312 266 HH21 ARG 34 HH21 ARG 34 2.960 5.108 -12.212 267 HH22 ARG 34 HH22 ARG 34 4.499 4.396 -12.579 268 H ALA 35 H ALA 35 -0.040 8.192 -13.638 269 HA ALA 35 HA ALA 35 -1.583 8.376 -15.932 270 HB1 ALA 35 HB1 ALA 35 0.283 9.629 -16.962 271 HB2 ALA 35 HB2 ALA 35 0.073 8.073 -17.766 272 HB3 ALA 35 HB3 ALA 35 1.394 8.305 -16.613 273 H PHE 36 H PHE 36 1.393 6.807 -14.817 274 HA PHE 36 HA PHE 36 0.430 4.157 -15.654 275 HB2 PHE 36 HB2 PHE 36 2.680 4.928 -16.426 276 HB3 PHE 36 HB3 PHE 36 3.192 5.076 -14.744 277 HD1 PHE 36 HD2 PHE 36 1.802 2.501 -17.134 278 HD2 PHE 36 HD1 PHE 36 4.363 3.255 -13.787 279 HE1 PHE 36 HE2 PHE 36 2.546 0.151 -17.155 280 HE2 PHE 36 HE1 PHE 36 5.094 0.909 -13.819 281 HZ PHE 36 HZ PHE 36 4.191 -0.644 -15.501 282 H ASN 37 H ASN 37 0.710 2.361 -14.237 283 HA ASN 37 HA ASN 37 -0.369 2.759 -11.610 284 HB2 ASN 37 HB2 ASN 37 0.573 0.203 -12.995 285 HB3 ASN 37 HB3 ASN 37 -0.439 0.273 -11.552 286 HD21 ASN 37 HD21 ASN 37 -0.881 -0.846 -14.290 287 HD22 ASN 37 HD22 ASN 37 -2.387 -0.161 -14.786 288 H VAL 38 H VAL 38 0.523 1.500 -9.730 289 HA VAL 38 HA VAL 38 3.467 1.371 -9.585 290 HB VAL 38 HB VAL 38 1.372 0.978 -7.385 291 HG11 VAL 38 HG11 VAL 38 4.404 1.090 -7.161 292 HG12 VAL 38 HG12 VAL 38 3.395 -0.340 -6.919 293 HG13 VAL 38 HG13 VAL 38 3.278 1.022 -5.801 294 HG21 VAL 38 HG21 VAL 38 3.252 3.323 -7.853 295 HG22 VAL 38 HG22 VAL 38 2.125 3.146 -6.501 296 HG23 VAL 38 HG23 VAL 38 1.509 3.324 -8.146 297 H GLU 39 H GLU 39 4.483 -0.617 -9.541 298 HA GLU 39 HA GLU 39 3.077 -2.929 -10.498 299 HB2 GLU 39 HB2 GLU 39 5.460 -2.316 -11.091 300 HB3 GLU 39 HB3 GLU 39 5.938 -2.709 -9.446 301 HG2 GLU 39 HG2 GLU 39 6.504 -4.536 -10.947 302 HG3 GLU 39 HG3 GLU 39 5.252 -5.057 -9.814 303 H GLY 40 H GLY 40 4.843 -2.149 -7.484 304 HA2 GLY 40 HA2 GLY 40 3.104 -3.989 -5.938 305 HA3 GLY 40 HA3 GLY 40 4.852 -4.218 -5.878 306 H ILE 41 H ILE 41 3.000 -3.512 -3.714 307 HA ILE 41 HA ILE 41 4.140 -0.879 -2.874 308 HB ILE 41 HB ILE 41 1.399 -2.012 -2.122 309 HG12 ILE 41 HG12 ILE 41 2.003 0.397 -3.892 310 HG13 ILE 41 HG13 ILE 41 1.519 -1.183 -4.496 311 HG21 ILE 41 HG21 ILE 41 2.632 0.661 -1.376 312 HG22 ILE 41 HG22 ILE 41 2.363 -0.697 -0.284 313 HG23 ILE 41 HG23 ILE 41 0.986 0.148 -0.993 314 HD11 ILE 41 HD11 ILE 41 -0.145 0.630 -2.751 315 HD12 ILE 41 HD12 ILE 41 -0.624 -0.966 -3.341 316 HD13 ILE 41 HD13 ILE 41 -0.342 0.348 -4.481 317 H LEU 42 H LEU 42 5.137 -0.899 -0.870 318 HA LEU 42 HA LEU 42 4.668 -3.170 0.940 319 HB2 LEU 42 HB2 LEU 42 6.444 -3.943 -0.496 320 HB3 LEU 42 HB3 LEU 42 7.354 -2.457 -0.281 321 HG LEU 42 HG LEU 42 8.019 -3.045 1.936 322 HD11 LEU 42 HD11 LEU 42 5.926 -3.873 2.845 323 HD12 LEU 42 HD12 LEU 42 7.244 -4.988 3.186 324 HD13 LEU 42 HD13 LEU 42 6.077 -5.368 1.912 325 HD21 LEU 42 HD21 LEU 42 9.160 -5.202 1.606 326 HD22 LEU 42 HD22 LEU 42 9.272 -4.151 0.192 327 HD23 LEU 42 HD23 LEU 42 8.143 -5.516 0.193 328 H CYS 43 H CYS 43 3.877 -1.998 2.526 329 HA CYS 43 HA CYS 43 5.383 0.205 3.765 330 HB2 CYS 43 HB2 CYS 43 3.003 0.645 3.412 331 HB3 CYS 43 HB3 CYS 43 2.569 -0.847 4.241 332 HG CYS 43 HG CYS 43 3.331 0.005 6.757 333 H LEU 44 H LEU 44 6.958 -0.739 4.940 334 HA LEU 44 HA LEU 44 6.414 -2.956 6.781 335 HB2 LEU 44 HB2 LEU 44 8.512 -2.929 5.420 336 HB3 LEU 44 HB3 LEU 44 8.981 -1.426 6.199 337 HG LEU 44 HG LEU 44 9.016 -2.671 8.419 338 HD11 LEU 44 HD11 LEU 44 8.691 -5.126 6.664 339 HD12 LEU 44 HD12 LEU 44 7.540 -4.526 7.866 340 HD13 LEU 44 HD13 LEU 44 9.113 -5.132 8.383 341 HD21 LEU 44 HD21 LEU 44 11.089 -2.196 7.226 342 HD22 LEU 44 HD22 LEU 44 10.909 -3.669 6.270 343 HD23 LEU 44 HD23 LEU 44 11.183 -3.772 8.012 344 HA PRO 45 HA PRO 45 5.633 0.428 9.832 345 HB2 PRO 45 HB2 PRO 45 4.634 -1.173 11.845 346 HB3 PRO 45 HB3 PRO 45 3.663 -0.655 10.454 347 HG2 PRO 45 HG2 PRO 45 5.052 -3.278 10.891 348 HG3 PRO 45 HG3 PRO 45 3.422 -2.962 10.251 349 HD2 PRO 45 HD2 PRO 45 5.537 -3.521 8.621 350 HD3 PRO 45 HD3 PRO 45 4.208 -2.451 8.117 351 H ILE 46 H ILE 46 6.844 1.146 11.568 352 HA ILE 46 HA ILE 46 9.121 -0.503 12.471 353 HB ILE 46 HB ILE 46 8.680 2.518 12.497 354 HG12 ILE 46 HG12 ILE 46 10.926 2.483 11.228 355 HG13 ILE 46 HG13 ILE 46 10.732 0.740 11.106 356 HG21 ILE 46 HG21 ILE 46 10.967 1.034 13.832 357 HG22 ILE 46 HG22 ILE 46 9.706 1.963 14.649 358 HG23 ILE 46 HG23 ILE 46 10.876 2.783 13.611 359 HD11 ILE 46 HD11 ILE 46 10.064 1.829 9.071 360 HD12 ILE 46 HD12 ILE 46 8.912 2.833 9.942 361 HD13 ILE 46 HD13 ILE 46 8.661 1.092 9.834 362 H GLN 47 H GLN 47 9.077 -1.324 14.500 363 HA GLN 47 HA GLN 47 6.772 -0.956 16.196 364 HB2 GLN 47 HB2 GLN 47 7.846 -2.640 17.671 365 HB3 GLN 47 HB3 GLN 47 7.774 -3.160 16.000 366 HG2 GLN 47 HG2 GLN 47 10.155 -2.579 15.704 367 HG3 GLN 47 HG3 GLN 47 10.233 -2.081 17.392 368 HE21 GLN 47 HE21 GLN 47 9.965 -4.807 15.218 369 HE22 GLN 47 HE22 GLN 47 10.341 -6.021 16.387 370 H ASP 48 H ASP 48 9.868 0.482 15.997 371 HA ASP 48 HA ASP 48 10.351 1.082 18.725 372 HB2 ASP 48 HB2 ASP 48 12.189 0.972 17.149 373 HB3 ASP 48 HB3 ASP 48 11.481 2.222 16.139 374 H SER 49 H SER 49 8.843 2.879 16.082 375 HA SER 49 HA SER 49 7.601 4.794 17.910 376 HB2 SER 49 HB2 SER 49 9.444 5.706 15.640 377 HB3 SER 49 HB3 SER 49 8.391 6.768 16.576 378 HG SER 49 HG SER 49 10.470 5.173 17.672 379 H ASP 50 H ASP 50 6.041 6.228 16.667 380 HA ASP 50 HA ASP 50 4.435 4.670 14.861 381 HB2 ASP 50 HB2 ASP 50 4.168 7.604 15.675 382 HB3 ASP 50 HB3 ASP 50 2.961 6.694 14.768 383 H LYS 51 H LYS 51 5.999 4.308 13.246 384 HA LYS 51 HA LYS 51 5.968 6.184 11.034 385 HB2 LYS 51 HB2 LYS 51 8.571 5.100 12.227 386 HB3 LYS 51 HB3 LYS 51 8.461 5.739 10.590 387 HG2 LYS 51 HG2 LYS 51 7.802 7.951 11.507 388 HG3 LYS 51 HG3 LYS 51 7.958 7.310 13.144 389 HD2 LYS 51 HD2 LYS 51 10.205 7.527 11.099 390 HD3 LYS 51 HD3 LYS 51 9.957 8.610 12.470 391 HE2 LYS 51 HE2 LYS 51 10.311 6.691 14.023 392 HE3 LYS 51 HE3 LYS 51 10.608 5.641 12.633 393 HZ1 LYS 51 HZ1 LYS 51 12.673 6.391 13.583 394 HZ2 LYS 51 HZ2 LYS 51 12.220 8.006 13.409 395 HZ3 LYS 51 HZ3 LYS 51 12.490 7.060 12.041 396 H SER 52 H SER 52 6.383 5.149 9.040 397 HA SER 52 HA SER 52 6.804 2.262 8.908 398 HB2 SER 52 HB2 SER 52 4.268 3.614 7.861 399 HB3 SER 52 HB3 SER 52 4.782 1.997 7.408 400 HG SER 52 HG SER 52 4.147 2.896 10.008 401 H HIS 53 H HIS 53 8.110 1.876 7.164 402 HA HIS 53 HA HIS 53 8.583 4.016 5.196 403 HB2 HIS 53 HB2 HIS 53 9.876 1.247 5.449 404 HB3 HIS 53 HB3 HIS 53 10.372 2.503 4.325 405 HD1 HIS 53 HD1 HIS 53 11.000 4.864 5.819 406 HD2 HIS 53 HD2 HIS 53 11.621 1.125 7.505 407 HE1 HIS 53 HE1 HIS 53 12.708 5.213 7.610 408 HE2 HIS 53 HE2 HIS 53 13.215 2.903 8.466 409 H ILE 54 H ILE 54 6.995 4.081 3.697 410 HA ILE 54 HA ILE 54 6.025 1.594 2.418 411 HB ILE 54 HB ILE 54 5.047 4.449 1.867 412 HG12 ILE 54 HG12 ILE 54 2.920 3.766 3.068 413 HG13 ILE 54 HG13 ILE 54 3.756 2.331 3.629 414 HG21 ILE 54 HG21 ILE 54 3.877 1.762 1.027 415 HG22 ILE 54 HG22 ILE 54 4.720 2.906 -0.023 416 HG23 ILE 54 HG23 ILE 54 3.167 3.346 0.687 417 HD11 ILE 54 HD11 ILE 54 3.610 4.092 5.305 418 HD12 ILE 54 HD12 ILE 54 4.570 5.146 4.267 419 HD13 ILE 54 HD13 ILE 54 5.273 3.664 4.916 420 H TRP 55 H TRP 55 7.676 0.991 1.017 421 HA TRP 55 HA TRP 55 8.499 3.051 -0.918 422 HB2 TRP 55 HB2 TRP 55 10.308 1.567 -1.652 423 HB3 TRP 55 HB3 TRP 55 10.432 2.051 0.022 424 HD1 TRP 55 HD1 TRP 55 10.140 -1.063 -2.150 425 HE1 TRP 55 HE1 TRP 55 10.650 -3.081 -0.641 426 HE3 TRP 55 HE3 TRP 55 10.027 1.242 2.414 427 HZ2 TRP 55 HZ2 TRP 55 10.973 -3.621 2.096 428 HZ3 TRP 55 HZ3 TRP 55 10.411 -0.127 4.423 429 HH2 TRP 55 HH2 TRP 55 10.883 -2.493 4.269 430 H LEU 56 H LEU 56 7.821 3.094 -2.817 431 HA LEU 56 HA LEU 56 5.887 1.093 -3.751 432 HB2 LEU 56 HB2 LEU 56 6.502 3.914 -4.734 433 HB3 LEU 56 HB3 LEU 56 5.296 2.855 -5.443 434 HG LEU 56 HG LEU 56 4.118 4.424 -4.076 435 HD11 LEU 56 HD11 LEU 56 2.943 3.032 -2.463 436 HD12 LEU 56 HD12 LEU 56 4.228 1.824 -2.530 437 HD13 LEU 56 HD13 LEU 56 3.245 2.151 -3.961 438 HD21 LEU 56 HD21 LEU 56 5.941 3.746 -1.739 439 HD22 LEU 56 HD22 LEU 56 4.543 4.825 -1.683 440 HD23 LEU 56 HD23 LEU 56 5.941 5.250 -2.667 441 H LEU 57 H LEU 57 6.471 -0.315 -5.213 442 HA LEU 57 HA LEU 57 8.960 -0.113 -6.714 443 HB2 LEU 57 HB2 LEU 57 6.838 -2.318 -6.625 444 HB3 LEU 57 HB3 LEU 57 8.340 -2.405 -7.528 445 HG LEU 57 HG LEU 57 8.621 -3.722 -5.539 446 HD11 LEU 57 HD11 LEU 57 10.570 -2.422 -6.219 447 HD12 LEU 57 HD12 LEU 57 10.543 -2.694 -4.479 448 HD13 LEU 57 HD13 LEU 57 10.094 -1.113 -5.131 449 HD21 LEU 57 HD21 LEU 57 6.827 -2.761 -4.155 450 HD22 LEU 57 HD22 LEU 57 7.803 -1.321 -3.871 451 HD23 LEU 57 HD23 LEU 57 8.337 -2.889 -3.251 452 H VAL 58 H VAL 58 8.622 1.489 -8.135 453 HA VAL 58 HA VAL 58 6.568 1.216 -10.240 454 HB VAL 58 HB VAL 58 5.592 2.607 -8.353 455 HG11 VAL 58 HG11 VAL 58 7.753 4.615 -9.005 456 HG12 VAL 58 HG12 VAL 58 7.624 3.671 -7.520 457 HG13 VAL 58 HG13 VAL 58 6.391 4.875 -7.908 458 HG21 VAL 58 HG21 VAL 58 4.754 2.905 -10.633 459 HG22 VAL 58 HG22 VAL 58 6.005 4.110 -10.951 460 HG23 VAL 58 HG23 VAL 58 4.741 4.443 -9.764 461 H ASN 59 H ASN 59 7.249 2.388 -12.197 462 HA ASN 59 HA ASN 59 10.072 3.125 -12.230 463 HB2 ASN 59 HB2 ASN 59 9.730 3.543 -14.671 464 HB3 ASN 59 HB3 ASN 59 9.254 1.935 -14.149 465 HD21 ASN 59 HD21 ASN 59 8.007 1.673 -16.014 466 HD22 ASN 59 HD22 ASN 59 6.469 2.436 -16.212 467 H ASP 60 H ASP 60 10.908 5.186 -12.459 468 HA ASP 60 HA ASP 60 9.413 7.361 -11.420 469 HB2 ASP 60 HB2 ASP 60 11.775 7.050 -10.827 470 HB3 ASP 60 HB3 ASP 60 12.247 7.277 -12.508 471 H ASP 61 H ASP 61 9.113 9.406 -12.397 472 HA ASP 61 HA ASP 61 9.135 9.573 -15.320 473 HB2 ASP 61 HB2 ASP 61 6.926 8.544 -14.523 474 HB3 ASP 61 HB3 ASP 61 6.598 10.052 -13.684 475 H GLN 62 H GLN 62 8.655 11.781 -16.032 476 HA GLN 62 HA GLN 62 10.172 13.749 -14.697 477 HB2 GLN 62 HB2 GLN 62 8.068 14.140 -16.875 478 HB3 GLN 62 HB3 GLN 62 9.347 15.280 -16.455 479 HG2 GLN 62 HG2 GLN 62 11.052 13.668 -17.194 480 HG3 GLN 62 HG3 GLN 62 9.794 12.493 -17.571 481 HE21 GLN 62 HE21 GLN 62 11.813 13.631 -19.346 482 HE22 GLN 62 HE22 GLN 62 10.943 14.390 -20.630 483 H ARG 63 H ARG 63 6.720 13.101 -14.803 484 HA ARG 63 HA ARG 63 5.926 15.479 -13.336 485 HB2 ARG 63 HB2 ARG 63 4.322 13.018 -14.185 486 HB3 ARG 63 HB3 ARG 63 3.634 14.375 -13.309 487 HG2 ARG 63 HG2 ARG 63 3.033 14.651 -15.604 488 HG3 ARG 63 HG3 ARG 63 4.257 15.868 -15.243 489 HD2 ARG 63 HD2 ARG 63 5.963 14.549 -16.374 490 HD3 ARG 63 HD3 ARG 63 4.825 13.219 -16.611 491 HE ARG 63 HE ARG 63 3.796 15.540 -17.818 492 HH11 ARG 63 HH11 ARG 63 6.389 13.205 -18.277 493 HH12 ARG 63 HH12 ARG 63 6.445 13.420 -19.997 494 HH21 ARG 63 HH21 ARG 63 3.860 15.794 -20.062 495 HH22 ARG 63 HH22 ARG 63 5.003 14.892 -21.010 496 H LEU 64 H LEU 64 6.811 12.175 -12.652 497 HA LEU 64 HA LEU 64 5.449 11.719 -10.251 498 HB2 LEU 64 HB2 LEU 64 6.764 10.043 -11.719 499 HB3 LEU 64 HB3 LEU 64 8.198 10.595 -10.874 500 HG LEU 64 HG LEU 64 6.930 9.899 -8.682 501 HD11 LEU 64 HD11 LEU 64 5.259 8.166 -8.899 502 HD12 LEU 64 HD12 LEU 64 5.342 8.254 -10.662 503 HD13 LEU 64 HD13 LEU 64 4.704 9.622 -9.731 504 HD21 LEU 64 HD21 LEU 64 7.699 7.609 -8.831 505 HD22 LEU 64 HD22 LEU 64 8.877 8.686 -9.582 506 HD23 LEU 64 HD23 LEU 64 7.793 7.721 -10.590 507 H GLU 65 H GLU 65 8.767 12.953 -10.829 508 HA GLU 65 HA GLU 65 9.642 13.296 -8.207 509 HB2 GLU 65 HB2 GLU 65 10.327 15.012 -10.636 510 HB3 GLU 65 HB3 GLU 65 11.249 14.961 -9.134 511 HG2 GLU 65 HG2 GLU 65 11.669 12.517 -9.569 512 HG3 GLU 65 HG3 GLU 65 10.910 12.719 -11.149 513 H GLN 66 H GLN 66 7.696 15.446 -10.205 514 HA GLN 66 HA GLN 66 7.841 17.796 -8.616 515 HB2 GLN 66 HB2 GLN 66 5.660 16.915 -10.559 516 HB3 GLN 66 HB3 GLN 66 5.912 18.558 -9.979 517 HG2 GLN 66 HG2 GLN 66 7.826 16.963 -11.709 518 HG3 GLN 66 HG3 GLN 66 6.777 18.266 -12.257 519 HE21 GLN 66 HE21 GLN 66 7.291 20.398 -11.696 520 HE22 GLN 66 HE22 GLN 66 8.856 20.856 -11.129 521 H MET 67 H MET 67 5.480 15.174 -8.830 522 HA MET 67 HA MET 67 3.719 16.127 -6.786 523 HB2 MET 67 HB2 MET 67 4.004 13.409 -8.117 524 HB3 MET 67 HB3 MET 67 2.703 13.827 -7.005 525 HG2 MET 67 HG2 MET 67 1.939 15.589 -8.536 526 HG3 MET 67 HG3 MET 67 3.256 15.208 -9.646 527 HE1 MET 67 HE1 MET 67 3.340 12.017 -9.435 528 HE2 MET 67 HE2 MET 67 3.436 12.876 -10.976 529 HE3 MET 67 HE3 MET 67 2.275 11.571 -10.760 530 H ILE 68 H ILE 68 6.562 14.097 -6.828 531 HA ILE 68 HA ILE 68 6.382 13.015 -4.198 532 HB ILE 68 HB ILE 68 8.670 13.388 -6.162 533 HG12 ILE 68 HG12 ILE 68 7.347 10.857 -5.075 534 HG13 ILE 68 HG13 ILE 68 6.930 11.622 -6.602 535 HG21 ILE 68 HG21 ILE 68 8.919 12.118 -3.423 536 HG22 ILE 68 HG22 ILE 68 9.710 13.601 -3.957 537 HG23 ILE 68 HG23 ILE 68 10.144 12.059 -4.689 538 HD11 ILE 68 HD11 ILE 68 9.579 10.373 -5.899 539 HD12 ILE 68 HD12 ILE 68 9.208 11.196 -7.418 540 HD13 ILE 68 HD13 ILE 68 8.345 9.723 -6.978 541 H SER 69 H SER 69 7.756 16.000 -5.534 542 HA SER 69 HA SER 69 8.931 16.994 -3.125 543 HB2 SER 69 HB2 SER 69 7.994 18.511 -5.596 544 HB3 SER 69 HB3 SER 69 9.081 19.134 -4.352 545 HG SER 69 HG SER 69 9.720 16.749 -5.702 546 H GLN 70 H GLN 70 5.737 17.143 -4.561 547 HA GLN 70 HA GLN 70 4.682 19.218 -2.858 548 HB2 GLN 70 HB2 GLN 70 3.925 18.777 -5.204 549 HB3 GLN 70 HB3 GLN 70 3.277 17.224 -4.709 550 HG2 GLN 70 HG2 GLN 70 2.266 19.786 -3.461 551 HG3 GLN 70 HG3 GLN 70 1.669 19.258 -5.026 552 HE21 GLN 70 HE21 GLN 70 1.586 18.710 -1.612 553 HE22 GLN 70 HE22 GLN 70 0.366 17.494 -1.617 554 H ILE 71 H ILE 71 4.507 15.633 -2.932 555 HA ILE 71 HA ILE 71 2.618 15.387 -0.806 556 HB ILE 71 HB ILE 71 3.021 13.565 -2.471 557 HG12 ILE 71 HG12 ILE 71 3.302 12.863 0.478 558 HG13 ILE 71 HG13 ILE 71 1.823 12.925 -0.475 559 HG21 ILE 71 HG21 ILE 71 5.594 13.023 -0.972 560 HG22 ILE 71 HG22 ILE 71 5.477 13.722 -2.583 561 HG23 ILE 71 HG23 ILE 71 4.935 12.069 -2.306 562 HD11 ILE 71 HD11 ILE 71 2.421 10.659 -0.042 563 HD12 ILE 71 HD12 ILE 71 4.038 10.900 -0.697 564 HD13 ILE 71 HD13 ILE 71 2.629 10.977 -1.762 565 H ASP 72 H ASP 72 6.124 15.604 -0.957 566 HA ASP 72 HA ASP 72 6.920 14.966 1.618 567 HB2 ASP 72 HB2 ASP 72 8.554 15.436 -0.078 568 HB3 ASP 72 HB3 ASP 72 7.919 17.035 -0.361 569 H LYS 73 H LYS 73 5.262 17.833 0.464 570 HA LYS 73 HA LYS 73 5.729 19.570 2.676 571 HB2 LYS 73 HB2 LYS 73 3.448 19.694 0.667 572 HB3 LYS 73 HB3 LYS 73 4.065 21.018 1.631 573 HG2 LYS 73 HG2 LYS 73 5.999 19.682 -0.236 574 HG3 LYS 73 HG3 LYS 73 4.715 20.641 -0.963 575 HD2 LYS 73 HD2 LYS 73 6.711 21.993 -0.698 576 HD3 LYS 73 HD3 LYS 73 5.427 22.602 0.347 577 HE2 LYS 73 HE2 LYS 73 7.552 22.650 1.499 578 HE3 LYS 73 HE3 LYS 73 6.508 21.482 2.284 579 HZ1 LYS 73 HZ1 LYS 73 8.757 20.661 2.051 580 HZ2 LYS 73 HZ2 LYS 73 8.693 20.865 0.379 581 HZ3 LYS 73 HZ3 LYS 73 7.703 19.720 1.130 582 H LEU 74 H LEU 74 3.641 16.897 2.278 583 HA LEU 74 HA LEU 74 1.536 17.682 4.085 584 HB2 LEU 74 HB2 LEU 74 2.311 15.092 2.705 585 HB3 LEU 74 HB3 LEU 74 1.125 15.065 3.993 586 HG LEU 74 HG LEU 74 0.034 15.088 1.796 587 HD11 LEU 74 HD11 LEU 74 -1.150 16.110 3.673 588 HD12 LEU 74 HD12 LEU 74 -1.541 16.927 2.162 589 HD13 LEU 74 HD13 LEU 74 -0.424 17.680 3.305 590 HD21 LEU 74 HD21 LEU 74 0.155 17.023 0.290 591 HD22 LEU 74 HD22 LEU 74 1.738 16.284 0.500 592 HD23 LEU 74 HD23 LEU 74 1.353 17.784 1.341 593 H GLU 75 H GLU 75 1.198 16.966 6.160 594 HA GLU 75 HA GLU 75 3.414 16.609 7.923 595 HB2 GLU 75 HB2 GLU 75 0.449 16.164 8.484 596 HB3 GLU 75 HB3 GLU 75 1.708 16.435 9.691 597 HG2 GLU 75 HG2 GLU 75 2.058 18.711 8.856 598 HG3 GLU 75 HG3 GLU 75 0.869 18.449 7.580 599 H ASP 76 H ASP 76 1.361 14.476 6.199 600 HA ASP 76 HA ASP 76 1.536 12.015 7.476 601 HB2 ASP 76 HB2 ASP 76 1.634 12.521 4.452 602 HB3 ASP 76 HB3 ASP 76 1.094 11.045 5.247 603 H VAL 77 H VAL 77 3.722 13.514 5.115 604 HA VAL 77 HA VAL 77 5.572 11.281 5.095 605 HB VAL 77 HB VAL 77 5.442 13.905 3.549 606 HG11 VAL 77 HG11 VAL 77 7.551 11.739 3.242 607 HG12 VAL 77 HG12 VAL 77 7.834 13.359 3.877 608 HG13 VAL 77 HG13 VAL 77 7.356 13.144 2.192 609 HG21 VAL 77 HG21 VAL 77 3.812 12.149 2.912 610 HG22 VAL 77 HG22 VAL 77 5.140 11.010 2.656 611 HG23 VAL 77 HG23 VAL 77 4.986 12.435 1.624 612 H VAL 78 H VAL 78 6.873 11.127 6.777 613 HA VAL 78 HA VAL 78 8.241 13.302 8.106 614 HB VAL 78 HB VAL 78 8.911 10.324 8.294 615 HG11 VAL 78 HG11 VAL 78 9.316 12.569 10.304 616 HG12 VAL 78 HG12 VAL 78 10.578 11.827 9.314 617 HG13 VAL 78 HG13 VAL 78 9.747 10.872 10.545 618 HG21 VAL 78 HG21 VAL 78 7.359 10.150 10.201 619 HG22 VAL 78 HG22 VAL 78 6.505 10.563 8.713 620 HG23 VAL 78 HG23 VAL 78 6.819 11.809 9.924 621 H LYS 79 H LYS 79 9.153 10.620 5.939 622 HA LYS 79 HA LYS 79 11.493 12.142 4.907 623 HB2 LYS 79 HB2 LYS 79 11.250 9.122 5.276 624 HB3 LYS 79 HB3 LYS 79 12.545 9.913 4.384 625 HG2 LYS 79 HG2 LYS 79 13.345 10.977 6.447 626 HG3 LYS 79 HG3 LYS 79 12.016 10.237 7.352 627 HD2 LYS 79 HD2 LYS 79 14.121 8.945 7.627 628 HD3 LYS 79 HD3 LYS 79 12.877 7.984 6.823 629 HE2 LYS 79 HE2 LYS 79 13.996 8.724 4.603 630 HE3 LYS 79 HE3 LYS 79 15.342 9.268 5.603 631 HZ1 LYS 79 HZ1 LYS 79 15.772 7.076 4.816 632 HZ2 LYS 79 HZ2 LYS 79 14.285 6.510 5.373 633 HZ3 LYS 79 HZ3 LYS 79 15.480 6.975 6.476 634 H VAL 80 H VAL 80 11.818 11.998 2.665 635 HA VAL 80 HA VAL 80 10.315 10.053 1.099 636 HB VAL 80 HB VAL 80 8.908 12.197 1.085 637 HG11 VAL 80 HG11 VAL 80 10.619 13.898 1.081 638 HG12 VAL 80 HG12 VAL 80 9.628 14.068 -0.369 639 HG13 VAL 80 HG13 VAL 80 11.228 13.342 -0.477 640 HG21 VAL 80 HG21 VAL 80 8.642 10.497 -0.659 641 HG22 VAL 80 HG22 VAL 80 9.944 11.228 -1.602 642 HG23 VAL 80 HG23 VAL 80 8.439 12.114 -1.343 643 H GLN 81 H GLN 81 11.680 9.119 -0.321 644 HA GLN 81 HA GLN 81 13.919 10.555 -1.516 645 HB2 GLN 81 HB2 GLN 81 14.857 9.782 0.646 646 HB3 GLN 81 HB3 GLN 81 14.363 8.131 0.291 647 HG2 GLN 81 HG2 GLN 81 16.783 8.467 -0.064 648 HG3 GLN 81 HG3 GLN 81 15.962 8.001 -1.552 649 HE21 GLN 81 HE21 GLN 81 17.557 10.620 0.144 650 HE22 GLN 81 HE22 GLN 81 17.812 11.623 -1.239 651 H ARG 82 H ARG 82 14.418 9.771 -3.499 652 HA ARG 82 HA ARG 82 12.932 7.417 -4.494 653 HB2 ARG 82 HB2 ARG 82 14.323 9.551 -6.180 654 HB3 ARG 82 HB3 ARG 82 13.210 8.303 -6.734 655 HG2 ARG 82 HG2 ARG 82 11.762 10.085 -6.699 656 HG3 ARG 82 HG3 ARG 82 11.531 9.512 -5.050 657 HD2 ARG 82 HD2 ARG 82 11.780 11.818 -4.783 658 HD3 ARG 82 HD3 ARG 82 13.402 11.220 -4.433 659 HE ARG 82 HE ARG 82 13.623 11.745 -7.035 660 HH11 ARG 82 HH11 ARG 82 12.297 13.723 -4.441 661 HH12 ARG 82 HH12 ARG 82 12.682 15.223 -5.226 662 HH21 ARG 82 HH21 ARG 82 14.003 13.737 -8.113 663 HH22 ARG 82 HH22 ARG 82 13.642 15.226 -7.296 664 H ASN 83 H ASN 83 14.291 5.819 -3.787 665 HA ASN 83 HA ASN 83 17.157 5.822 -4.431 666 HB2 ASN 83 HB2 ASN 83 15.493 3.643 -3.056 667 HB3 ASN 83 HB3 ASN 83 17.251 3.767 -3.086 668 HD21 ASN 83 HD21 ASN 83 14.304 5.083 -1.744 669 HD22 ASN 83 HD22 ASN 83 15.043 5.948 -0.442 670 H GLN 84 H GLN 84 17.573 5.284 -6.573 671 HA GLN 84 HA GLN 84 15.723 3.556 -8.034 672 HB2 GLN 84 HB2 GLN 84 16.617 5.524 -9.182 673 HB3 GLN 84 HB3 GLN 84 18.269 4.984 -8.908 674 HG2 GLN 84 HG2 GLN 84 17.884 3.047 -10.391 675 HG3 GLN 84 HG3 GLN 84 16.220 3.562 -10.636 676 HE21 GLN 84 HE21 GLN 84 18.902 5.866 -10.541 677 HE22 GLN 84 HE22 GLN 84 18.832 6.263 -12.223 678 H SER 85 H SER 85 15.898 1.551 -7.279 679 HA SER 85 HA SER 85 18.383 0.027 -7.565 680 HB2 SER 85 HB2 SER 85 18.396 0.868 -5.214 681 HB3 SER 85 HB3 SER 85 16.797 0.176 -4.950 682 HG SER 85 HG SER 85 17.645 -1.822 -4.925 683 H ASP 86 H ASP 86 17.897 -2.319 -7.094 684 HA ASP 86 HA ASP 86 15.718 -3.242 -8.707 685 HB2 ASP 86 HB2 ASP 86 17.760 -4.739 -6.996 686 HB3 ASP 86 HB3 ASP 86 16.639 -5.517 -8.109 687 HA PRO 87 HA PRO 87 12.627 -3.933 -5.522 688 HB2 PRO 87 HB2 PRO 87 11.143 -5.973 -6.529 689 HB3 PRO 87 HB3 PRO 87 11.220 -4.390 -7.339 690 HG2 PRO 87 HG2 PRO 87 12.727 -6.910 -7.988 691 HG3 PRO 87 HG3 PRO 87 11.884 -5.792 -9.085 692 HD2 PRO 87 HD2 PRO 87 14.592 -5.711 -8.688 693 HD3 PRO 87 HD3 PRO 87 13.634 -4.274 -9.109 694 H THR 88 H THR 88 15.248 -5.664 -5.367 695 HA THR 88 HA THR 88 14.616 -8.060 -3.960 696 HB THR 88 HB THR 88 17.048 -7.966 -3.290 697 HG1 THR 88 HG1 THR 88 18.271 -6.182 -4.209 698 HG21 THR 88 HG21 THR 88 17.975 -8.094 -5.597 699 HG22 THR 88 HG22 THR 88 16.491 -7.366 -6.227 700 HG23 THR 88 HG23 THR 88 16.444 -8.960 -5.464 701 H MET 89 H MET 89 14.165 -4.881 -3.048 702 HA MET 89 HA MET 89 14.862 -4.670 -0.380 703 HB2 MET 89 HB2 MET 89 12.450 -3.508 -1.837 704 HB3 MET 89 HB3 MET 89 13.009 -2.975 -0.255 705 HG2 MET 89 HG2 MET 89 14.624 -2.809 -2.810 706 HG3 MET 89 HG3 MET 89 13.737 -1.475 -2.067 707 HE1 MET 89 HE1 MET 89 15.838 0.112 -1.939 708 HE2 MET 89 HE2 MET 89 16.765 -1.113 -2.806 709 HE3 MET 89 HE3 MET 89 17.413 -0.397 -1.332 710 H PHE 90 H PHE 90 12.089 -6.386 -1.794 711 HA PHE 90 HA PHE 90 10.554 -6.915 0.488 712 HB2 PHE 90 HB2 PHE 90 11.036 -8.606 -2.003 713 HB3 PHE 90 HB3 PHE 90 9.929 -9.113 -0.737 714 HD1 PHE 90 HD2 PHE 90 10.531 -6.464 -3.298 715 HD2 PHE 90 HD1 PHE 90 7.696 -8.247 -0.630 716 HE1 PHE 90 HE2 PHE 90 8.716 -5.213 -4.374 717 HE2 PHE 90 HE1 PHE 90 5.883 -6.986 -1.720 718 HZ PHE 90 HZ PHE 90 6.393 -5.468 -3.591 719 H ASN 91 H ASN 91 13.167 -8.899 -0.931 720 HA ASN 91 HA ASN 91 13.283 -10.840 1.149 721 HB2 ASN 91 HB2 ASN 91 14.041 -11.354 -1.136 722 HB3 ASN 91 HB3 ASN 91 15.303 -10.129 -1.036 723 HD21 ASN 91 HD21 ASN 91 17.184 -10.582 0.134 724 HD22 ASN 91 HD22 ASN 91 17.578 -12.166 0.705 725 H LYS 92 H LYS 92 15.006 -7.860 0.452 726 HA LYS 92 HA LYS 92 17.194 -8.039 2.154 727 HB2 LYS 92 HB2 LYS 92 16.884 -6.296 0.389 728 HB3 LYS 92 HB3 LYS 92 15.660 -5.520 1.387 729 HG2 LYS 92 HG2 LYS 92 17.786 -4.328 1.559 730 HG3 LYS 92 HG3 LYS 92 17.356 -5.046 3.116 731 HD2 LYS 92 HD2 LYS 92 18.920 -6.936 2.655 732 HD3 LYS 92 HD3 LYS 92 19.369 -6.181 1.123 733 HE2 LYS 92 HE2 LYS 92 20.276 -4.241 2.356 734 HE3 LYS 92 HE3 LYS 92 19.807 -4.992 3.885 735 HZ1 LYS 92 HZ1 LYS 92 22.124 -5.376 3.450 736 HZ2 LYS 92 HZ2 LYS 92 21.787 -6.053 1.940 737 HZ3 LYS 92 HZ3 LYS 92 21.298 -6.846 3.348 738 H ILE 93 H ILE 93 13.949 -6.710 2.860 739 HA ILE 93 HA ILE 93 14.601 -6.249 5.648 740 HB ILE 93 HB ILE 93 12.305 -5.531 5.970 741 HG12 ILE 93 HG12 ILE 93 11.713 -6.437 3.106 742 HG13 ILE 93 HG13 ILE 93 11.201 -7.298 4.543 743 HG21 ILE 93 HG21 ILE 93 13.876 -3.937 4.942 744 HG22 ILE 93 HG22 ILE 93 12.229 -3.656 4.379 745 HG23 ILE 93 HG23 ILE 93 13.387 -4.476 3.332 746 HD11 ILE 93 HD11 ILE 93 10.306 -4.531 3.764 747 HD12 ILE 93 HD12 ILE 93 9.785 -5.433 5.187 748 HD13 ILE 93 HD13 ILE 93 9.391 -6.024 3.574 749 H ALA 94 H ALA 94 13.129 -8.836 3.760 750 HA ALA 94 HA ALA 94 11.458 -9.985 5.704 751 HB1 ALA 94 HB1 ALA 94 11.391 -11.951 4.240 752 HB2 ALA 94 HB2 ALA 94 12.802 -11.360 3.354 753 HB3 ALA 94 HB3 ALA 94 11.284 -10.460 3.300 754 H VAL 95 H VAL 95 14.892 -10.542 5.018 755 HA VAL 95 HA VAL 95 15.263 -12.768 6.737 756 HB VAL 95 HB VAL 95 17.682 -12.250 6.662 757 HG11 VAL 95 HG11 VAL 95 16.665 -13.483 4.798 758 HG12 VAL 95 HG12 VAL 95 17.986 -12.465 4.221 759 HG13 VAL 95 HG13 VAL 95 16.312 -11.966 3.962 760 HG21 VAL 95 HG21 VAL 95 17.600 -9.792 6.803 761 HG22 VAL 95 HG22 VAL 95 16.884 -9.704 5.192 762 HG23 VAL 95 HG23 VAL 95 18.535 -10.298 5.392 763 H PHE 96 H PHE 96 15.328 -9.285 7.356 764 HA PHE 96 HA PHE 96 15.975 -9.573 10.188 765 HB2 PHE 96 HB2 PHE 96 15.109 -7.133 8.558 766 HB3 PHE 96 HB3 PHE 96 15.595 -7.088 10.247 767 HD1 PHE 96 HD2 PHE 96 17.999 -7.796 10.849 768 HD2 PHE 96 HD1 PHE 96 16.766 -6.954 6.834 769 HE1 PHE 96 HE2 PHE 96 20.346 -7.477 10.183 770 HE2 PHE 96 HE1 PHE 96 19.121 -6.637 6.180 771 HZ PHE 96 HZ PHE 96 20.912 -6.900 7.855 772 H PHE 97 H PHE 97 13.213 -9.589 8.169 773 HA PHE 97 HA PHE 97 11.014 -9.643 8.349 774 HB2 PHE 97 HB2 PHE 97 11.458 -9.834 11.347 775 HB3 PHE 97 HB3 PHE 97 9.861 -9.882 10.604 776 HD1 PHE 97 HD2 PHE 97 9.381 -11.711 8.870 777 HD2 PHE 97 HD1 PHE 97 12.765 -11.832 11.485 778 HE1 PHE 97 HE2 PHE 97 9.627 -14.116 8.457 779 HE2 PHE 97 HE1 PHE 97 13.002 -14.241 11.057 780 HZ PHE 97 HZ PHE 97 11.432 -15.384 9.542 781 H GLN 98 H GLN 98 12.522 -7.300 10.556 782 HA GLN 98 HA GLN 98 11.007 -5.151 9.321 783 HB2 GLN 98 HB2 GLN 98 9.633 -6.054 11.290 784 HB3 GLN 98 HB3 GLN 98 10.916 -5.511 12.356 785 HG2 GLN 98 HG2 GLN 98 9.521 -3.589 10.491 786 HG3 GLN 98 HG3 GLN 98 8.805 -4.035 12.031 787 HE21 GLN 98 HE21 GLN 98 11.388 -2.264 10.477 788 HE22 GLN 98 HE22 GLN 98 11.899 -1.402 11.884 789 H1 GLY 1 H1 GLY 1 0.187 5.723 16.795 790 H2 GLY 1 H2 GLY 1 -0.101 4.711 18.120 791 H3 GLY 1 H3 GLY 1 -0.952 6.159 17.965 792 HA2 GLY 1 HA3 GLY 1 -2.316 4.238 17.377 793 HA3 GLY 1 HA2 GLY 1 -2.118 5.382 16.060 794 H SER 2 H SER 2 0.657 3.427 16.804 795 HA SER 2 HA SER 2 -0.090 1.231 15.032 796 HB2 SER 2 HB2 SER 2 2.045 1.574 13.654 797 HB3 SER 2 HB3 SER 2 0.762 2.748 13.364 798 HG SER 2 HG SER 2 3.072 3.103 14.970 799 H MET 3 H MET 3 0.305 -0.410 16.345 800 HA MET 3 HA MET 3 2.994 -0.843 17.473 801 HB2 MET 3 HB2 MET 3 0.398 -1.287 19.033 802 HB3 MET 3 HB3 MET 3 1.991 -1.817 19.554 803 HG2 MET 3 HG2 MET 3 2.707 0.564 19.646 804 HG3 MET 3 HG3 MET 3 1.061 1.038 19.228 805 HE1 MET 3 HE1 MET 3 3.360 -0.667 21.942 806 HE2 MET 3 HE2 MET 3 2.187 -1.946 21.611 807 HE3 MET 3 HE3 MET 3 2.175 -1.116 23.166 808 H GLN 4 H GLN 4 3.498 -2.396 16.042 809 HA GLN 4 HA GLN 4 1.731 -4.249 14.866 810 HB2 GLN 4 HB2 GLN 4 3.910 -5.374 14.069 811 HB3 GLN 4 HB3 GLN 4 3.623 -3.709 13.577 812 HG2 GLN 4 HG2 GLN 4 5.163 -2.909 15.317 813 HG3 GLN 4 HG3 GLN 4 5.430 -4.566 15.851 814 HE21 GLN 4 HE21 GLN 4 6.039 -2.251 13.326 815 HE22 GLN 4 HE22 GLN 4 7.310 -3.129 12.552 816 H ASN 5 H ASN 5 0.619 -5.347 16.458 817 HA ASN 5 HA ASN 5 1.910 -7.298 18.175 818 HB2 ASN 5 HB2 ASN 5 -0.988 -6.719 17.456 819 HB3 ASN 5 HB3 ASN 5 -0.557 -8.170 18.355 820 HD21 ASN 5 HD21 ASN 5 -1.832 -7.391 20.099 821 HD22 ASN 5 HD22 ASN 5 -1.246 -6.158 21.156 822 H THR 6 H THR 6 2.758 -9.108 17.403 823 HA THR 6 HA THR 6 2.110 -10.110 14.737 824 HB THR 6 HB THR 6 4.114 -11.608 15.144 825 HG1 THR 6 HG1 THR 6 3.979 -11.559 17.479 826 HG21 THR 6 HG21 THR 6 5.809 -9.824 14.958 827 HG22 THR 6 HG22 THR 6 4.634 -8.635 15.525 828 HG23 THR 6 HG23 THR 6 4.390 -9.445 13.975 829 H THR 7 H THR 7 -0.050 -10.468 16.184 830 HA THR 7 HA THR 7 -0.257 -13.350 16.683 831 HB THR 7 HB THR 7 -1.691 -12.784 18.781 832 HG1 THR 7 HG1 THR 7 -1.766 -10.772 19.371 833 HG21 THR 7 HG21 THR 7 0.526 -13.873 19.010 834 HG22 THR 7 HG22 THR 7 0.236 -12.725 20.317 835 HG23 THR 7 HG23 THR 7 1.309 -12.289 18.985 836 H HIS 8 H HIS 8 -2.750 -13.773 17.254 837 HA HIS 8 HA HIS 8 -4.370 -12.895 15.088 838 HB2 HIS 8 HB2 HIS 8 -5.168 -14.278 17.682 839 HB3 HIS 8 HB3 HIS 8 -6.253 -14.025 16.320 840 HD1 HIS 8 HD1 HIS 8 -3.838 -16.375 17.671 841 HD2 HIS 8 HD2 HIS 8 -5.386 -15.500 13.917 842 HE1 HIS 8 HE1 HIS 8 -3.415 -18.415 16.277 843 HE2 HIS 8 HE2 HIS 8 -4.542 -17.930 14.082 844 H ASP 9 H ASP 9 -4.351 -10.655 15.134 845 HA ASP 9 HA ASP 9 -6.327 -9.334 16.822 846 HB2 ASP 9 HB2 ASP 9 -4.167 -9.130 18.133 847 HB3 ASP 9 HB3 ASP 9 -3.421 -8.341 16.746 848 H ASN 10 H ASN 10 -3.664 -8.840 14.514 849 HA ASN 10 HA ASN 10 -5.239 -7.093 12.827 850 HB2 ASN 10 HB2 ASN 10 -3.304 -7.179 11.273 851 HB3 ASN 10 HB3 ASN 10 -2.798 -6.769 12.907 852 HD21 ASN 10 HD21 ASN 10 -2.708 -9.239 10.412 853 HD22 ASN 10 HD22 ASN 10 -1.476 -10.201 11.139 854 H VAL 11 H VAL 11 -6.660 -7.786 11.382 855 HA VAL 11 HA VAL 11 -6.735 -10.513 10.372 856 HB VAL 11 HB VAL 11 -8.778 -9.810 9.139 857 HG11 VAL 11 HG11 VAL 11 -8.828 -8.999 12.072 858 HG12 VAL 11 HG12 VAL 11 -9.007 -10.640 11.443 859 HG13 VAL 11 HG13 VAL 11 -10.239 -9.426 11.096 860 HG21 VAL 11 HG21 VAL 11 -8.351 -7.052 10.378 861 HG22 VAL 11 HG22 VAL 11 -9.755 -7.550 9.429 862 HG23 VAL 11 HG23 VAL 11 -8.164 -7.445 8.668 863 H ILE 12 H ILE 12 -6.521 -11.000 8.220 864 HA ILE 12 HA ILE 12 -4.668 -9.359 6.652 865 HB ILE 12 HB ILE 12 -5.501 -12.252 6.121 866 HG12 ILE 12 HG12 ILE 12 -4.610 -12.213 8.406 867 HG13 ILE 12 HG13 ILE 12 -3.484 -13.036 7.337 868 HG21 ILE 12 HG21 ILE 12 -4.395 -11.176 4.231 869 HG22 ILE 12 HG22 ILE 12 -3.367 -12.439 4.908 870 HG23 ILE 12 HG23 ILE 12 -3.020 -10.743 5.251 871 HD11 ILE 12 HD11 ILE 12 -2.331 -11.659 8.935 872 HD12 ILE 12 HD12 ILE 12 -3.213 -10.230 8.399 873 HD13 ILE 12 HD13 ILE 12 -2.076 -11.029 7.309 874 H LEU 13 H LEU 13 -6.041 -7.884 5.568 875 HA LEU 13 HA LEU 13 -8.533 -8.831 4.361 876 HB2 LEU 13 HB2 LEU 13 -7.251 -6.064 4.252 877 HB3 LEU 13 HB3 LEU 13 -8.835 -6.476 3.609 878 HG LEU 13 HG LEU 13 -8.002 -6.330 6.525 879 HD11 LEU 13 HD11 LEU 13 -8.563 -4.200 5.431 880 HD12 LEU 13 HD12 LEU 13 -9.738 -4.628 6.669 881 HD13 LEU 13 HD13 LEU 13 -10.143 -4.846 4.962 882 HD21 LEU 13 HD21 LEU 13 -10.286 -7.045 7.118 883 HD22 LEU 13 HD22 LEU 13 -9.403 -8.321 6.288 884 HD23 LEU 13 HD23 LEU 13 -10.627 -7.390 5.419 885 H GLU 14 H GLU 14 -7.803 -10.270 2.797 886 HA GLU 14 HA GLU 14 -5.842 -9.424 0.817 887 HB2 GLU 14 HB2 GLU 14 -5.899 -11.772 1.873 888 HB3 GLU 14 HB3 GLU 14 -7.334 -12.086 0.919 889 HG2 GLU 14 HG2 GLU 14 -4.621 -11.372 -0.261 890 HG3 GLU 14 HG3 GLU 14 -5.194 -13.018 -0.033 891 H LEU 15 H LEU 15 -6.736 -7.966 -0.484 892 HA LEU 15 HA LEU 15 -9.038 -8.837 -2.106 893 HB2 LEU 15 HB2 LEU 15 -9.343 -6.322 -2.589 894 HB3 LEU 15 HB3 LEU 15 -9.877 -6.954 -1.047 895 HG LEU 15 HG LEU 15 -7.537 -6.077 -0.164 896 HD11 LEU 15 HD11 LEU 15 -6.739 -4.041 -1.280 897 HD12 LEU 15 HD12 LEU 15 -7.856 -4.328 -2.616 898 HD13 LEU 15 HD13 LEU 15 -6.549 -5.467 -2.295 899 HD21 LEU 15 HD21 LEU 15 -9.677 -5.251 0.609 900 HD22 LEU 15 HD22 LEU 15 -9.813 -4.187 -0.796 901 HD23 LEU 15 HD23 LEU 15 -8.540 -3.920 0.401 902 H THR 16 H THR 16 -8.571 -9.339 -4.071 903 HA THR 16 HA THR 16 -5.942 -8.787 -5.206 904 HB THR 16 HB THR 16 -8.228 -10.394 -6.434 905 HG1 THR 16 HG1 THR 16 -7.105 -11.015 -4.222 906 HG21 THR 16 HG21 THR 16 -6.446 -11.466 -7.750 907 HG22 THR 16 HG22 THR 16 -5.229 -10.468 -6.950 908 HG23 THR 16 HG23 THR 16 -6.427 -9.715 -8.007 909 H VAL 17 H VAL 17 -5.787 -6.851 -6.233 910 HA VAL 17 HA VAL 17 -8.097 -5.792 -7.730 911 HB VAL 17 HB VAL 17 -7.157 -3.649 -7.635 912 HG11 VAL 17 HG11 VAL 17 -6.452 -4.976 -4.988 913 HG12 VAL 17 HG12 VAL 17 -8.032 -4.329 -5.460 914 HG13 VAL 17 HG13 VAL 17 -6.669 -3.231 -5.233 915 HG21 VAL 17 HG21 VAL 17 -4.817 -3.119 -6.913 916 HG22 VAL 17 HG22 VAL 17 -4.882 -4.078 -8.391 917 HG23 VAL 17 HG23 VAL 17 -4.470 -4.851 -6.861 918 H ARG 18 H ARG 18 -7.947 -5.386 -9.907 919 HA ARG 18 HA ARG 18 -5.578 -6.347 -11.386 920 HB2 ARG 18 HB2 ARG 18 -7.051 -5.774 -13.425 921 HB3 ARG 18 HB3 ARG 18 -7.530 -7.144 -12.432 922 HG2 ARG 18 HG2 ARG 18 -9.268 -5.735 -11.343 923 HG3 ARG 18 HG3 ARG 18 -8.781 -4.366 -12.345 924 HD2 ARG 18 HD2 ARG 18 -9.879 -7.000 -13.388 925 HD3 ARG 18 HD3 ARG 18 -10.806 -5.507 -13.209 926 HE ARG 18 HE ARG 18 -8.402 -5.408 -14.876 927 HH11 ARG 18 HH11 ARG 18 -11.919 -5.586 -14.838 928 HH12 ARG 18 HH12 ARG 18 -12.072 -5.113 -16.501 929 HH21 ARG 18 HH21 ARG 18 -8.612 -4.828 -17.029 930 HH22 ARG 18 HH22 ARG 18 -10.186 -4.685 -17.745 931 H ASN 19 H ASN 19 -4.045 -4.941 -11.864 932 HA ASN 19 HA ASN 19 -3.988 -2.457 -10.596 933 HB2 ASN 19 HB2 ASN 19 -2.052 -3.558 -12.667 934 HB3 ASN 19 HB3 ASN 19 -1.742 -2.165 -11.634 935 HD21 ASN 19 HD21 ASN 19 0.027 -3.082 -10.577 936 HD22 ASN 19 HD22 ASN 19 -0.098 -4.430 -9.503 937 H HIS 20 H HIS 20 -5.648 -1.302 -11.325 938 HA HIS 20 HA HIS 20 -5.464 0.082 -13.930 939 HB2 HIS 20 HB2 HIS 20 -7.640 -1.037 -13.345 940 HB3 HIS 20 HB3 HIS 20 -7.740 -0.075 -11.875 941 HD1 HIS 20 HD1 HIS 20 -8.130 0.149 -15.597 942 HD2 HIS 20 HD2 HIS 20 -8.652 2.563 -12.258 943 HE1 HIS 20 HE1 HIS 20 -9.415 2.141 -16.400 944 HE2 HIS 20 HE2 HIS 20 -9.913 3.450 -14.321 945 HA PRO 21 HA PRO 21 -3.752 3.704 -11.829 946 HB2 PRO 21 HB2 PRO 21 -5.640 5.321 -13.546 947 HB3 PRO 21 HB3 PRO 21 -3.887 5.497 -13.317 948 HG2 PRO 21 HG2 PRO 21 -4.828 4.427 -15.554 949 HG3 PRO 21 HG3 PRO 21 -3.370 3.758 -14.784 950 HD2 PRO 21 HD2 PRO 21 -6.174 2.666 -14.775 951 HD3 PRO 21 HD3 PRO 21 -4.622 1.799 -14.862 952 H GLY 22 H GLY 22 -4.533 3.509 -9.750 953 HA2 GLY 22 HA2 GLY 22 -5.515 5.143 -8.177 954 HA3 GLY 22 HA3 GLY 22 -7.009 5.017 -9.082 955 H VAL 23 H VAL 23 -5.975 1.890 -9.055 956 HA VAL 23 HA VAL 23 -7.947 0.937 -7.356 957 HB VAL 23 HB VAL 23 -6.698 -1.268 -7.289 958 HG11 VAL 23 HG11 VAL 23 -8.244 -0.769 -9.114 959 HG12 VAL 23 HG12 VAL 23 -6.888 -1.739 -9.691 960 HG13 VAL 23 HG13 VAL 23 -6.945 -0.007 -10.031 961 HG21 VAL 23 HG21 VAL 23 -4.645 -1.563 -8.611 962 HG22 VAL 23 HG22 VAL 23 -4.378 -0.419 -7.291 963 HG23 VAL 23 HG23 VAL 23 -4.589 0.174 -8.940 964 H MET 24 H MET 24 -4.560 1.512 -6.565 965 HA MET 24 HA MET 24 -4.541 0.603 -3.909 966 HB2 MET 24 HB2 MET 24 -2.435 1.981 -3.742 967 HB3 MET 24 HB3 MET 24 -2.478 0.870 -5.105 968 HG2 MET 24 HG2 MET 24 -3.081 2.740 -6.600 969 HG3 MET 24 HG3 MET 24 -2.978 3.851 -5.230 970 HE1 MET 24 HE1 MET 24 -1.268 5.362 -6.591 971 HE2 MET 24 HE2 MET 24 -1.412 4.248 -7.952 972 HE3 MET 24 HE3 MET 24 0.180 4.723 -7.363 973 H THR 25 H THR 25 -5.377 3.764 -5.300 974 HA THR 25 HA THR 25 -5.503 5.213 -2.843 975 HB THR 25 HB THR 25 -6.997 5.964 -5.395 976 HG1 THR 25 HG1 THR 25 -4.660 7.091 -5.518 977 HG21 THR 25 HG21 THR 25 -5.585 7.657 -3.286 978 HG22 THR 25 HG22 THR 25 -7.335 7.460 -3.433 979 HG23 THR 25 HG23 THR 25 -6.425 8.274 -4.709 980 H HIS 26 H HIS 26 -7.787 3.369 -4.775 981 HA HIS 26 HA HIS 26 -10.204 4.076 -3.482 982 HB2 HIS 26 HB2 HIS 26 -9.411 1.636 -5.131 983 HB3 HIS 26 HB3 HIS 26 -11.028 1.815 -4.454 984 HD1 HIS 26 HD1 HIS 26 -12.230 2.018 -6.694 985 HD2 HIS 26 HD2 HIS 26 -9.162 4.791 -6.288 986 HE1 HIS 26 HE1 HIS 26 -12.528 3.638 -8.578 987 HE2 HIS 26 HE2 HIS 26 -10.565 5.192 -8.409 988 H VAL 27 H VAL 27 -7.976 1.286 -2.996 989 HA VAL 27 HA VAL 27 -9.527 0.068 -0.964 990 HB VAL 27 HB VAL 27 -7.712 -1.474 -0.581 991 HG11 VAL 27 HG11 VAL 27 -8.946 -1.797 -2.661 992 HG12 VAL 27 HG12 VAL 27 -7.264 -2.270 -2.898 993 HG13 VAL 27 HG13 VAL 27 -7.844 -0.726 -3.526 994 HG21 VAL 27 HG21 VAL 27 -5.444 -1.233 -1.554 995 HG22 VAL 27 HG22 VAL 27 -5.796 0.055 -0.400 996 HG23 VAL 27 HG23 VAL 27 -5.865 0.381 -2.132 997 H CYS 28 H CYS 28 -6.702 2.204 -0.798 998 HA CYS 28 HA CYS 28 -6.402 2.296 1.987 999 HB2 CYS 28 HB2 CYS 28 -5.660 4.292 -0.181 1000 HB3 CYS 28 HB3 CYS 28 -5.114 4.410 1.491 1001 HG CYS 28 HG CYS 28 -3.758 2.778 -0.971 1002 H GLY 29 H GLY 29 -8.569 4.017 -0.188 1003 HA2 GLY 29 HA2 GLY 29 -9.423 6.137 1.435 1004 HA3 GLY 29 HA3 GLY 29 -10.353 5.392 0.145 1005 H LEU 30 H LEU 30 -10.756 2.825 1.096 1006 HA LEU 30 HA LEU 30 -13.030 3.299 2.742 1007 HB2 LEU 30 HB2 LEU 30 -11.813 0.789 1.580 1008 HB3 LEU 30 HB3 LEU 30 -13.106 0.658 2.757 1009 HG LEU 30 HG LEU 30 -14.117 0.466 0.602 1010 HD11 LEU 30 HD11 LEU 30 -15.711 2.316 0.519 1011 HD12 LEU 30 HD12 LEU 30 -14.681 3.280 1.581 1012 HD13 LEU 30 HD13 LEU 30 -15.424 1.794 2.175 1013 HD21 LEU 30 HD21 LEU 30 -12.348 1.415 -0.789 1014 HD22 LEU 30 HD22 LEU 30 -12.777 3.044 -0.258 1015 HD23 LEU 30 HD23 LEU 30 -13.920 2.090 -1.209 1016 H PHE 31 H PHE 31 -9.832 1.966 3.452 1017 HA PHE 31 HA PHE 31 -10.598 1.061 6.117 1018 HB2 PHE 31 HB2 PHE 31 -7.818 1.157 4.877 1019 HB3 PHE 31 HB3 PHE 31 -8.319 0.214 6.284 1020 HD1 PHE 31 HD2 PHE 31 -10.911 -0.924 5.393 1021 HD2 PHE 31 HD1 PHE 31 -7.244 -0.480 3.225 1022 HE1 PHE 31 HE2 PHE 31 -11.578 -2.741 3.886 1023 HE2 PHE 31 HE1 PHE 31 -7.937 -2.298 1.717 1024 HZ PHE 31 HZ PHE 31 -10.098 -3.426 2.051 1025 H ALA 32 H ALA 32 -9.089 3.891 4.721 1026 HA ALA 32 HA ALA 32 -8.042 5.014 7.141 1027 HB1 ALA 32 HB1 ALA 32 -7.200 5.673 4.930 1028 HB2 ALA 32 HB2 ALA 32 -7.788 7.076 5.825 1029 HB3 ALA 32 HB3 ALA 32 -8.768 6.376 4.527 1030 H ARG 33 H ARG 33 -11.092 5.350 5.350 1031 HA ARG 33 HA ARG 33 -12.072 7.617 6.795 1032 HB2 ARG 33 HB2 ARG 33 -14.136 7.317 5.536 1033 HB3 ARG 33 HB3 ARG 33 -12.758 7.073 4.463 1034 HG2 ARG 33 HG2 ARG 33 -13.027 4.616 4.715 1035 HG3 ARG 33 HG3 ARG 33 -14.451 4.886 5.718 1036 HD2 ARG 33 HD2 ARG 33 -14.167 5.773 2.831 1037 HD3 ARG 33 HD3 ARG 33 -15.008 4.316 3.369 1038 HE ARG 33 HE ARG 33 -15.839 7.073 4.091 1039 HH11 ARG 33 HH11 ARG 33 -16.714 3.775 3.213 1040 HH12 ARG 33 HH12 ARG 33 -18.420 4.084 3.286 1041 HH21 ARG 33 HH21 ARG 33 -18.068 7.459 4.171 1042 HH22 ARG 33 HH22 ARG 33 -19.185 6.170 3.828 1043 H ARG 34 H ARG 34 -11.842 4.389 7.742 1044 HA ARG 34 HA ARG 34 -14.237 3.982 9.182 1045 HB2 ARG 34 HB2 ARG 34 -12.735 2.136 8.591 1046 HB3 ARG 34 HB3 ARG 34 -11.426 2.853 9.526 1047 HG2 ARG 34 HG2 ARG 34 -12.732 2.480 11.608 1048 HG3 ARG 34 HG3 ARG 34 -14.009 1.715 10.652 1049 HD2 ARG 34 HD2 ARG 34 -12.485 0.092 11.737 1050 HD3 ARG 34 HD3 ARG 34 -12.513 -0.061 9.981 1051 HE ARG 34 HE ARG 34 -10.375 1.491 10.271 1052 HH11 ARG 34 HH11 ARG 34 -11.261 -1.360 12.118 1053 HH12 ARG 34 HH12 ARG 34 -9.621 -1.794 12.462 1054 HH21 ARG 34 HH21 ARG 34 -8.237 0.930 10.734 1055 HH22 ARG 34 HH22 ARG 34 -7.902 -0.490 11.675 1056 H ALA 35 H ALA 35 -10.989 4.526 10.548 1057 HA ALA 35 HA ALA 35 -11.455 6.628 12.294 1058 HB1 ALA 35 HB1 ALA 35 -13.210 5.234 13.347 1059 HB2 ALA 35 HB2 ALA 35 -11.875 5.498 14.471 1060 HB3 ALA 35 HB3 ALA 35 -12.038 3.948 13.635 1061 H PHE 36 H PHE 36 -10.193 3.321 12.363 1062 HA PHE 36 HA PHE 36 -7.684 4.198 13.625 1063 HB2 PHE 36 HB2 PHE 36 -8.975 2.336 14.685 1064 HB3 PHE 36 HB3 PHE 36 -8.826 1.397 13.199 1065 HD1 PHE 36 HD2 PHE 36 -6.665 3.115 15.780 1066 HD2 PHE 36 HD1 PHE 36 -7.043 -0.156 13.040 1067 HE1 PHE 36 HE2 PHE 36 -4.532 2.178 16.585 1068 HE2 PHE 36 HE1 PHE 36 -4.913 -1.078 13.850 1069 HZ PHE 36 HZ PHE 36 -3.656 0.084 15.622 1070 H ASN 37 H ASN 37 -5.686 3.365 12.843 1071 HA ASN 37 HA ASN 37 -5.293 3.750 10.027 1072 HB2 ASN 37 HB2 ASN 37 -3.304 2.963 12.213 1073 HB3 ASN 37 HB3 ASN 37 -2.882 3.563 10.609 1074 HD21 ASN 37 HD21 ASN 37 -2.381 4.594 13.380 1075 HD22 ASN 37 HD22 ASN 37 -2.896 6.242 13.307 1076 H VAL 38 H VAL 38 -3.789 2.271 8.807 1077 HA VAL 38 HA VAL 38 -4.102 -0.603 9.398 1078 HB VAL 38 HB VAL 38 -2.891 0.773 6.944 1079 HG11 VAL 38 HG11 VAL 38 -3.435 -2.182 7.428 1080 HG12 VAL 38 HG12 VAL 38 -1.843 -1.422 7.338 1081 HG13 VAL 38 HG13 VAL 38 -2.875 -1.478 5.906 1082 HG21 VAL 38 HG21 VAL 38 -5.546 -0.683 7.221 1083 HG22 VAL 38 HG22 VAL 38 -4.891 0.014 5.733 1084 HG23 VAL 38 HG23 VAL 38 -5.341 1.066 7.077 1085 H GLU 39 H GLU 39 -2.348 -1.774 10.103 1086 HA GLU 39 HA GLU 39 -0.126 -0.400 11.282 1087 HB2 GLU 39 HB2 GLU 39 -1.246 -2.479 12.210 1088 HB3 GLU 39 HB3 GLU 39 -0.534 -3.404 10.893 1089 HG2 GLU 39 HG2 GLU 39 0.763 -3.714 12.918 1090 HG3 GLU 39 HG3 GLU 39 1.723 -2.827 11.731 1091 H GLY 40 H GLY 40 -0.446 -2.812 8.664 1092 HA2 GLY 40 HA2 GLY 40 1.953 -1.752 7.301 1093 HA3 GLY 40 HA3 GLY 40 1.900 -3.463 7.725 1094 H ILE 41 H ILE 41 2.022 -2.219 5.078 1095 HA ILE 41 HA ILE 41 -0.498 -3.275 3.866 1096 HB ILE 41 HB ILE 41 1.202 -0.956 2.817 1097 HG12 ILE 41 HG12 ILE 41 -1.615 -0.822 3.981 1098 HG13 ILE 41 HG13 ILE 41 -0.158 -0.355 4.851 1099 HG21 ILE 41 HG21 ILE 41 -1.395 -2.074 1.710 1100 HG22 ILE 41 HG22 ILE 41 0.202 -2.244 0.980 1101 HG23 ILE 41 HG23 ILE 41 -0.547 -0.650 1.099 1102 HD11 ILE 41 HD11 ILE 41 -1.219 0.950 2.347 1103 HD12 ILE 41 HD12 ILE 41 0.257 1.405 3.205 1104 HD13 ILE 41 HD13 ILE 41 -1.311 1.578 3.992 1105 H LEU 42 H LEU 42 -0.176 -4.702 2.171 1106 HA LEU 42 HA LEU 42 2.492 -5.025 1.017 1107 HB2 LEU 42 HB2 LEU 42 2.595 -6.412 2.992 1108 HB3 LEU 42 HB3 LEU 42 1.069 -7.188 2.606 1109 HG LEU 42 HG LEU 42 2.036 -8.486 0.850 1110 HD11 LEU 42 HD11 LEU 42 3.384 -6.811 -0.273 1111 HD12 LEU 42 HD12 LEU 42 4.315 -8.278 0.013 1112 HD13 LEU 42 HD13 LEU 42 4.579 -6.854 1.031 1113 HD21 LEU 42 HD21 LEU 42 3.840 -9.706 1.999 1114 HD22 LEU 42 HD22 LEU 42 2.487 -9.327 3.068 1115 HD23 LEU 42 HD23 LEU 42 3.983 -8.383 3.165 1116 H CYS 43 H CYS 43 1.858 -4.575 -0.960 1117 HA CYS 43 HA CYS 43 -0.223 -6.130 -2.344 1118 HB2 CYS 43 HB2 CYS 43 -0.334 -3.710 -2.688 1119 HB3 CYS 43 HB3 CYS 43 1.359 -3.667 -3.173 1120 HG CYS 43 HG CYS 43 0.993 -4.981 -5.574 1121 H LEU 44 H LEU 44 0.685 -8.046 -2.842 1122 HA LEU 44 HA LEU 44 3.332 -8.241 -4.091 1123 HB2 LEU 44 HB2 LEU 44 2.649 -9.878 -2.335 1124 HB3 LEU 44 HB3 LEU 44 1.309 -10.389 -3.349 1125 HG LEU 44 HG LEU 44 3.007 -11.154 -5.084 1126 HD11 LEU 44 HD11 LEU 44 5.014 -10.610 -2.873 1127 HD12 LEU 44 HD12 LEU 44 4.908 -9.779 -4.431 1128 HD13 LEU 44 HD13 LEU 44 5.344 -11.487 -4.374 1129 HD21 LEU 44 HD21 LEU 44 1.935 -12.760 -3.600 1130 HD22 LEU 44 HD22 LEU 44 3.155 -12.472 -2.357 1131 HD23 LEU 44 HD23 LEU 44 3.611 -13.222 -3.889 1132 HA PRO 45 HA PRO 45 0.933 -7.985 -8.030 1133 HB2 PRO 45 HB2 PRO 45 3.095 -7.665 -9.709 1134 HB3 PRO 45 HB3 PRO 45 2.408 -6.336 -8.755 1135 HG2 PRO 45 HG2 PRO 45 4.823 -8.011 -8.162 1136 HG3 PRO 45 HG3 PRO 45 4.612 -6.253 -8.006 1137 HD2 PRO 45 HD2 PRO 45 4.450 -7.935 -5.865 1138 HD3 PRO 45 HD3 PRO 45 3.505 -6.428 -5.965 1139 H ILE 46 H ILE 46 0.402 -9.554 -9.468 1140 HA ILE 46 HA ILE 46 1.840 -12.121 -9.409 1141 HB ILE 46 HB ILE 46 -0.976 -11.400 -10.344 1142 HG12 ILE 46 HG12 ILE 46 -1.612 -13.208 -8.618 1143 HG13 ILE 46 HG13 ILE 46 0.063 -13.173 -8.087 1144 HG21 ILE 46 HG21 ILE 46 0.395 -14.094 -10.655 1145 HG22 ILE 46 HG22 ILE 46 -0.104 -13.018 -11.963 1146 HG23 ILE 46 HG23 ILE 46 -1.320 -13.784 -10.939 1147 HD11 ILE 46 HD11 ILE 46 -1.329 -11.872 -6.626 1148 HD12 ILE 46 HD12 ILE 46 -1.905 -10.901 -7.975 1149 HD13 ILE 46 HD13 ILE 46 -0.216 -10.807 -7.477 1150 H GLN 47 H GLN 47 3.093 -12.689 -11.083 1151 HA GLN 47 HA GLN 47 3.526 -10.889 -13.294 1152 HB2 GLN 47 HB2 GLN 47 5.298 -12.489 -13.966 1153 HB3 GLN 47 HB3 GLN 47 5.418 -12.020 -12.280 1154 HG2 GLN 47 HG2 GLN 47 4.418 -14.159 -11.589 1155 HG3 GLN 47 HG3 GLN 47 4.267 -14.636 -13.281 1156 HE21 GLN 47 HE21 GLN 47 6.509 -14.113 -10.639 1157 HE22 GLN 47 HE22 GLN 47 7.853 -14.907 -11.374 1158 H ASP 48 H ASP 48 1.601 -13.690 -12.787 1159 HA ASP 48 HA ASP 48 1.575 -14.799 -15.396 1160 HB2 ASP 48 HB2 ASP 48 0.980 -16.164 -13.478 1161 HB3 ASP 48 HB3 ASP 48 -0.323 -15.078 -13.028 1162 H SER 49 H SER 49 -0.524 -12.468 -13.752 1163 HA SER 49 HA SER 49 -1.723 -11.575 -16.266 1164 HB2 SER 49 HB2 SER 49 -3.434 -12.646 -13.957 1165 HB3 SER 49 HB3 SER 49 -4.060 -11.779 -15.359 1166 HG SER 49 HG SER 49 -2.608 -14.219 -15.496 1167 H ASP 50 H ASP 50 -3.102 -9.569 -15.862 1168 HA ASP 50 HA ASP 50 -1.782 -7.726 -14.100 1169 HB2 ASP 50 HB2 ASP 50 -4.348 -7.389 -15.725 1170 HB3 ASP 50 HB3 ASP 50 -3.518 -6.084 -14.881 1171 H LYS 51 H LYS 51 -2.078 -8.856 -12.145 1172 HA LYS 51 HA LYS 51 -4.392 -8.058 -10.578 1173 HB2 LYS 51 HB2 LYS 51 -3.482 -10.974 -10.811 1174 HB3 LYS 51 HB3 LYS 51 -4.459 -10.381 -9.471 1175 HG2 LYS 51 HG2 LYS 51 -6.258 -9.764 -11.075 1176 HG3 LYS 51 HG3 LYS 51 -5.288 -10.425 -12.394 1177 HD2 LYS 51 HD2 LYS 51 -6.344 -11.998 -10.010 1178 HD3 LYS 51 HD3 LYS 51 -7.027 -12.017 -11.636 1179 HE2 LYS 51 HE2 LYS 51 -4.879 -12.959 -12.497 1180 HE3 LYS 51 HE3 LYS 51 -4.258 -13.003 -10.842 1181 HZ1 LYS 51 HZ1 LYS 51 -5.116 -15.148 -11.501 1182 HZ2 LYS 51 HZ2 LYS 51 -6.626 -14.481 -11.858 1183 HZ3 LYS 51 HZ3 LYS 51 -6.074 -14.507 -10.264 1184 H SER 52 H SER 52 -3.914 -8.016 -8.345 1185 HA SER 52 HA SER 52 -1.245 -8.667 -7.362 1186 HB2 SER 52 HB2 SER 52 -2.375 -5.824 -7.342 1187 HB3 SER 52 HB3 SER 52 -1.012 -6.349 -6.366 1188 HG SER 52 HG SER 52 -1.164 -6.350 -9.187 1189 H HIS 53 H HIS 53 -1.494 -9.489 -5.321 1190 HA HIS 53 HA HIS 53 -4.079 -9.205 -3.937 1191 HB2 HIS 53 HB2 HIS 53 -1.573 -10.790 -3.150 1192 HB3 HIS 53 HB3 HIS 53 -3.112 -10.839 -2.304 1193 HD1 HIS 53 HD1 HIS 53 -5.144 -11.585 -4.195 1194 HD2 HIS 53 HD2 HIS 53 -1.289 -13.047 -4.599 1195 HE1 HIS 53 HE1 HIS 53 -5.362 -13.681 -5.541 1196 HE2 HIS 53 HE2 HIS 53 -3.034 -14.631 -5.625 1197 H ILE 54 H ILE 54 -4.226 -7.273 -2.916 1198 HA ILE 54 HA ILE 54 -1.976 -6.250 -1.288 1199 HB ILE 54 HB ILE 54 -4.681 -4.880 -1.763 1200 HG12 ILE 54 HG12 ILE 54 -3.396 -3.234 -3.205 1201 HG13 ILE 54 HG13 ILE 54 -2.029 -4.330 -3.151 1202 HG21 ILE 54 HG21 ILE 54 -2.106 -3.799 -0.542 1203 HG22 ILE 54 HG22 ILE 54 -3.581 -4.215 0.336 1204 HG23 ILE 54 HG23 ILE 54 -3.588 -2.873 -0.808 1205 HD11 ILE 54 HD11 ILE 54 -3.305 -4.462 -5.222 1206 HD12 ILE 54 HD12 ILE 54 -4.715 -5.000 -4.307 1207 HD13 ILE 54 HD13 ILE 54 -3.260 -5.994 -4.356 1208 H TRP 55 H TRP 55 -1.994 -7.505 0.578 1209 HA TRP 55 HA TRP 55 -4.558 -7.584 2.027 1210 HB2 TRP 55 HB2 TRP 55 -3.598 -9.280 3.519 1211 HB3 TRP 55 HB3 TRP 55 -3.692 -9.786 1.851 1212 HD1 TRP 55 HD1 TRP 55 -1.159 -9.225 4.641 1213 HE1 TRP 55 HE1 TRP 55 1.043 -10.315 3.885 1214 HE3 TRP 55 HE3 TRP 55 -2.298 -10.128 -0.263 1215 HZ2 TRP 55 HZ2 TRP 55 2.141 -11.416 1.547 1216 HZ3 TRP 55 HZ3 TRP 55 -0.582 -11.169 -1.688 1217 HH2 TRP 55 HH2 TRP 55 1.577 -11.808 -0.804 1218 H LEU 56 H LEU 56 -4.918 -6.401 3.636 1219 HA LEU 56 HA LEU 56 -2.895 -4.510 4.574 1220 HB2 LEU 56 HB2 LEU 56 -5.927 -4.553 4.895 1221 HB3 LEU 56 HB3 LEU 56 -4.878 -3.311 5.555 1222 HG LEU 56 HG LEU 56 -5.875 -2.397 3.582 1223 HD11 LEU 56 HD11 LEU 56 -3.975 -1.842 2.168 1224 HD12 LEU 56 HD12 LEU 56 -3.044 -3.175 2.852 1225 HD13 LEU 56 HD13 LEU 56 -3.526 -1.817 3.873 1226 HD21 LEU 56 HD21 LEU 56 -4.985 -4.840 2.007 1227 HD22 LEU 56 HD22 LEU 56 -5.779 -3.410 1.338 1228 HD23 LEU 56 HD23 LEU 56 -6.640 -4.443 2.477 1229 H LEU 57 H LEU 57 -1.977 -4.805 6.460 1230 HA LEU 57 HA LEU 57 -2.922 -6.766 8.396 1231 HB2 LEU 57 HB2 LEU 57 -0.436 -4.985 8.394 1232 HB3 LEU 57 HB3 LEU 57 -0.808 -6.190 9.613 1233 HG LEU 57 HG LEU 57 0.861 -7.130 8.161 1234 HD11 LEU 57 HD11 LEU 57 -0.867 -8.680 8.913 1235 HD12 LEU 57 HD12 LEU 57 -0.202 -9.151 7.351 1236 HD13 LEU 57 HD13 LEU 57 -1.792 -8.385 7.435 1237 HD21 LEU 57 HD21 LEU 57 0.557 -5.682 6.193 1238 HD22 LEU 57 HD22 LEU 57 -0.923 -6.545 5.774 1239 HD23 LEU 57 HD23 LEU 57 0.632 -7.385 5.733 1240 H VAL 58 H VAL 58 -4.733 -5.893 9.205 1241 HA VAL 58 HA VAL 58 -4.634 -3.398 10.774 1242 HB VAL 58 HB VAL 58 -5.367 -2.836 8.409 1243 HG11 VAL 58 HG11 VAL 58 -7.796 -4.539 8.987 1244 HG12 VAL 58 HG12 VAL 58 -6.522 -4.903 7.820 1245 HG13 VAL 58 HG13 VAL 58 -7.566 -3.501 7.574 1246 HG21 VAL 58 HG21 VAL 58 -6.045 -1.391 10.260 1247 HG22 VAL 58 HG22 VAL 58 -7.477 -2.387 10.536 1248 HG23 VAL 58 HG23 VAL 58 -7.316 -1.463 9.039 1249 H ASN 59 H ASN 59 -6.331 -3.411 12.433 1250 HA ASN 59 HA ASN 59 -7.491 -6.045 12.940 1251 HB2 ASN 59 HB2 ASN 59 -8.394 -5.028 15.039 1252 HB3 ASN 59 HB3 ASN 59 -6.654 -4.856 14.860 1253 HD21 ASN 59 HD21 ASN 59 -6.598 -3.183 16.342 1254 HD22 ASN 59 HD22 ASN 59 -7.154 -1.589 15.976 1255 H ASP 60 H ASP 60 -9.652 -6.583 12.768 1256 HA ASP 60 HA ASP 60 -11.275 -5.209 10.902 1257 HB2 ASP 60 HB2 ASP 60 -11.247 -7.681 11.013 1258 HB3 ASP 60 HB3 ASP 60 -11.936 -7.628 12.631 1259 H ASP 61 H ASP 61 -13.395 -4.439 11.225 1260 HA ASP 61 HA ASP 61 -14.231 -3.688 13.932 1261 HB2 ASP 61 HB2 ASP 61 -12.714 -1.869 12.946 1262 HB3 ASP 61 HB3 ASP 61 -13.913 -1.636 11.681 1263 H GLN 62 H GLN 62 -16.445 -2.790 13.882 1264 HA GLN 62 HA GLN 62 -18.259 -4.439 12.479 1265 HB2 GLN 62 HB2 GLN 62 -18.813 -1.807 13.923 1266 HB3 GLN 62 HB3 GLN 62 -20.010 -3.044 13.529 1267 HG2 GLN 62 HG2 GLN 62 -18.901 -4.633 15.038 1268 HG3 GLN 62 HG3 GLN 62 -17.649 -3.443 15.402 1269 HE21 GLN 62 HE21 GLN 62 -19.491 -4.793 17.232 1270 HE22 GLN 62 HE22 GLN 62 -20.386 -3.539 18.019 1271 H ARG 63 H ARG 63 -17.115 -1.162 11.930 1272 HA ARG 63 HA ARG 63 -18.936 -0.590 9.736 1273 HB2 ARG 63 HB2 ARG 63 -16.527 0.950 10.812 1274 HB3 ARG 63 HB3 ARG 63 -17.518 1.498 9.471 1275 HG2 ARG 63 HG2 ARG 63 -18.231 2.713 11.392 1276 HG3 ARG 63 HG3 ARG 63 -19.501 1.541 11.036 1277 HD2 ARG 63 HD2 ARG 63 -18.755 0.111 12.857 1278 HD3 ARG 63 HD3 ARG 63 -17.345 1.140 13.136 1279 HE ARG 63 HE ARG 63 -19.675 2.681 13.404 1280 HH11 ARG 63 HH11 ARG 63 -17.971 0.113 15.087 1281 HH12 ARG 63 HH12 ARG 63 -18.575 0.566 16.645 1282 HH21 ARG 63 HH21 ARG 63 -20.445 3.278 15.441 1283 HH22 ARG 63 HH22 ARG 63 -19.985 2.369 16.846 1284 H LEU 64 H LEU 64 -15.733 -1.905 10.190 1285 HA LEU 64 HA LEU 64 -14.514 -1.286 7.753 1286 HB2 LEU 64 HB2 LEU 64 -13.462 -2.323 9.871 1287 HB3 LEU 64 HB3 LEU 64 -14.037 -3.869 9.272 1288 HG LEU 64 HG LEU 64 -12.661 -3.316 7.104 1289 HD11 LEU 64 HD11 LEU 64 -10.768 -1.834 7.372 1290 HD12 LEU 64 HD12 LEU 64 -11.273 -1.428 9.015 1291 HD13 LEU 64 HD13 LEU 64 -12.264 -0.932 7.633 1292 HD21 LEU 64 HD21 LEU 64 -10.622 -4.245 8.020 1293 HD22 LEU 64 HD22 LEU 64 -12.020 -5.063 8.721 1294 HD23 LEU 64 HD23 LEU 64 -11.141 -3.851 9.661 1295 H GLU 65 H GLU 65 -16.360 -4.204 8.720 1296 HA GLU 65 HA GLU 65 -16.225 -5.697 6.371 1297 HB2 GLU 65 HB2 GLU 65 -18.532 -5.588 8.372 1298 HB3 GLU 65 HB3 GLU 65 -18.274 -6.870 7.189 1299 HG2 GLU 65 HG2 GLU 65 -16.088 -7.382 8.311 1300 HG3 GLU 65 HG3 GLU 65 -16.491 -6.193 9.548 1301 H GLN 66 H GLN 66 -18.431 -3.109 7.245 1302 HA GLN 66 HA GLN 66 -20.362 -3.423 5.186 1303 HB2 GLN 66 HB2 GLN 66 -19.582 -0.914 6.738 1304 HB3 GLN 66 HB3 GLN 66 -21.064 -1.123 5.811 1305 HG2 GLN 66 HG2 GLN 66 -20.281 -2.671 8.298 1306 HG3 GLN 66 HG3 GLN 66 -21.478 -1.380 8.210 1307 HE21 GLN 66 HE21 GLN 66 -23.480 -1.807 7.201 1308 HE22 GLN 66 HE22 GLN 66 -24.041 -3.418 6.939 1309 H MET 67 H MET 67 -17.499 -1.368 5.515 1310 HA MET 67 HA MET 67 -17.672 -0.138 2.935 1311 HB2 MET 67 HB2 MET 67 -15.408 -0.311 4.954 1312 HB3 MET 67 HB3 MET 67 -15.354 0.678 3.499 1313 HG2 MET 67 HG2 MET 67 -17.272 1.986 4.293 1314 HG3 MET 67 HG3 MET 67 -17.371 0.979 5.741 1315 HE1 MET 67 HE1 MET 67 -14.268 0.536 6.407 1316 HE2 MET 67 HE2 MET 67 -15.465 0.934 7.642 1317 HE3 MET 67 HE3 MET 67 -13.980 1.869 7.516 1318 H ILE 68 H ILE 68 -16.186 -3.043 4.176 1319 HA ILE 68 HA ILE 68 -14.526 -3.688 1.953 1320 HB ILE 68 HB ILE 68 -15.697 -5.317 4.235 1321 HG12 ILE 68 HG12 ILE 68 -12.807 -4.582 3.570 1322 HG13 ILE 68 HG13 ILE 68 -13.825 -3.700 4.701 1323 HG21 ILE 68 HG21 ILE 68 -13.893 -6.410 2.059 1324 HG22 ILE 68 HG22 ILE 68 -15.564 -6.884 2.357 1325 HG23 ILE 68 HG23 ILE 68 -14.319 -7.252 3.549 1326 HD11 ILE 68 HD11 ILE 68 -12.893 -6.548 4.989 1327 HD12 ILE 68 HD12 ILE 68 -13.973 -5.709 6.106 1328 HD13 ILE 68 HD13 ILE 68 -12.318 -5.143 5.884 1329 H SER 69 H SER 69 -17.926 -4.302 2.738 1330 HA SER 69 HA SER 69 -18.511 -6.015 0.516 1331 HB2 SER 69 HB2 SER 69 -20.401 -4.289 2.172 1332 HB3 SER 69 HB3 SER 69 -20.862 -5.649 1.145 1333 HG SER 69 HG SER 69 -18.944 -6.092 3.128 1334 H GLN 70 H GLN 70 -18.427 -2.557 1.037 1335 HA GLN 70 HA GLN 70 -19.878 -1.799 -1.338 1336 HB2 GLN 70 HB2 GLN 70 -19.885 -0.493 0.793 1337 HB3 GLN 70 HB3 GLN 70 -18.174 -0.161 0.608 1338 HG2 GLN 70 HG2 GLN 70 -20.126 0.745 -1.513 1339 HG3 GLN 70 HG3 GLN 70 -19.962 1.661 -0.021 1340 HE21 GLN 70 HE21 GLN 70 -18.463 0.832 -3.042 1341 HE22 GLN 70 HE22 GLN 70 -17.128 1.917 -2.919 1342 H ILE 71 H ILE 71 -16.433 -1.979 -0.368 1343 HA ILE 71 HA ILE 71 -15.390 -0.755 -2.729 1344 HB ILE 71 HB ILE 71 -14.098 -0.883 -0.595 1345 HG12 ILE 71 HG12 ILE 71 -12.779 -2.009 -3.099 1346 HG13 ILE 71 HG13 ILE 71 -12.824 -0.330 -2.570 1347 HG21 ILE 71 HG21 ILE 71 -13.662 -3.807 -1.246 1348 HG22 ILE 71 HG22 ILE 71 -14.687 -3.188 0.044 1349 HG23 ILE 71 HG23 ILE 71 -12.947 -2.913 0.100 1350 HD11 ILE 71 HD11 ILE 71 -10.645 -1.235 -2.229 1351 HD12 ILE 71 HD12 ILE 71 -11.288 -2.587 -1.300 1352 HD13 ILE 71 HD13 ILE 71 -11.388 -0.942 -0.659 1353 H ASP 72 H ASP 72 -16.249 -4.036 -1.854 1354 HA ASP 72 HA ASP 72 -15.116 -5.559 -3.879 1355 HB2 ASP 72 HB2 ASP 72 -16.243 -6.630 -2.048 1356 HB3 ASP 72 HB3 ASP 72 -17.737 -5.786 -2.372 1357 H LYS 73 H LYS 73 -17.878 -3.409 -3.966 1358 HA LYS 73 HA LYS 73 -19.096 -4.261 -6.394 1359 HB2 LYS 73 HB2 LYS 73 -19.302 -1.537 -5.066 1360 HB3 LYS 73 HB3 LYS 73 -20.458 -2.250 -6.171 1361 HG2 LYS 73 HG2 LYS 73 -19.911 -3.748 -3.629 1362 HG3 LYS 73 HG3 LYS 73 -20.775 -2.220 -3.487 1363 HD2 LYS 73 HD2 LYS 73 -22.363 -4.043 -3.614 1364 HD3 LYS 73 HD3 LYS 73 -22.487 -3.048 -5.065 1365 HE2 LYS 73 HE2 LYS 73 -22.635 -5.389 -5.633 1366 HE3 LYS 73 HE3 LYS 73 -21.160 -4.729 -6.307 1367 HZ1 LYS 73 HZ1 LYS 73 -20.808 -6.904 -5.338 1368 HZ2 LYS 73 HZ2 LYS 73 -21.362 -6.370 -3.838 1369 HZ3 LYS 73 HZ3 LYS 73 -19.929 -5.742 -4.482 1370 H LEU 74 H LEU 74 -16.302 -2.388 -5.768 1371 HA LEU 74 HA LEU 74 -16.282 -0.771 -8.151 1372 HB2 LEU 74 HB2 LEU 74 -14.256 -1.405 -5.981 1373 HB3 LEU 74 HB3 LEU 74 -13.725 -0.620 -7.453 1374 HG LEU 74 HG LEU 74 -14.077 1.028 -5.681 1375 HD11 LEU 74 HD11 LEU 74 -14.447 1.738 -7.983 1376 HD12 LEU 74 HD12 LEU 74 -15.512 2.605 -6.879 1377 HD13 LEU 74 HD13 LEU 74 -16.154 1.293 -7.873 1378 HD21 LEU 74 HD21 LEU 74 -16.291 1.518 -4.740 1379 HD22 LEU 74 HD22 LEU 74 -15.796 -0.129 -4.365 1380 HD23 LEU 74 HD23 LEU 74 -16.986 0.160 -5.631 1381 H GLU 75 H GLU 75 -15.067 -1.074 -9.984 1382 HA GLU 75 HA GLU 75 -14.675 -3.706 -11.020 1383 HB2 GLU 75 HB2 GLU 75 -13.660 -1.047 -12.121 1384 HB3 GLU 75 HB3 GLU 75 -13.820 -2.554 -13.028 1385 HG2 GLU 75 HG2 GLU 75 -16.259 -2.482 -12.767 1386 HG3 GLU 75 HG3 GLU 75 -16.131 -1.016 -11.795 1387 H ASP 76 H ASP 76 -12.691 -1.496 -9.315 1388 HA ASP 76 HA ASP 76 -10.066 -2.244 -9.844 1389 HB2 ASP 76 HB2 ASP 76 -11.245 -1.490 -7.118 1390 HB3 ASP 76 HB3 ASP 76 -9.564 -1.321 -7.613 1391 H VAL 77 H VAL 77 -12.373 -3.547 -7.493 1392 HA VAL 77 HA VAL 77 -10.557 -5.565 -6.487 1393 HB VAL 77 HB VAL 77 -13.417 -4.778 -5.774 1394 HG11 VAL 77 HG11 VAL 77 -11.740 -6.918 -4.421 1395 HG12 VAL 77 HG12 VAL 77 -13.186 -7.208 -5.385 1396 HG13 VAL 77 HG13 VAL 77 -13.307 -6.326 -3.861 1397 HG21 VAL 77 HG21 VAL 77 -11.626 -3.205 -5.075 1398 HG22 VAL 77 HG22 VAL 77 -10.810 -4.519 -4.219 1399 HG23 VAL 77 HG23 VAL 77 -12.401 -3.968 -3.682 1400 H VAL 78 H VAL 78 -10.254 -7.310 -7.647 1401 HA VAL 78 HA VAL 78 -12.261 -8.724 -9.190 1402 HB VAL 78 HB VAL 78 -9.482 -9.739 -8.413 1403 HG11 VAL 78 HG11 VAL 78 -11.251 -10.433 -10.788 1404 HG12 VAL 78 HG12 VAL 78 -10.977 -11.451 -9.368 1405 HG13 VAL 78 HG13 VAL 78 -9.644 -11.094 -10.469 1406 HG21 VAL 78 HG21 VAL 78 -8.606 -8.791 -10.516 1407 HG22 VAL 78 HG22 VAL 78 -9.204 -7.525 -9.441 1408 HG23 VAL 78 HG23 VAL 78 -10.169 -8.029 -10.830 1409 H LYS 79 H LYS 79 -10.318 -9.329 -6.255 1410 HA LYS 79 HA LYS 79 -12.426 -11.118 -5.133 1411 HB2 LYS 79 HB2 LYS 79 -9.400 -11.281 -4.727 1412 HB3 LYS 79 HB3 LYS 79 -10.578 -12.205 -3.806 1413 HG2 LYS 79 HG2 LYS 79 -11.238 -13.421 -5.835 1414 HG3 LYS 79 HG3 LYS 79 -10.092 -12.465 -6.783 1415 HD2 LYS 79 HD2 LYS 79 -9.141 -14.688 -6.193 1416 HD3 LYS 79 HD3 LYS 79 -8.204 -13.376 -5.473 1417 HE2 LYS 79 HE2 LYS 79 -9.614 -13.774 -3.336 1418 HE3 LYS 79 HE3 LYS 79 -10.144 -15.270 -4.103 1419 HZ1 LYS 79 HZ1 LYS 79 -8.302 -15.696 -2.660 1420 HZ2 LYS 79 HZ2 LYS 79 -7.363 -14.510 -3.412 1421 HZ3 LYS 79 HZ3 LYS 79 -7.785 -15.915 -4.254 1422 H VAL 80 H VAL 80 -12.866 -10.815 -2.925 1423 HA VAL 80 HA VAL 80 -11.093 -9.164 -1.297 1424 HB VAL 80 HB VAL 80 -12.932 -7.600 -2.168 1425 HG11 VAL 80 HG11 VAL 80 -14.848 -9.069 -2.188 1426 HG12 VAL 80 HG12 VAL 80 -15.170 -7.705 -1.116 1427 HG13 VAL 80 HG13 VAL 80 -14.758 -9.281 -0.438 1428 HG21 VAL 80 HG21 VAL 80 -11.637 -7.038 -0.167 1429 HG22 VAL 80 HG22 VAL 80 -12.755 -7.959 0.843 1430 HG23 VAL 80 HG23 VAL 80 -13.311 -6.502 0.016 1431 H GLN 81 H GLN 81 -10.748 -10.178 0.618 1432 HA GLN 81 HA GLN 81 -12.767 -11.872 1.863 1433 HB2 GLN 81 HB2 GLN 81 -11.673 -13.426 0.271 1434 HB3 GLN 81 HB3 GLN 81 -10.092 -13.014 0.926 1435 HG2 GLN 81 HG2 GLN 81 -10.877 -15.205 1.741 1436 HG3 GLN 81 HG3 GLN 81 -10.657 -14.061 3.063 1437 HE21 GLN 81 HE21 GLN 81 -13.015 -15.828 1.165 1438 HE22 GLN 81 HE22 GLN 81 -14.340 -15.605 2.251 1439 H ARG 82 H ARG 82 -12.581 -11.864 4.042 1440 HA ARG 82 HA ARG 82 -10.297 -10.439 5.258 1441 HB2 ARG 82 HB2 ARG 82 -12.961 -11.109 6.593 1442 HB3 ARG 82 HB3 ARG 82 -11.704 -10.033 7.193 1443 HG2 ARG 82 HG2 ARG 82 -13.162 -8.457 6.368 1444 HG3 ARG 82 HG3 ARG 82 -12.190 -8.725 4.924 1445 HD2 ARG 82 HD2 ARG 82 -14.364 -8.795 4.093 1446 HD3 ARG 82 HD3 ARG 82 -14.006 -10.507 4.320 1447 HE ARG 82 HE ARG 82 -15.151 -9.886 6.661 1448 HH11 ARG 82 HH11 ARG 82 -16.200 -9.251 3.361 1449 HH12 ARG 82 HH12 ARG 82 -17.884 -9.264 3.772 1450 HH21 ARG 82 HH21 ARG 82 -17.364 -9.814 7.201 1451 HH22 ARG 82 HH22 ARG 82 -18.543 -9.582 5.945 1452 H ASN 83 H ASN 83 -8.826 -12.084 5.327 1453 HA ASN 83 HA ASN 83 -9.433 -14.661 6.595 1454 HB2 ASN 83 HB2 ASN 83 -6.760 -13.640 5.493 1455 HB3 ASN 83 HB3 ASN 83 -7.168 -15.305 5.903 1456 HD21 ASN 83 HD21 ASN 83 -7.615 -12.730 3.581 1457 HD22 ASN 83 HD22 ASN 83 -8.269 -13.715 2.320 1458 H GLN 84 H GLN 84 -9.483 -14.528 8.843 1459 HA GLN 84 HA GLN 84 -7.847 -12.532 10.224 1460 HB2 GLN 84 HB2 GLN 84 -10.133 -12.857 11.020 1461 HB3 GLN 84 HB3 GLN 84 -9.853 -14.579 11.249 1462 HG2 GLN 84 HG2 GLN 84 -8.221 -14.064 13.043 1463 HG3 GLN 84 HG3 GLN 84 -8.534 -12.347 12.820 1464 HE21 GLN 84 HE21 GLN 84 -11.112 -14.750 12.660 1465 HE22 GLN 84 HE22 GLN 84 -11.865 -14.277 14.140 1466 H SER 85 H SER 85 -5.786 -13.095 10.132 1467 HA SER 85 HA SER 85 -4.808 -15.556 11.375 1468 HB2 SER 85 HB2 SER 85 -5.060 -16.131 8.959 1469 HB3 SER 85 HB3 SER 85 -4.080 -14.736 8.512 1470 HG SER 85 HG SER 85 -2.300 -15.750 9.169 1471 H ASP 86 H ASP 86 -2.374 -15.458 11.442 1472 HA ASP 86 HA ASP 86 -1.469 -13.057 12.681 1473 HB2 ASP 86 HB2 ASP 86 0.009 -15.604 11.872 1474 HB3 ASP 86 HB3 ASP 86 0.701 -14.328 12.867 1475 HA PRO 87 HA PRO 87 0.390 -10.984 9.143 1476 HB2 PRO 87 HB2 PRO 87 2.375 -9.513 10.273 1477 HB3 PRO 87 HB3 PRO 87 0.660 -9.194 10.629 1478 HG2 PRO 87 HG2 PRO 87 2.666 -10.737 12.256 1479 HG3 PRO 87 HG3 PRO 87 1.495 -9.508 12.788 1480 HD2 PRO 87 HD2 PRO 87 1.026 -12.192 13.041 1481 HD3 PRO 87 HD3 PRO 87 -0.280 -11.007 12.812 1482 H THR 88 H THR 88 1.651 -13.716 10.064 1483 HA THR 88 HA THR 88 4.375 -13.717 9.278 1484 HB THR 88 HB THR 88 4.029 -16.221 9.126 1485 HG1 THR 88 HG1 THR 88 1.922 -16.970 9.792 1486 HG21 THR 88 HG21 THR 88 3.500 -16.539 11.529 1487 HG22 THR 88 HG22 THR 88 2.907 -14.874 11.615 1488 HG23 THR 88 HG23 THR 88 4.614 -15.197 11.285 1489 H MET 89 H MET 89 1.627 -13.228 7.431 1490 HA MET 89 HA MET 89 1.940 -14.579 5.046 1491 HB2 MET 89 HB2 MET 89 0.880 -11.764 5.528 1492 HB3 MET 89 HB3 MET 89 0.641 -12.678 4.043 1493 HG2 MET 89 HG2 MET 89 -0.366 -13.509 6.774 1494 HG3 MET 89 HG3 MET 89 -1.334 -12.738 5.515 1495 HE1 MET 89 HE1 MET 89 -3.165 -14.633 5.470 1496 HE2 MET 89 HE2 MET 89 -2.345 -15.409 6.828 1497 HE3 MET 89 HE3 MET 89 -2.792 -16.355 5.408 1498 H PHE 90 H PHE 90 3.719 -11.720 6.171 1499 HA PHE 90 HA PHE 90 5.007 -10.907 3.818 1500 HB2 PHE 90 HB2 PHE 90 5.964 -10.877 6.713 1501 HB3 PHE 90 HB3 PHE 90 6.928 -10.202 5.410 1502 HD1 PHE 90 HD2 PHE 90 3.697 -9.831 7.243 1503 HD2 PHE 90 HD1 PHE 90 6.486 -8.007 4.554 1504 HE1 PHE 90 HE2 PHE 90 2.548 -7.678 7.496 1505 HE2 PHE 90 HE1 PHE 90 5.323 -5.852 4.818 1506 HZ PHE 90 HZ PHE 90 3.353 -5.686 6.288 1507 H ASN 91 H ASN 91 6.144 -13.228 6.286 1508 HA ASN 91 HA ASN 91 8.457 -14.107 4.870 1509 HB2 ASN 91 HB2 ASN 91 8.307 -14.256 7.317 1510 HB3 ASN 91 HB3 ASN 91 6.946 -15.365 7.206 1511 HD21 ASN 91 HD21 ASN 91 7.337 -17.528 6.664 1512 HD22 ASN 91 HD22 ASN 91 8.919 -18.221 6.676 1513 H LYS 92 H LYS 92 5.138 -15.214 5.059 1514 HA LYS 92 HA LYS 92 5.363 -17.828 4.106 1515 HB2 LYS 92 HB2 LYS 92 3.335 -16.880 5.210 1516 HB3 LYS 92 HB3 LYS 92 3.018 -15.906 3.779 1517 HG2 LYS 92 HG2 LYS 92 1.565 -17.870 3.812 1518 HG3 LYS 92 HG3 LYS 92 2.687 -17.964 2.449 1519 HD2 LYS 92 HD2 LYS 92 4.133 -19.512 3.781 1520 HD3 LYS 92 HD3 LYS 92 2.965 -19.451 5.101 1521 HE2 LYS 92 HE2 LYS 92 1.263 -20.471 3.638 1522 HE3 LYS 92 HE3 LYS 92 2.421 -20.501 2.304 1523 HZ1 LYS 92 HZ1 LYS 92 2.294 -22.644 3.367 1524 HZ2 LYS 92 HZ2 LYS 92 2.676 -21.972 4.870 1525 HZ3 LYS 92 HZ3 LYS 92 3.824 -21.973 3.633 1526 H ILE 93 H ILE 93 4.790 -14.789 2.322 1527 HA ILE 93 HA ILE 93 4.897 -16.107 -0.257 1528 HB ILE 93 HB ILE 93 4.646 -13.915 -1.271 1529 HG12 ILE 93 HG12 ILE 93 4.947 -12.688 1.517 1530 HG13 ILE 93 HG13 ILE 93 6.192 -12.660 0.286 1531 HG21 ILE 93 HG21 ILE 93 2.625 -15.002 -0.363 1532 HG22 ILE 93 HG22 ILE 93 2.492 -13.247 -0.290 1533 HG23 ILE 93 HG23 ILE 93 2.853 -14.160 1.175 1534 HD11 ILE 93 HD11 ILE 93 3.504 -11.322 0.072 1535 HD12 ILE 93 HD12 ILE 93 4.784 -11.291 -1.141 1536 HD13 ILE 93 HD13 ILE 93 5.042 -10.543 0.432 1537 H ALA 94 H ALA 94 7.183 -14.471 1.866 1538 HA ALA 94 HA ALA 94 9.002 -13.472 -0.034 1539 HB1 ALA 94 HB1 ALA 94 10.558 -13.215 1.847 1540 HB2 ALA 94 HB2 ALA 94 9.557 -14.279 2.843 1541 HB3 ALA 94 HB3 ALA 94 8.927 -12.720 2.304 1542 H VAL 95 H VAL 95 8.810 -16.647 1.513 1543 HA VAL 95 HA VAL 95 11.293 -17.665 0.600 1544 HB VAL 95 HB VAL 95 10.390 -19.916 1.094 1545 HG11 VAL 95 HG11 VAL 95 11.265 -18.566 2.947 1546 HG12 VAL 95 HG12 VAL 95 9.938 -19.582 3.505 1547 HG13 VAL 95 HG13 VAL 95 9.672 -17.859 3.218 1548 HG21 VAL 95 HG21 VAL 95 8.082 -19.648 0.270 1549 HG22 VAL 95 HG22 VAL 95 7.726 -18.529 1.588 1550 HG23 VAL 95 HG23 VAL 95 8.085 -20.221 1.941 1551 H PHE 96 H PHE 96 8.086 -17.534 -0.900 1552 HA PHE 96 HA PHE 96 8.880 -18.998 -3.293 1553 HB2 PHE 96 HB2 PHE 96 6.312 -17.484 -2.620 1554 HB3 PHE 96 HB3 PHE 96 6.564 -18.400 -4.102 1555 HD1 PHE 96 HD2 PHE 96 7.019 -20.931 -3.904 1556 HD2 PHE 96 HD1 PHE 96 5.478 -18.584 -0.666 1557 HE1 PHE 96 HE2 PHE 96 6.186 -22.969 -2.807 1558 HE2 PHE 96 HE1 PHE 96 4.648 -20.633 0.419 1559 HZ PHE 96 HZ PHE 96 5.003 -22.823 -0.651 1560 H PHE 97 H PHE 97 8.830 -15.736 -2.176 1561 HA PHE 97 HA PHE 97 9.334 -13.727 -2.977 1562 HB2 PHE 97 HB2 PHE 97 10.093 -15.100 -5.582 1563 HB3 PHE 97 HB3 PHE 97 10.328 -13.386 -5.265 1564 HD1 PHE 97 HD2 PHE 97 12.003 -12.640 -3.554 1565 HD2 PHE 97 HD1 PHE 97 11.601 -16.765 -4.637 1566 HE1 PHE 97 HE2 PHE 97 14.177 -13.135 -2.516 1567 HE2 PHE 97 HE1 PHE 97 13.773 -17.250 -3.594 1568 HZ PHE 97 HZ PHE 97 15.062 -15.434 -2.531 1569 H GLN 98 H GLN 98 7.145 -15.682 -4.941 1570 HA GLN 98 HA GLN 98 5.182 -13.550 -4.938 1571 HB2 GLN 98 HB2 GLN 98 6.648 -13.265 -7.055 1572 HB3 GLN 98 HB3 GLN 98 5.969 -14.774 -7.632 1573 HG2 GLN 98 HG2 GLN 98 4.196 -12.439 -6.886 1574 HG3 GLN 98 HG3 GLN 98 4.972 -12.520 -8.457 1575 HE21 GLN 98 HE21 GLN 98 2.505 -13.854 -6.418 1576 HE22 GLN 98 HE22 GLN 98 1.686 -14.749 -7.648 Start of MODEL 9 1 H1 GLY 1 H1 GLY 1 8.472 10.012 -18.170 2 H2 GLY 1 H2 GLY 1 7.450 8.675 -18.301 3 H3 GLY 1 H3 GLY 1 8.381 9.152 -19.624 4 HA2 GLY 1 HA3 GLY 1 10.410 8.652 -18.359 5 HA3 GLY 1 HA2 GLY 1 9.376 8.045 -17.069 6 H SER 2 H SER 2 10.987 6.202 -17.715 7 HA SER 2 HA SER 2 10.335 4.623 -20.029 8 HB2 SER 2 HB2 SER 2 11.991 3.875 -17.572 9 HB3 SER 2 HB3 SER 2 11.973 3.017 -19.117 10 HG SER 2 HG SER 2 12.774 4.934 -20.084 11 H MET 3 H MET 3 8.039 4.412 -19.706 12 HA MET 3 HA MET 3 6.869 3.205 -17.398 13 HB2 MET 3 HB2 MET 3 5.758 3.736 -20.177 14 HB3 MET 3 HB3 MET 3 4.789 3.104 -18.852 15 HG2 MET 3 HG2 MET 3 5.121 5.130 -17.572 16 HG3 MET 3 HG3 MET 3 6.246 5.755 -18.778 17 HE1 MET 3 HE1 MET 3 1.736 5.178 -19.683 18 HE2 MET 3 HE2 MET 3 2.466 4.679 -18.159 19 HE3 MET 3 HE3 MET 3 2.868 3.827 -19.655 20 H GLN 4 H GLN 4 8.094 1.307 -17.114 21 HA GLN 4 HA GLN 4 7.048 -1.094 -18.290 22 HB2 GLN 4 HB2 GLN 4 9.193 -1.956 -19.207 23 HB3 GLN 4 HB3 GLN 4 8.661 -0.517 -20.066 24 HG2 GLN 4 HG2 GLN 4 10.296 0.853 -18.870 25 HG3 GLN 4 HG3 GLN 4 10.806 -0.537 -17.911 26 HE21 GLN 4 HE21 GLN 4 12.383 1.154 -19.703 27 HE22 GLN 4 HE22 GLN 4 13.070 0.086 -20.870 28 H ASN 5 H ASN 5 8.744 -2.982 -17.490 29 HA ASN 5 HA ASN 5 9.406 -2.464 -14.649 30 HB2 ASN 5 HB2 ASN 5 8.689 -4.930 -14.295 31 HB3 ASN 5 HB3 ASN 5 7.427 -3.730 -14.500 32 HD21 ASN 5 HD21 ASN 5 5.948 -5.327 -15.083 33 HD22 ASN 5 HD22 ASN 5 5.962 -6.071 -16.639 34 H THR 6 H THR 6 11.519 -2.641 -14.363 35 HA THR 6 HA THR 6 13.058 -4.914 -15.276 36 HB THR 6 HB THR 6 13.980 -2.122 -16.152 37 HG1 THR 6 HG1 THR 6 12.643 -4.164 -17.610 38 HG21 THR 6 HG21 THR 6 15.825 -3.721 -15.778 39 HG22 THR 6 HG22 THR 6 15.658 -3.328 -17.490 40 HG23 THR 6 HG23 THR 6 15.057 -4.870 -16.877 41 H THR 7 H THR 7 15.285 -4.830 -14.229 42 HA THR 7 HA THR 7 14.924 -4.159 -11.458 43 HB THR 7 HB THR 7 17.150 -5.302 -11.177 44 HG1 THR 7 HG1 THR 7 18.044 -6.257 -13.125 45 HG21 THR 7 HG21 THR 7 15.194 -6.818 -12.953 46 HG22 THR 7 HG22 THR 7 15.067 -6.652 -11.201 47 HG23 THR 7 HG23 THR 7 16.417 -7.544 -11.907 48 H HIS 8 H HIS 8 15.310 -1.809 -13.288 49 HA HIS 8 HA HIS 8 16.853 -0.231 -11.494 50 HB2 HIS 8 HB2 HIS 8 18.547 0.652 -13.026 51 HB3 HIS 8 HB3 HIS 8 18.740 -1.088 -12.871 52 HD1 HIS 8 HD1 HIS 8 18.669 1.489 -15.350 53 HD2 HIS 8 HD2 HIS 8 17.454 -2.480 -15.224 54 HE1 HIS 8 HE1 HIS 8 18.555 0.748 -17.740 55 HE2 HIS 8 HE2 HIS 8 17.623 -1.582 -17.637 56 H ASP 9 H ASP 9 15.054 -0.570 -14.504 57 HA ASP 9 HA ASP 9 14.355 2.130 -14.909 58 HB2 ASP 9 HB2 ASP 9 12.912 -0.437 -15.703 59 HB3 ASP 9 HB3 ASP 9 12.345 1.162 -16.181 60 H ASN 10 H ASN 10 12.827 -0.452 -12.930 61 HA ASN 10 HA ASN 10 10.918 1.420 -11.809 62 HB2 ASN 10 HB2 ASN 10 10.123 -0.304 -10.393 63 HB3 ASN 10 HB3 ASN 10 10.529 -1.143 -11.882 64 HD21 ASN 10 HD21 ASN 10 10.278 -2.091 -9.086 65 HD22 ASN 10 HD22 ASN 10 11.767 -2.886 -8.737 66 H VAL 11 H VAL 11 10.976 2.000 -9.542 67 HA VAL 11 HA VAL 11 13.656 2.305 -8.392 68 HB VAL 11 HB VAL 11 13.171 4.651 -7.742 69 HG11 VAL 11 HG11 VAL 11 13.560 5.715 -9.911 70 HG12 VAL 11 HG12 VAL 11 13.008 4.261 -10.749 71 HG13 VAL 11 HG13 VAL 11 14.480 4.217 -9.780 72 HG21 VAL 11 HG21 VAL 11 10.712 4.486 -9.535 73 HG22 VAL 11 HG22 VAL 11 11.307 5.928 -8.712 74 HG23 VAL 11 HG23 VAL 11 10.690 4.570 -7.773 75 H ILE 12 H ILE 12 13.702 2.259 -6.257 76 HA ILE 12 HA ILE 12 11.368 1.443 -4.740 77 HB ILE 12 HB ILE 12 14.217 1.938 -3.743 78 HG12 ILE 12 HG12 ILE 12 14.339 0.256 -5.535 79 HG13 ILE 12 HG13 ILE 12 14.668 -0.482 -3.979 80 HG21 ILE 12 HG21 ILE 12 13.576 0.442 -1.890 81 HG22 ILE 12 HG22 ILE 12 11.949 0.305 -2.555 82 HG23 ILE 12 HG23 ILE 12 12.537 1.865 -1.971 83 HD11 ILE 12 HD11 ILE 12 13.345 -1.940 -5.371 84 HD12 ILE 12 HD12 ILE 12 12.104 -0.703 -5.552 85 HD13 ILE 12 HD13 ILE 12 12.398 -1.435 -3.972 86 H LEU 13 H LEU 13 10.088 3.239 -4.411 87 HA LEU 13 HA LEU 13 11.220 5.743 -3.419 88 HB2 LEU 13 HB2 LEU 13 8.285 4.948 -3.654 89 HB3 LEU 13 HB3 LEU 13 8.913 6.562 -3.369 90 HG LEU 13 HG LEU 13 9.175 4.964 -5.945 91 HD11 LEU 13 HD11 LEU 13 7.556 7.458 -5.343 92 HD12 LEU 13 HD12 LEU 13 6.915 5.827 -5.571 93 HD13 LEU 13 HD13 LEU 13 7.702 6.655 -6.912 94 HD21 LEU 13 HD21 LEU 13 11.165 6.327 -5.610 95 HD22 LEU 13 HD22 LEU 13 10.170 7.758 -5.327 96 HD23 LEU 13 HD23 LEU 13 10.176 6.981 -6.913 97 H GLU 14 H GLU 14 12.090 5.311 -1.402 98 HA GLU 14 HA GLU 14 10.481 3.758 0.516 99 HB2 GLU 14 HB2 GLU 14 12.480 3.975 2.064 100 HB3 GLU 14 HB3 GLU 14 12.723 3.004 0.626 101 HG2 GLU 14 HG2 GLU 14 13.629 5.878 0.758 102 HG3 GLU 14 HG3 GLU 14 14.618 4.575 1.400 103 H LEU 15 H LEU 15 8.906 4.961 1.077 104 HA LEU 15 HA LEU 15 9.088 7.813 1.637 105 HB2 LEU 15 HB2 LEU 15 6.645 6.017 1.884 106 HB3 LEU 15 HB3 LEU 15 6.686 7.755 1.616 107 HG LEU 15 HG LEU 15 7.569 5.672 -0.426 108 HD11 LEU 15 HD11 LEU 15 5.186 5.499 0.016 109 HD12 LEU 15 HD12 LEU 15 5.475 6.163 -1.589 110 HD13 LEU 15 HD13 LEU 15 4.984 7.229 -0.267 111 HD21 LEU 15 HD21 LEU 15 8.695 7.817 -0.762 112 HD22 LEU 15 HD22 LEU 15 7.142 8.658 -0.752 113 HD23 LEU 15 HD23 LEU 15 7.523 7.519 -2.047 114 H THR 16 H THR 16 9.189 8.582 3.673 115 HA THR 16 HA THR 16 8.631 6.790 5.968 116 HB THR 16 HB THR 16 10.121 9.457 5.959 117 HG1 THR 16 HG1 THR 16 11.568 8.063 5.183 118 HG21 THR 16 HG21 THR 16 8.916 9.027 8.095 119 HG22 THR 16 HG22 THR 16 10.670 8.952 8.296 120 HG23 THR 16 HG23 THR 16 9.728 7.461 8.223 121 H VAL 17 H VAL 17 6.441 6.945 6.120 122 HA VAL 17 HA VAL 17 5.274 9.630 6.641 123 HB VAL 17 HB VAL 17 3.126 8.823 6.026 124 HG11 VAL 17 HG11 VAL 17 4.540 9.360 4.094 125 HG12 VAL 17 HG12 VAL 17 3.382 8.096 3.681 126 HG13 VAL 17 HG13 VAL 17 5.074 7.676 3.992 127 HG21 VAL 17 HG21 VAL 17 4.242 5.998 5.892 128 HG22 VAL 17 HG22 VAL 17 2.606 6.460 5.416 129 HG23 VAL 17 HG23 VAL 17 3.115 6.629 7.095 130 H ARG 18 H ARG 18 3.981 9.810 8.579 131 HA ARG 18 HA ARG 18 4.547 7.732 10.586 132 HB2 ARG 18 HB2 ARG 18 3.531 9.299 12.235 133 HB3 ARG 18 HB3 ARG 18 4.981 9.885 11.443 134 HG2 ARG 18 HG2 ARG 18 3.550 11.312 9.974 135 HG3 ARG 18 HG3 ARG 18 2.128 10.756 10.870 136 HD2 ARG 18 HD2 ARG 18 4.504 12.256 12.039 137 HD3 ARG 18 HD3 ARG 18 2.909 12.936 11.719 138 HE ARG 18 HE ARG 18 2.960 10.635 13.518 139 HH11 ARG 18 HH11 ARG 18 2.997 14.149 13.367 140 HH12 ARG 18 HH12 ARG 18 2.460 14.337 15.007 141 HH21 ARG 18 HH21 ARG 18 2.247 10.906 15.646 142 HH22 ARG 18 HH22 ARG 18 2.041 12.507 16.286 143 H ASN 19 H ASN 19 2.894 6.779 11.848 144 HA ASN 19 HA ASN 19 1.006 5.610 10.082 145 HB2 ASN 19 HB2 ASN 19 2.305 4.305 11.780 146 HB3 ASN 19 HB3 ASN 19 1.402 5.102 13.063 147 HD21 ASN 19 HD21 ASN 19 0.203 3.806 9.949 148 HD22 ASN 19 HD22 ASN 19 -0.847 2.634 10.653 149 H HIS 20 H HIS 20 -0.428 7.164 9.562 150 HA HIS 20 HA HIS 20 -2.580 7.758 11.512 151 HB2 HIS 20 HB2 HIS 20 -1.252 9.826 11.125 152 HB3 HIS 20 HB3 HIS 20 -1.435 9.644 9.389 153 HD1 HIS 20 HD1 HIS 20 -3.229 10.827 12.445 154 HD2 HIS 20 HD2 HIS 20 -3.962 10.446 8.371 155 HE1 HIS 20 HE1 HIS 20 -5.311 12.156 12.000 156 HE2 HIS 20 HE2 HIS 20 -5.856 11.703 9.595 157 HA PRO 21 HA PRO 21 -4.931 5.642 8.323 158 HB2 PRO 21 HB2 PRO 21 -7.499 6.396 8.978 159 HB3 PRO 21 HB3 PRO 21 -6.564 5.217 9.920 160 HG2 PRO 21 HG2 PRO 21 -7.018 8.128 10.476 161 HG3 PRO 21 HG3 PRO 21 -7.047 6.751 11.602 162 HD2 PRO 21 HD2 PRO 21 -4.895 8.405 11.386 163 HD3 PRO 21 HD3 PRO 21 -4.734 6.682 11.791 164 H GLY 22 H GLY 22 -4.450 6.490 6.347 165 HA2 GLY 22 HA2 GLY 22 -5.832 7.464 4.477 166 HA3 GLY 22 HA3 GLY 22 -5.862 8.948 5.419 167 H VAL 23 H VAL 23 -2.862 7.768 5.986 168 HA VAL 23 HA VAL 23 -1.643 9.655 4.133 169 HB VAL 23 HB VAL 23 0.421 9.321 5.379 170 HG11 VAL 23 HG11 VAL 23 -1.287 10.831 6.308 171 HG12 VAL 23 HG12 VAL 23 -0.338 10.083 7.597 172 HG13 VAL 23 HG13 VAL 23 -1.972 9.503 7.256 173 HG21 VAL 23 HG21 VAL 23 0.583 7.728 7.287 174 HG22 VAL 23 HG22 VAL 23 0.366 6.901 5.745 175 HG23 VAL 23 HG23 VAL 23 -0.995 7.061 6.853 176 H MET 24 H MET 24 -1.802 6.169 4.520 177 HA MET 24 HA MET 24 0.045 5.517 2.429 178 HB2 MET 24 HB2 MET 24 -0.837 3.227 2.626 179 HB3 MET 24 HB3 MET 24 -0.501 3.903 4.211 180 HG2 MET 24 HG2 MET 24 -3.245 3.677 2.963 181 HG3 MET 24 HG3 MET 24 -2.573 2.581 4.170 182 HE1 MET 24 HE1 MET 24 -4.878 3.013 5.510 183 HE2 MET 24 HE2 MET 24 -5.411 4.209 4.329 184 HE3 MET 24 HE3 MET 24 -5.402 4.606 6.049 185 H THR 25 H THR 25 -3.443 6.102 2.614 186 HA THR 25 HA THR 25 -4.203 5.714 -0.066 187 HB THR 25 HB THR 25 -5.188 7.813 1.926 188 HG1 THR 25 HG1 THR 25 -6.651 5.522 1.480 189 HG21 THR 25 HG21 THR 25 -5.987 8.359 -0.332 190 HG22 THR 25 HG22 THR 25 -7.322 7.737 0.644 191 HG23 THR 25 HG23 THR 25 -6.553 6.696 -0.556 192 H HIS 26 H HIS 26 -2.778 8.438 1.640 193 HA HIS 26 HA HIS 26 -3.016 10.450 -0.288 194 HB2 HIS 26 HB2 HIS 26 -2.501 10.658 2.232 195 HB3 HIS 26 HB3 HIS 26 -0.829 10.286 1.837 196 HD1 HIS 26 HD1 HIS 26 0.596 12.272 1.257 197 HD2 HIS 26 HD2 HIS 26 -3.466 13.063 1.013 198 HE1 HIS 26 HE1 HIS 26 0.421 14.715 0.686 199 HE2 HIS 26 HE2 HIS 26 -2.046 15.175 0.533 200 H VAL 27 H VAL 27 -0.222 8.355 0.548 201 HA VAL 27 HA VAL 27 1.541 9.424 -1.373 202 HB VAL 27 HB VAL 27 3.024 7.510 -0.946 203 HG11 VAL 27 HG11 VAL 27 1.754 8.587 1.599 204 HG12 VAL 27 HG12 VAL 27 3.028 9.361 0.657 205 HG13 VAL 27 HG13 VAL 27 3.354 7.840 1.488 206 HG21 VAL 27 HG21 VAL 27 1.410 5.666 -0.813 207 HG22 VAL 27 HG22 VAL 27 0.765 6.310 0.696 208 HG23 VAL 27 HG23 VAL 27 2.421 5.702 0.636 209 H CYS 28 H CYS 28 -0.454 6.467 -1.459 210 HA CYS 28 HA CYS 28 0.238 5.592 -4.025 211 HB2 CYS 28 HB2 CYS 28 -2.300 5.210 -2.393 212 HB3 CYS 28 HB3 CYS 28 -1.971 4.336 -3.887 213 HG CYS 28 HG CYS 28 -0.954 3.702 -0.819 214 H GLY 29 H GLY 29 -2.024 8.052 -2.954 215 HA2 GLY 29 HA2 GLY 29 -3.619 8.366 -5.257 216 HA3 GLY 29 HA3 GLY 29 -3.352 9.575 -4.008 217 H LEU 30 H LEU 30 -0.606 10.011 -4.235 218 HA LEU 30 HA LEU 30 -0.502 11.788 -6.468 219 HB2 LEU 30 HB2 LEU 30 1.506 10.960 -4.380 220 HB3 LEU 30 HB3 LEU 30 2.070 11.844 -5.783 221 HG LEU 30 HG LEU 30 1.756 13.489 -4.120 222 HD11 LEU 30 HD11 LEU 30 0.874 14.205 -6.268 223 HD12 LEU 30 HD12 LEU 30 -0.009 14.961 -4.951 224 HD13 LEU 30 HD13 LEU 30 -0.737 13.620 -5.842 225 HD21 LEU 30 HD21 LEU 30 -0.997 12.402 -3.489 226 HD22 LEU 30 HD22 LEU 30 -0.223 13.813 -2.754 227 HD23 LEU 30 HD23 LEU 30 0.458 12.210 -2.505 228 H PHE 31 H PHE 31 1.031 8.624 -5.885 229 HA PHE 31 HA PHE 31 2.589 8.696 -8.308 230 HB2 PHE 31 HB2 PHE 31 1.953 6.292 -6.549 231 HB3 PHE 31 HB3 PHE 31 3.251 6.403 -7.745 232 HD1 PHE 31 HD2 PHE 31 4.470 9.012 -7.300 233 HD2 PHE 31 HD1 PHE 31 2.966 6.245 -4.404 234 HE1 PHE 31 HE2 PHE 31 5.932 10.002 -5.584 235 HE2 PHE 31 HE1 PHE 31 4.424 7.252 -2.699 236 HZ PHE 31 HZ PHE 31 5.910 9.125 -3.282 237 H ALA 32 H ALA 32 -0.595 7.534 -7.521 238 HA ALA 32 HA ALA 32 -1.261 6.061 -9.832 239 HB1 ALA 32 HB1 ALA 32 -3.601 6.581 -9.229 240 HB2 ALA 32 HB2 ALA 32 -3.042 7.830 -8.110 241 HB3 ALA 32 HB3 ALA 32 -2.668 6.137 -7.801 242 H ARG 33 H ARG 33 -1.583 9.539 -9.090 243 HA ARG 33 HA ARG 33 -2.920 10.150 -11.593 244 HB2 ARG 33 HB2 ARG 33 -3.178 12.391 -10.704 245 HB3 ARG 33 HB3 ARG 33 -3.538 11.238 -9.424 246 HG2 ARG 33 HG2 ARG 33 -1.245 11.604 -8.504 247 HG3 ARG 33 HG3 ARG 33 -0.975 12.832 -9.740 248 HD2 ARG 33 HD2 ARG 33 -3.103 12.924 -7.579 249 HD3 ARG 33 HD3 ARG 33 -1.601 13.854 -7.601 250 HE ARG 33 HE ARG 33 -2.717 14.586 -9.922 251 HH11 ARG 33 HH11 ARG 33 -4.077 14.493 -6.679 252 HH12 ARG 33 HH12 ARG 33 -5.184 15.797 -6.984 253 HH21 ARG 33 HH21 ARG 33 -4.155 16.278 -10.314 254 HH22 ARG 33 HH22 ARG 33 -5.228 16.812 -9.055 255 H ARG 34 H ARG 34 0.286 9.654 -10.906 256 HA ARG 34 HA ARG 34 1.559 11.823 -12.239 257 HB2 ARG 34 HB2 ARG 34 2.753 10.350 -10.646 258 HB3 ARG 34 HB3 ARG 34 2.547 8.980 -11.722 259 HG2 ARG 34 HG2 ARG 34 4.009 11.399 -12.775 260 HG3 ARG 34 HG3 ARG 34 4.831 10.364 -11.614 261 HD2 ARG 34 HD2 ARG 34 3.635 9.373 -14.220 262 HD3 ARG 34 HD3 ARG 34 5.331 9.802 -13.995 263 HE ARG 34 HE ARG 34 4.432 7.876 -12.071 264 HH11 ARG 34 HH11 ARG 34 5.576 8.127 -15.416 265 HH12 ARG 34 HH12 ARG 34 6.150 6.486 -15.437 266 HH21 ARG 34 HH21 ARG 34 5.213 5.761 -12.161 267 HH22 ARG 34 HH22 ARG 34 5.948 5.165 -13.613 268 H ALA 35 H ALA 35 0.960 8.442 -13.266 269 HA ALA 35 HA ALA 35 -0.090 8.946 -15.803 270 HB1 ALA 35 HB1 ALA 35 2.120 9.893 -16.397 271 HB2 ALA 35 HB2 ALA 35 1.816 8.422 -17.320 272 HB3 ALA 35 HB3 ALA 35 2.915 8.392 -15.933 273 H PHE 36 H PHE 36 2.406 6.812 -14.423 274 HA PHE 36 HA PHE 36 1.178 4.450 -15.651 275 HB2 PHE 36 HB2 PHE 36 3.644 4.926 -15.907 276 HB3 PHE 36 HB3 PHE 36 3.836 4.758 -14.170 277 HD1 PHE 36 HD2 PHE 36 2.930 2.898 -17.271 278 HD2 PHE 36 HD1 PHE 36 4.161 2.581 -13.189 279 HE1 PHE 36 HE2 PHE 36 3.332 0.489 -17.573 280 HE2 PHE 36 HE1 PHE 36 4.558 0.172 -13.499 281 HZ PHE 36 HZ PHE 36 4.145 -0.872 -15.689 282 H ASN 37 H ASN 37 1.139 2.453 -14.348 283 HA ASN 37 HA ASN 37 -0.417 2.589 -11.975 284 HB2 ASN 37 HB2 ASN 37 1.063 0.164 -13.117 285 HB3 ASN 37 HB3 ASN 37 -0.351 0.136 -12.068 286 HD21 ASN 37 HD21 ASN 37 -1.360 -1.199 -13.618 287 HD22 ASN 37 HD22 ASN 37 -2.037 -0.558 -15.069 288 H VAL 38 H VAL 38 0.269 1.161 -9.995 289 HA VAL 38 HA VAL 38 3.134 1.486 -9.312 290 HB VAL 38 HB VAL 38 0.735 0.873 -7.515 291 HG11 VAL 38 HG11 VAL 38 2.637 -0.469 -6.715 292 HG12 VAL 38 HG12 VAL 38 2.340 0.870 -5.606 293 HG13 VAL 38 HG13 VAL 38 3.685 0.954 -6.747 294 HG21 VAL 38 HG21 VAL 38 2.675 3.215 -7.536 295 HG22 VAL 38 HG22 VAL 38 1.319 3.000 -6.423 296 HG23 VAL 38 HG23 VAL 38 1.013 3.251 -8.143 297 H GLU 39 H GLU 39 4.414 -0.238 -9.190 298 HA GLU 39 HA GLU 39 3.574 -2.818 -10.164 299 HB2 GLU 39 HB2 GLU 39 5.723 -1.779 -10.806 300 HB3 GLU 39 HB3 GLU 39 6.239 -1.757 -9.124 301 HG2 GLU 39 HG2 GLU 39 6.283 -4.227 -9.111 302 HG3 GLU 39 HG3 GLU 39 5.779 -4.245 -10.803 303 H GLY 40 H GLY 40 5.109 -1.649 -7.117 304 HA2 GLY 40 HA2 GLY 40 3.803 -3.816 -5.582 305 HA3 GLY 40 HA3 GLY 40 5.559 -3.709 -5.560 306 H ILE 41 H ILE 41 3.593 -3.425 -3.364 307 HA ILE 41 HA ILE 41 4.658 -0.881 -2.253 308 HB ILE 41 HB ILE 41 1.832 -1.937 -1.703 309 HG12 ILE 41 HG12 ILE 41 2.648 0.529 -3.298 310 HG13 ILE 41 HG13 ILE 41 1.987 -0.951 -3.975 311 HG21 ILE 41 HG21 ILE 41 1.480 0.141 -0.416 312 HG22 ILE 41 HG22 ILE 41 3.146 0.626 -0.729 313 HG23 ILE 41 HG23 ILE 41 2.817 -0.799 0.256 314 HD11 ILE 41 HD11 ILE 41 0.306 0.767 -3.873 315 HD12 ILE 41 HD12 ILE 41 0.547 0.957 -2.138 316 HD13 ILE 41 HD13 ILE 41 -0.115 -0.549 -2.780 317 H LEU 42 H LEU 42 5.493 -1.099 -0.208 318 HA LEU 42 HA LEU 42 4.629 -3.356 1.483 319 HB2 LEU 42 HB2 LEU 42 6.736 -4.121 0.509 320 HB3 LEU 42 HB3 LEU 42 7.534 -2.617 0.946 321 HG LEU 42 HG LEU 42 7.247 -3.198 3.375 322 HD11 LEU 42 HD11 LEU 42 6.213 -5.853 2.359 323 HD12 LEU 42 HD12 LEU 42 5.295 -4.638 3.254 324 HD13 LEU 42 HD13 LEU 42 6.638 -5.476 4.032 325 HD21 LEU 42 HD21 LEU 42 8.976 -4.924 3.452 326 HD22 LEU 42 HD22 LEU 42 9.333 -3.696 2.240 327 HD23 LEU 42 HD23 LEU 42 8.714 -5.272 1.739 328 H CYS 43 H CYS 43 3.482 -2.026 2.846 329 HA CYS 43 HA CYS 43 4.757 0.270 4.149 330 HB2 CYS 43 HB2 CYS 43 2.399 0.457 3.486 331 HB3 CYS 43 HB3 CYS 43 1.985 -0.952 4.454 332 HG CYS 43 HG CYS 43 2.597 0.334 6.897 333 H LEU 44 H LEU 44 6.373 -0.611 5.370 334 HA LEU 44 HA LEU 44 5.914 -2.840 7.214 335 HB2 LEU 44 HB2 LEU 44 8.006 -2.529 5.716 336 HB3 LEU 44 HB3 LEU 44 8.469 -1.247 6.816 337 HG LEU 44 HG LEU 44 8.349 -3.049 8.693 338 HD11 LEU 44 HD11 LEU 44 8.446 -4.889 6.287 339 HD12 LEU 44 HD12 LEU 44 7.114 -4.742 7.440 340 HD13 LEU 44 HD13 LEU 44 8.672 -5.365 7.972 341 HD21 LEU 44 HD21 LEU 44 10.516 -3.277 6.575 342 HD22 LEU 44 HD22 LEU 44 10.641 -3.819 8.253 343 HD23 LEU 44 HD23 LEU 44 10.470 -2.103 7.892 344 HA PRO 45 HA PRO 45 5.031 0.460 10.268 345 HB2 PRO 45 HB2 PRO 45 4.121 -1.118 12.310 346 HB3 PRO 45 HB3 PRO 45 3.160 -0.819 10.849 347 HG2 PRO 45 HG2 PRO 45 4.841 -3.211 11.526 348 HG3 PRO 45 HG3 PRO 45 3.206 -3.150 10.830 349 HD2 PRO 45 HD2 PRO 45 5.446 -3.538 9.302 350 HD3 PRO 45 HD3 PRO 45 3.986 -2.727 8.686 351 H ILE 46 H ILE 46 6.129 1.400 11.910 352 HA ILE 46 HA ILE 46 8.541 0.092 13.007 353 HB ILE 46 HB ILE 46 7.807 3.023 12.585 354 HG12 ILE 46 HG12 ILE 46 10.113 3.066 11.474 355 HG13 ILE 46 HG13 ILE 46 10.162 1.318 11.651 356 HG21 ILE 46 HG21 ILE 46 9.841 3.731 13.777 357 HG22 ILE 46 HG22 ILE 46 10.148 2.064 14.267 358 HG23 ILE 46 HG23 ILE 46 8.721 2.906 14.860 359 HD11 ILE 46 HD11 ILE 46 9.529 1.907 9.424 360 HD12 ILE 46 HD12 ILE 46 8.218 2.922 10.013 361 HD13 ILE 46 HD13 ILE 46 8.145 1.174 10.231 362 H GLN 47 H GLN 47 8.545 -0.480 15.116 363 HA GLN 47 HA GLN 47 6.220 0.047 16.802 364 HB2 GLN 47 HB2 GLN 47 7.270 -1.546 18.395 365 HB3 GLN 47 HB3 GLN 47 7.139 -2.222 16.782 366 HG2 GLN 47 HG2 GLN 47 9.532 -1.769 16.382 367 HG3 GLN 47 HG3 GLN 47 9.671 -1.091 18.002 368 HE21 GLN 47 HE21 GLN 47 11.068 -3.393 16.770 369 HE22 GLN 47 HE22 GLN 47 10.747 -4.732 17.815 370 H ASP 48 H ASP 48 9.488 1.147 16.464 371 HA ASP 48 HA ASP 48 10.085 2.029 19.053 372 HB2 ASP 48 HB2 ASP 48 11.766 1.712 17.261 373 HB3 ASP 48 HB3 ASP 48 11.106 3.075 16.370 374 H SER 49 H SER 49 8.550 3.678 16.357 375 HA SER 49 HA SER 49 7.286 5.663 18.075 376 HB2 SER 49 HB2 SER 49 8.990 6.462 15.665 377 HB3 SER 49 HB3 SER 49 7.981 7.557 16.612 378 HG SER 49 HG SER 49 9.449 6.498 18.407 379 H ASP 50 H ASP 50 5.492 6.808 16.847 380 HA ASP 50 HA ASP 50 4.032 4.906 15.271 381 HB2 ASP 50 HB2 ASP 50 2.230 6.613 15.174 382 HB3 ASP 50 HB3 ASP 50 2.816 6.369 16.811 383 H LYS 51 H LYS 51 5.452 4.572 13.520 384 HA LYS 51 HA LYS 51 5.142 6.374 11.241 385 HB2 LYS 51 HB2 LYS 51 7.851 5.435 12.288 386 HB3 LYS 51 HB3 LYS 51 7.614 6.048 10.655 387 HG2 LYS 51 HG2 LYS 51 6.921 8.235 11.561 388 HG3 LYS 51 HG3 LYS 51 7.125 7.625 13.203 389 HD2 LYS 51 HD2 LYS 51 9.355 7.864 11.143 390 HD3 LYS 51 HD3 LYS 51 9.055 9.009 12.451 391 HE2 LYS 51 HE2 LYS 51 9.508 7.251 14.115 392 HE3 LYS 51 HE3 LYS 51 9.763 6.077 12.821 393 HZ1 LYS 51 HZ1 LYS 51 11.405 8.506 13.305 394 HZ2 LYS 51 HZ2 LYS 51 11.643 7.388 12.061 395 HZ3 LYS 51 HZ3 LYS 51 11.854 6.919 13.664 396 H SER 52 H SER 52 5.866 5.305 9.244 397 HA SER 52 HA SER 52 6.275 2.463 9.165 398 HB2 SER 52 HB2 SER 52 3.763 2.645 9.324 399 HB3 SER 52 HB3 SER 52 3.769 3.631 7.858 400 HG SER 52 HG SER 52 4.223 1.900 6.680 401 H HIS 53 H HIS 53 7.608 2.062 7.442 402 HA HIS 53 HA HIS 53 7.996 4.185 5.422 403 HB2 HIS 53 HB2 HIS 53 9.641 1.662 5.910 404 HB3 HIS 53 HB3 HIS 53 10.004 2.894 4.709 405 HD1 HIS 53 HD1 HIS 53 10.317 5.425 5.966 406 HD2 HIS 53 HD2 HIS 53 11.132 1.982 8.141 407 HE1 HIS 53 HE1 HIS 53 11.803 6.146 7.858 408 HE2 HIS 53 HE2 HIS 53 12.458 4.017 9.001 409 H ILE 54 H ILE 54 7.199 3.958 3.396 410 HA ILE 54 HA ILE 54 6.033 1.361 2.572 411 HB ILE 54 HB ILE 54 5.461 4.204 1.591 412 HG12 ILE 54 HG12 ILE 54 3.064 3.595 2.221 413 HG13 ILE 54 HG13 ILE 54 3.682 2.113 2.934 414 HG21 ILE 54 HG21 ILE 54 5.523 2.733 -0.377 415 HG22 ILE 54 HG22 ILE 54 3.863 3.222 -0.032 416 HG23 ILE 54 HG23 ILE 54 4.414 1.606 0.411 417 HD11 ILE 54 HD11 ILE 54 3.206 3.804 4.605 418 HD12 ILE 54 HD12 ILE 54 4.338 4.912 3.833 419 HD13 ILE 54 HD13 ILE 54 4.927 3.422 4.571 420 H TRP 55 H TRP 55 7.378 0.179 1.277 421 HA TRP 55 HA TRP 55 9.302 1.445 -0.528 422 HB2 TRP 55 HB2 TRP 55 8.635 -1.461 0.156 423 HB3 TRP 55 HB3 TRP 55 9.692 -1.055 -1.193 424 HD1 TRP 55 HD1 TRP 55 12.196 -0.660 -0.624 425 HE1 TRP 55 HE1 TRP 55 13.585 -0.469 1.519 426 HE3 TRP 55 HE3 TRP 55 8.427 -0.655 2.789 427 HZ2 TRP 55 HZ2 TRP 55 13.164 -0.351 4.284 428 HZ3 TRP 55 HZ3 TRP 55 9.005 -0.510 5.162 429 HH2 TRP 55 HH2 TRP 55 11.323 -0.364 5.909 430 H LEU 56 H LEU 56 8.142 2.503 -2.027 431 HA LEU 56 HA LEU 56 5.884 1.258 -3.429 432 HB2 LEU 56 HB2 LEU 56 5.949 3.666 -2.399 433 HB3 LEU 56 HB3 LEU 56 6.930 4.094 -3.779 434 HG LEU 56 HG LEU 56 4.605 4.791 -4.081 435 HD11 LEU 56 HD11 LEU 56 5.252 2.573 -6.038 436 HD12 LEU 56 HD12 LEU 56 5.830 4.238 -6.118 437 HD13 LEU 56 HD13 LEU 56 4.111 3.901 -6.291 438 HD21 LEU 56 HD21 LEU 56 2.755 3.201 -4.302 439 HD22 LEU 56 HD22 LEU 56 3.477 3.138 -2.697 440 HD23 LEU 56 HD23 LEU 56 3.833 1.869 -3.874 441 H LEU 57 H LEU 57 6.597 -0.021 -5.044 442 HA LEU 57 HA LEU 57 8.968 0.566 -6.648 443 HB2 LEU 57 HB2 LEU 57 7.145 -1.839 -6.360 444 HB3 LEU 57 HB3 LEU 57 8.179 -1.693 -7.770 445 HG LEU 57 HG LEU 57 10.189 -1.724 -6.356 446 HD11 LEU 57 HD11 LEU 57 8.339 -2.034 -3.978 447 HD12 LEU 57 HD12 LEU 57 9.368 -0.643 -4.341 448 HD13 LEU 57 HD13 LEU 57 10.099 -2.198 -3.956 449 HD21 LEU 57 HD21 LEU 57 9.332 -3.836 -7.203 450 HD22 LEU 57 HD22 LEU 57 8.293 -4.021 -5.787 451 HD23 LEU 57 HD23 LEU 57 10.051 -4.070 -5.608 452 H VAL 58 H VAL 58 8.682 1.912 -8.273 453 HA VAL 58 HA VAL 58 6.641 1.438 -10.319 454 HB VAL 58 HB VAL 58 5.629 3.113 -8.669 455 HG11 VAL 58 HG11 VAL 58 7.759 5.017 -9.682 456 HG12 VAL 58 HG12 VAL 58 7.652 4.350 -8.052 457 HG13 VAL 58 HG13 VAL 58 6.392 5.435 -8.638 458 HG21 VAL 58 HG21 VAL 58 4.753 4.637 -10.392 459 HG22 VAL 58 HG22 VAL 58 4.807 2.971 -10.970 460 HG23 VAL 58 HG23 VAL 58 6.034 4.126 -11.498 461 H ASN 59 H ASN 59 7.416 2.280 -12.425 462 HA ASN 59 HA ASN 59 10.196 2.962 -12.561 463 HB2 ASN 59 HB2 ASN 59 9.715 3.632 -14.969 464 HB3 ASN 59 HB3 ASN 59 9.329 1.973 -14.543 465 HD21 ASN 59 HD21 ASN 59 7.367 1.251 -14.969 466 HD22 ASN 59 HD22 ASN 59 6.043 2.210 -15.520 467 H ASP 60 H ASP 60 11.176 4.884 -12.325 468 HA ASP 60 HA ASP 60 9.832 7.204 -11.462 469 HB2 ASP 60 HB2 ASP 60 12.149 6.663 -10.795 470 HB3 ASP 60 HB3 ASP 60 12.695 6.924 -12.440 471 H ASP 61 H ASP 61 9.819 9.249 -12.434 472 HA ASP 61 HA ASP 61 9.907 9.458 -15.360 473 HB2 ASP 61 HB2 ASP 61 7.559 8.732 -14.457 474 HB3 ASP 61 HB3 ASP 61 7.456 10.333 -13.752 475 H GLN 62 H GLN 62 10.091 11.698 -15.987 476 HA GLN 62 HA GLN 62 11.438 13.472 -14.245 477 HB2 GLN 62 HB2 GLN 62 9.971 14.071 -16.854 478 HB3 GLN 62 HB3 GLN 62 11.124 15.152 -16.070 479 HG2 GLN 62 HG2 GLN 62 12.934 13.538 -16.414 480 HG3 GLN 62 HG3 GLN 62 11.792 12.369 -17.078 481 HE21 GLN 62 HE21 GLN 62 12.898 12.228 -19.043 482 HE22 GLN 62 HE22 GLN 62 12.896 13.505 -20.206 483 H ARG 63 H ARG 63 8.087 13.066 -15.093 484 HA ARG 63 HA ARG 63 7.055 15.312 -13.620 485 HB2 ARG 63 HB2 ARG 63 5.993 14.360 -15.665 486 HB3 ARG 63 HB3 ARG 63 5.638 12.876 -14.789 487 HG2 ARG 63 HG2 ARG 63 4.030 13.985 -13.389 488 HG3 ARG 63 HG3 ARG 63 4.572 15.581 -13.914 489 HD2 ARG 63 HD2 ARG 63 3.179 13.525 -15.668 490 HD3 ARG 63 HD3 ARG 63 2.431 14.967 -14.971 491 HE ARG 63 HE ARG 63 4.581 15.916 -16.386 492 HH11 ARG 63 HH11 ARG 63 1.732 14.033 -17.267 493 HH12 ARG 63 HH12 ARG 63 1.706 14.637 -18.893 494 HH21 ARG 63 HH21 ARG 63 4.532 16.680 -18.499 495 HH22 ARG 63 HH22 ARG 63 3.295 16.139 -19.594 496 H LEU 64 H LEU 64 7.719 11.894 -12.939 497 HA LEU 64 HA LEU 64 6.160 11.621 -10.573 498 HB2 LEU 64 HB2 LEU 64 7.247 9.691 -11.839 499 HB3 LEU 64 HB3 LEU 64 8.782 10.178 -11.147 500 HG LEU 64 HG LEU 64 7.442 9.881 -8.820 501 HD11 LEU 64 HD11 LEU 64 5.955 7.946 -10.606 502 HD12 LEU 64 HD12 LEU 64 5.272 9.392 -9.848 503 HD13 LEU 64 HD13 LEU 64 5.845 8.061 -8.844 504 HD21 LEU 64 HD21 LEU 64 8.292 7.637 -8.574 505 HD22 LEU 64 HD22 LEU 64 9.469 8.616 -9.450 506 HD23 LEU 64 HD23 LEU 64 8.455 7.460 -10.322 507 H GLU 65 H GLU 65 9.467 12.753 -11.208 508 HA GLU 65 HA GLU 65 10.476 13.082 -8.631 509 HB2 GLU 65 HB2 GLU 65 10.930 14.910 -11.037 510 HB3 GLU 65 HB3 GLU 65 11.951 14.831 -9.604 511 HG2 GLU 65 HG2 GLU 65 12.555 12.500 -10.166 512 HG3 GLU 65 HG3 GLU 65 11.536 12.594 -11.604 513 H GLN 66 H GLN 66 8.650 15.392 -10.617 514 HA GLN 66 HA GLN 66 8.408 17.529 -8.798 515 HB2 GLN 66 HB2 GLN 66 7.937 17.752 -11.212 516 HB3 GLN 66 HB3 GLN 66 6.578 16.641 -11.080 517 HG2 GLN 66 HG2 GLN 66 5.490 18.330 -9.522 518 HG3 GLN 66 HG3 GLN 66 6.783 19.448 -9.953 519 HE21 GLN 66 HE21 GLN 66 3.970 17.722 -11.126 520 HE22 GLN 66 HE22 GLN 66 3.749 18.662 -12.559 521 H MET 67 H MET 67 6.427 14.673 -9.360 522 HA MET 67 HA MET 67 4.200 15.311 -7.733 523 HB2 MET 67 HB2 MET 67 4.365 13.576 -9.614 524 HB3 MET 67 HB3 MET 67 5.208 12.532 -8.477 525 HG2 MET 67 HG2 MET 67 2.904 11.867 -8.585 526 HG3 MET 67 HG3 MET 67 3.199 12.592 -7.006 527 HE1 MET 67 HE1 MET 67 1.462 13.008 -10.509 528 HE2 MET 67 HE2 MET 67 2.599 14.359 -10.526 529 HE3 MET 67 HE3 MET 67 0.867 14.669 -10.420 530 H ILE 68 H ILE 68 7.186 13.522 -7.148 531 HA ILE 68 HA ILE 68 6.789 12.675 -4.469 532 HB ILE 68 HB ILE 68 9.295 13.127 -6.161 533 HG12 ILE 68 HG12 ILE 68 8.034 10.516 -5.201 534 HG13 ILE 68 HG13 ILE 68 7.758 11.223 -6.787 535 HG21 ILE 68 HG21 ILE 68 9.234 11.924 -3.375 536 HG22 ILE 68 HG22 ILE 68 9.987 13.452 -3.833 537 HG23 ILE 68 HG23 ILE 68 10.632 11.930 -4.454 538 HD11 ILE 68 HD11 ILE 68 10.153 10.997 -7.287 539 HD12 ILE 68 HD12 ILE 68 9.374 9.456 -6.935 540 HD13 ILE 68 HD13 ILE 68 10.392 10.224 -5.717 541 H SER 69 H SER 69 8.174 15.571 -5.953 542 HA SER 69 HA SER 69 9.166 16.808 -3.597 543 HB2 SER 69 HB2 SER 69 8.439 18.034 -6.288 544 HB3 SER 69 HB3 SER 69 9.397 18.823 -5.032 545 HG SER 69 HG SER 69 10.180 16.299 -5.997 546 H GLN 70 H GLN 70 5.986 16.721 -5.086 547 HA GLN 70 HA GLN 70 4.962 19.106 -3.829 548 HB2 GLN 70 HB2 GLN 70 4.130 18.215 -6.017 549 HB3 GLN 70 HB3 GLN 70 3.532 16.776 -5.211 550 HG2 GLN 70 HG2 GLN 70 2.515 19.532 -4.476 551 HG3 GLN 70 HG3 GLN 70 1.843 18.639 -5.831 552 HE21 GLN 70 HE21 GLN 70 2.058 16.028 -4.494 553 HE22 GLN 70 HE22 GLN 70 0.813 16.009 -3.300 554 H ILE 71 H ILE 71 4.591 15.588 -3.386 555 HA ILE 71 HA ILE 71 2.837 15.762 -1.150 556 HB ILE 71 HB ILE 71 2.867 13.818 -2.682 557 HG12 ILE 71 HG12 ILE 71 3.383 13.211 0.254 558 HG13 ILE 71 HG13 ILE 71 1.831 13.523 -0.511 559 HG21 ILE 71 HG21 ILE 71 4.597 12.083 -2.567 560 HG22 ILE 71 HG22 ILE 71 5.514 13.049 -1.410 561 HG23 ILE 71 HG23 ILE 71 5.296 13.628 -3.063 562 HD11 ILE 71 HD11 ILE 71 3.588 11.123 -0.890 563 HD12 ILE 71 HD12 ILE 71 2.098 11.435 -1.791 564 HD13 ILE 71 HD13 ILE 71 2.045 11.211 -0.042 565 H ASP 72 H ASP 72 6.306 15.592 -1.486 566 HA ASP 72 HA ASP 72 7.231 14.925 1.033 567 HB2 ASP 72 HB2 ASP 72 8.813 15.173 -0.731 568 HB3 ASP 72 HB3 ASP 72 8.260 16.785 -1.135 569 H LYS 73 H LYS 73 5.907 17.967 -0.121 570 HA LYS 73 HA LYS 73 6.725 19.573 2.115 571 HB2 LYS 73 HB2 LYS 73 4.712 20.161 -0.085 572 HB3 LYS 73 HB3 LYS 73 5.403 21.343 1.024 573 HG2 LYS 73 HG2 LYS 73 7.679 20.825 0.084 574 HG3 LYS 73 HG3 LYS 73 6.905 19.756 -1.088 575 HD2 LYS 73 HD2 LYS 73 7.365 21.909 -2.139 576 HD3 LYS 73 HD3 LYS 73 5.617 21.712 -1.977 577 HE2 LYS 73 HE2 LYS 73 5.604 23.183 -0.021 578 HE3 LYS 73 HE3 LYS 73 7.364 23.307 -0.076 579 HZ1 LYS 73 HZ1 LYS 73 5.493 24.290 -2.166 580 HZ2 LYS 73 HZ2 LYS 73 7.179 24.384 -2.233 581 HZ3 LYS 73 HZ3 LYS 73 6.337 25.242 -1.052 582 H LEU 74 H LEU 74 4.269 17.304 1.818 583 HA LEU 74 HA LEU 74 2.412 18.590 3.682 584 HB2 LEU 74 HB2 LEU 74 2.342 15.963 2.158 585 HB3 LEU 74 HB3 LEU 74 1.209 16.298 3.451 586 HG LEU 74 HG LEU 74 0.114 16.737 1.354 587 HD11 LEU 74 HD11 LEU 74 -0.599 19.059 1.631 588 HD12 LEU 74 HD12 LEU 74 0.780 19.372 2.689 589 HD13 LEU 74 HD13 LEU 74 -0.472 18.229 3.183 590 HD21 LEU 74 HD21 LEU 74 2.071 17.082 -0.081 591 HD22 LEU 74 HD22 LEU 74 2.353 18.663 0.648 592 HD23 LEU 74 HD23 LEU 74 0.889 18.374 -0.298 593 H GLU 75 H GLU 75 1.845 17.589 5.661 594 HA GLU 75 HA GLU 75 4.188 16.940 7.208 595 HB2 GLU 75 HB2 GLU 75 1.287 17.273 8.090 596 HB3 GLU 75 HB3 GLU 75 2.697 17.271 9.149 597 HG2 GLU 75 HG2 GLU 75 3.483 19.376 8.225 598 HG3 GLU 75 HG3 GLU 75 2.240 19.344 6.972 599 H ASP 76 H ASP 76 1.821 15.021 5.638 600 HA ASP 76 HA ASP 76 1.760 12.838 7.502 601 HB2 ASP 76 HB2 ASP 76 0.590 11.585 5.826 602 HB3 ASP 76 HB3 ASP 76 -0.014 13.232 5.731 603 H VAL 77 H VAL 77 3.521 13.528 4.494 604 HA VAL 77 HA VAL 77 5.362 11.311 4.809 605 HB VAL 77 HB VAL 77 5.262 13.672 2.872 606 HG11 VAL 77 HG11 VAL 77 7.252 11.364 2.874 607 HG12 VAL 77 HG12 VAL 77 7.627 13.058 3.199 608 HG13 VAL 77 HG13 VAL 77 7.076 12.570 1.596 609 HG21 VAL 77 HG21 VAL 77 4.771 10.699 2.454 610 HG22 VAL 77 HG22 VAL 77 4.679 11.951 1.211 611 HG23 VAL 77 HG23 VAL 77 3.527 11.952 2.548 612 H VAL 78 H VAL 78 6.477 11.509 6.645 613 HA VAL 78 HA VAL 78 7.466 13.898 7.826 614 HB VAL 78 HB VAL 78 8.571 11.092 8.341 615 HG11 VAL 78 HG11 VAL 78 8.254 13.465 10.220 616 HG12 VAL 78 HG12 VAL 78 9.769 12.935 9.478 617 HG13 VAL 78 HG13 VAL 78 8.941 11.891 10.634 618 HG21 VAL 78 HG21 VAL 78 6.793 10.747 10.015 619 HG22 VAL 78 HG22 VAL 78 6.119 10.928 8.395 620 HG23 VAL 78 HG23 VAL 78 6.036 12.269 9.538 621 H LYS 79 H LYS 79 8.947 11.348 5.862 622 HA LYS 79 HA LYS 79 10.907 13.207 4.733 623 HB2 LYS 79 HB2 LYS 79 11.712 10.484 5.885 624 HB3 LYS 79 HB3 LYS 79 12.749 11.499 4.890 625 HG2 LYS 79 HG2 LYS 79 12.809 13.212 6.623 626 HG3 LYS 79 HG3 LYS 79 11.674 12.286 7.609 627 HD2 LYS 79 HD2 LYS 79 13.324 10.467 7.836 628 HD3 LYS 79 HD3 LYS 79 14.456 11.343 6.800 629 HE2 LYS 79 HE2 LYS 79 13.455 12.260 9.520 630 HE3 LYS 79 HE3 LYS 79 15.053 11.598 9.165 631 HZ1 LYS 79 HZ1 LYS 79 15.473 13.489 7.717 632 HZ2 LYS 79 HZ2 LYS 79 15.110 13.998 9.284 633 HZ3 LYS 79 HZ3 LYS 79 13.946 14.129 8.067 634 H VAL 80 H VAL 80 11.565 12.539 2.591 635 HA VAL 80 HA VAL 80 10.294 10.078 1.521 636 HB VAL 80 HB VAL 80 8.953 12.160 0.840 637 HG11 VAL 80 HG11 VAL 80 9.779 13.594 -0.960 638 HG12 VAL 80 HG12 VAL 80 11.356 12.805 -0.881 639 HG13 VAL 80 HG13 VAL 80 10.776 13.750 0.491 640 HG21 VAL 80 HG21 VAL 80 10.146 10.516 -1.416 641 HG22 VAL 80 HG22 VAL 80 8.650 11.448 -1.501 642 HG23 VAL 80 HG23 VAL 80 8.766 10.065 -0.412 643 H GLN 81 H GLN 81 11.674 8.844 0.262 644 HA GLN 81 HA GLN 81 13.956 10.166 -1.074 645 HB2 GLN 81 HB2 GLN 81 14.120 7.589 0.549 646 HB3 GLN 81 HB3 GLN 81 15.368 8.114 -0.579 647 HG2 GLN 81 HG2 GLN 81 15.735 10.141 0.774 648 HG3 GLN 81 HG3 GLN 81 14.498 9.608 1.909 649 HE21 GLN 81 HE21 GLN 81 17.728 9.076 0.732 650 HE22 GLN 81 HE22 GLN 81 18.249 8.040 2.014 651 H ARG 82 H ARG 82 14.532 9.296 -3.024 652 HA ARG 82 HA ARG 82 13.095 6.917 -4.026 653 HB2 ARG 82 HB2 ARG 82 13.142 7.893 -6.288 654 HB3 ARG 82 HB3 ARG 82 12.231 8.913 -5.185 655 HG2 ARG 82 HG2 ARG 82 13.954 10.564 -5.133 656 HG3 ARG 82 HG3 ARG 82 15.109 9.491 -5.918 657 HD2 ARG 82 HD2 ARG 82 13.486 9.527 -7.944 658 HD3 ARG 82 HD3 ARG 82 12.739 10.920 -7.143 659 HE ARG 82 HE ARG 82 15.244 11.713 -7.117 660 HH11 ARG 82 HH11 ARG 82 13.540 10.180 -9.786 661 HH12 ARG 82 HH12 ARG 82 14.528 10.947 -10.986 662 HH21 ARG 82 HH21 ARG 82 16.569 12.625 -8.677 663 HH22 ARG 82 HH22 ARG 82 16.248 12.339 -10.355 664 H ASN 83 H ASN 83 14.539 5.320 -4.132 665 HA ASN 83 HA ASN 83 17.265 5.826 -5.208 666 HB2 ASN 83 HB2 ASN 83 16.297 3.948 -3.009 667 HB3 ASN 83 HB3 ASN 83 17.774 3.595 -3.901 668 HD21 ASN 83 HD21 ASN 83 16.231 5.945 -1.780 669 HD22 ASN 83 HD22 ASN 83 17.683 6.672 -1.206 670 H GLN 84 H GLN 84 17.632 4.851 -7.081 671 HA GLN 84 HA GLN 84 15.686 2.961 -8.189 672 HB2 GLN 84 HB2 GLN 84 17.042 3.172 -10.328 673 HB3 GLN 84 HB3 GLN 84 16.329 4.674 -9.773 674 HG2 GLN 84 HG2 GLN 84 19.237 3.946 -9.313 675 HG3 GLN 84 HG3 GLN 84 18.671 4.846 -10.717 676 HE21 GLN 84 HE21 GLN 84 20.550 5.705 -8.644 677 HE22 GLN 84 HE22 GLN 84 19.873 7.135 -7.950 678 H SER 85 H SER 85 15.955 0.866 -7.906 679 HA SER 85 HA SER 85 18.529 -0.439 -7.720 680 HB2 SER 85 HB2 SER 85 18.236 0.656 -5.458 681 HB3 SER 85 HB3 SER 85 16.758 -0.276 -5.229 682 HG SER 85 HG SER 85 17.904 -2.003 -4.818 683 H ASP 86 H ASP 86 18.088 -2.763 -6.836 684 HA ASP 86 HA ASP 86 16.439 -4.056 -8.735 685 HB2 ASP 86 HB2 ASP 86 18.632 -4.927 -7.761 686 HB3 ASP 86 HB3 ASP 86 17.762 -5.309 -6.282 687 HA PRO 87 HA PRO 87 12.372 -4.098 -6.773 688 HB2 PRO 87 HB2 PRO 87 12.364 -6.923 -7.893 689 HB3 PRO 87 HB3 PRO 87 11.094 -5.675 -7.959 690 HG2 PRO 87 HG2 PRO 87 12.609 -6.095 -10.085 691 HG3 PRO 87 HG3 PRO 87 12.192 -4.432 -9.601 692 HD2 PRO 87 HD2 PRO 87 14.790 -5.895 -9.271 693 HD3 PRO 87 HD3 PRO 87 14.495 -4.171 -9.596 694 H THR 88 H THR 88 14.524 -6.920 -6.234 695 HA THR 88 HA THR 88 12.984 -8.159 -4.195 696 HB THR 88 HB THR 88 14.964 -9.553 -3.729 697 HG1 THR 88 HG1 THR 88 16.553 -8.430 -5.681 698 HG21 THR 88 HG21 THR 88 13.588 -10.132 -5.706 699 HG22 THR 88 HG22 THR 88 15.287 -10.525 -5.975 700 HG23 THR 88 HG23 THR 88 14.591 -9.081 -6.713 701 H MET 89 H MET 89 14.676 -5.260 -3.940 702 HA MET 89 HA MET 89 15.639 -5.214 -1.345 703 HB2 MET 89 HB2 MET 89 15.871 -3.280 -2.823 704 HB3 MET 89 HB3 MET 89 14.129 -3.021 -2.838 705 HG2 MET 89 HG2 MET 89 14.158 -2.380 -0.494 706 HG3 MET 89 HG3 MET 89 15.857 -2.817 -0.355 707 HE1 MET 89 HE1 MET 89 17.612 0.003 -2.421 708 HE2 MET 89 HE2 MET 89 17.186 -1.613 -2.983 709 HE3 MET 89 HE3 MET 89 17.858 -1.386 -1.367 710 H PHE 90 H PHE 90 12.213 -4.917 -2.442 711 HA PHE 90 HA PHE 90 11.099 -4.312 0.090 712 HB2 PHE 90 HB2 PHE 90 8.963 -4.506 -0.868 713 HB3 PHE 90 HB3 PHE 90 9.945 -4.151 -2.275 714 HD1 PHE 90 HD2 PHE 90 10.385 -5.953 -3.974 715 HD2 PHE 90 HD1 PHE 90 7.811 -6.650 -0.632 716 HE1 PHE 90 HE2 PHE 90 9.502 -7.973 -5.071 717 HE2 PHE 90 HE1 PHE 90 6.932 -8.668 -1.733 718 HZ PHE 90 HZ PHE 90 7.778 -9.326 -3.946 719 H ASN 91 H ASN 91 11.764 -7.364 -1.546 720 HA ASN 91 HA ASN 91 10.628 -9.155 0.336 721 HB2 ASN 91 HB2 ASN 91 11.260 -9.734 -2.023 722 HB3 ASN 91 HB3 ASN 91 12.956 -9.595 -1.595 723 HD21 ASN 91 HD21 ASN 91 11.542 -11.851 -2.694 724 HD22 ASN 91 HD22 ASN 91 11.746 -13.154 -1.579 725 H LYS 92 H LYS 92 13.804 -7.634 0.022 726 HA LYS 92 HA LYS 92 15.316 -9.238 1.742 727 HB2 LYS 92 HB2 LYS 92 16.118 -7.494 0.021 728 HB3 LYS 92 HB3 LYS 92 15.858 -6.271 1.252 729 HG2 LYS 92 HG2 LYS 92 17.687 -8.647 1.699 730 HG3 LYS 92 HG3 LYS 92 18.254 -7.174 0.919 731 HD2 LYS 92 HD2 LYS 92 17.803 -5.878 2.942 732 HD3 LYS 92 HD3 LYS 92 17.063 -7.280 3.721 733 HE2 LYS 92 HE2 LYS 92 19.362 -6.890 4.537 734 HE3 LYS 92 HE3 LYS 92 19.222 -8.446 3.721 735 HZ1 LYS 92 HZ1 LYS 92 20.242 -7.490 1.765 736 HZ2 LYS 92 HZ2 LYS 92 21.242 -7.252 3.106 737 HZ3 LYS 92 HZ3 LYS 92 20.323 -5.968 2.503 738 H ILE 93 H ILE 93 13.773 -6.042 2.506 739 HA ILE 93 HA ILE 93 14.455 -6.352 5.310 740 HB ILE 93 HB ILE 93 13.345 -4.305 5.849 741 HG12 ILE 93 HG12 ILE 93 11.286 -4.650 4.374 742 HG13 ILE 93 HG13 ILE 93 11.910 -3.012 4.434 743 HG21 ILE 93 HG21 ILE 93 14.502 -2.700 4.380 744 HG22 ILE 93 HG22 ILE 93 14.796 -3.981 3.204 745 HG23 ILE 93 HG23 ILE 93 15.536 -4.066 4.804 746 HD11 ILE 93 HD11 ILE 93 11.213 -3.612 2.216 747 HD12 ILE 93 HD12 ILE 93 12.331 -4.974 2.200 748 HD13 ILE 93 HD13 ILE 93 12.951 -3.321 2.259 749 H ALA 94 H ALA 94 11.625 -7.108 3.339 750 HA ALA 94 HA ALA 94 9.682 -7.412 5.333 751 HB1 ALA 94 HB1 ALA 94 8.560 -8.983 3.797 752 HB2 ALA 94 HB2 ALA 94 10.033 -9.095 2.828 753 HB3 ALA 94 HB3 ALA 94 9.163 -7.564 2.934 754 H VAL 95 H VAL 95 11.979 -9.870 4.085 755 HA VAL 95 HA VAL 95 11.253 -11.859 6.010 756 HB VAL 95 HB VAL 95 12.159 -12.454 3.768 757 HG11 VAL 95 HG11 VAL 95 13.880 -10.744 3.499 758 HG12 VAL 95 HG12 VAL 95 14.580 -12.352 3.301 759 HG13 VAL 95 HG13 VAL 95 14.831 -11.457 4.803 760 HG21 VAL 95 HG21 VAL 95 13.600 -14.331 4.499 761 HG22 VAL 95 HG22 VAL 95 12.204 -14.130 5.558 762 HG23 VAL 95 HG23 VAL 95 13.790 -13.565 6.082 763 H PHE 96 H PHE 96 13.696 -9.333 5.872 764 HA PHE 96 HA PHE 96 15.329 -10.193 8.038 765 HB2 PHE 96 HB2 PHE 96 16.102 -8.586 6.329 766 HB3 PHE 96 HB3 PHE 96 14.925 -7.400 6.877 767 HD1 PHE 96 HD2 PHE 96 17.920 -9.354 8.008 768 HD2 PHE 96 HD1 PHE 96 15.533 -5.846 8.599 769 HE1 PHE 96 HE2 PHE 96 19.566 -8.494 9.622 770 HE2 PHE 96 HE1 PHE 96 17.188 -5.000 10.216 771 HZ PHE 96 HZ PHE 96 19.202 -6.323 10.727 772 H PHE 97 H PHE 97 12.380 -8.321 7.842 773 HA PHE 97 HA PHE 97 12.319 -7.218 10.467 774 HB2 PHE 97 HB2 PHE 97 10.927 -6.319 8.641 775 HB3 PHE 97 HB3 PHE 97 10.078 -7.851 8.487 776 HD1 PHE 97 HD1 PHE 97 10.713 -5.055 10.912 777 HD2 PHE 97 HD2 PHE 97 8.053 -8.181 9.689 778 HE1 PHE 97 HE1 PHE 97 9.008 -4.227 12.479 779 HE2 PHE 97 HE2 PHE 97 6.357 -7.347 11.260 780 HZ PHE 97 HZ PHE 97 6.831 -5.371 12.657 781 H GLN 98 H GLN 98 11.011 -10.152 8.968 782 HA GLN 98 HA GLN 98 10.405 -12.171 9.700 783 HB2 GLN 98 HB2 GLN 98 12.474 -12.085 11.060 784 HB3 GLN 98 HB3 GLN 98 11.570 -11.375 12.391 785 HG2 GLN 98 HG2 GLN 98 10.243 -13.412 12.608 786 HG3 GLN 98 HG3 GLN 98 11.078 -14.126 11.222 787 HE21 GLN 98 HE21 GLN 98 13.266 -14.746 11.457 788 HE22 GLN 98 HE22 GLN 98 13.982 -14.998 13.011 789 H1 GLY 1 H1 GLY 1 -13.982 -1.421 16.605 790 H2 GLY 1 H2 GLY 1 -14.830 -2.265 17.789 791 H3 GLY 1 H3 GLY 1 -15.030 -2.671 16.166 792 HA2 GLY 1 HA3 GLY 1 -13.633 -4.296 17.233 793 HA3 GLY 1 HA2 GLY 1 -12.723 -3.382 16.038 794 H SER 2 H SER 2 -10.814 -4.054 17.207 795 HA SER 2 HA SER 2 -10.324 -2.822 19.820 796 HB2 SER 2 HB2 SER 2 -8.565 -4.631 18.110 797 HB3 SER 2 HB3 SER 2 -8.208 -4.109 19.760 798 HG SER 2 HG SER 2 -9.271 -6.257 19.381 799 H MET 3 H MET 3 -7.926 -1.976 19.955 800 HA MET 3 HA MET 3 -7.201 -0.246 17.676 801 HB2 MET 3 HB2 MET 3 -7.517 0.624 20.586 802 HB3 MET 3 HB3 MET 3 -6.644 1.571 19.392 803 HG2 MET 3 HG2 MET 3 -8.722 1.801 18.070 804 HG3 MET 3 HG3 MET 3 -9.590 0.884 19.304 805 HE1 MET 3 HE1 MET 3 -7.586 4.206 18.532 806 HE2 MET 3 HE2 MET 3 -6.719 3.590 19.940 807 HE3 MET 3 HE3 MET 3 -7.700 5.048 20.079 808 H GLN 4 H GLN 4 -6.071 -2.674 18.137 809 HA GLN 4 HA GLN 4 -3.325 -2.121 18.908 810 HB2 GLN 4 HB2 GLN 4 -3.223 -3.778 20.731 811 HB3 GLN 4 HB3 GLN 4 -4.419 -2.545 21.120 812 HG2 GLN 4 HG2 GLN 4 -6.235 -4.057 20.460 813 HG3 GLN 4 HG3 GLN 4 -5.069 -5.295 19.997 814 HE21 GLN 4 HE21 GLN 4 -7.204 -5.525 21.894 815 HE22 GLN 4 HE22 GLN 4 -6.489 -5.900 23.423 816 H ASN 5 H ASN 5 -2.230 -4.516 19.095 817 HA ASN 5 HA ASN 5 -3.571 -6.694 17.823 818 HB2 ASN 5 HB2 ASN 5 -2.730 -5.567 15.781 819 HB3 ASN 5 HB3 ASN 5 -1.095 -5.571 16.433 820 HD21 ASN 5 HD21 ASN 5 -0.324 -6.780 14.650 821 HD22 ASN 5 HD22 ASN 5 -0.695 -8.454 14.436 822 H THR 6 H THR 6 -2.476 -8.685 18.217 823 HA THR 6 HA THR 6 0.094 -8.645 19.656 824 HB THR 6 HB THR 6 -2.372 -10.144 20.663 825 HG1 THR 6 HG1 THR 6 -1.221 -7.690 21.320 826 HG21 THR 6 HG21 THR 6 -0.286 -11.406 21.104 827 HG22 THR 6 HG22 THR 6 -0.967 -10.765 22.601 828 HG23 THR 6 HG23 THR 6 0.425 -9.975 21.858 829 H THR 7 H THR 7 -2.504 -10.867 18.498 830 HA THR 7 HA THR 7 -0.487 -12.546 17.123 831 HB THR 7 HB THR 7 -1.797 -14.578 17.982 832 HG1 THR 7 HG1 THR 7 -2.962 -14.113 19.999 833 HG21 THR 7 HG21 THR 7 0.396 -14.034 18.973 834 HG22 THR 7 HG22 THR 7 -0.713 -14.636 20.208 835 HG23 THR 7 HG23 THR 7 -0.376 -12.908 20.091 836 H HIS 8 H HIS 8 -4.028 -12.488 17.714 837 HA HIS 8 HA HIS 8 -4.533 -12.670 14.790 838 HB2 HIS 8 HB2 HIS 8 -6.448 -14.166 15.253 839 HB3 HIS 8 HB3 HIS 8 -4.941 -14.872 15.821 840 HD1 HIS 8 HD1 HIS 8 -8.182 -13.409 17.072 841 HD2 HIS 8 HD2 HIS 8 -4.833 -15.349 18.596 842 HE1 HIS 8 HE1 HIS 8 -8.788 -14.076 19.418 843 HE2 HIS 8 HE2 HIS 8 -6.775 -15.297 20.291 844 H ASP 9 H ASP 9 -4.582 -10.478 16.970 845 HA ASP 9 HA ASP 9 -7.304 -9.561 17.125 846 HB2 ASP 9 HB2 ASP 9 -5.465 -8.945 18.759 847 HB3 ASP 9 HB3 ASP 9 -4.731 -7.954 17.505 848 H ASN 10 H ASN 10 -4.481 -8.854 15.099 849 HA ASN 10 HA ASN 10 -5.939 -7.170 13.253 850 HB2 ASN 10 HB2 ASN 10 -3.911 -7.009 11.981 851 HB3 ASN 10 HB3 ASN 10 -3.435 -6.941 13.673 852 HD21 ASN 10 HD21 ASN 10 -1.818 -7.644 11.365 853 HD22 ASN 10 HD22 ASN 10 -1.231 -9.241 11.645 854 H VAL 11 H VAL 11 -5.943 -7.777 10.919 855 HA VAL 11 HA VAL 11 -6.436 -10.624 10.397 856 HB VAL 11 HB VAL 11 -8.451 -10.099 9.040 857 HG11 VAL 11 HG11 VAL 11 -10.042 -9.795 10.875 858 HG12 VAL 11 HG12 VAL 11 -8.757 -9.181 11.921 859 HG13 VAL 11 HG13 VAL 11 -8.723 -10.855 11.369 860 HG21 VAL 11 HG21 VAL 11 -8.313 -7.282 10.199 861 HG22 VAL 11 HG22 VAL 11 -9.597 -7.927 9.178 862 HG23 VAL 11 HG23 VAL 11 -7.975 -7.715 8.523 863 H ILE 12 H ILE 12 -5.895 -11.241 8.419 864 HA ILE 12 HA ILE 12 -4.371 -9.483 6.684 865 HB ILE 12 HB ILE 12 -5.084 -12.431 6.287 866 HG12 ILE 12 HG12 ILE 12 -3.905 -12.228 8.438 867 HG13 ILE 12 HG13 ILE 12 -2.893 -13.040 7.259 868 HG21 ILE 12 HG21 ILE 12 -3.116 -12.471 4.806 869 HG22 ILE 12 HG22 ILE 12 -2.872 -10.746 5.077 870 HG23 ILE 12 HG23 ILE 12 -4.328 -11.312 4.254 871 HD11 ILE 12 HD11 ILE 12 -1.594 -11.541 8.630 872 HD12 ILE 12 HD12 ILE 12 -2.618 -10.179 8.179 873 HD13 ILE 12 HD13 ILE 12 -1.602 -10.962 6.964 874 H LEU 13 H LEU 13 -5.815 -8.158 5.598 875 HA LEU 13 HA LEU 13 -8.161 -9.268 4.255 876 HB2 LEU 13 HB2 LEU 13 -6.985 -6.464 4.011 877 HB3 LEU 13 HB3 LEU 13 -8.567 -6.987 3.461 878 HG LEU 13 HG LEU 13 -7.678 -6.714 6.358 879 HD11 LEU 13 HD11 LEU 13 -9.660 -5.065 4.759 880 HD12 LEU 13 HD12 LEU 13 -8.045 -4.554 5.266 881 HD13 LEU 13 HD13 LEU 13 -9.285 -4.875 6.476 882 HD21 LEU 13 HD21 LEU 13 -9.232 -8.573 6.137 883 HD22 LEU 13 HD22 LEU 13 -10.375 -7.550 5.262 884 HD23 LEU 13 HD23 LEU 13 -10.002 -7.215 6.955 885 H GLU 14 H GLU 14 -7.378 -10.687 2.688 886 HA GLU 14 HA GLU 14 -5.191 -9.789 0.938 887 HB2 GLU 14 HB2 GLU 14 -5.366 -12.094 -0.114 888 HB3 GLU 14 HB3 GLU 14 -4.832 -12.058 1.554 889 HG2 GLU 14 HG2 GLU 14 -7.705 -12.629 0.843 890 HG3 GLU 14 HG3 GLU 14 -6.490 -13.900 0.804 891 H LEU 15 H LEU 15 -5.973 -8.296 -0.271 892 HA LEU 15 HA LEU 15 -8.609 -8.360 -1.511 893 HB2 LEU 15 HB2 LEU 15 -6.443 -6.248 -1.834 894 HB3 LEU 15 HB3 LEU 15 -8.179 -6.053 -2.035 895 HG LEU 15 HG LEU 15 -6.801 -6.555 0.637 896 HD11 LEU 15 HD11 LEU 15 -6.145 -4.401 -0.287 897 HD12 LEU 15 HD12 LEU 15 -7.201 -4.186 1.105 898 HD13 LEU 15 HD13 LEU 15 -7.837 -3.965 -0.529 899 HD21 LEU 15 HD21 LEU 15 -9.121 -7.333 0.633 900 HD22 LEU 15 HD22 LEU 15 -9.669 -5.762 0.042 901 HD23 LEU 15 HD23 LEU 15 -8.943 -5.900 1.646 902 H THR 16 H THR 16 -8.896 -8.909 -3.605 903 HA THR 16 HA THR 16 -6.555 -9.163 -5.408 904 HB THR 16 HB THR 16 -9.354 -10.333 -5.758 905 HG1 THR 16 HG1 THR 16 -8.467 -11.689 -4.364 906 HG21 THR 16 HG21 THR 16 -8.249 -9.795 -7.927 907 HG22 THR 16 HG22 THR 16 -8.419 -11.537 -7.680 908 HG23 THR 16 HG23 THR 16 -6.852 -10.761 -7.438 909 H VAL 17 H VAL 17 -6.313 -7.090 -6.092 910 HA VAL 17 HA VAL 17 -8.571 -5.840 -7.568 911 HB VAL 17 HB VAL 17 -7.586 -3.699 -7.272 912 HG11 VAL 17 HG11 VAL 17 -8.789 -4.487 -5.285 913 HG12 VAL 17 HG12 VAL 17 -7.480 -3.396 -4.826 914 HG13 VAL 17 HG13 VAL 17 -7.288 -5.142 -4.614 915 HG21 VAL 17 HG21 VAL 17 -5.095 -5.016 -6.129 916 HG22 VAL 17 HG22 VAL 17 -5.380 -3.273 -6.186 917 HG23 VAL 17 HG23 VAL 17 -5.230 -4.191 -7.684 918 H ARG 18 H ARG 18 -8.076 -5.092 -9.730 919 HA ARG 18 HA ARG 18 -5.705 -6.380 -10.909 920 HB2 ARG 18 HB2 ARG 18 -6.633 -5.691 -13.117 921 HB3 ARG 18 HB3 ARG 18 -7.632 -6.808 -12.206 922 HG2 ARG 18 HG2 ARG 18 -9.104 -4.893 -11.559 923 HG3 ARG 18 HG3 ARG 18 -8.113 -3.829 -12.568 924 HD2 ARG 18 HD2 ARG 18 -9.664 -6.260 -13.532 925 HD3 ARG 18 HD3 ARG 18 -10.137 -4.580 -13.765 926 HE ARG 18 HE ARG 18 -7.524 -5.311 -14.835 927 HH11 ARG 18 HH11 ARG 18 -10.949 -4.940 -15.573 928 HH12 ARG 18 HH12 ARG 18 -10.680 -4.827 -17.288 929 HH21 ARG 18 HH21 ARG 18 -7.195 -5.188 -17.062 930 HH22 ARG 18 HH22 ARG 18 -8.547 -4.969 -18.132 931 H ASN 19 H ASN 19 -4.232 -5.228 -12.220 932 HA ASN 19 HA ASN 19 -3.205 -3.077 -10.676 933 HB2 ASN 19 HB2 ASN 19 -1.783 -4.915 -11.604 934 HB3 ASN 19 HB3 ASN 19 -2.082 -4.309 -13.229 935 HD21 ASN 19 HD21 ASN 19 -1.410 -2.407 -10.282 936 HD22 ASN 19 HD22 ASN 19 0.078 -1.747 -10.849 937 H HIS 20 H HIS 20 -4.631 -1.422 -10.965 938 HA HIS 20 HA HIS 20 -4.328 0.190 -13.439 939 HB2 HIS 20 HB2 HIS 20 -6.622 -0.762 -13.353 940 HB3 HIS 20 HB3 HIS 20 -6.838 -0.148 -11.723 941 HD1 HIS 20 HD1 HIS 20 -6.932 0.885 -15.314 942 HD2 HIS 20 HD2 HIS 20 -7.426 2.631 -11.568 943 HE1 HIS 20 HE1 HIS 20 -7.946 3.145 -15.740 944 HE2 HIS 20 HE2 HIS 20 -8.098 4.227 -13.473 945 HA PRO 21 HA PRO 21 -2.673 3.102 -10.436 946 HB2 PRO 21 HB2 PRO 21 -2.827 5.468 -11.837 947 HB3 PRO 21 HB3 PRO 21 -1.622 4.211 -12.184 948 HG2 PRO 21 HG2 PRO 21 -4.210 4.769 -13.598 949 HG3 PRO 21 HG3 PRO 21 -2.615 4.385 -14.285 950 HD2 PRO 21 HD2 PRO 21 -4.570 2.508 -14.052 951 HD3 PRO 21 HD3 PRO 21 -2.847 2.101 -13.898 952 H GLY 22 H GLY 22 -4.008 3.261 -8.693 953 HA2 GLY 22 HA2 GLY 22 -5.148 5.162 -7.511 954 HA3 GLY 22 HA3 GLY 22 -6.344 5.108 -8.798 955 H VAL 23 H VAL 23 -5.590 1.952 -8.332 956 HA VAL 23 HA VAL 23 -8.031 1.469 -6.824 957 HB VAL 23 HB VAL 23 -7.769 -0.875 -7.423 958 HG11 VAL 23 HG11 VAL 23 -8.714 0.661 -9.095 959 HG12 VAL 23 HG12 VAL 23 -7.853 -0.666 -9.878 960 HG13 VAL 23 HG13 VAL 23 -7.108 0.933 -9.784 961 HG21 VAL 23 HG21 VAL 23 -5.827 -1.703 -8.745 962 HG22 VAL 23 HG22 VAL 23 -5.359 -1.174 -7.128 963 HG23 VAL 23 HG23 VAL 23 -5.023 -0.146 -8.521 964 H MET 24 H MET 24 -4.574 1.156 -6.298 965 HA MET 24 HA MET 24 -4.742 -0.112 -3.735 966 HB2 MET 24 HB2 MET 24 -2.356 0.432 -3.515 967 HB3 MET 24 HB3 MET 24 -2.692 -0.240 -5.102 968 HG2 MET 24 HG2 MET 24 -2.307 2.695 -4.504 969 HG3 MET 24 HG3 MET 24 -1.087 1.622 -5.185 970 HE1 MET 24 HE1 MET 24 -0.807 3.519 -7.085 971 HE2 MET 24 HE2 MET 24 -2.140 4.463 -6.422 972 HE3 MET 24 HE3 MET 24 -2.122 4.041 -8.134 973 H THR 25 H THR 25 -4.708 3.233 -4.885 974 HA THR 25 HA THR 25 -4.815 4.632 -2.437 975 HB THR 25 HB THR 25 -6.213 5.263 -5.080 976 HG1 THR 25 HG1 THR 25 -3.861 6.530 -4.387 977 HG21 THR 25 HG21 THR 25 -7.116 6.683 -3.293 978 HG22 THR 25 HG22 THR 25 -6.075 7.641 -4.351 979 HG23 THR 25 HG23 THR 25 -5.477 7.113 -2.777 980 H HIS 26 H HIS 26 -7.254 3.091 -4.442 981 HA HIS 26 HA HIS 26 -9.595 4.031 -3.239 982 HB2 HIS 26 HB2 HIS 26 -9.284 2.892 -5.533 983 HB3 HIS 26 HB3 HIS 26 -9.309 1.355 -4.679 984 HD1 HIS 26 HD1 HIS 26 -11.584 0.365 -4.320 985 HD2 HIS 26 HD2 HIS 26 -11.704 4.394 -5.282 986 HE1 HIS 26 HE1 HIS 26 -14.023 0.936 -4.488 987 HE2 HIS 26 HE2 HIS 26 -14.077 3.401 -4.984 988 H VAL 27 H VAL 27 -7.838 0.928 -2.804 989 HA VAL 27 HA VAL 27 -9.623 -0.153 -0.905 990 HB VAL 27 HB VAL 27 -7.932 -1.880 -0.437 991 HG11 VAL 27 HG11 VAL 27 -8.160 -1.236 -3.399 992 HG12 VAL 27 HG12 VAL 27 -9.332 -2.130 -2.432 993 HG13 VAL 27 HG13 VAL 27 -7.732 -2.811 -2.723 994 HG21 VAL 27 HG21 VAL 27 -5.871 -0.548 -0.441 995 HG22 VAL 27 HG22 VAL 27 -6.031 -0.267 -2.175 996 HG23 VAL 27 HG23 VAL 27 -5.730 -1.900 -1.572 997 H CYS 28 H CYS 28 -6.498 1.499 -0.470 998 HA CYS 28 HA CYS 28 -6.370 1.394 2.322 999 HB2 CYS 28 HB2 CYS 28 -5.199 3.366 0.328 1000 HB3 CYS 28 HB3 CYS 28 -4.771 3.356 2.036 1001 HG CYS 28 HG CYS 28 -3.592 1.520 -0.427 1002 H GLY 29 H GLY 29 -8.090 3.548 0.157 1003 HA2 GLY 29 HA2 GLY 29 -8.672 5.715 1.852 1004 HA3 GLY 29 HA3 GLY 29 -9.590 5.236 0.434 1005 H LEU 30 H LEU 30 -10.465 2.688 1.242 1006 HA LEU 30 HA LEU 30 -12.746 3.400 2.812 1007 HB2 LEU 30 HB2 LEU 30 -11.787 0.842 1.538 1008 HB3 LEU 30 HB3 LEU 30 -13.056 0.744 2.741 1009 HG LEU 30 HG LEU 30 -14.187 0.777 0.670 1010 HD11 LEU 30 HD11 LEU 30 -15.247 2.245 2.291 1011 HD12 LEU 30 HD12 LEU 30 -15.512 2.833 0.658 1012 HD13 LEU 30 HD13 LEU 30 -14.325 3.626 1.696 1013 HD21 LEU 30 HD21 LEU 30 -12.554 3.156 -0.243 1014 HD22 LEU 30 HD22 LEU 30 -13.859 2.365 -1.138 1015 HD23 LEU 30 HD23 LEU 30 -12.375 1.486 -0.791 1016 H PHE 31 H PHE 31 -9.851 1.463 3.491 1017 HA PHE 31 HA PHE 31 -10.725 0.612 6.089 1018 HB2 PHE 31 HB2 PHE 31 -7.913 0.530 4.918 1019 HB3 PHE 31 HB3 PHE 31 -8.497 -0.395 6.305 1020 HD1 PHE 31 HD2 PHE 31 -11.105 -1.424 5.469 1021 HD2 PHE 31 HD1 PHE 31 -7.525 -1.015 3.159 1022 HE1 PHE 31 HE2 PHE 31 -11.887 -3.181 3.931 1023 HE2 PHE 31 HE1 PHE 31 -8.325 -2.765 1.628 1024 HZ PHE 31 HZ PHE 31 -10.499 -3.854 2.009 1025 H ALA 32 H ALA 32 -8.905 3.336 4.905 1026 HA ALA 32 HA ALA 32 -7.921 4.450 7.299 1027 HB1 ALA 32 HB1 ALA 32 -7.881 6.579 6.046 1028 HB2 ALA 32 HB2 ALA 32 -8.909 5.870 4.794 1029 HB3 ALA 32 HB3 ALA 32 -7.279 5.253 5.052 1030 H ARG 33 H ARG 33 -11.022 4.900 5.594 1031 HA ARG 33 HA ARG 33 -11.972 6.905 7.460 1032 HB2 ARG 33 HB2 ARG 33 -13.877 7.130 5.985 1033 HB3 ARG 33 HB3 ARG 33 -12.423 7.012 5.000 1034 HG2 ARG 33 HG2 ARG 33 -12.947 4.606 4.592 1035 HG3 ARG 33 HG3 ARG 33 -14.450 4.807 5.490 1036 HD2 ARG 33 HD2 ARG 33 -13.693 6.264 2.942 1037 HD3 ARG 33 HD3 ARG 33 -14.836 4.926 3.072 1038 HE ARG 33 HE ARG 33 -15.904 6.695 4.775 1039 HH11 ARG 33 HH11 ARG 33 -14.797 7.115 1.455 1040 HH12 ARG 33 HH12 ARG 33 -15.929 8.389 1.125 1041 HH21 ARG 33 HH21 ARG 33 -17.362 8.377 4.321 1042 HH22 ARG 33 HH22 ARG 33 -17.382 9.106 2.744 1043 H ARG 34 H ARG 34 -11.861 3.596 7.694 1044 HA ARG 34 HA ARG 34 -14.457 2.954 8.663 1045 HB2 ARG 34 HB2 ARG 34 -12.877 1.233 7.840 1046 HB3 ARG 34 HB3 ARG 34 -11.779 1.577 9.166 1047 HG2 ARG 34 HG2 ARG 34 -14.587 0.707 9.840 1048 HG3 ARG 34 HG3 ARG 34 -13.461 -0.497 9.224 1049 HD2 ARG 34 HD2 ARG 34 -12.924 1.242 11.650 1050 HD3 ARG 34 HD3 ARG 34 -13.566 -0.400 11.715 1051 HE ARG 34 HE ARG 34 -11.121 -0.248 10.227 1052 HH11 ARG 34 HH11 ARG 34 -12.332 -0.413 13.546 1053 HH12 ARG 34 HH12 ARG 34 -10.862 -1.119 14.147 1054 HH21 ARG 34 HH21 ARG 34 -9.247 -1.188 11.065 1055 HH22 ARG 34 HH22 ARG 34 -9.138 -1.556 12.756 1056 H ALA 35 H ALA 35 -11.358 3.450 10.393 1057 HA ALA 35 HA ALA 35 -12.257 5.203 12.372 1058 HB1 ALA 35 HB1 ALA 35 -13.682 3.353 13.192 1059 HB2 ALA 35 HB2 ALA 35 -12.436 3.737 14.379 1060 HB3 ALA 35 HB3 ALA 35 -12.274 2.306 13.351 1061 H PHE 36 H PHE 36 -10.316 2.216 12.252 1062 HA PHE 36 HA PHE 36 -8.127 3.488 13.726 1063 HB2 PHE 36 HB2 PHE 36 -9.042 1.241 14.424 1064 HB3 PHE 36 HB3 PHE 36 -8.511 0.568 12.891 1065 HD1 PHE 36 HD2 PHE 36 -7.273 2.159 16.041 1066 HD2 PHE 36 HD1 PHE 36 -6.270 -0.254 12.652 1067 HE1 PHE 36 HE2 PHE 36 -5.083 1.642 17.043 1068 HE2 PHE 36 HE1 PHE 36 -4.083 -0.761 13.661 1069 HZ PHE 36 HZ PHE 36 -3.491 0.185 15.857 1070 H ASN 37 H ASN 37 -5.900 2.952 13.029 1071 HA ASN 37 HA ASN 37 -5.226 3.841 10.412 1072 HB2 ASN 37 HB2 ASN 37 -3.409 2.486 12.471 1073 HB3 ASN 37 HB3 ASN 37 -2.904 3.552 11.161 1074 HD21 ASN 37 HD21 ASN 37 -1.813 4.812 12.726 1075 HD22 ASN 37 HD22 ASN 37 -2.652 5.912 13.754 1076 H VAL 38 H VAL 38 -3.508 2.518 9.105 1077 HA VAL 38 HA VAL 38 -4.120 -0.378 9.041 1078 HB VAL 38 HB VAL 38 -2.723 1.386 6.970 1079 HG11 VAL 38 HG11 VAL 38 -1.567 -0.786 7.020 1080 HG12 VAL 38 HG12 VAL 38 -2.541 -0.659 5.556 1081 HG13 VAL 38 HG13 VAL 38 -3.110 -1.638 6.909 1082 HG21 VAL 38 HG21 VAL 38 -5.296 -0.228 6.809 1083 HG22 VAL 38 HG22 VAL 38 -4.606 0.760 5.516 1084 HG23 VAL 38 HG23 VAL 38 -5.195 1.529 6.992 1085 H GLU 39 H GLU 39 -2.648 -1.802 9.677 1086 HA GLU 39 HA GLU 39 -0.270 -0.991 11.093 1087 HB2 GLU 39 HB2 GLU 39 -1.749 -2.776 11.921 1088 HB3 GLU 39 HB3 GLU 39 -1.492 -3.711 10.453 1089 HG2 GLU 39 HG2 GLU 39 0.884 -4.014 11.077 1090 HG3 GLU 39 HG3 GLU 39 0.607 -3.095 12.559 1091 H GLY 40 H GLY 40 -0.915 -3.149 8.280 1092 HA2 GLY 40 HA2 GLY 40 1.728 -2.524 7.119 1093 HA3 GLY 40 HA3 GLY 40 1.347 -4.203 7.483 1094 H ILE 41 H ILE 41 1.896 -2.882 4.895 1095 HA ILE 41 HA ILE 41 -0.462 -3.942 3.427 1096 HB ILE 41 HB ILE 41 1.142 -1.482 2.540 1097 HG12 ILE 41 HG12 ILE 41 -1.728 -1.598 3.561 1098 HG13 ILE 41 HG13 ILE 41 -0.361 -0.931 4.440 1099 HG21 ILE 41 HG21 ILE 41 -0.494 -1.278 0.703 1100 HG22 ILE 41 HG22 ILE 41 -1.307 -2.743 1.252 1101 HG23 ILE 41 HG23 ILE 41 0.341 -2.832 0.632 1102 HD11 ILE 41 HD11 ILE 41 -1.706 0.824 3.494 1103 HD12 ILE 41 HD12 ILE 41 -1.523 0.151 1.875 1104 HD13 ILE 41 HD13 ILE 41 -0.121 0.807 2.725 1105 H LEU 42 H LEU 42 0.083 -5.279 1.731 1106 HA LEU 42 HA LEU 42 2.783 -5.156 0.578 1107 HB2 LEU 42 HB2 LEU 42 2.937 -6.991 2.188 1108 HB3 LEU 42 HB3 LEU 42 1.465 -7.722 1.560 1109 HG LEU 42 HG LEU 42 2.638 -8.150 -0.622 1110 HD11 LEU 42 HD11 LEU 42 5.115 -7.158 0.803 1111 HD12 LEU 42 HD12 LEU 42 4.316 -6.393 -0.575 1112 HD13 LEU 42 HD13 LEU 42 5.078 -7.973 -0.763 1113 HD21 LEU 42 HD21 LEU 42 4.023 -10.001 0.167 1114 HD22 LEU 42 HD22 LEU 42 2.504 -9.897 1.054 1115 HD23 LEU 42 HD23 LEU 42 3.999 -9.329 1.801 1116 H CYS 43 H CYS 43 2.010 -4.281 -1.314 1117 HA CYS 43 HA CYS 43 -0.098 -5.620 -2.851 1118 HB2 CYS 43 HB2 CYS 43 -0.043 -3.164 -2.827 1119 HB3 CYS 43 HB3 CYS 43 1.600 -3.165 -3.451 1120 HG CYS 43 HG CYS 43 0.839 -4.271 -5.938 1121 H LEU 44 H LEU 44 0.773 -7.582 -3.373 1122 HA LEU 44 HA LEU 44 3.406 -7.854 -4.616 1123 HB2 LEU 44 HB2 LEU 44 2.410 -9.432 -2.817 1124 HB3 LEU 44 HB3 LEU 44 1.366 -10.039 -4.086 1125 HG LEU 44 HG LEU 44 3.554 -10.599 -5.380 1126 HD11 LEU 44 HD11 LEU 44 4.724 -10.232 -2.610 1127 HD12 LEU 44 HD12 LEU 44 5.077 -9.247 -4.035 1128 HD13 LEU 44 HD13 LEU 44 5.547 -10.944 -4.001 1129 HD21 LEU 44 HD21 LEU 44 2.921 -12.140 -2.838 1130 HD22 LEU 44 HD22 LEU 44 3.812 -12.756 -4.235 1131 HD23 LEU 44 HD23 LEU 44 2.110 -12.329 -4.395 1132 HA PRO 45 HA PRO 45 1.109 -7.479 -8.560 1133 HB2 PRO 45 HB2 PRO 45 3.247 -7.319 -10.258 1134 HB3 PRO 45 HB3 PRO 45 2.779 -5.976 -9.198 1135 HG2 PRO 45 HG2 PRO 45 4.955 -8.004 -8.796 1136 HG3 PRO 45 HG3 PRO 45 4.997 -6.246 -8.538 1137 HD2 PRO 45 HD2 PRO 45 4.641 -8.031 -6.490 1138 HD3 PRO 45 HD3 PRO 45 3.965 -6.383 -6.464 1139 H ILE 46 H ILE 46 0.406 -8.873 -10.093 1140 HA ILE 46 HA ILE 46 1.516 -11.605 -10.217 1141 HB ILE 46 HB ILE 46 -1.273 -10.511 -10.783 1142 HG12 ILE 46 HG12 ILE 46 -1.960 -12.410 -9.215 1143 HG13 ILE 46 HG13 ILE 46 -0.254 -12.690 -8.899 1144 HG21 ILE 46 HG21 ILE 46 -1.982 -12.722 -11.608 1145 HG22 ILE 46 HG22 ILE 46 -0.314 -13.290 -11.542 1146 HG23 ILE 46 HG23 ILE 46 -0.761 -12.004 -12.658 1147 HD11 ILE 46 HD11 ILE 46 -1.217 -11.426 -7.118 1148 HD12 ILE 46 HD12 ILE 46 -1.844 -10.225 -8.242 1149 HD13 ILE 46 HD13 ILE 46 -0.104 -10.384 -8.004 1150 H GLN 47 H GLN 47 2.578 -12.188 -12.023 1151 HA GLN 47 HA GLN 47 2.823 -10.382 -14.292 1152 HB2 GLN 47 HB2 GLN 47 4.573 -11.944 -15.082 1153 HB3 GLN 47 HB3 GLN 47 4.834 -11.463 -13.415 1154 HG2 GLN 47 HG2 GLN 47 3.926 -13.613 -12.629 1155 HG3 GLN 47 HG3 GLN 47 3.641 -14.106 -14.295 1156 HE21 GLN 47 HE21 GLN 47 5.292 -15.384 -12.248 1157 HE22 GLN 47 HE22 GLN 47 6.889 -15.467 -12.902 1158 H ASP 48 H ASP 48 1.164 -13.319 -13.503 1159 HA ASP 48 HA ASP 48 0.843 -14.518 -16.012 1160 HB2 ASP 48 HB2 ASP 48 0.444 -15.658 -13.849 1161 HB3 ASP 48 HB3 ASP 48 -0.956 -14.642 -13.547 1162 H SER 49 H SER 49 -1.115 -12.160 -14.312 1163 HA SER 49 HA SER 49 -2.417 -11.205 -16.734 1164 HB2 SER 49 HB2 SER 49 -4.018 -12.176 -14.313 1165 HB3 SER 49 HB3 SER 49 -4.692 -11.334 -15.709 1166 HG SER 49 HG SER 49 -3.512 -13.263 -16.828 1167 H ASP 50 H ASP 50 -3.467 -9.060 -16.313 1168 HA ASP 50 HA ASP 50 -1.803 -7.419 -14.672 1169 HB2 ASP 50 HB2 ASP 50 -3.214 -5.519 -15.475 1170 HB3 ASP 50 HB3 ASP 50 -2.637 -6.533 -16.788 1171 H LYS 51 H LYS 51 -2.137 -8.352 -12.609 1172 HA LYS 51 HA LYS 51 -4.344 -7.246 -11.048 1173 HB2 LYS 51 HB2 LYS 51 -3.660 -10.222 -11.126 1174 HB3 LYS 51 HB3 LYS 51 -4.590 -9.486 -9.824 1175 HG2 LYS 51 HG2 LYS 51 -6.359 -8.853 -11.423 1176 HG3 LYS 51 HG3 LYS 51 -5.423 -9.552 -12.745 1177 HD2 LYS 51 HD2 LYS 51 -6.499 -11.109 -10.358 1178 HD3 LYS 51 HD3 LYS 51 -7.247 -11.061 -11.955 1179 HE2 LYS 51 HE2 LYS 51 -5.259 -12.126 -12.938 1180 HE3 LYS 51 HE3 LYS 51 -4.462 -12.129 -11.364 1181 HZ1 LYS 51 HZ1 LYS 51 -6.962 -13.586 -12.029 1182 HZ2 LYS 51 HZ2 LYS 51 -6.185 -13.599 -10.535 1183 HZ3 LYS 51 HZ3 LYS 51 -5.432 -14.278 -11.883 1184 H SER 52 H SER 52 -3.912 -7.525 -8.715 1185 HA SER 52 HA SER 52 -1.275 -8.181 -7.781 1186 HB2 SER 52 HB2 SER 52 -1.000 -5.794 -8.552 1187 HB3 SER 52 HB3 SER 52 -2.288 -5.317 -7.441 1188 HG SER 52 HG SER 52 -0.978 -5.619 -5.773 1189 H HIS 53 H HIS 53 -1.507 -9.040 -5.752 1190 HA HIS 53 HA HIS 53 -4.078 -8.664 -4.337 1191 HB2 HIS 53 HB2 HIS 53 -1.819 -10.628 -3.738 1192 HB3 HIS 53 HB3 HIS 53 -3.340 -10.529 -2.860 1193 HD1 HIS 53 HD1 HIS 53 -5.523 -10.894 -4.644 1194 HD2 HIS 53 HD2 HIS 53 -1.860 -12.626 -5.562 1195 HE1 HIS 53 HE1 HIS 53 -6.024 -12.736 -6.273 1196 HE2 HIS 53 HE2 HIS 53 -3.834 -13.879 -6.634 1197 H ILE 54 H ILE 54 -4.203 -7.390 -2.562 1198 HA ILE 54 HA ILE 54 -1.715 -6.309 -1.366 1199 HB ILE 54 HB ILE 54 -4.576 -5.221 -1.340 1200 HG12 ILE 54 HG12 ILE 54 -3.452 -3.149 -2.324 1201 HG13 ILE 54 HG13 ILE 54 -1.969 -4.080 -2.452 1202 HG21 ILE 54 HG21 ILE 54 -3.636 -4.898 0.907 1203 HG22 ILE 54 HG22 ILE 54 -3.752 -3.351 0.067 1204 HG23 ILE 54 HG23 ILE 54 -2.188 -4.157 0.213 1205 HD11 ILE 54 HD11 ILE 54 -3.120 -3.899 -4.577 1206 HD12 ILE 54 HD12 ILE 54 -4.549 -4.667 -3.890 1207 HD13 ILE 54 HD13 ILE 54 -3.047 -5.577 -4.045 1208 H TRP 55 H TRP 55 -1.104 -7.381 0.474 1209 HA TRP 55 HA TRP 55 -3.057 -8.623 2.261 1210 HB2 TRP 55 HB2 TRP 55 -0.004 -8.470 2.246 1211 HB3 TRP 55 HB3 TRP 55 -0.883 -9.081 3.645 1212 HD1 TRP 55 HD1 TRP 55 -1.577 -11.595 3.575 1213 HE1 TRP 55 HE1 TRP 55 -1.503 -13.475 1.837 1214 HE3 TRP 55 HE3 TRP 55 -0.119 -8.886 -0.475 1215 HZ2 TRP 55 HZ2 TRP 55 -0.880 -13.789 -0.884 1216 HZ3 TRP 55 HZ3 TRP 55 0.200 -10.050 -2.601 1217 HH2 TRP 55 HH2 TRP 55 -0.165 -12.454 -2.816 1218 H LEU 56 H LEU 56 -4.235 -6.998 3.104 1219 HA LEU 56 HA LEU 56 -2.995 -4.591 4.233 1220 HB2 LEU 56 HB2 LEU 56 -5.073 -4.684 2.644 1221 HB3 LEU 56 HB3 LEU 56 -5.967 -5.219 4.047 1222 HG LEU 56 HG LEU 56 -6.322 -2.838 3.607 1223 HD11 LEU 56 HD11 LEU 56 -4.762 -3.163 6.181 1224 HD12 LEU 56 HD12 LEU 56 -6.471 -3.526 5.945 1225 HD13 LEU 56 HD13 LEU 56 -5.902 -1.867 5.799 1226 HD21 LEU 56 HD21 LEU 56 -4.545 -1.164 3.812 1227 HD22 LEU 56 HD22 LEU 56 -4.228 -2.290 2.495 1228 HD23 LEU 56 HD23 LEU 56 -3.347 -2.447 4.018 1229 H LEU 57 H LEU 57 -2.267 -4.966 6.263 1230 HA LEU 57 HA LEU 57 -3.601 -6.756 8.151 1231 HB2 LEU 57 HB2 LEU 57 -0.929 -5.324 8.106 1232 HB3 LEU 57 HB3 LEU 57 -1.565 -5.930 9.624 1233 HG LEU 57 HG LEU 57 -1.535 -8.238 8.763 1234 HD11 LEU 57 HD11 LEU 57 -0.375 -7.117 6.199 1235 HD12 LEU 57 HD12 LEU 57 -1.962 -7.869 6.397 1236 HD13 LEU 57 HD13 LEU 57 -0.502 -8.829 6.623 1237 HD21 LEU 57 HD21 LEU 57 0.434 -7.404 9.927 1238 HD22 LEU 57 HD22 LEU 57 1.113 -6.801 8.412 1239 HD23 LEU 57 HD23 LEU 57 0.910 -8.538 8.663 1240 H VAL 58 H VAL 58 -5.221 -5.919 9.263 1241 HA VAL 58 HA VAL 58 -4.916 -3.472 10.833 1242 HB VAL 58 HB VAL 58 -5.959 -2.776 8.598 1243 HG11 VAL 58 HG11 VAL 58 -8.376 -4.353 9.518 1244 HG12 VAL 58 HG12 VAL 58 -7.332 -4.750 8.151 1245 HG13 VAL 58 HG13 VAL 58 -8.299 -3.276 8.115 1246 HG21 VAL 58 HG21 VAL 58 -7.679 -1.320 9.584 1247 HG22 VAL 58 HG22 VAL 58 -6.231 -1.382 10.589 1248 HG23 VAL 58 HG23 VAL 58 -7.666 -2.297 11.057 1249 H ASN 59 H ASN 59 -6.319 -3.592 12.770 1250 HA ASN 59 HA ASN 59 -7.469 -6.151 13.354 1251 HB2 ASN 59 HB2 ASN 59 -8.572 -4.999 15.336 1252 HB3 ASN 59 HB3 ASN 59 -6.821 -4.890 15.272 1253 HD21 ASN 59 HD21 ASN 59 -5.938 -2.961 15.475 1254 HD22 ASN 59 HD22 ASN 59 -6.780 -1.453 15.405 1255 H ASP 60 H ASP 60 -9.411 -6.966 12.816 1256 HA ASP 60 HA ASP 60 -11.225 -5.666 11.093 1257 HB2 ASP 60 HB2 ASP 60 -10.909 -8.133 11.155 1258 HB3 ASP 60 HB3 ASP 60 -11.677 -8.190 12.732 1259 H ASP 61 H ASP 61 -13.393 -5.174 11.433 1260 HA ASP 61 HA ASP 61 -14.317 -4.489 14.137 1261 HB2 ASP 61 HB2 ASP 61 -13.011 -2.540 12.970 1262 HB3 ASP 61 HB3 ASP 61 -14.352 -2.459 11.844 1263 H GLN 62 H GLN 62 -16.635 -4.318 14.155 1264 HA GLN 62 HA GLN 62 -18.136 -5.856 12.333 1265 HB2 GLN 62 HB2 GLN 62 -19.102 -3.704 14.272 1266 HB3 GLN 62 HB3 GLN 62 -20.125 -4.925 13.518 1267 HG2 GLN 62 HG2 GLN 62 -18.969 -6.706 14.719 1268 HG3 GLN 62 HG3 GLN 62 -17.804 -5.552 15.364 1269 HE21 GLN 62 HE21 GLN 62 -18.295 -6.136 17.490 1270 HE22 GLN 62 HE22 GLN 62 -19.766 -5.662 18.262 1271 H ARG 63 H ARG 63 -17.391 -2.453 12.489 1272 HA ARG 63 HA ARG 63 -19.032 -1.616 10.279 1273 HB2 ARG 63 HB2 ARG 63 -18.433 -0.157 12.212 1274 HB3 ARG 63 HB3 ARG 63 -16.748 -0.185 11.707 1275 HG2 ARG 63 HG2 ARG 63 -17.229 1.098 9.730 1276 HG3 ARG 63 HG3 ARG 63 -18.971 0.881 9.933 1277 HD2 ARG 63 HD2 ARG 63 -17.161 2.448 11.807 1278 HD3 ARG 63 HD3 ARG 63 -18.244 3.149 10.598 1279 HE ARG 63 HE ARG 63 -19.850 1.559 12.169 1280 HH11 ARG 63 HH11 ARG 63 -17.795 4.348 12.788 1281 HH12 ARG 63 HH12 ARG 63 -18.747 4.895 14.131 1282 HH21 ARG 63 HH21 ARG 63 -21.073 2.275 13.937 1283 HH22 ARG 63 HH22 ARG 63 -20.598 3.722 14.778 1284 H LEU 64 H LEU 64 -15.704 -2.757 10.713 1285 HA LEU 64 HA LEU 64 -14.642 -1.924 8.206 1286 HB2 LEU 64 HB2 LEU 64 -13.265 -2.812 10.160 1287 HB3 LEU 64 HB3 LEU 64 -13.819 -4.423 9.745 1288 HG LEU 64 HG LEU 64 -12.765 -3.793 7.334 1289 HD11 LEU 64 HD11 LEU 64 -11.083 -2.086 9.181 1290 HD12 LEU 64 HD12 LEU 64 -12.179 -1.485 7.927 1291 HD13 LEU 64 HD13 LEU 64 -10.766 -2.436 7.477 1292 HD21 LEU 64 HD21 LEU 64 -10.700 -4.901 7.912 1293 HD22 LEU 64 HD22 LEU 64 -12.039 -5.692 8.743 1294 HD23 LEU 64 HD23 LEU 64 -10.970 -4.604 9.631 1295 H GLU 65 H GLU 65 -16.421 -4.808 9.271 1296 HA GLU 65 HA GLU 65 -16.291 -6.425 7.006 1297 HB2 GLU 65 HB2 GLU 65 -18.692 -6.046 8.860 1298 HB3 GLU 65 HB3 GLU 65 -18.441 -7.414 7.781 1299 HG2 GLU 65 HG2 GLU 65 -16.437 -8.063 9.082 1300 HG3 GLU 65 HG3 GLU 65 -16.716 -6.706 10.174 1301 H GLN 66 H GLN 66 -18.671 -3.916 7.821 1302 HA GLN 66 HA GLN 66 -20.243 -3.945 5.483 1303 HB2 GLN 66 HB2 GLN 66 -20.947 -2.843 7.573 1304 HB3 GLN 66 HB3 GLN 66 -19.625 -1.686 7.444 1305 HG2 GLN 66 HG2 GLN 66 -20.690 -0.861 5.291 1306 HG3 GLN 66 HG3 GLN 66 -22.072 -1.893 5.665 1307 HE21 GLN 66 HE21 GLN 66 -20.272 0.943 6.612 1308 HE22 GLN 66 HE22 GLN 66 -21.469 1.599 7.666 1309 H MET 67 H MET 67 -17.307 -2.199 6.325 1310 HA MET 67 HA MET 67 -17.174 -0.417 4.126 1311 HB2 MET 67 HB2 MET 67 -15.973 -0.258 6.383 1312 HB3 MET 67 HB3 MET 67 -14.856 -1.482 5.796 1313 HG2 MET 67 HG2 MET 67 -13.848 0.680 5.540 1314 HG3 MET 67 HG3 MET 67 -14.225 0.049 3.937 1315 HE1 MET 67 HE1 MET 67 -15.131 2.689 6.694 1316 HE2 MET 67 HE2 MET 67 -16.621 1.746 6.616 1317 HE3 MET 67 HE3 MET 67 -16.600 3.410 6.036 1318 H ILE 68 H ILE 68 -15.824 -3.621 4.734 1319 HA ILE 68 HA ILE 68 -14.319 -4.031 2.363 1320 HB ILE 68 HB ILE 68 -15.565 -5.945 4.399 1321 HG12 ILE 68 HG12 ILE 68 -12.627 -5.252 3.919 1322 HG13 ILE 68 HG13 ILE 68 -13.633 -4.497 5.148 1323 HG21 ILE 68 HG21 ILE 68 -13.746 -6.739 2.104 1324 HG22 ILE 68 HG22 ILE 68 -15.440 -7.188 2.293 1325 HG23 ILE 68 HG23 ILE 68 -14.235 -7.796 3.430 1326 HD11 ILE 68 HD11 ILE 68 -13.933 -6.684 6.224 1327 HD12 ILE 68 HD12 ILE 68 -12.245 -6.188 6.132 1328 HD13 ILE 68 HD13 ILE 68 -12.863 -7.407 5.019 1329 H SER 69 H SER 69 -17.675 -4.654 3.288 1330 HA SER 69 HA SER 69 -18.464 -6.124 0.987 1331 HB2 SER 69 HB2 SER 69 -20.142 -4.605 3.021 1332 HB3 SER 69 HB3 SER 69 -20.771 -5.764 1.846 1333 HG SER 69 HG SER 69 -18.711 -6.492 3.628 1334 H GLN 70 H GLN 70 -18.220 -2.694 1.669 1335 HA GLN 70 HA GLN 70 -20.046 -1.799 -0.377 1336 HB2 GLN 70 HB2 GLN 70 -19.586 -0.507 1.717 1337 HB3 GLN 70 HB3 GLN 70 -17.913 -0.305 1.236 1338 HG2 GLN 70 HG2 GLN 70 -20.180 0.790 -0.448 1339 HG3 GLN 70 HG3 GLN 70 -19.533 1.686 0.917 1340 HE21 GLN 70 HE21 GLN 70 -16.774 0.828 0.457 1341 HE22 GLN 70 HE22 GLN 70 -16.229 1.690 -0.927 1342 H ILE 71 H ILE 71 -16.505 -1.918 0.061 1343 HA ILE 71 HA ILE 71 -15.866 -0.812 -2.483 1344 HB ILE 71 HB ILE 71 -14.365 -0.627 -0.522 1345 HG12 ILE 71 HG12 ILE 71 -13.184 -1.956 -2.990 1346 HG13 ILE 71 HG13 ILE 71 -13.405 -0.233 -2.713 1347 HG21 ILE 71 HG21 ILE 71 -12.958 -2.489 0.232 1348 HG22 ILE 71 HG22 ILE 71 -13.765 -3.576 -0.898 1349 HG23 ILE 71 HG23 ILE 71 -14.670 -2.874 0.442 1350 HD11 ILE 71 HD11 ILE 71 -11.480 -2.063 -1.316 1351 HD12 ILE 71 HD12 ILE 71 -11.741 -0.364 -0.899 1352 HD13 ILE 71 HD13 ILE 71 -11.115 -0.798 -2.489 1353 H ASP 72 H ASP 72 -16.362 -4.059 -1.318 1354 HA ASP 72 HA ASP 72 -15.271 -5.686 -3.279 1355 HB2 ASP 72 HB2 ASP 72 -16.164 -6.705 -1.322 1356 HB3 ASP 72 HB3 ASP 72 -17.712 -5.904 -1.489 1357 H LYS 73 H LYS 73 -18.205 -3.774 -3.334 1358 HA LYS 73 HA LYS 73 -19.370 -5.033 -5.645 1359 HB2 LYS 73 HB2 LYS 73 -20.134 -2.465 -4.204 1360 HB3 LYS 73 HB3 LYS 73 -21.110 -3.298 -5.411 1361 HG2 LYS 73 HG2 LYS 73 -21.231 -5.288 -3.881 1362 HG3 LYS 73 HG3 LYS 73 -20.349 -4.356 -2.669 1363 HD2 LYS 73 HD2 LYS 73 -22.730 -4.273 -2.153 1364 HD3 LYS 73 HD3 LYS 73 -22.200 -2.668 -2.661 1365 HE2 LYS 73 HE2 LYS 73 -23.157 -3.026 -4.889 1366 HE3 LYS 73 HE3 LYS 73 -23.596 -4.678 -4.454 1367 HZ1 LYS 73 HZ1 LYS 73 -24.686 -2.221 -3.185 1368 HZ2 LYS 73 HZ2 LYS 73 -25.109 -3.809 -2.789 1369 HZ3 LYS 73 HZ3 LYS 73 -25.492 -3.193 -4.314 1370 H LEU 74 H LEU 74 -16.862 -2.832 -5.344 1371 HA LEU 74 HA LEU 74 -17.363 -1.393 -7.849 1372 HB2 LEU 74 HB2 LEU 74 -15.200 -1.179 -5.724 1373 HB3 LEU 74 HB3 LEU 74 -15.025 -0.396 -7.280 1374 HG LEU 74 HG LEU 74 -15.767 1.247 -5.693 1375 HD11 LEU 74 HD11 LEU 74 -17.802 2.082 -6.745 1376 HD12 LEU 74 HD12 LEU 74 -18.076 0.510 -7.502 1377 HD13 LEU 74 HD13 LEU 74 -16.659 1.469 -7.940 1378 HD21 LEU 74 HD21 LEU 74 -16.757 -0.218 -3.997 1379 HD22 LEU 74 HD22 LEU 74 -18.147 -0.521 -5.041 1380 HD23 LEU 74 HD23 LEU 74 -17.847 1.104 -4.415 1381 H GLU 75 H GLU 75 -15.898 -1.497 -9.588 1382 HA GLU 75 HA GLU 75 -15.256 -4.200 -10.307 1383 HB2 GLU 75 HB2 GLU 75 -14.888 -1.616 -11.883 1384 HB3 GLU 75 HB3 GLU 75 -14.835 -3.247 -12.553 1385 HG2 GLU 75 HG2 GLU 75 -17.197 -3.586 -12.101 1386 HG3 GLU 75 HG3 GLU 75 -17.291 -2.069 -11.207 1387 H ASP 76 H ASP 76 -13.385 -1.703 -8.870 1388 HA ASP 76 HA ASP 76 -10.849 -2.382 -10.030 1389 HB2 ASP 76 HB2 ASP 76 -9.838 -0.969 -8.369 1390 HB3 ASP 76 HB3 ASP 76 -11.311 -0.173 -8.906 1391 H VAL 77 H VAL 77 -12.526 -3.205 -7.004 1392 HA VAL 77 HA VAL 77 -10.640 -5.286 -6.283 1393 HB VAL 77 HB VAL 77 -13.334 -4.435 -5.116 1394 HG11 VAL 77 HG11 VAL 77 -11.442 -6.573 -4.046 1395 HG12 VAL 77 HG12 VAL 77 -13.053 -6.853 -4.711 1396 HG13 VAL 77 HG13 VAL 77 -12.868 -5.945 -3.211 1397 HG21 VAL 77 HG21 VAL 77 -10.498 -4.152 -4.048 1398 HG22 VAL 77 HG22 VAL 77 -11.972 -3.608 -3.240 1399 HG23 VAL 77 HG23 VAL 77 -11.471 -2.857 -4.757 1400 H VAL 78 H VAL 78 -10.585 -6.815 -7.785 1401 HA VAL 78 HA VAL 78 -12.760 -7.845 -9.302 1402 HB VAL 78 HB VAL 78 -10.112 -9.293 -8.815 1403 HG11 VAL 78 HG11 VAL 78 -11.918 -9.253 -11.266 1404 HG12 VAL 78 HG12 VAL 78 -11.820 -10.562 -10.081 1405 HG13 VAL 78 HG13 VAL 78 -10.421 -10.173 -11.083 1406 HG21 VAL 78 HG21 VAL 78 -9.127 -8.041 -10.696 1407 HG22 VAL 78 HG22 VAL 78 -9.576 -6.957 -9.379 1408 HG23 VAL 78 HG23 VAL 78 -10.588 -7.056 -10.821 1409 H LYS 79 H LYS 79 -11.009 -8.976 -6.437 1410 HA LYS 79 HA LYS 79 -13.367 -10.400 -5.444 1411 HB2 LYS 79 HB2 LYS 79 -10.602 -11.715 -5.611 1412 HB3 LYS 79 HB3 LYS 79 -11.961 -12.364 -4.705 1413 HG2 LYS 79 HG2 LYS 79 -13.218 -12.712 -6.773 1414 HG3 LYS 79 HG3 LYS 79 -11.911 -11.982 -7.707 1415 HD2 LYS 79 HD2 LYS 79 -10.393 -13.816 -7.037 1416 HD3 LYS 79 HD3 LYS 79 -11.676 -14.531 -6.057 1417 HE2 LYS 79 HE2 LYS 79 -11.715 -14.206 -9.077 1418 HE3 LYS 79 HE3 LYS 79 -11.451 -15.710 -8.195 1419 HZ1 LYS 79 HZ1 LYS 79 -13.680 -15.539 -7.296 1420 HZ2 LYS 79 HZ2 LYS 79 -13.723 -15.517 -8.985 1421 HZ3 LYS 79 HZ3 LYS 79 -13.937 -14.083 -8.117 1422 H VAL 80 H VAL 80 -13.362 -10.488 -3.103 1423 HA VAL 80 HA VAL 80 -11.035 -9.249 -1.725 1424 HB VAL 80 HB VAL 80 -12.960 -7.572 -1.965 1425 HG11 VAL 80 HG11 VAL 80 -14.901 -7.743 -0.476 1426 HG12 VAL 80 HG12 VAL 80 -14.390 -9.357 0.021 1427 HG13 VAL 80 HG13 VAL 80 -14.871 -9.062 -1.651 1428 HG21 VAL 80 HG21 VAL 80 -12.103 -8.273 0.863 1429 HG22 VAL 80 HG22 VAL 80 -12.773 -6.723 0.347 1430 HG23 VAL 80 HG23 VAL 80 -11.216 -7.263 -0.282 1431 H GLN 81 H GLN 81 -10.423 -10.310 0.155 1432 HA GLN 81 HA GLN 81 -12.348 -12.056 1.533 1433 HB2 GLN 81 HB2 GLN 81 -9.534 -12.899 0.694 1434 HB3 GLN 81 HB3 GLN 81 -10.473 -13.746 1.919 1435 HG2 GLN 81 HG2 GLN 81 -12.195 -14.282 0.233 1436 HG3 GLN 81 HG3 GLN 81 -11.255 -13.435 -0.993 1437 HE21 GLN 81 HE21 GLN 81 -11.444 -16.293 0.995 1438 HE22 GLN 81 HE22 GLN 81 -10.244 -17.206 0.153 1439 H ARG 82 H ARG 82 -12.011 -12.214 3.722 1440 HA ARG 82 HA ARG 82 -9.734 -10.777 4.936 1441 HB2 ARG 82 HB2 ARG 82 -11.213 -10.137 6.820 1442 HB3 ARG 82 HB3 ARG 82 -11.765 -9.437 5.305 1443 HG2 ARG 82 HG2 ARG 82 -13.606 -10.964 5.172 1444 HG3 ARG 82 HG3 ARG 82 -12.969 -11.947 6.486 1445 HD2 ARG 82 HD2 ARG 82 -13.250 -9.831 7.956 1446 HD3 ARG 82 HD3 ARG 82 -14.268 -9.221 6.640 1447 HE ARG 82 HE ARG 82 -15.413 -11.564 6.996 1448 HH11 ARG 82 HH11 ARG 82 -14.303 -9.331 9.493 1449 HH12 ARG 82 HH12 ARG 82 -15.473 -9.891 10.645 1450 HH21 ARG 82 HH21 ARG 82 -16.884 -12.306 8.535 1451 HH22 ARG 82 HH22 ARG 82 -16.930 -11.567 10.108 1452 H ASN 83 H ASN 83 -8.467 -12.282 5.822 1453 HA ASN 83 HA ASN 83 -9.655 -14.566 7.318 1454 HB2 ASN 83 HB2 ASN 83 -7.174 -14.402 5.549 1455 HB3 ASN 83 HB3 ASN 83 -7.299 -15.621 6.815 1456 HD21 ASN 83 HD21 ASN 83 -8.743 -14.484 3.825 1457 HD22 ASN 83 HD22 ASN 83 -9.579 -15.945 3.443 1458 H GLN 84 H GLN 84 -9.210 -14.547 9.421 1459 HA GLN 84 HA GLN 84 -7.357 -12.565 10.527 1460 HB2 GLN 84 HB2 GLN 84 -8.330 -13.262 12.766 1461 HB3 GLN 84 HB3 GLN 84 -9.491 -12.575 11.649 1462 HG2 GLN 84 HG2 GLN 84 -9.196 -15.555 12.071 1463 HG3 GLN 84 HG3 GLN 84 -10.267 -14.555 13.045 1464 HE21 GLN 84 HE21 GLN 84 -10.917 -16.796 11.294 1465 HE22 GLN 84 HE22 GLN 84 -12.074 -16.195 10.160 1466 H SER 85 H SER 85 -5.327 -13.114 10.831 1467 HA SER 85 HA SER 85 -4.436 -15.763 11.613 1468 HB2 SER 85 HB2 SER 85 -4.923 -15.985 9.150 1469 HB3 SER 85 HB3 SER 85 -3.778 -14.687 8.824 1470 HG SER 85 HG SER 85 -2.139 -16.006 9.233 1471 H ASP 86 H ASP 86 -1.942 -15.800 11.310 1472 HA ASP 86 HA ASP 86 -0.883 -13.843 13.060 1473 HB2 ASP 86 HB2 ASP 86 -0.180 -16.294 12.854 1474 HB3 ASP 86 HB3 ASP 86 0.692 -15.857 11.391 1475 HA PRO 87 HA PRO 87 0.281 -10.460 10.320 1476 HB2 PRO 87 HB2 PRO 87 2.732 -10.449 12.116 1477 HB3 PRO 87 HB3 PRO 87 1.730 -9.086 11.561 1478 HG2 PRO 87 HG2 PRO 87 1.390 -10.027 14.008 1479 HG3 PRO 87 HG3 PRO 87 -0.024 -9.585 13.020 1480 HD2 PRO 87 HD2 PRO 87 1.032 -12.315 13.689 1481 HD3 PRO 87 HD3 PRO 87 -0.652 -11.775 13.474 1482 H THR 88 H THR 88 2.756 -12.954 11.058 1483 HA THR 88 HA THR 88 4.684 -12.141 9.152 1484 HB THR 88 HB THR 88 5.774 -14.326 9.505 1485 HG1 THR 88 HG1 THR 88 3.919 -15.247 11.339 1486 HG21 THR 88 HG21 THR 88 6.075 -12.591 11.248 1487 HG22 THR 88 HG22 THR 88 6.097 -14.213 11.945 1488 HG23 THR 88 HG23 THR 88 4.656 -13.205 12.101 1489 H MET 89 H MET 89 1.668 -13.490 8.479 1490 HA MET 89 HA MET 89 2.094 -15.119 6.274 1491 HB2 MET 89 HB2 MET 89 -0.148 -14.783 7.190 1492 HB3 MET 89 HB3 MET 89 -0.141 -13.089 6.716 1493 HG2 MET 89 HG2 MET 89 -0.198 -13.697 4.365 1494 HG3 MET 89 HG3 MET 89 0.006 -15.402 4.758 1495 HE1 MET 89 HE1 MET 89 -3.449 -16.307 6.342 1496 HE2 MET 89 HE2 MET 89 -1.965 -15.885 7.193 1497 HE3 MET 89 HE3 MET 89 -1.905 -16.940 5.778 1498 H PHE 90 H PHE 90 2.107 -11.519 6.436 1499 HA PHE 90 HA PHE 90 2.297 -11.061 3.644 1500 HB2 PHE 90 HB2 PHE 90 2.630 -8.781 4.101 1501 HB3 PHE 90 HB3 PHE 90 1.791 -9.309 5.545 1502 HD1 PHE 90 HD2 PHE 90 3.049 -9.483 7.720 1503 HD2 PHE 90 HD1 PHE 90 4.932 -7.964 4.193 1504 HE1 PHE 90 HE2 PHE 90 4.875 -8.560 9.090 1505 HE2 PHE 90 HE1 PHE 90 6.755 -7.044 5.567 1506 HZ PHE 90 HZ PHE 90 6.727 -7.342 8.010 1507 H ASN 91 H ASN 91 4.721 -11.630 6.138 1508 HA ASN 91 HA ASN 91 7.060 -11.177 4.586 1509 HB2 ASN 91 HB2 ASN 91 6.958 -11.223 7.106 1510 HB3 ASN 91 HB3 ASN 91 6.692 -12.959 7.044 1511 HD21 ASN 91 HD21 ASN 91 8.789 -11.583 8.377 1512 HD22 ASN 91 HD22 ASN 91 10.280 -12.123 7.690 1513 H LYS 92 H LYS 92 4.988 -13.977 5.153 1514 HA LYS 92 HA LYS 92 6.709 -16.049 4.383 1515 HB2 LYS 92 HB2 LYS 92 4.494 -16.177 5.699 1516 HB3 LYS 92 HB3 LYS 92 3.662 -16.152 4.155 1517 HG2 LYS 92 HG2 LYS 92 5.742 -18.253 4.832 1518 HG3 LYS 92 HG3 LYS 92 4.051 -18.438 5.290 1519 HD2 LYS 92 HD2 LYS 92 3.363 -18.453 2.952 1520 HD3 LYS 92 HD3 LYS 92 5.001 -18.063 2.421 1521 HE2 LYS 92 HE2 LYS 92 4.504 -20.449 2.096 1522 HE3 LYS 92 HE3 LYS 92 5.804 -20.235 3.267 1523 HZ1 LYS 92 HZ1 LYS 92 4.208 -20.598 5.043 1524 HZ2 LYS 92 HZ2 LYS 92 4.216 -21.906 3.976 1525 HZ3 LYS 92 HZ3 LYS 92 2.956 -20.781 3.922 1526 H ILE 93 H ILE 93 4.099 -14.469 2.431 1527 HA ILE 93 HA ILE 93 4.933 -15.897 0.056 1528 HB ILE 93 HB ILE 93 3.257 -14.784 -1.235 1529 HG12 ILE 93 HG12 ILE 93 3.596 -12.445 -0.248 1530 HG13 ILE 93 HG13 ILE 93 1.937 -12.895 -0.592 1531 HG21 ILE 93 HG21 ILE 93 1.198 -15.338 0.008 1532 HG22 ILE 93 HG22 ILE 93 2.120 -15.423 1.510 1533 HG23 ILE 93 HG23 ILE 93 2.441 -16.576 0.213 1534 HD11 ILE 93 HD11 ILE 93 2.118 -11.686 1.480 1535 HD12 ILE 93 HD12 ILE 93 3.233 -12.892 2.120 1536 HD13 ILE 93 HD13 ILE 93 1.558 -13.330 1.772 1537 H ALA 94 H ALA 94 5.675 -12.767 1.462 1538 HA ALA 94 HA ALA 94 6.731 -11.431 -0.766 1539 HB1 ALA 94 HB1 ALA 94 8.048 -10.100 0.839 1540 HB2 ALA 94 HB2 ALA 94 7.686 -11.270 2.112 1541 HB3 ALA 94 HB3 ALA 94 6.386 -10.317 1.396 1542 H VAL 95 H VAL 95 8.414 -13.542 1.592 1543 HA VAL 95 HA VAL 95 10.892 -13.553 0.154 1544 HB VAL 95 HB VAL 95 10.789 -13.887 2.622 1545 HG11 VAL 95 HG11 VAL 95 8.805 -15.291 2.809 1546 HG12 VAL 95 HG12 VAL 95 10.183 -16.073 3.588 1547 HG13 VAL 95 HG13 VAL 95 9.635 -16.621 2.000 1548 HG21 VAL 95 HG21 VAL 95 12.520 -15.652 2.776 1549 HG22 VAL 95 HG22 VAL 95 12.808 -14.573 1.410 1550 HG23 VAL 95 HG23 VAL 95 12.128 -16.176 1.132 1551 H PHE 96 H PHE 96 8.024 -15.602 0.168 1552 HA PHE 96 HA PHE 96 9.106 -17.826 -1.249 1553 HB2 PHE 96 HB2 PHE 96 7.032 -17.959 0.083 1554 HB3 PHE 96 HB3 PHE 96 6.217 -16.866 -1.028 1555 HD1 PHE 96 HD2 PHE 96 7.892 -20.226 -0.858 1556 HD2 PHE 96 HD1 PHE 96 5.040 -17.765 -2.897 1557 HE1 PHE 96 HE2 PHE 96 7.169 -22.160 -2.199 1558 HE2 PHE 96 HE1 PHE 96 4.328 -19.706 -4.234 1559 HZ PHE 96 HZ PHE 96 5.389 -21.903 -3.886 1560 H PHE 97 H PHE 97 7.786 -14.756 -2.242 1561 HA PHE 97 HA PHE 97 7.348 -15.220 -5.009 1562 HB2 PHE 97 HB2 PHE 97 6.360 -13.324 -3.782 1563 HB3 PHE 97 HB3 PHE 97 7.952 -12.674 -3.435 1564 HD1 PHE 97 HD1 PHE 97 5.590 -13.414 -6.246 1565 HD2 PHE 97 HD2 PHE 97 8.939 -11.099 -4.923 1566 HE1 PHE 97 HE1 PHE 97 5.414 -11.999 -8.251 1567 HE2 PHE 97 HE2 PHE 97 8.757 -9.694 -6.932 1568 HZ PHE 97 HZ PHE 97 6.996 -10.140 -8.596 1569 H GLN 98 H GLN 98 10.075 -13.935 -3.134 1570 HA GLN 98 HA GLN 98 12.247 -13.563 -3.499 1571 HB2 GLN 98 HB2 GLN 98 12.187 -16.041 -4.001 1572 HB3 GLN 98 HB3 GLN 98 12.080 -15.641 -5.712 1573 HG2 GLN 98 HG2 GLN 98 14.278 -14.539 -5.604 1574 HG3 GLN 98 HG3 GLN 98 14.380 -14.900 -3.880 1575 HE21 GLN 98 HE21 GLN 98 14.790 -17.046 -3.227 1576 HE22 GLN 98 HE22 GLN 98 15.383 -18.246 -4.319 Start of MODEL 10 1 H1 GLY 1 H1 GLY 1 8.513 0.574 -16.922 2 H2 GLY 1 H2 GLY 1 7.617 -0.577 -16.074 3 H3 GLY 1 H3 GLY 1 7.140 1.044 -16.053 4 HA2 GLY 1 HA3 GLY 1 5.726 -0.225 -17.515 5 HA3 GLY 1 HA2 GLY 1 6.658 0.971 -18.399 6 H SER 2 H SER 2 8.638 -1.583 -17.390 7 HA SER 2 HA SER 2 8.853 -2.670 -20.072 8 HB2 SER 2 HB2 SER 2 10.882 -2.219 -18.662 9 HB3 SER 2 HB3 SER 2 10.355 -3.467 -17.534 10 HG SER 2 HG SER 2 11.576 -3.689 -19.987 11 H MET 3 H MET 3 8.168 -4.642 -20.708 12 HA MET 3 HA MET 3 6.331 -6.208 -19.122 13 HB2 MET 3 HB2 MET 3 7.566 -6.707 -21.867 14 HB3 MET 3 HB3 MET 3 6.311 -7.710 -21.147 15 HG2 MET 3 HG2 MET 3 4.740 -5.860 -21.186 16 HG3 MET 3 HG3 MET 3 5.996 -4.765 -21.766 17 HE1 MET 3 HE1 MET 3 3.829 -7.948 -22.649 18 HE2 MET 3 HE2 MET 3 5.472 -8.515 -22.950 19 HE3 MET 3 HE3 MET 3 4.361 -8.282 -24.298 20 H GLN 4 H GLN 4 9.678 -6.065 -19.365 21 HA GLN 4 HA GLN 4 10.359 -8.827 -18.854 22 HB2 GLN 4 HB2 GLN 4 12.032 -6.286 -18.569 23 HB3 GLN 4 HB3 GLN 4 12.656 -7.934 -18.591 24 HG2 GLN 4 HG2 GLN 4 12.053 -8.213 -20.906 25 HG3 GLN 4 HG3 GLN 4 11.157 -6.696 -20.911 26 HE21 GLN 4 HE21 GLN 4 13.189 -5.170 -19.462 27 HE22 GLN 4 HE22 GLN 4 14.497 -4.939 -20.565 28 H ASN 5 H ASN 5 11.865 -9.177 -16.861 29 HA ASN 5 HA ASN 5 10.433 -8.908 -14.456 30 HB2 ASN 5 HB2 ASN 5 12.485 -9.772 -13.344 31 HB3 ASN 5 HB3 ASN 5 12.057 -10.713 -14.768 32 HD21 ASN 5 HD21 ASN 5 14.646 -10.283 -13.309 33 HD22 ASN 5 HD22 ASN 5 15.774 -9.828 -14.539 34 H THR 6 H THR 6 10.241 -7.237 -13.079 35 HA THR 6 HA THR 6 11.498 -4.708 -13.571 36 HB THR 6 HB THR 6 10.198 -4.040 -11.426 37 HG1 THR 6 HG1 THR 6 8.815 -5.510 -10.564 38 HG21 THR 6 HG21 THR 6 8.011 -4.040 -12.570 39 HG22 THR 6 HG22 THR 6 8.619 -5.198 -13.753 40 HG23 THR 6 HG23 THR 6 9.307 -3.574 -13.679 41 H THR 7 H THR 7 13.703 -5.245 -13.317 42 HA THR 7 HA THR 7 14.751 -5.754 -10.619 43 HB THR 7 HB THR 7 16.297 -5.422 -13.237 44 HG1 THR 7 HG1 THR 7 14.691 -7.238 -13.064 45 HG21 THR 7 HG21 THR 7 18.105 -6.625 -12.069 46 HG22 THR 7 HG22 THR 7 17.115 -6.740 -10.614 47 HG23 THR 7 HG23 THR 7 17.678 -5.164 -11.177 48 H HIS 8 H HIS 8 15.104 -3.422 -13.301 49 HA HIS 8 HA HIS 8 15.001 -1.196 -11.435 50 HB2 HIS 8 HB2 HIS 8 16.944 -0.014 -12.406 51 HB3 HIS 8 HB3 HIS 8 17.427 -1.508 -11.619 52 HD1 HIS 8 HD1 HIS 8 17.571 0.293 -14.828 53 HD2 HIS 8 HD2 HIS 8 18.249 -3.580 -13.482 54 HE1 HIS 8 HE1 HIS 8 18.865 -0.832 -16.655 55 HE2 HIS 8 HE2 HIS 8 19.096 -3.219 -15.898 56 H ASP 9 H ASP 9 12.942 -1.265 -12.370 57 HA ASP 9 HA ASP 9 12.652 0.266 -14.871 58 HB2 ASP 9 HB2 ASP 9 12.227 -1.993 -15.627 59 HB3 ASP 9 HB3 ASP 9 11.275 -2.374 -14.194 60 H ASN 10 H ASN 10 10.840 -1.307 -12.275 61 HA ASN 10 HA ASN 10 9.410 1.059 -11.486 62 HB2 ASN 10 HB2 ASN 10 8.792 -0.288 -9.494 63 HB3 ASN 10 HB3 ASN 10 8.540 -1.214 -10.968 64 HD21 ASN 10 HD21 ASN 10 8.800 -2.328 -8.367 65 HD22 ASN 10 HD22 ASN 10 10.214 -3.319 -8.338 66 H VAL 11 H VAL 11 9.851 2.082 -9.359 67 HA VAL 11 HA VAL 11 12.654 1.989 -8.447 68 HB VAL 11 HB VAL 11 12.649 4.447 -8.032 69 HG11 VAL 11 HG11 VAL 11 13.015 5.193 -10.350 70 HG12 VAL 11 HG12 VAL 11 12.179 3.760 -10.953 71 HG13 VAL 11 HG13 VAL 11 13.699 3.589 -10.076 72 HG21 VAL 11 HG21 VAL 11 10.187 4.822 -7.901 73 HG22 VAL 11 HG22 VAL 11 10.060 4.568 -9.638 74 HG23 VAL 11 HG23 VAL 11 10.966 5.946 -9.016 75 H ILE 12 H ILE 12 12.904 2.473 -6.245 76 HA ILE 12 HA ILE 12 10.549 1.633 -4.687 77 HB ILE 12 HB ILE 12 13.501 1.659 -3.890 78 HG12 ILE 12 HG12 ILE 12 13.067 0.133 -5.828 79 HG13 ILE 12 HG13 ILE 12 13.625 -0.710 -4.396 80 HG21 ILE 12 HG21 ILE 12 12.829 0.092 -2.128 81 HG22 ILE 12 HG22 ILE 12 11.145 0.241 -2.633 82 HG23 ILE 12 HG23 ILE 12 11.997 1.640 -1.975 83 HD11 ILE 12 HD11 ILE 12 10.792 -0.603 -5.418 84 HD12 ILE 12 HD12 ILE 12 11.330 -1.461 -3.971 85 HD13 ILE 12 HD13 ILE 12 11.915 -1.954 -5.559 86 H LEU 13 H LEU 13 9.564 3.697 -4.601 87 HA LEU 13 HA LEU 13 10.999 5.949 -3.405 88 HB2 LEU 13 HB2 LEU 13 8.084 5.715 -4.265 89 HB3 LEU 13 HB3 LEU 13 8.887 7.191 -3.744 90 HG LEU 13 HG LEU 13 9.476 5.614 -6.270 91 HD11 LEU 13 HD11 LEU 13 8.660 7.608 -7.437 92 HD12 LEU 13 HD12 LEU 13 8.263 8.366 -5.895 93 HD13 LEU 13 HD13 LEU 13 7.416 6.903 -6.408 94 HD21 LEU 13 HD21 LEU 13 10.850 8.126 -5.255 95 HD22 LEU 13 HD22 LEU 13 11.085 7.387 -6.841 96 HD23 LEU 13 HD23 LEU 13 11.568 6.517 -5.389 97 H GLU 14 H GLU 14 11.430 5.238 -1.307 98 HA GLU 14 HA GLU 14 9.138 4.335 0.307 99 HB2 GLU 14 HB2 GLU 14 10.638 3.715 2.047 100 HB3 GLU 14 HB3 GLU 14 11.276 3.095 0.534 101 HG2 GLU 14 HG2 GLU 14 13.062 4.648 0.513 102 HG3 GLU 14 HG3 GLU 14 12.314 5.652 1.753 103 H LEU 15 H LEU 15 8.291 5.495 1.904 104 HA LEU 15 HA LEU 15 9.564 8.019 2.685 105 HB2 LEU 15 HB2 LEU 15 7.013 8.888 2.734 106 HB3 LEU 15 HB3 LEU 15 8.060 9.080 1.345 107 HG LEU 15 HG LEU 15 7.012 6.886 0.451 108 HD11 LEU 15 HD11 LEU 15 5.941 6.114 2.486 109 HD12 LEU 15 HD12 LEU 15 4.756 6.348 1.206 110 HD13 LEU 15 HD13 LEU 15 4.891 7.535 2.506 111 HD21 LEU 15 HD21 LEU 15 5.126 8.078 -0.569 112 HD22 LEU 15 HD22 LEU 15 6.590 9.058 -0.564 113 HD23 LEU 15 HD23 LEU 15 5.308 9.388 0.604 114 H THR 16 H THR 16 9.669 8.224 4.724 115 HA THR 16 HA THR 16 8.554 6.233 6.532 116 HB THR 16 HB THR 16 10.487 8.556 7.046 117 HG1 THR 16 HG1 THR 16 11.040 6.500 5.705 118 HG21 THR 16 HG21 THR 16 10.933 7.422 9.195 119 HG22 THR 16 HG22 THR 16 9.711 6.206 8.820 120 HG23 THR 16 HG23 THR 16 9.235 7.888 9.076 121 H VAL 17 H VAL 17 6.579 6.660 7.297 122 HA VAL 17 HA VAL 17 5.740 9.462 7.779 123 HB VAL 17 HB VAL 17 3.607 9.068 6.907 124 HG11 VAL 17 HG11 VAL 17 5.224 9.217 5.077 125 HG12 VAL 17 HG12 VAL 17 3.863 8.197 4.612 126 HG13 VAL 17 HG13 VAL 17 5.404 7.460 5.059 127 HG21 VAL 17 HG21 VAL 17 2.982 6.993 8.016 128 HG22 VAL 17 HG22 VAL 17 4.062 6.061 6.981 129 HG23 VAL 17 HG23 VAL 17 2.637 6.842 6.292 130 H ARG 18 H ARG 18 4.520 9.811 9.613 131 HA ARG 18 HA ARG 18 4.141 7.563 11.499 132 HB2 ARG 18 HB2 ARG 18 3.526 9.407 13.138 133 HB3 ARG 18 HB3 ARG 18 5.195 9.420 12.588 134 HG2 ARG 18 HG2 ARG 18 4.578 11.231 10.951 135 HG3 ARG 18 HG3 ARG 18 2.974 11.277 11.684 136 HD2 ARG 18 HD2 ARG 18 5.591 11.830 13.120 137 HD3 ARG 18 HD3 ARG 18 4.445 13.055 12.577 138 HE ARG 18 HE ARG 18 3.728 10.994 14.587 139 HH11 ARG 18 HH11 ARG 18 3.880 14.394 13.656 140 HH12 ARG 18 HH12 ARG 18 3.016 14.931 15.065 141 HH21 ARG 18 HH21 ARG 18 2.620 11.719 16.421 142 HH22 ARG 18 HH22 ARG 18 2.304 13.414 16.634 143 H ASN 19 H ASN 19 1.999 7.120 12.275 144 HA ASN 19 HA ASN 19 0.301 6.942 9.996 145 HB2 ASN 19 HB2 ASN 19 0.739 5.091 11.716 146 HB3 ASN 19 HB3 ASN 19 -0.383 5.923 12.788 147 HD21 ASN 19 HD21 ASN 19 -0.614 3.240 11.604 148 HD22 ASN 19 HD22 ASN 19 -2.075 3.233 10.687 149 H HIS 20 H HIS 20 -0.219 9.088 9.668 150 HA HIS 20 HA HIS 20 -2.349 10.353 11.216 151 HB2 HIS 20 HB2 HIS 20 -0.746 11.131 8.742 152 HB3 HIS 20 HB3 HIS 20 -2.197 12.017 9.176 153 HD1 HIS 20 HD1 HIS 20 -2.088 13.548 11.238 154 HD2 HIS 20 HD2 HIS 20 1.469 11.570 10.439 155 HE1 HIS 20 HE1 HIS 20 -0.371 14.647 12.700 156 HE2 HIS 20 HE2 HIS 20 1.803 13.593 12.003 157 HA PRO 21 HA PRO 21 -5.986 8.808 9.090 158 HB2 PRO 21 HB2 PRO 21 -6.382 11.646 8.087 159 HB3 PRO 21 HB3 PRO 21 -7.572 10.526 8.788 160 HG2 PRO 21 HG2 PRO 21 -6.565 12.439 10.299 161 HG3 PRO 21 HG3 PRO 21 -6.757 10.799 10.969 162 HD2 PRO 21 HD2 PRO 21 -4.257 12.189 10.068 163 HD3 PRO 21 HD3 PRO 21 -4.490 11.029 11.393 164 H GLY 22 H GLY 22 -5.111 7.479 7.575 165 HA2 GLY 22 HA2 GLY 22 -4.702 6.570 5.526 166 HA3 GLY 22 HA3 GLY 22 -5.759 7.822 4.902 167 H VAL 23 H VAL 23 -2.403 7.692 6.229 168 HA VAL 23 HA VAL 23 -1.382 9.723 4.527 169 HB VAL 23 HB VAL 23 0.316 7.456 5.672 170 HG11 VAL 23 HG11 VAL 23 2.110 9.166 5.629 171 HG12 VAL 23 HG12 VAL 23 0.994 10.324 4.914 172 HG13 VAL 23 HG13 VAL 23 1.453 8.871 4.021 173 HG21 VAL 23 HG21 VAL 23 0.687 8.834 7.670 174 HG22 VAL 23 HG22 VAL 23 -1.015 8.405 7.503 175 HG23 VAL 23 HG23 VAL 23 -0.472 10.030 7.079 176 H MET 24 H MET 24 -1.305 6.209 4.325 177 HA MET 24 HA MET 24 0.049 5.894 1.903 178 HB2 MET 24 HB2 MET 24 -0.962 3.601 1.864 179 HB3 MET 24 HB3 MET 24 -0.181 4.018 3.378 180 HG2 MET 24 HG2 MET 24 -3.155 4.116 2.911 181 HG3 MET 24 HG3 MET 24 -2.306 2.762 3.646 182 HE1 MET 24 HE1 MET 24 -1.074 4.354 7.038 183 HE2 MET 24 HE2 MET 24 -0.167 4.203 5.534 184 HE3 MET 24 HE3 MET 24 -1.181 2.870 6.091 185 H THR 25 H THR 25 -3.345 6.740 2.469 186 HA THR 25 HA THR 25 -4.307 6.463 -0.190 187 HB THR 25 HB THR 25 -5.179 8.670 1.736 188 HG1 THR 25 HG1 THR 25 -5.993 5.943 1.712 189 HG21 THR 25 HG21 THR 25 -6.752 7.096 -0.343 190 HG22 THR 25 HG22 THR 25 -6.174 8.755 -0.541 191 HG23 THR 25 HG23 THR 25 -7.386 8.383 0.687 192 H HIS 26 H HIS 26 -2.597 9.108 1.509 193 HA HIS 26 HA HIS 26 -2.665 11.089 -0.523 194 HB2 HIS 26 HB2 HIS 26 -0.433 10.748 1.536 195 HB3 HIS 26 HB3 HIS 26 -0.841 12.222 0.669 196 HD1 HIS 26 HD1 HIS 26 -0.632 12.527 3.564 197 HD2 HIS 26 HD2 HIS 26 -4.192 11.268 1.827 198 HE1 HIS 26 HE1 HIS 26 -2.418 13.024 5.260 199 HE2 HIS 26 HE2 HIS 26 -4.530 12.102 4.251 200 H VAL 27 H VAL 27 -0.311 8.523 0.240 201 HA VAL 27 HA VAL 27 1.732 9.449 -1.491 202 HB VAL 27 HB VAL 27 3.014 7.533 -0.946 203 HG11 VAL 27 HG11 VAL 27 2.836 7.338 1.509 204 HG12 VAL 27 HG12 VAL 27 1.238 8.079 1.457 205 HG13 VAL 27 HG13 VAL 27 2.658 9.008 0.972 206 HG21 VAL 27 HG21 VAL 27 1.482 5.717 -1.535 207 HG22 VAL 27 HG22 VAL 27 0.498 6.044 -0.110 208 HG23 VAL 27 HG23 VAL 27 2.147 5.443 0.076 209 H CYS 28 H CYS 28 -0.716 6.881 -1.885 210 HA CYS 28 HA CYS 28 0.063 6.190 -4.542 211 HB2 CYS 28 HB2 CYS 28 -1.239 4.622 -3.184 212 HB3 CYS 28 HB3 CYS 28 -2.591 5.753 -3.125 213 HG CYS 28 HG CYS 28 -2.475 5.660 -6.152 214 H GLY 29 H GLY 29 -2.064 8.613 -3.155 215 HA2 GLY 29 HA2 GLY 29 -3.633 9.368 -5.341 216 HA3 GLY 29 HA3 GLY 29 -3.140 10.437 -4.032 217 H LEU 30 H LEU 30 -0.419 10.540 -4.345 218 HA LEU 30 HA LEU 30 -0.072 12.406 -6.466 219 HB2 LEU 30 HB2 LEU 30 1.765 11.201 -4.401 220 HB3 LEU 30 HB3 LEU 30 2.499 12.006 -5.773 221 HG LEU 30 HG LEU 30 2.399 13.584 -3.957 222 HD11 LEU 30 HD11 LEU 30 1.149 15.441 -4.954 223 HD12 LEU 30 HD12 LEU 30 0.252 14.318 -5.978 224 HD13 LEU 30 HD13 LEU 30 1.992 14.514 -6.195 225 HD21 LEU 30 HD21 LEU 30 -0.594 13.092 -3.759 226 HD22 LEU 30 HD22 LEU 30 0.326 14.289 -2.844 227 HD23 LEU 30 HD23 LEU 30 0.627 12.571 -2.593 228 H PHE 31 H PHE 31 1.259 9.117 -5.997 229 HA PHE 31 HA PHE 31 2.806 9.185 -8.397 230 HB2 PHE 31 HB2 PHE 31 2.032 6.778 -6.703 231 HB3 PHE 31 HB3 PHE 31 3.311 6.813 -7.919 232 HD1 PHE 31 HD2 PHE 31 4.537 9.524 -7.323 233 HD2 PHE 31 HD1 PHE 31 3.282 6.405 -4.676 234 HE1 PHE 31 HE2 PHE 31 6.107 10.337 -5.615 235 HE2 PHE 31 HE1 PHE 31 4.855 7.235 -2.976 236 HZ PHE 31 HZ PHE 31 6.266 9.196 -3.437 237 H ALA 32 H ALA 32 -0.467 8.139 -7.769 238 HA ALA 32 HA ALA 32 -0.900 6.736 -10.245 239 HB1 ALA 32 HB1 ALA 32 -2.283 6.299 -8.240 240 HB2 ALA 32 HB2 ALA 32 -3.279 6.776 -9.614 241 HB3 ALA 32 HB3 ALA 32 -2.936 7.941 -8.328 242 H ARG 33 H ARG 33 -1.725 10.041 -9.060 243 HA ARG 33 HA ARG 33 -3.105 10.863 -11.436 244 HB2 ARG 33 HB2 ARG 33 -3.236 13.076 -10.471 245 HB3 ARG 33 HB3 ARG 33 -3.500 11.899 -9.190 246 HG2 ARG 33 HG2 ARG 33 -1.178 12.232 -8.398 247 HG3 ARG 33 HG3 ARG 33 -0.907 13.400 -9.691 248 HD2 ARG 33 HD2 ARG 33 -2.997 13.722 -7.510 249 HD3 ARG 33 HD3 ARG 33 -1.381 14.438 -7.461 250 HE ARG 33 HE ARG 33 -2.550 15.195 -9.867 251 HH11 ARG 33 HH11 ARG 33 -3.124 15.822 -6.450 252 HH12 ARG 33 HH12 ARG 33 -3.829 17.380 -6.743 253 HH21 ARG 33 HH21 ARG 33 -3.449 17.245 -10.228 254 HH22 ARG 33 HH22 ARG 33 -4.010 18.187 -8.881 255 H ARG 34 H ARG 34 0.177 10.505 -10.818 256 HA ARG 34 HA ARG 34 1.372 12.559 -12.313 257 HB2 ARG 34 HB2 ARG 34 2.610 11.228 -10.716 258 HB3 ARG 34 HB3 ARG 34 2.233 9.735 -11.550 259 HG2 ARG 34 HG2 ARG 34 3.864 11.817 -12.999 260 HG3 ARG 34 HG3 ARG 34 4.623 10.873 -11.722 261 HD2 ARG 34 HD2 ARG 34 3.368 9.816 -14.264 262 HD3 ARG 34 HD3 ARG 34 5.072 9.788 -13.812 263 HE ARG 34 HE ARG 34 3.235 8.366 -12.032 264 HH11 ARG 34 HH11 ARG 34 5.534 8.057 -14.682 265 HH12 ARG 34 HH12 ARG 34 5.754 6.354 -14.429 266 HH21 ARG 34 HH21 ARG 34 3.466 6.146 -11.811 267 HH22 ARG 34 HH22 ARG 34 4.593 5.285 -12.818 268 H ALA 35 H ALA 35 0.690 9.156 -13.212 269 HA ALA 35 HA ALA 35 -0.394 9.658 -15.759 270 HB1 ALA 35 HB1 ALA 35 1.438 8.902 -17.245 271 HB2 ALA 35 HB2 ALA 35 2.534 8.818 -15.859 272 HB3 ALA 35 HB3 ALA 35 1.887 10.373 -16.379 273 H PHE 36 H PHE 36 1.927 7.363 -14.342 274 HA PHE 36 HA PHE 36 0.146 5.099 -15.018 275 HB2 PHE 36 HB2 PHE 36 2.464 5.044 -15.983 276 HB3 PHE 36 HB3 PHE 36 3.131 5.099 -14.354 277 HD1 PHE 36 HD1 PHE 36 0.762 3.040 -16.439 278 HD2 PHE 36 HD2 PHE 36 3.700 3.037 -13.331 279 HE1 PHE 36 HE1 PHE 36 0.675 0.584 -16.345 280 HE2 PHE 36 HE2 PHE 36 3.606 0.583 -13.245 281 HZ PHE 36 HZ PHE 36 2.092 -0.648 -14.751 282 H ASN 37 H ASN 37 -0.321 3.570 -13.424 283 HA ASN 37 HA ASN 37 -0.655 4.615 -10.750 284 HB2 ASN 37 HB2 ASN 37 -1.316 1.841 -11.840 285 HB3 ASN 37 HB3 ASN 37 -1.955 2.560 -10.363 286 HD21 ASN 37 HD21 ASN 37 -3.235 1.556 -12.886 287 HD22 ASN 37 HD22 ASN 37 -4.261 2.846 -13.399 288 H VAL 38 H VAL 38 -0.292 2.877 -8.907 289 HA VAL 38 HA VAL 38 2.540 2.278 -8.797 290 HB VAL 38 HB VAL 38 0.409 1.570 -6.714 291 HG11 VAL 38 HG11 VAL 38 2.524 0.379 -6.392 292 HG12 VAL 38 HG12 VAL 38 2.313 1.585 -5.122 293 HG13 VAL 38 HG13 VAL 38 3.423 1.897 -6.460 294 HG21 VAL 38 HG21 VAL 38 2.084 4.109 -6.855 295 HG22 VAL 38 HG22 VAL 38 0.972 3.667 -5.553 296 HG23 VAL 38 HG23 VAL 38 0.349 4.001 -7.169 297 H GLU 39 H GLU 39 3.484 0.293 -8.925 298 HA GLU 39 HA GLU 39 1.971 -1.931 -10.067 299 HB2 GLU 39 HB2 GLU 39 3.938 -1.391 -11.269 300 HB3 GLU 39 HB3 GLU 39 4.909 -1.195 -9.826 301 HG2 GLU 39 HG2 GLU 39 3.877 -3.956 -10.387 302 HG3 GLU 39 HG3 GLU 39 5.106 -3.332 -11.477 303 H GLY 40 H GLY 40 4.034 -1.218 -7.272 304 HA2 GLY 40 HA2 GLY 40 2.894 -3.466 -5.738 305 HA3 GLY 40 HA3 GLY 40 4.639 -3.430 -5.994 306 H ILE 41 H ILE 41 3.172 -3.251 -3.483 307 HA ILE 41 HA ILE 41 4.334 -0.738 -2.447 308 HB ILE 41 HB ILE 41 1.563 -1.780 -1.607 309 HG12 ILE 41 HG12 ILE 41 2.247 0.732 -3.202 310 HG13 ILE 41 HG13 ILE 41 1.440 -0.699 -3.831 311 HG21 ILE 41 HG21 ILE 41 2.788 -0.732 0.272 312 HG22 ILE 41 HG22 ILE 41 1.409 0.258 -0.201 313 HG23 ILE 41 HG23 ILE 41 3.039 0.729 -0.689 314 HD11 ILE 41 HD11 ILE 41 -0.126 1.094 -3.439 315 HD12 ILE 41 HD12 ILE 41 0.342 1.176 -1.742 316 HD13 ILE 41 HD13 ILE 41 -0.469 -0.263 -2.368 317 H LEU 42 H LEU 42 5.293 -1.000 -0.472 318 HA LEU 42 HA LEU 42 4.625 -3.355 1.162 319 HB2 LEU 42 HB2 LEU 42 6.757 -3.871 0.010 320 HB3 LEU 42 HB3 LEU 42 7.462 -2.370 0.589 321 HG LEU 42 HG LEU 42 7.462 -3.177 2.886 322 HD11 LEU 42 HD11 LEU 42 6.706 -5.426 3.514 323 HD12 LEU 42 HD12 LEU 42 6.061 -5.666 1.887 324 HD13 LEU 42 HD13 LEU 42 5.382 -4.416 2.935 325 HD21 LEU 42 HD21 LEU 42 9.026 -5.066 2.706 326 HD22 LEU 42 HD22 LEU 42 9.377 -3.821 1.510 327 HD23 LEU 42 HD23 LEU 42 8.557 -5.306 1.020 328 H CYS 43 H CYS 43 4.310 -2.797 3.238 329 HA CYS 43 HA CYS 43 5.232 -0.259 4.342 330 HB2 CYS 43 HB2 CYS 43 3.110 0.443 3.375 331 HB3 CYS 43 HB3 CYS 43 2.282 -0.974 4.013 332 HG CYS 43 HG CYS 43 2.422 -0.165 6.675 333 H LEU 44 H LEU 44 5.935 -0.700 6.313 334 HA LEU 44 HA LEU 44 4.492 -2.519 8.063 335 HB2 LEU 44 HB2 LEU 44 6.720 -3.744 8.638 336 HB3 LEU 44 HB3 LEU 44 5.830 -4.219 7.207 337 HG LEU 44 HG LEU 44 7.461 -2.645 5.911 338 HD11 LEU 44 HD11 LEU 44 9.737 -2.484 6.884 339 HD12 LEU 44 HD12 LEU 44 9.072 -2.989 8.443 340 HD13 LEU 44 HD13 LEU 44 8.535 -1.481 7.701 341 HD21 LEU 44 HD21 LEU 44 7.423 -5.068 5.636 342 HD22 LEU 44 HD22 LEU 44 8.469 -5.268 7.044 343 HD23 LEU 44 HD23 LEU 44 9.077 -4.457 5.599 344 HA PRO 45 HA PRO 45 5.620 0.695 10.827 345 HB2 PRO 45 HB2 PRO 45 4.946 -0.382 13.232 346 HB3 PRO 45 HB3 PRO 45 3.717 -0.024 11.999 347 HG2 PRO 45 HG2 PRO 45 4.995 -2.653 12.667 348 HG3 PRO 45 HG3 PRO 45 3.281 -2.276 12.368 349 HD2 PRO 45 HD2 PRO 45 4.925 -3.340 10.446 350 HD3 PRO 45 HD3 PRO 45 3.535 -2.299 10.066 351 H ILE 46 H ILE 46 7.154 1.371 12.274 352 HA ILE 46 HA ILE 46 9.593 -0.194 12.554 353 HB ILE 46 HB ILE 46 8.878 2.697 13.247 354 HG12 ILE 46 HG12 ILE 46 8.914 2.375 10.842 355 HG13 ILE 46 HG13 ILE 46 10.382 3.237 11.286 356 HG21 ILE 46 HG21 ILE 46 11.260 3.116 13.608 357 HG22 ILE 46 HG22 ILE 46 11.615 1.406 13.364 358 HG23 ILE 46 HG23 ILE 46 10.652 1.915 14.749 359 HD11 ILE 46 HD11 ILE 46 10.168 0.297 10.614 360 HD12 ILE 46 HD12 ILE 46 11.646 1.120 11.119 361 HD13 ILE 46 HD13 ILE 46 10.859 1.569 9.610 362 H GLN 47 H GLN 47 10.058 -1.284 14.404 363 HA GLN 47 HA GLN 47 8.114 -1.452 16.498 364 HB2 GLN 47 HB2 GLN 47 9.634 -3.046 17.600 365 HB3 GLN 47 HB3 GLN 47 9.452 -3.421 15.894 366 HG2 GLN 47 HG2 GLN 47 11.636 -2.629 15.371 367 HG3 GLN 47 HG3 GLN 47 11.816 -1.866 16.949 368 HE21 GLN 47 HE21 GLN 47 11.688 -4.945 15.285 369 HE22 GLN 47 HE22 GLN 47 12.515 -5.852 16.488 370 H ASP 48 H ASP 48 11.174 0.244 16.149 371 HA ASP 48 HA ASP 48 11.507 0.747 18.969 372 HB2 ASP 48 HB2 ASP 48 13.453 0.396 17.520 373 HB3 ASP 48 HB3 ASP 48 13.026 1.801 16.548 374 H SER 49 H SER 49 10.012 2.446 16.320 375 HA SER 49 HA SER 49 9.540 4.845 17.967 376 HB2 SER 49 HB2 SER 49 10.656 4.938 15.128 377 HB3 SER 49 HB3 SER 49 10.238 6.333 16.124 378 HG SER 49 HG SER 49 11.868 5.070 17.626 379 H ASP 50 H ASP 50 7.695 6.079 17.312 380 HA ASP 50 HA ASP 50 5.561 4.501 16.155 381 HB2 ASP 50 HB2 ASP 50 5.574 7.365 17.192 382 HB3 ASP 50 HB3 ASP 50 4.129 6.502 16.673 383 H LYS 51 H LYS 51 6.460 4.257 14.055 384 HA LYS 51 HA LYS 51 5.404 6.060 12.115 385 HB2 LYS 51 HB2 LYS 51 7.566 6.592 10.972 386 HB3 LYS 51 HB3 LYS 51 7.437 7.329 12.565 387 HG2 LYS 51 HG2 LYS 51 8.861 5.462 13.484 388 HG3 LYS 51 HG3 LYS 51 9.085 4.887 11.828 389 HD2 LYS 51 HD2 LYS 51 10.097 7.104 11.243 390 HD3 LYS 51 HD3 LYS 51 9.943 7.589 12.931 391 HE2 LYS 51 HE2 LYS 51 11.454 5.755 13.596 392 HE3 LYS 51 HE3 LYS 51 11.591 5.254 11.907 393 HZ1 LYS 51 HZ1 LYS 51 12.619 7.359 11.383 394 HZ2 LYS 51 HZ2 LYS 51 13.468 6.609 12.639 395 HZ3 LYS 51 HZ3 LYS 51 12.428 7.897 12.975 396 H SER 52 H SER 52 6.491 5.226 9.840 397 HA SER 52 HA SER 52 6.807 2.343 9.708 398 HB2 SER 52 HB2 SER 52 4.335 2.563 9.830 399 HB3 SER 52 HB3 SER 52 4.353 3.740 8.516 400 HG SER 52 HG SER 52 3.831 1.582 7.845 401 H HIS 53 H HIS 53 7.641 1.716 7.648 402 HA HIS 53 HA HIS 53 8.299 3.937 5.770 403 HB2 HIS 53 HB2 HIS 53 9.687 1.268 6.240 404 HB3 HIS 53 HB3 HIS 53 10.030 2.287 4.848 405 HD1 HIS 53 HD1 HIS 53 12.352 3.025 5.331 406 HD2 HIS 53 HD2 HIS 53 9.873 3.532 8.621 407 HE1 HIS 53 HE1 HIS 53 13.762 4.175 7.054 408 HE2 HIS 53 HE2 HIS 53 12.287 4.317 9.088 409 H ILE 54 H ILE 54 7.232 3.941 3.900 410 HA ILE 54 HA ILE 54 5.906 1.469 2.945 411 HB ILE 54 HB ILE 54 4.979 4.332 2.352 412 HG12 ILE 54 HG12 ILE 54 2.893 3.647 3.723 413 HG13 ILE 54 HG13 ILE 54 3.857 2.320 4.351 414 HG21 ILE 54 HG21 ILE 54 4.469 2.742 0.548 415 HG22 ILE 54 HG22 ILE 54 2.985 3.246 1.358 416 HG23 ILE 54 HG23 ILE 54 3.681 1.659 1.699 417 HD11 ILE 54 HD11 ILE 54 4.470 5.251 4.687 418 HD12 ILE 54 HD12 ILE 54 5.389 3.909 5.375 419 HD13 ILE 54 HD13 ILE 54 3.730 4.198 5.893 420 H TRP 55 H TRP 55 7.243 0.677 1.417 421 HA TRP 55 HA TRP 55 8.738 2.365 -0.438 422 HB2 TRP 55 HB2 TRP 55 8.523 -0.678 -0.203 423 HB3 TRP 55 HB3 TRP 55 9.631 0.180 -1.272 424 HD1 TRP 55 HD1 TRP 55 11.863 1.154 -0.171 425 HE1 TRP 55 HE1 TRP 55 12.983 0.879 2.097 426 HE3 TRP 55 HE3 TRP 55 8.014 -1.015 2.355 427 HZ2 TRP 55 HZ2 TRP 55 12.367 -0.146 4.613 428 HZ3 TRP 55 HZ3 TRP 55 8.373 -1.634 4.701 429 HH2 TRP 55 HH2 TRP 55 10.509 -1.209 5.812 430 H LEU 56 H LEU 56 7.506 3.238 -2.041 431 HA LEU 56 HA LEU 56 5.339 1.732 -3.312 432 HB2 LEU 56 HB2 LEU 56 6.268 4.608 -3.722 433 HB3 LEU 56 HB3 LEU 56 4.975 3.861 -4.640 434 HG LEU 56 HG LEU 56 3.903 5.191 -3.005 435 HD11 LEU 56 HD11 LEU 56 3.816 2.353 -1.944 436 HD12 LEU 56 HD12 LEU 56 2.857 2.999 -3.276 437 HD13 LEU 56 HD13 LEU 56 2.619 3.616 -1.645 438 HD21 LEU 56 HD21 LEU 56 5.680 3.980 -0.863 439 HD22 LEU 56 HD22 LEU 56 4.362 5.122 -0.585 440 HD23 LEU 56 HD23 LEU 56 5.778 5.622 -1.507 441 H LEU 57 H LEU 57 5.892 0.399 -4.849 442 HA LEU 57 HA LEU 57 8.220 0.737 -6.583 443 HB2 LEU 57 HB2 LEU 57 6.153 -1.467 -6.246 444 HB3 LEU 57 HB3 LEU 57 7.307 -1.482 -7.564 445 HG LEU 57 HG LEU 57 9.169 -1.692 -5.991 446 HD11 LEU 57 HD11 LEU 57 8.831 -2.073 -3.585 447 HD12 LEU 57 HD12 LEU 57 7.122 -1.654 -3.756 448 HD13 LEU 57 HD13 LEU 57 8.372 -0.445 -4.079 449 HD21 LEU 57 HD21 LEU 57 6.976 -3.730 -5.501 450 HD22 LEU 57 HD22 LEU 57 8.698 -3.976 -5.191 451 HD23 LEU 57 HD23 LEU 57 8.130 -3.722 -6.840 452 H VAL 58 H VAL 58 7.828 2.274 -8.058 453 HA VAL 58 HA VAL 58 5.587 1.974 -9.940 454 HB VAL 58 HB VAL 58 4.942 3.614 -8.069 455 HG11 VAL 58 HG11 VAL 58 5.843 5.882 -8.054 456 HG12 VAL 58 HG12 VAL 58 7.030 5.429 -9.282 457 HG13 VAL 58 HG13 VAL 58 7.088 4.688 -7.681 458 HG21 VAL 58 HG21 VAL 58 4.988 4.735 -10.887 459 HG22 VAL 58 HG22 VAL 58 3.930 5.283 -9.582 460 HG23 VAL 58 HG23 VAL 58 3.774 3.643 -10.210 461 H ASN 59 H ASN 59 6.155 2.954 -12.065 462 HA ASN 59 HA ASN 59 9.029 2.965 -12.474 463 HB2 ASN 59 HB2 ASN 59 8.570 3.127 -14.841 464 HB3 ASN 59 HB3 ASN 59 7.470 1.951 -14.142 465 HD21 ASN 59 HD21 ASN 59 7.277 3.504 -16.638 466 HD22 ASN 59 HD22 ASN 59 5.760 4.325 -16.540 467 H ASP 60 H ASP 60 10.354 4.699 -12.824 468 HA ASP 60 HA ASP 60 9.531 7.233 -11.841 469 HB2 ASP 60 HB2 ASP 60 11.821 7.985 -12.137 470 HB3 ASP 60 HB3 ASP 60 11.812 6.379 -11.423 471 H ASP 61 H ASP 61 9.290 9.151 -12.852 472 HA ASP 61 HA ASP 61 9.392 9.371 -15.776 473 HB2 ASP 61 HB2 ASP 61 7.101 8.593 -15.198 474 HB3 ASP 61 HB3 ASP 61 6.925 9.916 -14.056 475 H GLN 62 H GLN 62 9.243 11.670 -16.438 476 HA GLN 62 HA GLN 62 10.861 13.428 -14.982 477 HB2 GLN 62 HB2 GLN 62 8.785 14.061 -17.114 478 HB3 GLN 62 HB3 GLN 62 9.996 15.204 -16.545 479 HG2 GLN 62 HG2 GLN 62 11.789 13.766 -17.420 480 HG3 GLN 62 HG3 GLN 62 10.602 12.572 -17.939 481 HE21 GLN 62 HE21 GLN 62 8.683 14.534 -18.954 482 HE22 GLN 62 HE22 GLN 62 9.362 15.176 -20.407 483 H ARG 63 H ARG 63 7.320 13.209 -15.162 484 HA ARG 63 HA ARG 63 6.808 15.524 -13.519 485 HB2 ARG 63 HB2 ARG 63 5.198 14.840 -15.266 486 HB3 ARG 63 HB3 ARG 63 4.934 13.300 -14.455 487 HG2 ARG 63 HG2 ARG 63 3.967 14.508 -12.509 488 HG3 ARG 63 HG3 ARG 63 4.206 16.039 -13.350 489 HD2 ARG 63 HD2 ARG 63 2.441 13.767 -14.328 490 HD3 ARG 63 HD3 ARG 63 1.871 15.214 -13.490 491 HE ARG 63 HE ARG 63 3.120 16.352 -15.511 492 HH11 ARG 63 HH11 ARG 63 0.989 13.569 -15.605 493 HH12 ARG 63 HH12 ARG 63 0.433 13.894 -17.211 494 HH21 ARG 63 HH21 ARG 63 2.390 16.771 -17.626 495 HH22 ARG 63 HH22 ARG 63 1.231 15.709 -18.360 496 H LEU 64 H LEU 64 7.239 12.083 -12.967 497 HA LEU 64 HA LEU 64 5.910 11.700 -10.546 498 HB2 LEU 64 HB2 LEU 64 7.043 9.922 -11.986 499 HB3 LEU 64 HB3 LEU 64 8.565 10.407 -11.260 500 HG LEU 64 HG LEU 64 7.451 9.840 -8.972 501 HD11 LEU 64 HD11 LEU 64 5.125 9.702 -9.753 502 HD12 LEU 64 HD12 LEU 64 5.652 8.199 -9.001 503 HD13 LEU 64 HD13 LEU 64 5.544 8.308 -10.761 504 HD21 LEU 64 HD21 LEU 64 9.228 8.476 -9.988 505 HD22 LEU 64 HD22 LEU 64 8.008 7.562 -10.883 506 HD23 LEU 64 HD23 LEU 64 8.052 7.492 -9.121 507 H GLU 65 H GLU 65 9.062 13.117 -11.171 508 HA GLU 65 HA GLU 65 10.089 13.255 -8.546 509 HB2 GLU 65 HB2 GLU 65 10.616 15.108 -10.905 510 HB3 GLU 65 HB3 GLU 65 11.616 14.982 -9.456 511 HG2 GLU 65 HG2 GLU 65 12.118 12.628 -10.010 512 HG3 GLU 65 HG3 GLU 65 11.127 12.759 -11.460 513 H GLN 66 H GLN 66 7.948 15.417 -10.334 514 HA GLN 66 HA GLN 66 7.831 17.575 -8.486 515 HB2 GLN 66 HB2 GLN 66 7.027 17.703 -10.860 516 HB3 GLN 66 HB3 GLN 66 5.691 16.631 -10.454 517 HG2 GLN 66 HG2 GLN 66 4.876 18.371 -8.830 518 HG3 GLN 66 HG3 GLN 66 6.158 19.439 -9.408 519 HE21 GLN 66 HE21 GLN 66 4.684 20.984 -10.177 520 HE22 GLN 66 HE22 GLN 66 3.689 20.725 -11.563 521 H MET 67 H MET 67 5.858 14.639 -8.915 522 HA MET 67 HA MET 67 4.002 15.018 -6.835 523 HB2 MET 67 HB2 MET 67 5.079 12.529 -8.189 524 HB3 MET 67 HB3 MET 67 3.911 12.405 -6.881 525 HG2 MET 67 HG2 MET 67 2.837 12.242 -9.064 526 HG3 MET 67 HG3 MET 67 2.270 13.651 -8.179 527 HE1 MET 67 HE1 MET 67 1.597 15.585 -9.662 528 HE2 MET 67 HE2 MET 67 2.810 16.481 -10.576 529 HE3 MET 67 HE3 MET 67 3.036 16.207 -8.849 530 H ILE 68 H ILE 68 7.203 13.477 -6.813 531 HA ILE 68 HA ILE 68 7.288 12.575 -4.134 532 HB ILE 68 HB ILE 68 9.569 13.378 -6.008 533 HG12 ILE 68 HG12 ILE 68 8.551 10.566 -5.373 534 HG13 ILE 68 HG13 ILE 68 8.039 11.489 -6.779 535 HG21 ILE 68 HG21 ILE 68 11.072 12.014 -4.573 536 HG22 ILE 68 HG22 ILE 68 9.749 11.764 -3.431 537 HG23 ILE 68 HG23 ILE 68 10.394 13.384 -3.692 538 HD11 ILE 68 HD11 ILE 68 9.727 9.907 -7.403 539 HD12 ILE 68 HD12 ILE 68 10.834 10.537 -6.185 540 HD13 ILE 68 HD13 ILE 68 10.375 11.540 -7.565 541 H SER 69 H SER 69 8.263 15.642 -5.636 542 HA SER 69 HA SER 69 9.438 16.813 -3.302 543 HB2 SER 69 HB2 SER 69 8.433 18.117 -5.863 544 HB3 SER 69 HB3 SER 69 9.454 18.902 -4.654 545 HG SER 69 HG SER 69 10.276 16.463 -5.771 546 H GLN 70 H GLN 70 6.201 16.812 -4.687 547 HA GLN 70 HA GLN 70 5.114 18.976 -3.143 548 HB2 GLN 70 HB2 GLN 70 4.216 18.133 -5.372 549 HB3 GLN 70 HB3 GLN 70 3.615 16.704 -4.554 550 HG2 GLN 70 HG2 GLN 70 2.717 19.519 -3.869 551 HG3 GLN 70 HG3 GLN 70 1.917 18.517 -5.068 552 HE21 GLN 70 HE21 GLN 70 2.176 16.036 -3.481 553 HE22 GLN 70 HE22 GLN 70 1.041 16.186 -2.193 554 H ILE 71 H ILE 71 4.926 15.419 -2.930 555 HA ILE 71 HA ILE 71 3.267 15.366 -0.624 556 HB ILE 71 HB ILE 71 3.413 13.469 -2.262 557 HG12 ILE 71 HG12 ILE 71 3.866 12.876 0.696 558 HG13 ILE 71 HG13 ILE 71 2.324 13.078 -0.128 559 HG21 ILE 71 HG21 ILE 71 6.057 12.802 -0.913 560 HG22 ILE 71 HG22 ILE 71 5.874 13.415 -2.556 561 HG23 ILE 71 HG23 ILE 71 5.231 11.827 -2.135 562 HD11 ILE 71 HD11 ILE 71 2.713 10.781 0.376 563 HD12 ILE 71 HD12 ILE 71 4.261 10.814 -0.462 564 HD13 ILE 71 HD13 ILE 71 2.761 11.008 -1.375 565 H ASP 72 H ASP 72 6.718 15.493 -1.099 566 HA ASP 72 HA ASP 72 7.707 14.827 1.422 567 HB2 ASP 72 HB2 ASP 72 9.209 15.142 -0.443 568 HB3 ASP 72 HB3 ASP 72 8.683 16.801 -0.682 569 H LYS 73 H LYS 73 6.081 17.740 0.312 570 HA LYS 73 HA LYS 73 6.829 19.439 2.519 571 HB2 LYS 73 HB2 LYS 73 4.449 19.891 0.676 572 HB3 LYS 73 HB3 LYS 73 5.369 21.099 1.564 573 HG2 LYS 73 HG2 LYS 73 6.206 19.560 -0.903 574 HG3 LYS 73 HG3 LYS 73 5.933 21.295 -0.755 575 HD2 LYS 73 HD2 LYS 73 8.187 19.747 0.582 576 HD3 LYS 73 HD3 LYS 73 8.342 20.706 -0.888 577 HE2 LYS 73 HE2 LYS 73 7.857 22.745 0.321 578 HE3 LYS 73 HE3 LYS 73 7.487 21.834 1.787 579 HZ1 LYS 73 HZ1 LYS 73 10.152 21.958 0.462 580 HZ2 LYS 73 HZ2 LYS 73 9.793 21.101 1.874 581 HZ3 LYS 73 HZ3 LYS 73 9.711 22.787 1.869 582 H LEU 74 H LEU 74 4.437 17.006 2.044 583 HA LEU 74 HA LEU 74 2.529 17.887 3.990 584 HB2 LEU 74 HB2 LEU 74 2.932 15.299 2.475 585 HB3 LEU 74 HB3 LEU 74 1.816 15.348 3.825 586 HG LEU 74 HG LEU 74 0.584 15.613 1.741 587 HD11 LEU 74 HD11 LEU 74 -0.302 16.805 3.686 588 HD12 LEU 74 HD12 LEU 74 -0.658 17.681 2.201 589 HD13 LEU 74 HD13 LEU 74 0.638 18.240 3.261 590 HD21 LEU 74 HD21 LEU 74 2.367 16.548 0.318 591 HD22 LEU 74 HD22 LEU 74 2.254 18.088 1.165 592 HD23 LEU 74 HD23 LEU 74 0.891 17.503 0.208 593 H GLU 75 H GLU 75 2.301 17.295 6.096 594 HA GLU 75 HA GLU 75 4.785 16.823 7.489 595 HB2 GLU 75 HB2 GLU 75 3.402 17.368 9.537 596 HB3 GLU 75 HB3 GLU 75 3.426 18.606 8.291 597 HG2 GLU 75 HG2 GLU 75 1.210 18.577 9.021 598 HG3 GLU 75 HG3 GLU 75 1.173 17.678 7.509 599 H ASP 76 H ASP 76 1.929 14.963 6.822 600 HA ASP 76 HA ASP 76 2.173 12.853 8.639 601 HB2 ASP 76 HB2 ASP 76 1.008 11.485 6.752 602 HB3 ASP 76 HB3 ASP 76 0.167 12.886 7.398 603 H VAL 77 H VAL 77 3.612 13.213 5.410 604 HA VAL 77 HA VAL 77 5.436 11.007 5.689 605 HB VAL 77 HB VAL 77 5.265 13.325 3.695 606 HG11 VAL 77 HG11 VAL 77 7.032 12.248 2.355 607 HG12 VAL 77 HG12 VAL 77 7.275 11.039 3.619 608 HG13 VAL 77 HG13 VAL 77 7.652 12.733 3.934 609 HG21 VAL 77 HG21 VAL 77 4.809 10.337 3.345 610 HG22 VAL 77 HG22 VAL 77 4.607 11.575 2.101 611 HG23 VAL 77 HG23 VAL 77 3.539 11.559 3.505 612 H VAL 78 H VAL 78 6.818 11.134 7.336 613 HA VAL 78 HA VAL 78 7.955 13.468 8.491 614 HB VAL 78 HB VAL 78 8.997 10.589 8.623 615 HG11 VAL 78 HG11 VAL 78 10.028 11.227 10.767 616 HG12 VAL 78 HG12 VAL 78 9.485 12.893 10.547 617 HG13 VAL 78 HG13 VAL 78 10.665 12.193 9.434 618 HG21 VAL 78 HG21 VAL 78 7.012 11.946 10.493 619 HG22 VAL 78 HG22 VAL 78 7.656 10.311 10.664 620 HG23 VAL 78 HG23 VAL 78 6.622 10.710 9.291 621 H LYS 79 H LYS 79 9.242 11.000 6.273 622 HA LYS 79 HA LYS 79 10.991 12.950 4.939 623 HB2 LYS 79 HB2 LYS 79 11.995 10.289 6.056 624 HB3 LYS 79 HB3 LYS 79 12.880 11.249 4.875 625 HG2 LYS 79 HG2 LYS 79 13.067 13.091 6.505 626 HG3 LYS 79 HG3 LYS 79 12.186 12.128 7.690 627 HD2 LYS 79 HD2 LYS 79 14.891 11.440 6.476 628 HD3 LYS 79 HD3 LYS 79 14.608 12.034 8.112 629 HE2 LYS 79 HE2 LYS 79 13.327 9.979 8.631 630 HE3 LYS 79 HE3 LYS 79 13.630 9.386 6.992 631 HZ1 LYS 79 HZ1 LYS 79 15.181 8.452 8.609 632 HZ2 LYS 79 HZ2 LYS 79 15.715 10.003 9.015 633 HZ3 LYS 79 HZ3 LYS 79 15.994 9.395 7.462 634 H VAL 80 H VAL 80 11.314 12.447 2.758 635 HA VAL 80 HA VAL 80 10.148 9.918 1.713 636 HB VAL 80 HB VAL 80 8.995 12.077 0.939 637 HG11 VAL 80 HG11 VAL 80 10.956 13.514 0.691 638 HG12 VAL 80 HG12 VAL 80 10.052 13.427 -0.820 639 HG13 VAL 80 HG13 VAL 80 11.551 12.513 -0.638 640 HG21 VAL 80 HG21 VAL 80 8.693 9.987 -0.297 641 HG22 VAL 80 HG22 VAL 80 10.169 10.277 -1.221 642 HG23 VAL 80 HG23 VAL 80 8.775 11.341 -1.427 643 H GLN 81 H GLN 81 11.358 8.860 0.065 644 HA GLN 81 HA GLN 81 14.142 9.658 -0.415 645 HB2 GLN 81 HB2 GLN 81 13.301 7.009 0.829 646 HB3 GLN 81 HB3 GLN 81 14.875 7.267 0.096 647 HG2 GLN 81 HG2 GLN 81 15.366 8.987 1.806 648 HG3 GLN 81 HG3 GLN 81 13.797 8.680 2.546 649 HE21 GLN 81 HE21 GLN 81 15.820 6.087 1.212 650 HE22 GLN 81 HE22 GLN 81 16.208 5.377 2.734 651 H ARG 82 H ARG 82 14.770 9.159 -2.417 652 HA ARG 82 HA ARG 82 13.182 7.315 -4.095 653 HB2 ARG 82 HB2 ARG 82 15.408 9.265 -4.872 654 HB3 ARG 82 HB3 ARG 82 14.450 8.297 -5.991 655 HG2 ARG 82 HG2 ARG 82 12.425 9.540 -5.379 656 HG3 ARG 82 HG3 ARG 82 13.338 10.468 -4.185 657 HD2 ARG 82 HD2 ARG 82 13.009 11.772 -6.240 658 HD3 ARG 82 HD3 ARG 82 14.727 11.433 -5.987 659 HE ARG 82 HE ARG 82 13.607 9.432 -7.630 660 HH11 ARG 82 HH11 ARG 82 14.497 12.828 -7.832 661 HH12 ARG 82 HH12 ARG 82 14.765 12.776 -9.545 662 HH21 ARG 82 HH21 ARG 82 13.965 9.379 -9.867 663 HH22 ARG 82 HH22 ARG 82 14.468 10.817 -10.700 664 H ASN 83 H ASN 83 13.876 5.280 -3.719 665 HA ASN 83 HA ASN 83 16.760 4.680 -3.423 666 HB2 ASN 83 HB2 ASN 83 14.316 2.981 -2.723 667 HB3 ASN 83 HB3 ASN 83 15.987 2.448 -2.569 668 HD21 ASN 83 HD21 ASN 83 15.784 2.076 -0.386 669 HD22 ASN 83 HD22 ASN 83 15.620 3.333 0.787 670 H GLN 84 H GLN 84 17.653 2.949 -4.579 671 HA GLN 84 HA GLN 84 16.601 2.580 -7.272 672 HB2 GLN 84 HB2 GLN 84 18.794 1.454 -7.697 673 HB3 GLN 84 HB3 GLN 84 18.969 3.082 -7.064 674 HG2 GLN 84 HG2 GLN 84 19.411 2.113 -4.800 675 HG3 GLN 84 HG3 GLN 84 19.353 0.505 -5.515 676 HE21 GLN 84 HE21 GLN 84 20.841 3.376 -6.998 677 HE22 GLN 84 HE22 GLN 84 22.460 2.786 -6.936 678 H SER 85 H SER 85 15.956 0.611 -8.141 679 HA SER 85 HA SER 85 14.673 -1.087 -6.190 680 HB2 SER 85 HB2 SER 85 13.408 -0.259 -8.131 681 HB3 SER 85 HB3 SER 85 14.480 -1.134 -9.210 682 HG SER 85 HG SER 85 12.861 -2.531 -8.950 683 H ASP 86 H ASP 86 15.049 -3.130 -5.716 684 HA ASP 86 HA ASP 86 16.841 -4.834 -7.239 685 HB2 ASP 86 HB2 ASP 86 18.377 -3.568 -5.752 686 HB3 ASP 86 HB3 ASP 86 17.441 -4.053 -4.348 687 HA PRO 87 HA PRO 87 13.588 -7.750 -5.984 688 HB2 PRO 87 HB2 PRO 87 15.827 -9.759 -6.351 689 HB3 PRO 87 HB3 PRO 87 14.169 -9.783 -6.997 690 HG2 PRO 87 HG2 PRO 87 16.168 -9.128 -8.588 691 HG3 PRO 87 HG3 PRO 87 14.644 -8.210 -8.660 692 HD2 PRO 87 HD2 PRO 87 17.258 -7.429 -7.380 693 HD3 PRO 87 HD3 PRO 87 16.110 -6.438 -8.308 694 H THR 88 H THR 88 16.861 -8.418 -4.588 695 HA THR 88 HA THR 88 15.731 -9.908 -2.378 696 HB THR 88 HB THR 88 18.071 -10.058 -1.499 697 HG1 THR 88 HG1 THR 88 18.660 -8.440 -3.762 698 HG21 THR 88 HG21 THR 88 17.818 -10.768 -4.442 699 HG22 THR 88 HG22 THR 88 17.281 -11.765 -3.087 700 HG23 THR 88 HG23 THR 88 18.999 -11.438 -3.314 701 H MET 89 H MET 89 16.689 -6.588 -2.906 702 HA MET 89 HA MET 89 16.954 -5.647 -0.274 703 HB2 MET 89 HB2 MET 89 17.472 -4.254 -2.246 704 HB3 MET 89 HB3 MET 89 15.771 -4.217 -2.697 705 HG2 MET 89 HG2 MET 89 16.452 -2.117 -1.659 706 HG3 MET 89 HG3 MET 89 15.252 -2.939 -0.661 707 HE1 MET 89 HE1 MET 89 15.891 -1.309 1.392 708 HE2 MET 89 HE2 MET 89 17.118 -0.506 0.410 709 HE3 MET 89 HE3 MET 89 17.536 -1.127 2.005 710 H PHE 90 H PHE 90 14.083 -6.164 -2.260 711 HA PHE 90 HA PHE 90 12.099 -5.105 -0.569 712 HB2 PHE 90 HB2 PHE 90 11.823 -5.707 -3.002 713 HB3 PHE 90 HB3 PHE 90 11.811 -7.405 -2.551 714 HD1 PHE 90 HD1 PHE 90 9.855 -8.337 -1.268 715 HD2 PHE 90 HD2 PHE 90 9.853 -4.309 -2.696 716 HE1 PHE 90 HE1 PHE 90 7.416 -8.229 -0.964 717 HE2 PHE 90 HE2 PHE 90 7.416 -4.207 -2.386 718 HZ PHE 90 HZ PHE 90 6.196 -6.160 -1.517 719 H ASN 91 H ASN 91 13.557 -8.330 -0.740 720 HA ASN 91 HA ASN 91 11.864 -9.596 1.192 721 HB2 ASN 91 HB2 ASN 91 13.111 -10.890 -0.523 722 HB3 ASN 91 HB3 ASN 91 14.637 -10.384 0.189 723 HD21 ASN 91 HD21 ASN 91 11.822 -12.435 0.595 724 HD22 ASN 91 HD22 ASN 91 12.492 -13.437 1.832 725 H LYS 92 H LYS 92 15.018 -7.968 1.340 726 HA LYS 92 HA LYS 92 15.809 -8.639 3.952 727 HB2 LYS 92 HB2 LYS 92 16.444 -6.126 2.350 728 HB3 LYS 92 HB3 LYS 92 17.258 -6.578 3.847 729 HG2 LYS 92 HG2 LYS 92 18.177 -8.576 2.799 730 HG3 LYS 92 HG3 LYS 92 17.271 -8.253 1.320 731 HD2 LYS 92 HD2 LYS 92 18.561 -6.074 1.114 732 HD3 LYS 92 HD3 LYS 92 19.556 -6.608 2.471 733 HE2 LYS 92 HE2 LYS 92 20.239 -8.604 1.159 734 HE3 LYS 92 HE3 LYS 92 19.272 -8.026 -0.201 735 HZ1 LYS 92 HZ1 LYS 92 20.666 -6.031 -0.263 736 HZ2 LYS 92 HZ2 LYS 92 21.578 -7.434 -0.496 737 HZ3 LYS 92 HZ3 LYS 92 21.614 -6.644 0.995 738 H ILE 93 H ILE 93 14.161 -5.684 2.809 739 HA ILE 93 HA ILE 93 13.817 -4.506 5.372 740 HB ILE 93 HB ILE 93 12.265 -2.928 4.172 741 HG12 ILE 93 HG12 ILE 93 12.662 -4.936 1.935 742 HG13 ILE 93 HG13 ILE 93 11.160 -4.302 2.571 743 HG21 ILE 93 HG21 ILE 93 13.966 -1.923 2.702 744 HG22 ILE 93 HG22 ILE 93 14.896 -3.422 2.733 745 HG23 ILE 93 HG23 ILE 93 14.687 -2.483 4.213 746 HD11 ILE 93 HD11 ILE 93 13.122 -2.790 0.852 747 HD12 ILE 93 HD12 ILE 93 11.594 -2.164 1.474 748 HD13 ILE 93 HD13 ILE 93 11.597 -3.507 0.331 749 H ALA 94 H ALA 94 11.857 -6.731 3.449 750 HA ALA 94 HA ALA 94 9.440 -6.587 4.920 751 HB1 ALA 94 HB1 ALA 94 8.883 -8.727 3.846 752 HB2 ALA 94 HB2 ALA 94 10.564 -8.922 3.341 753 HB3 ALA 94 HB3 ALA 94 9.595 -7.602 2.686 754 H VAL 95 H VAL 95 12.313 -8.679 5.318 755 HA VAL 95 HA VAL 95 11.079 -10.181 7.505 756 HB VAL 95 HB VAL 95 12.461 -11.324 5.731 757 HG11 VAL 95 HG11 VAL 95 14.922 -11.262 5.846 758 HG12 VAL 95 HG12 VAL 95 14.839 -10.006 7.083 759 HG13 VAL 95 HG13 VAL 95 14.249 -9.679 5.453 760 HG21 VAL 95 HG21 VAL 95 12.005 -12.450 7.867 761 HG22 VAL 95 HG22 VAL 95 13.444 -11.724 8.583 762 HG23 VAL 95 HG23 VAL 95 13.606 -12.891 7.267 763 H PHE 96 H PHE 96 13.321 -7.543 7.119 764 HA PHE 96 HA PHE 96 14.436 -7.742 9.806 765 HB2 PHE 96 HB2 PHE 96 15.687 -6.885 7.704 766 HB3 PHE 96 HB3 PHE 96 14.759 -5.403 7.880 767 HD1 PHE 96 HD2 PHE 96 17.331 -7.566 9.474 768 HD2 PHE 96 HD1 PHE 96 15.367 -3.770 9.586 769 HE1 PHE 96 HE2 PHE 96 19.021 -6.735 11.051 770 HE2 PHE 96 HE1 PHE 96 17.058 -2.952 11.168 771 HZ PHE 96 HZ PHE 96 18.888 -4.427 11.902 772 H PHE 97 H PHE 97 12.116 -5.836 7.988 773 HA PHE 97 HA PHE 97 10.711 -4.167 8.423 774 HB2 PHE 97 HB2 PHE 97 8.907 -4.742 10.096 775 HB3 PHE 97 HB3 PHE 97 9.251 -5.971 8.900 776 HD1 PHE 97 HD1 PHE 97 10.302 -8.127 9.583 777 HD2 PHE 97 HD2 PHE 97 9.256 -5.170 12.489 778 HE1 PHE 97 HE1 PHE 97 10.459 -9.817 11.361 779 HE2 PHE 97 HE2 PHE 97 9.426 -6.866 14.264 780 HZ PHE 97 HZ PHE 97 10.029 -9.190 13.705 781 H GLN 98 H GLN 98 12.965 -3.131 9.171 782 HA GLN 98 HA GLN 98 12.241 -1.185 11.184 783 HB2 GLN 98 HB2 GLN 98 13.203 -3.011 12.584 784 HB3 GLN 98 HB3 GLN 98 14.676 -2.986 11.634 785 HG2 GLN 98 HG2 GLN 98 15.038 -1.857 13.740 786 HG3 GLN 98 HG3 GLN 98 15.130 -0.691 12.422 787 HE21 GLN 98 HE21 GLN 98 14.761 1.008 13.876 788 HE22 GLN 98 HE22 GLN 98 13.205 1.320 14.552 789 H1 GLY 1 H1 GLY 1 -5.595 -3.501 19.126 790 H2 GLY 1 H2 GLY 1 -4.151 -3.390 19.999 791 H3 GLY 1 H3 GLY 1 -5.218 -2.082 19.965 792 HA2 GLY 1 HA3 GLY 1 -6.866 -3.317 21.182 793 HA3 GLY 1 HA2 GLY 1 -5.815 -4.724 21.157 794 H SER 2 H SER 2 -3.389 -3.871 21.879 795 HA SER 2 HA SER 2 -3.386 -2.099 24.143 796 HB2 SER 2 HB2 SER 2 -4.485 -4.157 25.103 797 HB3 SER 2 HB3 SER 2 -3.054 -5.093 24.682 798 HG SER 2 HG SER 2 -2.965 -4.437 26.835 799 H MET 3 H MET 3 -1.149 -2.645 25.426 800 HA MET 3 HA MET 3 0.981 -2.066 23.623 801 HB2 MET 3 HB2 MET 3 1.088 -2.864 26.571 802 HB3 MET 3 HB3 MET 3 2.436 -2.200 25.658 803 HG2 MET 3 HG2 MET 3 1.288 -0.086 25.416 804 HG3 MET 3 HG3 MET 3 -0.163 -0.750 26.167 805 HE1 MET 3 HE1 MET 3 3.607 0.328 26.785 806 HE2 MET 3 HE2 MET 3 3.611 -1.366 27.277 807 HE3 MET 3 HE3 MET 3 3.803 -0.095 28.485 808 H GLN 4 H GLN 4 1.073 -3.814 22.162 809 HA GLN 4 HA GLN 4 2.568 -6.173 23.131 810 HB2 GLN 4 HB2 GLN 4 0.271 -6.312 21.114 811 HB3 GLN 4 HB3 GLN 4 1.297 -7.659 21.598 812 HG2 GLN 4 HG2 GLN 4 0.399 -7.395 23.943 813 HG3 GLN 4 HG3 GLN 4 -0.726 -6.194 23.318 814 HE21 GLN 4 HE21 GLN 4 -1.165 -7.728 20.781 815 HE22 GLN 4 HE22 GLN 4 -2.184 -9.045 21.232 816 H ASN 5 H ASN 5 3.777 -7.227 21.347 817 HA ASN 5 HA ASN 5 4.945 -5.433 19.423 818 HB2 ASN 5 HB2 ASN 5 6.267 -7.408 18.711 819 HB3 ASN 5 HB3 ASN 5 6.275 -7.236 20.462 820 HD21 ASN 5 HD21 ASN 5 6.892 -9.615 18.982 821 HD22 ASN 5 HD22 ASN 5 5.730 -10.820 19.415 822 H THR 6 H THR 6 5.153 -7.016 17.032 823 HA THR 6 HA THR 6 2.662 -6.397 15.776 824 HB THR 6 HB THR 6 3.634 -7.523 13.723 825 HG1 THR 6 HG1 THR 6 5.143 -8.787 15.362 826 HG21 THR 6 HG21 THR 6 5.400 -5.842 13.336 827 HG22 THR 6 HG22 THR 6 5.437 -5.469 15.059 828 HG23 THR 6 HG23 THR 6 3.993 -5.110 14.112 829 H THR 7 H THR 7 1.151 -7.505 16.940 830 HA THR 7 HA THR 7 1.022 -10.445 16.918 831 HB THR 7 HB THR 7 -0.941 -9.938 18.581 832 HG1 THR 7 HG1 THR 7 0.386 -7.405 18.681 833 HG21 THR 7 HG21 THR 7 1.244 -10.814 19.351 834 HG22 THR 7 HG22 THR 7 0.566 -9.665 20.505 835 HG23 THR 7 HG23 THR 7 1.876 -9.165 19.433 836 H HIS 8 H HIS 8 -1.444 -11.164 16.823 837 HA HIS 8 HA HIS 8 -2.363 -10.368 14.181 838 HB2 HIS 8 HB2 HIS 8 -3.853 -12.317 14.289 839 HB3 HIS 8 HB3 HIS 8 -2.220 -12.770 14.747 840 HD1 HIS 8 HD1 HIS 8 -5.517 -11.915 16.443 841 HD2 HIS 8 HD2 HIS 8 -2.138 -14.248 17.059 842 HE1 HIS 8 HE1 HIS 8 -6.000 -13.254 18.504 843 HE2 HIS 8 HE2 HIS 8 -3.879 -14.524 18.958 844 H ASP 9 H ASP 9 -2.741 -8.472 16.480 845 HA ASP 9 HA ASP 9 -5.509 -8.003 16.929 846 HB2 ASP 9 HB2 ASP 9 -3.716 -6.862 18.215 847 HB3 ASP 9 HB3 ASP 9 -3.186 -6.015 16.764 848 H ASN 10 H ASN 10 -3.294 -7.222 14.359 849 HA ASN 10 HA ASN 10 -5.194 -5.835 12.685 850 HB2 ASN 10 HB2 ASN 10 -3.383 -5.881 11.010 851 HB3 ASN 10 HB3 ASN 10 -2.756 -5.354 12.567 852 HD21 ASN 10 HD21 ASN 10 -1.165 -6.368 10.469 853 HD22 ASN 10 HD22 ASN 10 -0.433 -7.834 11.008 854 H VAL 11 H VAL 11 -5.747 -6.718 10.510 855 HA VAL 11 HA VAL 11 -5.923 -9.657 10.335 856 HB VAL 11 HB VAL 11 -8.182 -9.520 9.305 857 HG11 VAL 11 HG11 VAL 11 -9.488 -9.166 11.364 858 HG12 VAL 11 HG12 VAL 11 -8.113 -8.346 12.106 859 HG13 VAL 11 HG13 VAL 11 -7.999 -10.057 11.690 860 HG21 VAL 11 HG21 VAL 11 -8.118 -7.163 8.491 861 HG22 VAL 11 HG22 VAL 11 -8.247 -6.589 10.151 862 HG23 VAL 11 HG23 VAL 11 -9.575 -7.495 9.427 863 H ILE 12 H ILE 12 -5.928 -10.433 8.203 864 HA ILE 12 HA ILE 12 -4.376 -8.681 6.412 865 HB ILE 12 HB ILE 12 -4.715 -11.720 6.354 866 HG12 ILE 12 HG12 ILE 12 -3.617 -10.941 8.463 867 HG13 ILE 12 HG13 ILE 12 -2.578 -11.950 7.473 868 HG21 ILE 12 HG21 ILE 12 -2.699 -11.719 4.957 869 HG22 ILE 12 HG22 ILE 12 -2.674 -9.955 4.989 870 HG23 ILE 12 HG23 ILE 12 -4.011 -10.804 4.210 871 HD11 ILE 12 HD11 ILE 12 -2.433 -8.950 7.736 872 HD12 ILE 12 HD12 ILE 12 -1.373 -9.946 6.734 873 HD13 ILE 12 HD13 ILE 12 -1.360 -10.130 8.487 874 H LEU 13 H LEU 13 -6.180 -7.552 5.555 875 HA LEU 13 HA LEU 13 -8.295 -9.030 4.172 876 HB2 LEU 13 HB2 LEU 13 -7.794 -6.027 4.350 877 HB3 LEU 13 HB3 LEU 13 -9.221 -6.793 3.666 878 HG LEU 13 HG LEU 13 -8.380 -6.828 6.584 879 HD11 LEU 13 HD11 LEU 13 -10.424 -5.528 6.958 880 HD12 LEU 13 HD12 LEU 13 -10.737 -5.493 5.222 881 HD13 LEU 13 HD13 LEU 13 -9.310 -4.689 5.883 882 HD21 LEU 13 HD21 LEU 13 -10.789 -8.167 5.304 883 HD22 LEU 13 HD22 LEU 13 -10.474 -8.040 7.037 884 HD23 LEU 13 HD23 LEU 13 -9.391 -8.981 6.017 885 H GLU 14 H GLU 14 -7.143 -10.080 2.514 886 HA GLU 14 HA GLU 14 -5.583 -8.406 0.680 887 HB2 GLU 14 HB2 GLU 14 -4.847 -10.374 -0.435 888 HB3 GLU 14 HB3 GLU 14 -4.704 -10.647 1.292 889 HG2 GLU 14 HG2 GLU 14 -6.486 -12.190 1.325 890 HG3 GLU 14 HG3 GLU 14 -7.065 -11.698 -0.265 891 H LEU 15 H LEU 15 -6.192 -7.923 -1.329 892 HA LEU 15 HA LEU 15 -8.654 -9.090 -2.408 893 HB2 LEU 15 HB2 LEU 15 -9.056 -6.572 -3.292 894 HB3 LEU 15 HB3 LEU 15 -9.732 -7.182 -1.797 895 HG LEU 15 HG LEU 15 -7.660 -6.156 -0.627 896 HD11 LEU 15 HD11 LEU 15 -6.277 -5.755 -2.582 897 HD12 LEU 15 HD12 LEU 15 -6.599 -4.254 -1.721 898 HD13 LEU 15 HD13 LEU 15 -7.463 -4.610 -3.219 899 HD21 LEU 15 HD21 LEU 15 -8.730 -3.955 -0.434 900 HD22 LEU 15 HD22 LEU 15 -9.908 -5.262 -0.349 901 HD23 LEU 15 HD23 LEU 15 -9.747 -4.318 -1.834 902 H THR 16 H THR 16 -8.404 -9.721 -4.347 903 HA THR 16 HA THR 16 -5.898 -9.343 -5.779 904 HB THR 16 HB THR 16 -8.325 -11.116 -6.377 905 HG1 THR 16 HG1 THR 16 -6.731 -11.422 -4.457 906 HG21 THR 16 HG21 THR 16 -6.842 -12.269 -7.978 907 HG22 THR 16 HG22 THR 16 -5.545 -11.125 -7.625 908 HG23 THR 16 HG23 THR 16 -7.021 -10.569 -8.421 909 H VAL 17 H VAL 17 -5.818 -7.613 -7.062 910 HA VAL 17 HA VAL 17 -8.259 -6.664 -8.452 911 HB VAL 17 HB VAL 17 -7.729 -4.428 -8.038 912 HG11 VAL 17 HG11 VAL 17 -8.553 -5.462 -5.981 913 HG12 VAL 17 HG12 VAL 17 -7.457 -4.136 -5.601 914 HG13 VAL 17 HG13 VAL 17 -6.902 -5.807 -5.461 915 HG21 VAL 17 HG21 VAL 17 -5.382 -4.335 -8.678 916 HG22 VAL 17 HG22 VAL 17 -4.901 -5.182 -7.210 917 HG23 VAL 17 HG23 VAL 17 -5.573 -3.554 -7.107 918 H ARG 18 H ARG 18 -7.970 -5.948 -10.552 919 HA ARG 18 HA ARG 18 -5.318 -6.331 -11.811 920 HB2 ARG 18 HB2 ARG 18 -6.608 -5.994 -13.976 921 HB3 ARG 18 HB3 ARG 18 -7.026 -7.442 -13.071 922 HG2 ARG 18 HG2 ARG 18 -9.035 -6.225 -12.164 923 HG3 ARG 18 HG3 ARG 18 -8.645 -4.880 -13.236 924 HD2 ARG 18 HD2 ARG 18 -9.295 -7.716 -14.109 925 HD3 ARG 18 HD3 ARG 18 -10.393 -6.340 -14.200 926 HE ARG 18 HE ARG 18 -7.837 -6.437 -15.699 927 HH11 ARG 18 HH11 ARG 18 -11.323 -5.914 -15.700 928 HH12 ARG 18 HH12 ARG 18 -11.355 -5.410 -17.362 929 HH21 ARG 18 HH21 ARG 18 -7.919 -5.824 -17.875 930 HH22 ARG 18 HH22 ARG 18 -9.431 -5.361 -18.587 931 H ASN 19 H ASN 19 -4.341 -4.536 -12.916 932 HA ASN 19 HA ASN 19 -4.418 -2.305 -11.149 933 HB2 ASN 19 HB2 ASN 19 -2.313 -3.358 -12.159 934 HB3 ASN 19 HB3 ASN 19 -2.691 -2.509 -13.654 935 HD21 ASN 19 HD21 ASN 19 -0.350 -2.208 -11.861 936 HD22 ASN 19 HD22 ASN 19 -0.321 -0.552 -11.387 937 H HIS 20 H HIS 20 -6.473 -1.502 -11.528 938 HA HIS 20 HA HIS 20 -6.979 0.244 -13.816 939 HB2 HIS 20 HB2 HIS 20 -8.557 -0.538 -11.326 940 HB3 HIS 20 HB3 HIS 20 -9.064 0.827 -12.306 941 HD1 HIS 20 HD1 HIS 20 -10.118 0.320 -14.586 942 HD2 HIS 20 HD2 HIS 20 -8.926 -3.072 -12.527 943 HE1 HIS 20 HE1 HIS 20 -11.109 -1.606 -15.843 944 HE2 HIS 20 HE2 HIS 20 -10.605 -3.606 -14.410 945 HA PRO 21 HA PRO 21 -5.370 4.142 -12.284 946 HB2 PRO 21 HB2 PRO 21 -8.253 5.079 -12.199 947 HB3 PRO 21 HB3 PRO 21 -6.816 5.921 -12.829 948 HG2 PRO 21 HG2 PRO 21 -8.462 4.743 -14.521 949 HG3 PRO 21 HG3 PRO 21 -6.704 4.576 -14.751 950 HD2 PRO 21 HD2 PRO 21 -8.668 2.569 -13.700 951 HD3 PRO 21 HD3 PRO 21 -7.205 2.316 -14.676 952 H GLY 22 H GLY 22 -4.593 3.576 -10.305 953 HA2 GLY 22 HA2 GLY 22 -4.256 3.663 -8.053 954 HA3 GLY 22 HA3 GLY 22 -5.430 4.967 -8.055 955 H VAL 23 H VAL 23 -5.558 1.379 -8.470 956 HA VAL 23 HA VAL 23 -8.061 1.066 -7.166 957 HB VAL 23 HB VAL 23 -5.906 -1.096 -7.247 958 HG11 VAL 23 HG11 VAL 23 -7.851 -2.632 -7.233 959 HG12 VAL 23 HG12 VAL 23 -8.942 -1.256 -7.129 960 HG13 VAL 23 HG13 VAL 23 -7.826 -1.601 -5.805 961 HG21 VAL 23 HG21 VAL 23 -6.834 -1.849 -9.389 962 HG22 VAL 23 HG22 VAL 23 -6.182 -0.215 -9.519 963 HG23 VAL 23 HG23 VAL 23 -7.927 -0.461 -9.422 964 H MET 24 H MET 24 -4.747 0.691 -6.046 965 HA MET 24 HA MET 24 -5.209 0.014 -3.376 966 HB2 MET 24 HB2 MET 24 -2.854 0.766 -2.976 967 HB3 MET 24 HB3 MET 24 -3.034 -0.347 -4.322 968 HG2 MET 24 HG2 MET 24 -2.757 2.640 -4.606 969 HG3 MET 24 HG3 MET 24 -1.424 1.497 -4.736 970 HE1 MET 24 HE1 MET 24 -2.382 -0.453 -8.030 971 HE2 MET 24 HE2 MET 24 -2.735 -0.925 -6.369 972 HE3 MET 24 HE3 MET 24 -1.158 -0.244 -6.778 973 H THR 25 H THR 25 -5.344 3.198 -4.925 974 HA THR 25 HA THR 25 -5.519 4.800 -2.582 975 HB THR 25 HB THR 25 -7.050 5.341 -5.171 976 HG1 THR 25 HG1 THR 25 -4.315 5.908 -4.629 977 HG21 THR 25 HG21 THR 25 -5.752 7.253 -3.184 978 HG22 THR 25 HG22 THR 25 -7.484 6.922 -3.296 979 HG23 THR 25 HG23 THR 25 -6.649 7.710 -4.636 980 H HIS 26 H HIS 26 -7.955 2.984 -4.477 981 HA HIS 26 HA HIS 26 -10.306 3.787 -3.113 982 HB2 HIS 26 HB2 HIS 26 -9.879 1.061 -4.423 983 HB3 HIS 26 HB3 HIS 26 -11.423 1.835 -4.095 984 HD1 HIS 26 HD1 HIS 26 -11.077 0.877 -6.840 985 HD2 HIS 26 HD2 HIS 26 -9.715 4.637 -5.725 986 HE1 HIS 26 HE1 HIS 26 -10.884 2.182 -8.979 987 HE2 HIS 26 HE2 HIS 26 -9.876 4.379 -8.288 988 H VAL 27 H VAL 27 -8.048 1.082 -2.591 989 HA VAL 27 HA VAL 27 -9.674 -0.324 -0.742 990 HB VAL 27 HB VAL 27 -7.925 -1.894 -0.448 991 HG11 VAL 27 HG11 VAL 27 -7.150 -2.403 -2.738 992 HG12 VAL 27 HG12 VAL 27 -7.609 -0.782 -3.256 993 HG13 VAL 27 HG13 VAL 27 -8.845 -1.916 -2.715 994 HG21 VAL 27 HG21 VAL 27 -6.065 -0.449 0.221 995 HG22 VAL 27 HG22 VAL 27 -5.890 0.141 -1.429 996 HG23 VAL 27 HG23 VAL 27 -5.544 -1.550 -1.055 997 H CYS 28 H CYS 28 -6.917 1.884 -0.272 998 HA CYS 28 HA CYS 28 -6.980 1.769 2.581 999 HB2 CYS 28 HB2 CYS 28 -4.952 2.503 1.425 1000 HB3 CYS 28 HB3 CYS 28 -5.804 3.892 0.750 1001 HG CYS 28 HG CYS 28 -6.436 4.561 3.654 1002 H GLY 29 H GLY 29 -8.631 3.679 0.146 1003 HA2 GLY 29 HA2 GLY 29 -9.599 5.851 1.611 1004 HA3 GLY 29 HA3 GLY 29 -10.408 5.122 0.225 1005 H LEU 30 H LEU 30 -11.021 2.617 1.157 1006 HA LEU 30 HA LEU 30 -13.357 3.062 2.722 1007 HB2 LEU 30 HB2 LEU 30 -12.045 0.622 1.540 1008 HB3 LEU 30 HB3 LEU 30 -13.260 0.375 2.777 1009 HG LEU 30 HG LEU 30 -14.330 0.156 0.627 1010 HD11 LEU 30 HD11 LEU 30 -16.131 1.805 0.779 1011 HD12 LEU 30 HD12 LEU 30 -15.143 2.828 1.824 1012 HD13 LEU 30 HD13 LEU 30 -15.670 1.239 2.384 1013 HD21 LEU 30 HD21 LEU 30 -13.310 2.924 -0.110 1014 HD22 LEU 30 HD22 LEU 30 -14.398 1.924 -1.077 1015 HD23 LEU 30 HD23 LEU 30 -12.745 1.392 -0.784 1016 H PHE 31 H PHE 31 -10.324 1.331 3.480 1017 HA PHE 31 HA PHE 31 -11.196 0.495 6.062 1018 HB2 PHE 31 HB2 PHE 31 -8.371 0.529 4.927 1019 HB3 PHE 31 HB3 PHE 31 -8.894 -0.365 6.356 1020 HD1 PHE 31 HD2 PHE 31 -11.564 -1.422 5.367 1021 HD2 PHE 31 HD1 PHE 31 -7.752 -1.252 3.429 1022 HE1 PHE 31 HE2 PHE 31 -12.212 -3.303 3.920 1023 HE2 PHE 31 HE1 PHE 31 -8.416 -3.129 1.986 1024 HZ PHE 31 HZ PHE 31 -10.640 -4.158 2.224 1025 H ALA 32 H ALA 32 -9.477 3.340 4.979 1026 HA ALA 32 HA ALA 32 -8.640 4.287 7.562 1027 HB1 ALA 32 HB1 ALA 32 -7.526 5.016 5.479 1028 HB2 ALA 32 HB2 ALA 32 -8.131 6.393 6.400 1029 HB3 ALA 32 HB3 ALA 32 -9.009 5.833 4.968 1030 H ARG 33 H ARG 33 -11.398 5.088 5.378 1031 HA ARG 33 HA ARG 33 -12.519 7.118 7.072 1032 HB2 ARG 33 HB2 ARG 33 -14.378 7.225 5.542 1033 HB3 ARG 33 HB3 ARG 33 -12.914 6.996 4.592 1034 HG2 ARG 33 HG2 ARG 33 -13.457 4.607 4.305 1035 HG3 ARG 33 HG3 ARG 33 -14.904 4.810 5.292 1036 HD2 ARG 33 HD2 ARG 33 -14.398 6.274 2.683 1037 HD3 ARG 33 HD3 ARG 33 -15.335 4.780 2.826 1038 HE ARG 33 HE ARG 33 -16.425 6.602 4.624 1039 HH11 ARG 33 HH11 ARG 33 -16.139 6.346 1.114 1040 HH12 ARG 33 HH12 ARG 33 -17.592 7.250 0.821 1041 HH21 ARG 33 HH21 ARG 33 -18.324 7.765 4.227 1042 HH22 ARG 33 HH22 ARG 33 -18.829 8.059 2.591 1043 H ARG 34 H ARG 34 -12.542 3.781 7.370 1044 HA ARG 34 HA ARG 34 -15.068 3.239 8.485 1045 HB2 ARG 34 HB2 ARG 34 -13.639 1.482 7.646 1046 HB3 ARG 34 HB3 ARG 34 -12.332 1.918 8.725 1047 HG2 ARG 34 HG2 ARG 34 -14.933 0.972 9.921 1048 HG3 ARG 34 HG3 ARG 34 -13.862 -0.201 9.166 1049 HD2 ARG 34 HD2 ARG 34 -13.219 1.597 11.515 1050 HD3 ARG 34 HD3 ARG 34 -13.379 -0.159 11.517 1051 HE ARG 34 HE ARG 34 -11.301 0.935 9.782 1052 HH11 ARG 34 HH11 ARG 34 -11.978 -0.488 12.946 1053 HH12 ARG 34 HH12 ARG 34 -10.323 -0.929 13.212 1054 HH21 ARG 34 HH21 ARG 34 -9.159 0.426 10.215 1055 HH22 ARG 34 HH22 ARG 34 -8.740 -0.413 11.677 1056 H ALA 35 H ALA 35 -11.905 3.817 10.067 1057 HA ALA 35 HA ALA 35 -12.796 5.572 12.071 1058 HB1 ALA 35 HB1 ALA 35 -12.711 4.145 14.098 1059 HB2 ALA 35 HB2 ALA 35 -12.491 2.712 13.086 1060 HB3 ALA 35 HB3 ALA 35 -13.997 3.623 13.007 1061 H PHE 36 H PHE 36 -10.642 2.749 11.903 1062 HA PHE 36 HA PHE 36 -8.331 4.417 12.690 1063 HB2 PHE 36 HB2 PHE 36 -8.873 2.446 14.144 1064 HB3 PHE 36 HB3 PHE 36 -8.661 1.378 12.761 1065 HD1 PHE 36 HD1 PHE 36 -6.777 3.998 14.713 1066 HD2 PHE 36 HD2 PHE 36 -6.540 0.357 12.482 1067 HE1 PHE 36 HE1 PHE 36 -4.388 3.803 15.270 1068 HE2 PHE 36 HE2 PHE 36 -4.155 0.171 13.042 1069 HZ PHE 36 HZ PHE 36 -3.074 1.891 14.438 1070 H ASN 37 H ASN 37 -6.422 4.257 11.494 1071 HA ASN 37 HA ASN 37 -6.776 3.973 8.639 1072 HB2 ASN 37 HB2 ASN 37 -4.248 4.621 10.217 1073 HB3 ASN 37 HB3 ASN 37 -4.521 4.931 8.504 1074 HD21 ASN 37 HD21 ASN 37 -3.882 6.707 10.815 1075 HD22 ASN 37 HD22 ASN 37 -5.073 7.954 10.762 1076 H VAL 38 H VAL 38 -4.748 2.953 7.457 1077 HA VAL 38 HA VAL 38 -4.616 0.152 8.179 1078 HB VAL 38 HB VAL 38 -3.109 1.565 5.916 1079 HG11 VAL 38 HG11 VAL 38 -2.236 -0.665 6.429 1080 HG12 VAL 38 HG12 VAL 38 -3.066 -0.687 4.873 1081 HG13 VAL 38 HG13 VAL 38 -3.854 -1.359 6.304 1082 HG21 VAL 38 HG21 VAL 38 -5.851 0.249 5.782 1083 HG22 VAL 38 HG22 VAL 38 -4.950 0.916 4.415 1084 HG23 VAL 38 HG23 VAL 38 -5.535 1.984 5.690 1085 H GLU 39 H GLU 39 -2.890 -0.913 9.041 1086 HA GLU 39 HA GLU 39 -0.767 0.624 10.333 1087 HB2 GLU 39 HB2 GLU 39 -1.870 -0.872 11.791 1088 HB3 GLU 39 HB3 GLU 39 -1.921 -2.168 10.618 1089 HG2 GLU 39 HG2 GLU 39 0.789 -1.337 11.613 1090 HG3 GLU 39 HG3 GLU 39 -0.264 -2.175 12.745 1091 H GLY 40 H GLY 40 -1.156 -2.050 8.033 1092 HA2 GLY 40 HA2 GLY 40 1.538 -1.601 6.912 1093 HA3 GLY 40 HA3 GLY 40 1.152 -3.195 7.556 1094 H ILE 41 H ILE 41 1.799 -2.460 4.813 1095 HA ILE 41 HA ILE 41 -0.572 -3.589 3.455 1096 HB ILE 41 HB ILE 41 1.085 -1.270 2.293 1097 HG12 ILE 41 HG12 ILE 41 -1.802 -1.234 3.285 1098 HG13 ILE 41 HG13 ILE 41 -0.437 -0.440 4.059 1099 HG21 ILE 41 HG21 ILE 41 0.305 -2.840 0.546 1100 HG22 ILE 41 HG22 ILE 41 -0.522 -1.290 0.404 1101 HG23 ILE 41 HG23 ILE 41 -1.358 -2.671 1.118 1102 HD11 ILE 41 HD11 ILE 41 -1.807 1.137 2.851 1103 HD12 ILE 41 HD12 ILE 41 -1.575 0.241 1.352 1104 HD13 ILE 41 HD13 ILE 41 -0.203 1.038 2.128 1105 H LEU 42 H LEU 42 -0.026 -5.063 1.894 1106 HA LEU 42 HA LEU 42 2.720 -5.105 0.837 1107 HB2 LEU 42 HB2 LEU 42 2.598 -6.889 2.553 1108 HB3 LEU 42 HB3 LEU 42 1.174 -7.568 1.781 1109 HG LEU 42 HG LEU 42 2.474 -8.272 -0.153 1110 HD11 LEU 42 HD11 LEU 42 4.900 -7.943 -0.327 1111 HD12 LEU 42 HD12 LEU 42 4.865 -6.911 1.106 1112 HD13 LEU 42 HD13 LEU 42 4.019 -6.417 -0.364 1113 HD21 LEU 42 HD21 LEU 42 3.986 -9.910 0.884 1114 HD22 LEU 42 HD22 LEU 42 2.461 -9.797 1.758 1115 HD23 LEU 42 HD23 LEU 42 3.910 -9.027 2.413 1116 H CYS 43 H CYS 43 2.721 -5.304 -1.324 1117 HA CYS 43 HA CYS 43 0.398 -6.235 -2.825 1118 HB2 CYS 43 HB2 CYS 43 -0.155 -3.872 -2.593 1119 HB3 CYS 43 HB3 CYS 43 1.486 -3.387 -3.011 1120 HG CYS 43 HG CYS 43 1.298 -4.148 -5.682 1121 H LEU 44 H LEU 44 1.180 -7.471 -4.382 1122 HA LEU 44 HA LEU 44 3.557 -6.756 -5.876 1123 HB2 LEU 44 HB2 LEU 44 4.479 -9.170 -5.559 1124 HB3 LEU 44 HB3 LEU 44 4.756 -7.985 -4.301 1125 HG LEU 44 HG LEU 44 2.667 -9.034 -3.130 1126 HD11 LEU 44 HD11 LEU 44 2.360 -11.461 -3.545 1127 HD12 LEU 44 HD12 LEU 44 3.319 -11.297 -5.022 1128 HD13 LEU 44 HD13 LEU 44 1.792 -10.430 -4.863 1129 HD21 LEU 44 HD21 LEU 44 4.933 -9.171 -2.235 1130 HD22 LEU 44 HD22 LEU 44 5.273 -10.574 -3.251 1131 HD23 LEU 44 HD23 LEU 44 4.060 -10.680 -1.973 1132 HA PRO 45 HA PRO 45 0.865 -8.242 -9.015 1133 HB2 PRO 45 HB2 PRO 45 2.549 -8.403 -11.152 1134 HB3 PRO 45 HB3 PRO 45 2.131 -6.845 -10.408 1135 HG2 PRO 45 HG2 PRO 45 4.598 -8.504 -10.028 1136 HG3 PRO 45 HG3 PRO 45 4.447 -6.747 -10.272 1137 HD2 PRO 45 HD2 PRO 45 4.778 -7.880 -7.797 1138 HD3 PRO 45 HD3 PRO 45 3.915 -6.348 -8.053 1139 H ILE 46 H ILE 46 0.295 -10.043 -10.225 1140 HA ILE 46 HA ILE 46 1.451 -12.615 -9.472 1141 HB ILE 46 HB ILE 46 -1.062 -11.848 -11.039 1142 HG12 ILE 46 HG12 ILE 46 -1.284 -11.277 -8.682 1143 HG13 ILE 46 HG13 ILE 46 -2.262 -12.706 -8.991 1144 HG21 ILE 46 HG21 ILE 46 -1.748 -14.199 -10.927 1145 HG22 ILE 46 HG22 ILE 46 -0.213 -14.629 -10.172 1146 HG23 ILE 46 HG23 ILE 46 -0.240 -14.026 -11.828 1147 HD11 ILE 46 HD11 ILE 46 0.446 -12.648 -7.648 1148 HD12 ILE 46 HD12 ILE 46 -0.483 -14.107 -8.000 1149 HD13 ILE 46 HD13 ILE 46 -1.116 -12.909 -6.877 1150 H GLN 47 H GLN 47 2.838 -13.662 -10.795 1151 HA GLN 47 HA GLN 47 3.811 -12.378 -13.159 1152 HB2 GLN 47 HB2 GLN 47 5.354 -14.276 -13.389 1153 HB3 GLN 47 HB3 GLN 47 5.324 -13.687 -11.737 1154 HG2 GLN 47 HG2 GLN 47 4.062 -15.570 -10.981 1155 HG3 GLN 47 HG3 GLN 47 3.735 -16.097 -12.628 1156 HE21 GLN 47 HE21 GLN 47 6.204 -15.859 -10.147 1157 HE22 GLN 47 HE22 GLN 47 7.261 -17.045 -10.826 1158 H ASP 48 H ASP 48 1.613 -15.062 -12.580 1159 HA ASP 48 HA ASP 48 1.715 -16.080 -15.269 1160 HB2 ASP 48 HB2 ASP 48 1.379 -17.581 -13.366 1161 HB3 ASP 48 HB3 ASP 48 -0.117 -16.758 -12.935 1162 H SER 49 H SER 49 -0.274 -13.758 -13.595 1163 HA SER 49 HA SER 49 -2.113 -13.500 -15.884 1164 HB2 SER 49 HB2 SER 49 -3.056 -13.822 -12.997 1165 HB3 SER 49 HB3 SER 49 -4.086 -13.547 -14.405 1166 HG SER 49 HG SER 49 -2.772 -15.615 -15.104 1167 H ASP 50 H ASP 50 -3.144 -11.439 -16.037 1168 HA ASP 50 HA ASP 50 -1.573 -9.234 -15.029 1169 HB2 ASP 50 HB2 ASP 50 -4.093 -9.273 -16.743 1170 HB3 ASP 50 HB3 ASP 50 -3.167 -7.819 -16.378 1171 H LYS 51 H LYS 51 -1.950 -9.559 -12.786 1172 HA LYS 51 HA LYS 51 -3.951 -7.853 -11.683 1173 HB2 LYS 51 HB2 LYS 51 -5.071 -9.566 -10.243 1174 HB3 LYS 51 HB3 LYS 51 -5.398 -9.796 -11.958 1175 HG2 LYS 51 HG2 LYS 51 -3.622 -11.587 -11.992 1176 HG3 LYS 51 HG3 LYS 51 -3.491 -11.416 -10.239 1177 HD2 LYS 51 HD2 LYS 51 -5.911 -12.023 -10.040 1178 HD3 LYS 51 HD3 LYS 51 -5.968 -12.265 -11.786 1179 HE2 LYS 51 HE2 LYS 51 -4.287 -14.060 -11.591 1180 HE3 LYS 51 HE3 LYS 51 -4.224 -13.814 -9.845 1181 HZ1 LYS 51 HZ1 LYS 51 -6.491 -14.499 -9.659 1182 HZ2 LYS 51 HZ2 LYS 51 -5.651 -15.674 -10.537 1183 HZ3 LYS 51 HZ3 LYS 51 -6.669 -14.587 -11.339 1184 H SER 52 H SER 52 -3.853 -8.373 -9.083 1185 HA SER 52 HA SER 52 -1.175 -8.935 -8.116 1186 HB2 SER 52 HB2 SER 52 -0.940 -6.579 -8.879 1187 HB3 SER 52 HB3 SER 52 -2.367 -6.117 -7.952 1188 HG SER 52 HG SER 52 -0.372 -5.658 -6.877 1189 H HIS 53 H HIS 53 -1.201 -9.259 -5.834 1190 HA HIS 53 HA HIS 53 -3.866 -9.155 -4.510 1191 HB2 HIS 53 HB2 HIS 53 -1.418 -10.868 -3.922 1192 HB3 HIS 53 HB3 HIS 53 -2.773 -10.731 -2.810 1193 HD1 HIS 53 HD1 HIS 53 -3.713 -13.038 -2.917 1194 HD2 HIS 53 HD2 HIS 53 -3.097 -11.444 -6.704 1195 HE1 HIS 53 HE1 HIS 53 -4.649 -14.730 -4.514 1196 HE2 HIS 53 HE2 HIS 53 -4.078 -13.832 -6.794 1197 H ILE 54 H ILE 54 -4.117 -7.580 -3.038 1198 HA ILE 54 HA ILE 54 -1.727 -6.335 -1.805 1199 HB ILE 54 HB ILE 54 -4.444 -4.979 -2.214 1200 HG12 ILE 54 HG12 ILE 54 -3.124 -3.428 -3.808 1201 HG13 ILE 54 HG13 ILE 54 -1.868 -4.657 -3.815 1202 HG21 ILE 54 HG21 ILE 54 -3.244 -4.173 -0.227 1203 HG22 ILE 54 HG22 ILE 54 -3.289 -2.920 -1.466 1204 HG23 ILE 54 HG23 ILE 54 -1.809 -3.847 -1.203 1205 HD11 ILE 54 HD11 ILE 54 -4.703 -5.034 -4.764 1206 HD12 ILE 54 HD12 ILE 54 -3.412 -6.237 -4.834 1207 HD13 ILE 54 HD13 ILE 54 -3.293 -4.759 -5.784 1208 H TRP 55 H TRP 55 -1.526 -7.271 0.154 1209 HA TRP 55 HA TRP 55 -3.813 -8.030 1.805 1210 HB2 TRP 55 HB2 TRP 55 -0.800 -8.199 2.327 1211 HB3 TRP 55 HB3 TRP 55 -2.048 -8.882 3.368 1212 HD1 TRP 55 HD1 TRP 55 -3.115 -11.214 2.608 1213 HE1 TRP 55 HE1 TRP 55 -2.538 -12.928 0.816 1214 HE3 TRP 55 HE3 TRP 55 0.198 -8.450 -0.088 1215 HZ2 TRP 55 HZ2 TRP 55 -0.874 -13.132 -1.418 1216 HZ3 TRP 55 HZ3 TRP 55 1.261 -9.491 -2.036 1217 HH2 TRP 55 HH2 TRP 55 0.738 -11.787 -2.693 1218 H LEU 56 H LEU 56 -4.810 -6.327 2.782 1219 HA LEU 56 HA LEU 56 -3.297 -4.061 3.857 1220 HB2 LEU 56 HB2 LEU 56 -6.302 -4.551 3.701 1221 HB3 LEU 56 HB3 LEU 56 -5.581 -3.141 4.452 1222 HG LEU 56 HG LEU 56 -6.308 -2.418 2.322 1223 HD11 LEU 56 HD11 LEU 56 -3.330 -2.912 2.054 1224 HD12 LEU 56 HD12 LEU 56 -4.092 -1.568 2.906 1225 HD13 LEU 56 HD13 LEU 56 -4.274 -1.716 1.160 1226 HD21 LEU 56 HD21 LEU 56 -4.954 -4.819 1.052 1227 HD22 LEU 56 HD22 LEU 56 -5.770 -3.516 0.184 1228 HD23 LEU 56 HD23 LEU 56 -6.691 -4.574 1.249 1229 H LEU 57 H LEU 57 -2.461 -4.315 5.774 1230 HA LEU 57 HA LEU 57 -3.567 -6.040 7.856 1231 HB2 LEU 57 HB2 LEU 57 -1.032 -4.377 7.630 1232 HB3 LEU 57 HB3 LEU 57 -1.509 -5.126 9.140 1233 HG LEU 57 HG LEU 57 -1.259 -7.355 8.166 1234 HD11 LEU 57 HD11 LEU 57 -0.293 -7.721 5.934 1235 HD12 LEU 57 HD12 LEU 57 -0.450 -5.997 5.579 1236 HD13 LEU 57 HD13 LEU 57 -1.892 -6.982 5.862 1237 HD21 LEU 57 HD21 LEU 57 1.171 -5.596 7.719 1238 HD22 LEU 57 HD22 LEU 57 1.193 -7.353 7.904 1239 HD23 LEU 57 HD23 LEU 57 0.670 -6.335 9.246 1240 H VAL 58 H VAL 58 -5.305 -5.110 8.747 1241 HA VAL 58 HA VAL 58 -5.077 -2.484 10.049 1242 HB VAL 58 HB VAL 58 -6.123 -2.211 7.717 1243 HG11 VAL 58 HG11 VAL 58 -8.446 -2.848 7.328 1244 HG12 VAL 58 HG12 VAL 58 -8.484 -3.699 8.875 1245 HG13 VAL 58 HG13 VAL 58 -7.422 -4.262 7.583 1246 HG21 VAL 58 HG21 VAL 58 -7.841 -1.380 10.073 1247 HG22 VAL 58 HG22 VAL 58 -7.897 -0.664 8.460 1248 HG23 VAL 58 HG23 VAL 58 -6.440 -0.511 9.439 1249 H ASN 59 H ASN 59 -6.566 -2.360 11.919 1250 HA ASN 59 HA ASN 59 -7.165 -4.991 12.979 1251 HB2 ASN 59 HB2 ASN 59 -7.760 -3.900 15.044 1252 HB3 ASN 59 HB3 ASN 59 -6.302 -3.141 14.426 1253 HD21 ASN 59 HD21 ASN 59 -8.307 -2.131 16.322 1254 HD22 ASN 59 HD22 ASN 59 -8.857 -0.637 15.661 1255 H ASP 60 H ASP 60 -9.107 -5.985 13.135 1256 HA ASP 60 HA ASP 60 -11.191 -5.219 11.375 1257 HB2 ASP 60 HB2 ASP 60 -12.355 -7.249 12.049 1258 HB3 ASP 60 HB3 ASP 60 -10.659 -7.591 11.750 1259 H ASP 61 H ASP 61 -13.236 -4.539 11.752 1260 HA ASP 61 HA ASP 61 -14.130 -3.810 14.450 1261 HB2 ASP 61 HB2 ASP 61 -12.889 -1.848 13.540 1262 HB3 ASP 61 HB3 ASP 61 -13.900 -1.863 12.103 1263 H GLN 62 H GLN 62 -16.470 -3.235 14.422 1264 HA GLN 62 HA GLN 62 -18.103 -5.003 12.990 1265 HB2 GLN 62 HB2 GLN 62 -18.835 -2.370 14.329 1266 HB3 GLN 62 HB3 GLN 62 -20.012 -3.561 13.781 1267 HG2 GLN 62 HG2 GLN 62 -19.126 -5.197 15.393 1268 HG3 GLN 62 HG3 GLN 62 -17.906 -4.036 15.916 1269 HE21 GLN 62 HE21 GLN 62 -19.692 -1.719 15.923 1270 HE22 GLN 62 HE22 GLN 62 -20.754 -1.924 17.264 1271 H ARG 63 H ARG 63 -17.345 -1.589 12.387 1272 HA ARG 63 HA ARG 63 -19.094 -1.307 10.112 1273 HB2 ARG 63 HB2 ARG 63 -18.566 0.627 11.558 1274 HB3 ARG 63 HB3 ARG 63 -16.863 0.514 11.129 1275 HG2 ARG 63 HG2 ARG 63 -17.438 1.046 8.767 1276 HG3 ARG 63 HG3 ARG 63 -19.136 1.190 9.222 1277 HD2 ARG 63 HD2 ARG 63 -16.884 2.918 10.310 1278 HD3 ARG 63 HD3 ARG 63 -17.998 3.389 9.021 1279 HE ARG 63 HE ARG 63 -19.736 2.832 10.926 1280 HH11 ARG 63 HH11 ARG 63 -16.751 4.667 11.188 1281 HH12 ARG 63 HH12 ARG 63 -17.336 5.662 12.479 1282 HH21 ARG 63 HH21 ARG 63 -20.483 4.132 12.636 1283 HH22 ARG 63 HH22 ARG 63 -19.453 5.357 13.300 1284 H LEU 64 H LEU 64 -15.749 -2.229 10.608 1285 HA LEU 64 HA LEU 64 -14.604 -1.647 8.131 1286 HB2 LEU 64 HB2 LEU 64 -13.423 -2.527 10.217 1287 HB3 LEU 64 HB3 LEU 64 -13.976 -4.130 9.763 1288 HG LEU 64 HG LEU 64 -12.722 -3.736 7.514 1289 HD11 LEU 64 HD11 LEU 64 -12.383 -1.309 7.741 1290 HD12 LEU 64 HD12 LEU 64 -10.856 -2.169 7.553 1291 HD13 LEU 64 HD13 LEU 64 -11.344 -1.586 9.148 1292 HD21 LEU 64 HD21 LEU 64 -11.945 -5.302 9.243 1293 HD22 LEU 64 HD22 LEU 64 -11.069 -3.988 10.036 1294 HD23 LEU 64 HD23 LEU 64 -10.605 -4.511 8.416 1295 H GLU 65 H GLU 65 -16.643 -4.335 9.089 1296 HA GLU 65 HA GLU 65 -16.346 -6.026 6.850 1297 HB2 GLU 65 HB2 GLU 65 -18.749 -5.701 8.694 1298 HB3 GLU 65 HB3 GLU 65 -18.465 -7.067 7.615 1299 HG2 GLU 65 HG2 GLU 65 -16.401 -7.617 8.870 1300 HG3 GLU 65 HG3 GLU 65 -16.719 -6.275 9.968 1301 H GLN 66 H GLN 66 -18.446 -3.262 7.434 1302 HA GLN 66 HA GLN 66 -20.102 -3.445 5.125 1303 HB2 GLN 66 HB2 GLN 66 -20.618 -2.018 7.119 1304 HB3 GLN 66 HB3 GLN 66 -19.274 -0.961 6.701 1305 HG2 GLN 66 HG2 GLN 66 -20.440 -0.434 4.537 1306 HG3 GLN 66 HG3 GLN 66 -21.807 -1.402 5.094 1307 HE21 GLN 66 HE21 GLN 66 -23.233 0.347 5.087 1308 HE22 GLN 66 HE22 GLN 66 -23.139 1.648 6.219 1309 H MET 67 H MET 67 -17.053 -1.743 5.819 1310 HA MET 67 HA MET 67 -16.634 -0.486 3.337 1311 HB2 MET 67 HB2 MET 67 -14.735 -1.406 5.513 1312 HB3 MET 67 HB3 MET 67 -14.121 -0.658 4.046 1313 HG2 MET 67 HG2 MET 67 -14.277 0.946 5.872 1314 HG3 MET 67 HG3 MET 67 -15.333 1.394 4.541 1315 HE1 MET 67 HE1 MET 67 -17.404 2.653 5.270 1316 HE2 MET 67 HE2 MET 67 -18.679 1.830 6.170 1317 HE3 MET 67 HE3 MET 67 -18.060 1.124 4.678 1318 H ILE 68 H ILE 68 -15.676 -3.706 4.484 1319 HA ILE 68 HA ILE 68 -14.212 -4.601 2.235 1320 HB ILE 68 HB ILE 68 -15.785 -6.202 4.315 1321 HG12 ILE 68 HG12 ILE 68 -12.774 -5.679 4.223 1322 HG13 ILE 68 HG13 ILE 68 -13.897 -4.718 5.175 1323 HG21 ILE 68 HG21 ILE 68 -14.394 -8.161 3.684 1324 HG22 ILE 68 HG22 ILE 68 -13.674 -7.224 2.373 1325 HG23 ILE 68 HG23 ILE 68 -15.394 -7.609 2.339 1326 HD11 ILE 68 HD11 ILE 68 -12.804 -6.327 6.573 1327 HD12 ILE 68 HD12 ILE 68 -13.311 -7.651 5.526 1328 HD13 ILE 68 HD13 ILE 68 -14.513 -6.740 6.445 1329 H SER 69 H SER 69 -17.649 -4.851 3.089 1330 HA SER 69 HA SER 69 -18.470 -6.453 0.884 1331 HB2 SER 69 HB2 SER 69 -20.108 -4.600 2.660 1332 HB3 SER 69 HB3 SER 69 -20.768 -5.845 1.594 1333 HG SER 69 HG SER 69 -18.833 -6.645 3.431 1334 H GLN 70 H GLN 70 -18.196 -2.978 1.382 1335 HA GLN 70 HA GLN 70 -19.753 -2.147 -0.886 1336 HB2 GLN 70 HB2 GLN 70 -19.294 -0.764 1.209 1337 HB3 GLN 70 HB3 GLN 70 -17.642 -0.548 0.664 1338 HG2 GLN 70 HG2 GLN 70 -20.050 0.393 -0.914 1339 HG3 GLN 70 HG3 GLN 70 -19.230 1.387 0.278 1340 HE21 GLN 70 HE21 GLN 70 -16.529 0.476 -0.518 1341 HE22 GLN 70 HE22 GLN 70 -16.217 1.243 -2.030 1342 H ILE 71 H ILE 71 -16.260 -2.382 -0.203 1343 HA ILE 71 HA ILE 71 -15.412 -1.406 -2.735 1344 HB ILE 71 HB ILE 71 -13.986 -1.308 -0.672 1345 HG12 ILE 71 HG12 ILE 71 -12.823 -2.602 -3.177 1346 HG13 ILE 71 HG13 ILE 71 -12.948 -0.883 -2.825 1347 HG21 ILE 71 HG21 ILE 71 -13.488 -4.274 -1.139 1348 HG22 ILE 71 HG22 ILE 71 -14.423 -3.591 0.192 1349 HG23 ILE 71 HG23 ILE 71 -12.695 -3.259 0.072 1350 HD11 ILE 71 HD11 ILE 71 -10.695 -1.622 -2.599 1351 HD12 ILE 71 HD12 ILE 71 -11.175 -2.878 -1.461 1352 HD13 ILE 71 HD13 ILE 71 -11.321 -1.174 -1.009 1353 H ASP 72 H ASP 72 -16.210 -4.573 -1.518 1354 HA ASP 72 HA ASP 72 -15.164 -6.259 -3.478 1355 HB2 ASP 72 HB2 ASP 72 -16.124 -7.154 -1.447 1356 HB3 ASP 72 HB3 ASP 72 -17.689 -6.434 -1.784 1357 H LYS 73 H LYS 73 -17.960 -4.124 -3.566 1358 HA LYS 73 HA LYS 73 -19.209 -5.265 -5.898 1359 HB2 LYS 73 HB2 LYS 73 -19.687 -2.448 -4.843 1360 HB3 LYS 73 HB3 LYS 73 -20.787 -3.448 -5.783 1361 HG2 LYS 73 HG2 LYS 73 -20.004 -3.770 -2.881 1362 HG3 LYS 73 HG3 LYS 73 -21.594 -3.373 -3.525 1363 HD2 LYS 73 HD2 LYS 73 -20.165 -6.043 -3.880 1364 HD3 LYS 73 HD3 LYS 73 -21.446 -5.718 -2.714 1365 HE2 LYS 73 HE2 LYS 73 -23.046 -5.328 -4.504 1366 HE3 LYS 73 HE3 LYS 73 -21.771 -5.485 -5.714 1367 HZ1 LYS 73 HZ1 LYS 73 -22.698 -7.644 -3.885 1368 HZ2 LYS 73 HZ2 LYS 73 -21.482 -7.801 -5.048 1369 HZ3 LYS 73 HZ3 LYS 73 -23.075 -7.515 -5.528 1370 H LEU 74 H LEU 74 -16.573 -3.107 -5.403 1371 HA LEU 74 HA LEU 74 -16.690 -1.701 -7.906 1372 HB2 LEU 74 HB2 LEU 74 -14.597 -1.949 -5.727 1373 HB3 LEU 74 HB3 LEU 74 -14.169 -1.232 -7.266 1374 HG LEU 74 HG LEU 74 -14.680 0.522 -5.648 1375 HD11 LEU 74 HD11 LEU 74 -15.230 0.987 -7.991 1376 HD12 LEU 74 HD12 LEU 74 -16.349 1.814 -6.909 1377 HD13 LEU 74 HD13 LEU 74 -16.861 0.350 -7.753 1378 HD21 LEU 74 HD21 LEU 74 -16.201 -0.724 -4.158 1379 HD22 LEU 74 HD22 LEU 74 -17.465 -0.672 -5.385 1380 HD23 LEU 74 HD23 LEU 74 -16.895 0.822 -4.637 1381 H GLU 75 H GLU 75 -15.599 -2.115 -9.779 1382 HA GLU 75 HA GLU 75 -15.245 -4.916 -10.375 1383 HB2 GLU 75 HB2 GLU 75 -15.045 -4.077 -12.763 1384 HB3 GLU 75 HB3 GLU 75 -16.535 -3.673 -11.930 1385 HG2 GLU 75 HG2 GLU 75 -15.993 -1.731 -13.122 1386 HG3 GLU 75 HG3 GLU 75 -15.515 -1.382 -11.464 1387 H ASP 76 H ASP 76 -13.129 -2.202 -9.912 1388 HA ASP 76 HA ASP 76 -10.733 -3.136 -11.017 1389 HB2 ASP 76 HB2 ASP 76 -9.652 -1.653 -9.172 1390 HB3 ASP 76 HB3 ASP 76 -10.720 -0.876 -10.330 1391 H VAL 77 H VAL 77 -12.035 -3.596 -7.737 1392 HA VAL 77 HA VAL 77 -10.167 -5.653 -6.994 1393 HB VAL 77 HB VAL 77 -12.816 -4.716 -5.782 1394 HG11 VAL 77 HG11 VAL 77 -12.387 -6.157 -3.829 1395 HG12 VAL 77 HG12 VAL 77 -10.976 -6.854 -4.632 1396 HG13 VAL 77 HG13 VAL 77 -12.591 -7.127 -5.289 1397 HG21 VAL 77 HG21 VAL 77 -9.956 -4.485 -4.766 1398 HG22 VAL 77 HG22 VAL 77 -11.399 -3.835 -3.979 1399 HG23 VAL 77 HG23 VAL 77 -10.882 -3.189 -5.536 1400 H VAL 78 H VAL 78 -10.139 -7.405 -8.231 1401 HA VAL 78 HA VAL 78 -12.290 -8.585 -9.656 1402 HB VAL 78 HB VAL 78 -9.674 -9.903 -8.771 1403 HG11 VAL 78 HG11 VAL 78 -9.954 -11.408 -10.704 1404 HG12 VAL 78 HG12 VAL 78 -11.513 -10.665 -11.070 1405 HG13 VAL 78 HG13 VAL 78 -11.296 -11.567 -9.568 1406 HG21 VAL 78 HG21 VAL 78 -10.216 -8.366 -11.342 1407 HG22 VAL 78 HG22 VAL 78 -8.713 -9.192 -10.919 1408 HG23 VAL 78 HG23 VAL 78 -9.243 -7.794 -9.981 1409 H LYS 79 H LYS 79 -10.651 -9.444 -6.621 1410 HA LYS 79 HA LYS 79 -13.107 -10.562 -5.469 1411 HB2 LYS 79 HB2 LYS 79 -10.472 -12.112 -5.581 1412 HB3 LYS 79 HB3 LYS 79 -11.804 -12.530 -4.507 1413 HG2 LYS 79 HG2 LYS 79 -13.246 -12.957 -6.463 1414 HG3 LYS 79 HG3 LYS 79 -11.906 -12.548 -7.532 1415 HD2 LYS 79 HD2 LYS 79 -11.977 -14.871 -5.569 1416 HD3 LYS 79 HD3 LYS 79 -12.160 -14.987 -7.321 1417 HE2 LYS 79 HE2 LYS 79 -9.856 -14.112 -7.601 1418 HE3 LYS 79 HE3 LYS 79 -9.673 -14.051 -5.845 1419 HZ1 LYS 79 HZ1 LYS 79 -8.699 -16.053 -6.764 1420 HZ2 LYS 79 HZ2 LYS 79 -10.175 -16.497 -7.456 1421 HZ3 LYS 79 HZ3 LYS 79 -10.011 -16.446 -5.774 1422 H VAL 80 H VAL 80 -13.169 -10.319 -3.222 1423 HA VAL 80 HA VAL 80 -10.780 -9.172 -1.869 1424 HB VAL 80 HB VAL 80 -12.838 -7.645 -1.981 1425 HG11 VAL 80 HG11 VAL 80 -14.597 -9.310 -1.681 1426 HG12 VAL 80 HG12 VAL 80 -14.714 -8.052 -0.450 1427 HG13 VAL 80 HG13 VAL 80 -14.044 -9.632 -0.034 1428 HG21 VAL 80 HG21 VAL 80 -11.073 -7.237 -0.338 1429 HG22 VAL 80 HG22 VAL 80 -11.812 -8.375 0.792 1430 HG23 VAL 80 HG23 VAL 80 -12.648 -6.875 0.375 1431 H GLN 81 H GLN 81 -10.348 -10.000 0.258 1432 HA GLN 81 HA GLN 81 -11.705 -12.454 1.134 1433 HB2 GLN 81 HB2 GLN 81 -8.734 -12.262 0.498 1434 HB3 GLN 81 HB3 GLN 81 -9.422 -13.543 1.482 1435 HG2 GLN 81 HG2 GLN 81 -10.754 -14.293 -0.464 1436 HG3 GLN 81 HG3 GLN 81 -10.021 -13.021 -1.438 1437 HE21 GLN 81 HE21 GLN 81 -8.164 -14.860 0.954 1438 HE22 GLN 81 HE22 GLN 81 -7.212 -15.718 -0.200 1439 H ARG 82 H ARG 82 -11.747 -12.611 3.303 1440 HA ARG 82 HA ARG 82 -10.118 -10.793 4.975 1441 HB2 ARG 82 HB2 ARG 82 -12.529 -12.523 5.718 1442 HB3 ARG 82 HB3 ARG 82 -11.699 -11.394 6.790 1443 HG2 ARG 82 HG2 ARG 82 -12.417 -9.504 5.401 1444 HG3 ARG 82 HG3 ARG 82 -13.191 -10.616 4.263 1445 HD2 ARG 82 HD2 ARG 82 -14.839 -9.608 5.774 1446 HD3 ARG 82 HD3 ARG 82 -14.744 -11.354 6.026 1447 HE ARG 82 HE ARG 82 -13.005 -10.071 7.834 1448 HH11 ARG 82 HH11 ARG 82 -16.463 -10.454 7.314 1449 HH12 ARG 82 HH12 ARG 82 -16.854 -10.245 8.993 1450 HH21 ARG 82 HH21 ARG 82 -13.535 -9.820 10.020 1451 HH22 ARG 82 HH22 ARG 82 -15.192 -9.890 10.525 1452 H ASN 83 H ASN 83 -8.192 -11.766 5.313 1453 HA ASN 83 HA ASN 83 -8.025 -14.666 5.886 1454 HB2 ASN 83 HB2 ASN 83 -5.820 -12.685 5.127 1455 HB3 ASN 83 HB3 ASN 83 -5.560 -14.386 5.498 1456 HD21 ASN 83 HD21 ASN 83 -4.684 -14.835 3.507 1457 HD22 ASN 83 HD22 ASN 83 -5.586 -14.823 2.034 1458 H GLN 84 H GLN 84 -6.804 -15.381 7.649 1459 HA GLN 84 HA GLN 84 -6.887 -13.674 10.017 1460 HB2 GLN 84 HB2 GLN 84 -6.272 -15.781 11.229 1461 HB3 GLN 84 HB3 GLN 84 -7.720 -15.949 10.249 1462 HG2 GLN 84 HG2 GLN 84 -6.320 -17.057 8.476 1463 HG3 GLN 84 HG3 GLN 84 -4.959 -17.009 9.591 1464 HE21 GLN 84 HE21 GLN 84 -8.314 -17.708 10.524 1465 HE22 GLN 84 HE22 GLN 84 -8.038 -19.361 10.935 1466 H SER 85 H SER 85 -5.082 -13.016 11.182 1467 HA SER 85 HA SER 85 -2.795 -12.511 9.498 1468 HB2 SER 85 HB2 SER 85 -3.792 -10.664 10.756 1469 HB3 SER 85 HB3 SER 85 -3.436 -11.478 12.270 1470 HG SER 85 HG SER 85 -1.755 -10.125 12.006 1471 H ASP 86 H ASP 86 -0.802 -13.227 9.669 1472 HA ASP 86 HA ASP 86 0.203 -14.633 12.003 1473 HB2 ASP 86 HB2 ASP 86 -0.905 -16.427 10.688 1474 HB3 ASP 86 HB3 ASP 86 0.037 -15.981 9.269 1475 HA PRO 87 HA PRO 87 3.835 -12.193 10.803 1476 HB2 PRO 87 HB2 PRO 87 5.310 -14.458 12.178 1477 HB3 PRO 87 HB3 PRO 87 5.467 -12.699 12.412 1478 HG2 PRO 87 HG2 PRO 87 4.153 -14.120 14.196 1479 HG3 PRO 87 HG3 PRO 87 3.504 -12.548 13.668 1480 HD2 PRO 87 HD2 PRO 87 2.623 -15.319 12.869 1481 HD3 PRO 87 HD3 PRO 87 1.643 -13.879 13.235 1482 H THR 88 H THR 88 4.254 -15.767 10.448 1483 HA THR 88 HA THR 88 6.361 -15.441 8.499 1484 HB THR 88 HB THR 88 6.309 -17.934 8.270 1485 HG1 THR 88 HG1 THR 88 4.173 -17.732 10.133 1486 HG21 THR 88 HG21 THR 88 6.369 -16.961 11.145 1487 HG22 THR 88 HG22 THR 88 7.722 -16.918 10.011 1488 HG23 THR 88 HG23 THR 88 7.071 -18.466 10.549 1489 H MET 89 H MET 89 2.889 -15.899 8.351 1490 HA MET 89 HA MET 89 2.539 -16.749 5.700 1491 HB2 MET 89 HB2 MET 89 0.669 -16.578 7.309 1492 HB3 MET 89 HB3 MET 89 0.808 -14.824 7.318 1493 HG2 MET 89 HG2 MET 89 -1.087 -15.558 5.956 1494 HG3 MET 89 HG3 MET 89 0.122 -14.747 4.960 1495 HE1 MET 89 HE1 MET 89 -1.048 -15.758 2.743 1496 HE2 MET 89 HE2 MET 89 -2.249 -16.590 3.733 1497 HE3 MET 89 HE3 MET 89 -1.344 -17.481 2.510 1498 H PHE 90 H PHE 90 3.075 -13.526 7.028 1499 HA PHE 90 HA PHE 90 2.762 -11.973 4.696 1500 HB2 PHE 90 HB2 PHE 90 2.818 -11.103 7.060 1501 HB3 PHE 90 HB3 PHE 90 4.551 -11.382 7.094 1502 HD1 PHE 90 HD1 PHE 90 6.071 -9.960 5.670 1503 HD2 PHE 90 HD2 PHE 90 1.881 -9.158 5.936 1504 HE1 PHE 90 HE1 PHE 90 6.445 -7.701 4.774 1505 HE2 PHE 90 HE2 PHE 90 2.261 -6.903 5.036 1506 HZ PHE 90 HZ PHE 90 4.538 -6.170 4.452 1507 H ASN 91 H ASN 91 5.573 -13.663 6.043 1508 HA ASN 91 HA ASN 91 7.516 -12.683 4.177 1509 HB2 ASN 91 HB2 ASN 91 8.162 -13.565 6.405 1510 HB3 ASN 91 HB3 ASN 91 7.573 -15.160 5.963 1511 HD21 ASN 91 HD21 ASN 91 10.130 -12.808 5.461 1512 HD22 ASN 91 HD22 ASN 91 11.243 -13.894 4.707 1513 H LYS 92 H LYS 92 5.442 -15.558 4.322 1514 HA LYS 92 HA LYS 92 6.558 -17.095 2.252 1515 HB2 LYS 92 HB2 LYS 92 3.686 -17.004 3.257 1516 HB3 LYS 92 HB3 LYS 92 4.309 -18.237 2.162 1517 HG2 LYS 92 HG2 LYS 92 5.863 -19.029 3.870 1518 HG3 LYS 92 HG3 LYS 92 5.361 -17.733 4.961 1519 HD2 LYS 92 HD2 LYS 92 3.022 -18.702 4.901 1520 HD3 LYS 92 HD3 LYS 92 3.672 -20.065 3.985 1521 HE2 LYS 92 HE2 LYS 92 5.174 -20.610 5.877 1522 HE3 LYS 92 HE3 LYS 92 4.511 -19.248 6.789 1523 HZ1 LYS 92 HZ1 LYS 92 2.328 -20.299 6.661 1524 HZ2 LYS 92 HZ2 LYS 92 3.448 -21.290 7.445 1525 HZ3 LYS 92 HZ3 LYS 92 2.998 -21.623 5.850 1526 H ILE 93 H ILE 93 3.757 -14.897 2.154 1527 HA ILE 93 HA ILE 93 3.254 -15.154 -0.634 1528 HB ILE 93 HB ILE 93 1.726 -13.182 -0.288 1529 HG12 ILE 93 HG12 ILE 93 3.081 -13.171 2.425 1530 HG13 ILE 93 HG13 ILE 93 2.869 -11.837 1.312 1531 HG21 ILE 93 HG21 ILE 93 0.147 -14.324 1.220 1532 HG22 ILE 93 HG22 ILE 93 1.443 -15.368 1.809 1533 HG23 ILE 93 HG23 ILE 93 0.917 -15.477 0.127 1534 HD11 ILE 93 HD11 ILE 93 0.700 -13.100 2.983 1535 HD12 ILE 93 HD12 ILE 93 0.494 -11.739 1.879 1536 HD13 ILE 93 HD13 ILE 93 1.523 -11.572 3.302 1537 H ALA 94 H ALA 94 5.306 -13.033 1.260 1538 HA ALA 94 HA ALA 94 5.873 -11.057 -0.694 1539 HB1 ALA 94 HB1 ALA 94 7.780 -10.456 0.743 1540 HB2 ALA 94 HB2 ALA 94 7.569 -11.953 1.659 1541 HB3 ALA 94 HB3 ALA 94 6.316 -10.711 1.699 1542 H VAL 95 H VAL 95 7.492 -14.120 0.151 1543 HA VAL 95 HA VAL 95 9.630 -13.678 -1.791 1544 HB VAL 95 HB VAL 95 10.103 -14.645 0.488 1545 HG11 VAL 95 HG11 VAL 95 9.664 -17.023 0.948 1546 HG12 VAL 95 HG12 VAL 95 8.748 -17.152 -0.556 1547 HG13 VAL 95 HG13 VAL 95 8.164 -16.113 0.746 1548 HG21 VAL 95 HG21 VAL 95 11.735 -14.891 -1.328 1549 HG22 VAL 95 HG22 VAL 95 10.960 -16.385 -1.857 1550 HG23 VAL 95 HG23 VAL 95 11.760 -16.313 -0.284 1551 H PHE 96 H PHE 96 6.629 -15.449 -1.601 1552 HA PHE 96 HA PHE 96 7.269 -17.295 -3.764 1553 HB2 PHE 96 HB2 PHE 96 5.778 -17.843 -1.735 1554 HB3 PHE 96 HB3 PHE 96 4.537 -16.852 -2.487 1555 HD1 PHE 96 HD2 PHE 96 6.523 -19.966 -2.810 1556 HD2 PHE 96 HD1 PHE 96 3.260 -17.708 -4.388 1557 HE1 PHE 96 HE2 PHE 96 5.805 -21.917 -4.112 1558 HE2 PHE 96 HE1 PHE 96 2.551 -19.662 -5.694 1559 HZ PHE 96 HZ PHE 96 3.817 -21.772 -5.559 1560 H PHE 97 H PHE 97 5.238 -14.445 -3.206 1561 HA PHE 97 HA PHE 97 4.133 -12.996 -4.490 1562 HB2 PHE 97 HB2 PHE 97 5.465 -11.891 -6.279 1563 HB3 PHE 97 HB3 PHE 97 6.362 -12.134 -4.793 1564 HD1 PHE 97 HD2 PHE 97 5.968 -13.415 -8.296 1565 HD2 PHE 97 HD1 PHE 97 8.453 -13.317 -4.815 1566 HE1 PHE 97 HE2 PHE 97 7.807 -14.430 -9.574 1567 HE2 PHE 97 HE1 PHE 97 10.288 -14.326 -6.103 1568 HZ PHE 97 HZ PHE 97 9.968 -14.886 -8.481 1569 H GLN 98 H GLN 98 3.274 -15.682 -5.101 1570 HA GLN 98 HA GLN 98 1.856 -15.115 -7.602 1571 HB2 GLN 98 HB2 GLN 98 3.785 -16.453 -8.349 1572 HB3 GLN 98 HB3 GLN 98 3.451 -17.683 -7.139 1573 HG2 GLN 98 HG2 GLN 98 2.773 -18.399 -9.389 1574 HG3 GLN 98 HG3 GLN 98 1.403 -18.324 -8.286 1575 HE21 GLN 98 HE21 GLN 98 -0.090 -18.180 -9.962 1576 HE22 GLN 98 HE22 GLN 98 -0.270 -16.775 -10.947 Start of MODEL 11 1 H1 GLY 1 H1 GLY 1 0.382 -1.279 -15.655 2 H2 GLY 1 H2 GLY 1 1.399 -2.448 -16.333 3 H3 GLY 1 H3 GLY 1 1.615 -1.970 -14.726 4 HA2 GLY 1 HA3 GLY 1 -0.480 -2.910 -14.105 5 HA3 GLY 1 HA2 GLY 1 -0.771 -3.360 -15.783 6 H SER 2 H SER 2 -0.598 -5.042 -13.390 7 HA SER 2 HA SER 2 1.798 -6.506 -13.239 8 HB2 SER 2 HB2 SER 2 -1.038 -7.399 -12.567 9 HB3 SER 2 HB3 SER 2 0.448 -8.134 -11.967 10 HG SER 2 HG SER 2 0.660 -5.614 -11.372 11 H MET 3 H MET 3 2.423 -6.889 -15.393 12 HA MET 3 HA MET 3 1.713 -9.396 -16.541 13 HB2 MET 3 HB2 MET 3 0.794 -8.614 -18.703 14 HB3 MET 3 HB3 MET 3 -0.246 -8.115 -17.377 15 HG2 MET 3 HG2 MET 3 0.738 -5.838 -17.485 16 HG3 MET 3 HG3 MET 3 1.723 -6.346 -18.857 17 HE1 MET 3 HE1 MET 3 0.536 -7.295 -21.185 18 HE2 MET 3 HE2 MET 3 -1.198 -7.173 -21.474 19 HE3 MET 3 HE3 MET 3 -0.585 -8.314 -20.279 20 H GLN 4 H GLN 4 4.033 -7.642 -15.673 21 HA GLN 4 HA GLN 4 5.644 -7.599 -18.169 22 HB2 GLN 4 HB2 GLN 4 5.600 -5.457 -15.989 23 HB3 GLN 4 HB3 GLN 4 6.744 -5.499 -17.329 24 HG2 GLN 4 HG2 GLN 4 4.919 -5.178 -18.934 25 HG3 GLN 4 HG3 GLN 4 3.733 -5.212 -17.630 26 HE21 GLN 4 HE21 GLN 4 4.256 -3.080 -19.569 27 HE22 GLN 4 HE22 GLN 4 4.632 -1.675 -18.638 28 H ASN 5 H ASN 5 7.871 -7.907 -17.926 29 HA ASN 5 HA ASN 5 8.875 -9.059 -15.402 30 HB2 ASN 5 HB2 ASN 5 10.085 -9.024 -18.212 31 HB3 ASN 5 HB3 ASN 5 10.859 -9.746 -16.804 32 HD21 ASN 5 HD21 ASN 5 9.942 -10.940 -19.350 33 HD22 ASN 5 HD22 ASN 5 8.898 -12.241 -18.890 34 H THR 6 H THR 6 9.807 -7.625 -14.057 35 HA THR 6 HA THR 6 11.292 -5.292 -15.129 36 HB THR 6 HB THR 6 9.021 -4.584 -14.402 37 HG1 THR 6 HG1 THR 6 9.851 -2.788 -13.686 38 HG21 THR 6 HG21 THR 6 8.589 -6.219 -12.598 39 HG22 THR 6 HG22 THR 6 8.386 -4.565 -12.018 40 HG23 THR 6 HG23 THR 6 9.845 -5.468 -11.609 41 H THR 7 H THR 7 12.875 -4.396 -13.673 42 HA THR 7 HA THR 7 13.706 -5.925 -11.340 43 HB THR 7 HB THR 7 15.579 -5.666 -13.744 44 HG1 THR 7 HG1 THR 7 13.919 -7.706 -12.827 45 HG21 THR 7 HG21 THR 7 16.825 -5.511 -11.602 46 HG22 THR 7 HG22 THR 7 17.168 -7.035 -12.420 47 HG23 THR 7 HG23 THR 7 16.063 -7.006 -11.045 48 H HIS 8 H HIS 8 14.261 -3.194 -13.566 49 HA HIS 8 HA HIS 8 14.834 -1.480 -11.241 50 HB2 HIS 8 HB2 HIS 8 16.798 -0.477 -12.120 51 HB3 HIS 8 HB3 HIS 8 17.039 -2.196 -12.393 52 HD1 HIS 8 HD1 HIS 8 16.808 -3.023 -14.915 53 HD2 HIS 8 HD2 HIS 8 16.794 1.104 -14.403 54 HE1 HIS 8 HE1 HIS 8 17.245 -2.052 -17.191 55 HE2 HIS 8 HE2 HIS 8 17.059 0.435 -16.874 56 H ASP 9 H ASP 9 13.095 -2.016 -14.045 57 HA ASP 9 HA ASP 9 12.639 0.546 -15.137 58 HB2 ASP 9 HB2 ASP 9 11.937 -1.493 -16.303 59 HB3 ASP 9 HB3 ASP 9 10.838 -1.915 -14.995 60 H ASN 10 H ASN 10 10.962 -1.255 -12.601 61 HA ASN 10 HA ASN 10 9.438 1.007 -11.648 62 HB2 ASN 10 HB2 ASN 10 8.857 -0.480 -9.738 63 HB3 ASN 10 HB3 ASN 10 8.577 -1.288 -11.273 64 HD21 ASN 10 HD21 ASN 10 9.130 -2.342 -8.514 65 HD22 ASN 10 HD22 ASN 10 10.459 -3.423 -8.705 66 H VAL 11 H VAL 11 9.907 2.158 -9.722 67 HA VAL 11 HA VAL 11 12.701 2.054 -8.758 68 HB VAL 11 HB VAL 11 12.738 4.438 -8.393 69 HG11 VAL 11 HG11 VAL 11 11.648 3.903 -11.179 70 HG12 VAL 11 HG12 VAL 11 13.326 3.735 -10.660 71 HG13 VAL 11 HG13 VAL 11 12.572 5.329 -10.694 72 HG21 VAL 11 HG21 VAL 11 9.847 4.605 -9.338 73 HG22 VAL 11 HG22 VAL 11 10.876 5.981 -8.946 74 HG23 VAL 11 HG23 VAL 11 10.412 4.838 -7.687 75 H ILE 12 H ILE 12 12.959 2.391 -6.543 76 HA ILE 12 HA ILE 12 10.642 1.539 -4.932 77 HB ILE 12 HB ILE 12 13.621 1.406 -4.284 78 HG12 ILE 12 HG12 ILE 12 13.039 -0.048 -6.206 79 HG13 ILE 12 HG13 ILE 12 13.553 -0.970 -4.805 80 HG21 ILE 12 HG21 ILE 12 11.282 0.088 -2.896 81 HG22 ILE 12 HG22 ILE 12 12.250 1.424 -2.265 82 HG23 ILE 12 HG23 ILE 12 12.984 -0.164 -2.507 83 HD11 ILE 12 HD11 ILE 12 10.727 -0.611 -5.777 84 HD12 ILE 12 HD12 ILE 12 11.205 -1.517 -4.339 85 HD13 ILE 12 HD13 ILE 12 11.733 -2.049 -5.935 86 H LEU 13 H LEU 13 9.679 3.509 -4.420 87 HA LEU 13 HA LEU 13 11.297 5.715 -3.397 88 HB2 LEU 13 HB2 LEU 13 8.288 5.494 -3.771 89 HB3 LEU 13 HB3 LEU 13 9.145 6.941 -3.244 90 HG LEU 13 HG LEU 13 9.378 5.596 -5.962 91 HD11 LEU 13 HD11 LEU 13 7.332 6.885 -5.636 92 HD12 LEU 13 HD12 LEU 13 8.398 7.632 -6.815 93 HD13 LEU 13 HD13 LEU 13 8.284 8.305 -5.189 94 HD21 LEU 13 HD21 LEU 13 10.886 7.443 -6.601 95 HD22 LEU 13 HD22 LEU 13 11.584 6.459 -5.318 96 HD23 LEU 13 HD23 LEU 13 10.883 8.034 -4.936 97 H GLU 14 H GLU 14 12.083 5.182 -1.537 98 HA GLU 14 HA GLU 14 10.579 3.831 0.545 99 HB2 GLU 14 HB2 GLU 14 12.905 3.169 0.011 100 HB3 GLU 14 HB3 GLU 14 13.468 4.802 0.355 101 HG2 GLU 14 HG2 GLU 14 12.695 4.486 2.729 102 HG3 GLU 14 HG3 GLU 14 12.336 2.805 2.334 103 H LEU 15 H LEU 15 9.068 5.409 1.149 104 HA LEU 15 HA LEU 15 10.187 7.798 2.498 105 HB2 LEU 15 HB2 LEU 15 7.778 8.712 2.258 106 HB3 LEU 15 HB3 LEU 15 8.823 8.677 0.854 107 HG LEU 15 HG LEU 15 7.580 6.420 0.281 108 HD11 LEU 15 HD11 LEU 15 5.233 6.342 0.988 109 HD12 LEU 15 HD12 LEU 15 5.514 7.694 2.089 110 HD13 LEU 15 HD13 LEU 15 6.335 6.155 2.351 111 HD21 LEU 15 HD21 LEU 15 5.890 7.651 -1.002 112 HD22 LEU 15 HD22 LEU 15 7.475 8.408 -1.102 113 HD23 LEU 15 HD23 LEU 15 6.229 9.110 -0.064 114 H THR 16 H THR 16 9.979 8.015 4.556 115 HA THR 16 HA THR 16 8.680 5.995 6.209 116 HB THR 16 HB THR 16 10.418 8.389 6.986 117 HG1 THR 16 HG1 THR 16 11.790 7.050 5.932 118 HG21 THR 16 HG21 THR 16 10.703 7.236 9.134 119 HG22 THR 16 HG22 THR 16 9.620 5.948 8.606 120 HG23 THR 16 HG23 THR 16 8.993 7.584 8.839 121 H VAL 17 H VAL 17 6.540 6.389 6.589 122 HA VAL 17 HA VAL 17 5.650 9.157 7.154 123 HB VAL 17 HB VAL 17 3.484 8.646 6.434 124 HG11 VAL 17 HG11 VAL 17 3.686 7.711 4.149 125 HG12 VAL 17 HG12 VAL 17 5.300 7.097 4.554 126 HG13 VAL 17 HG13 VAL 17 4.991 8.842 4.527 127 HG21 VAL 17 HG21 VAL 17 4.125 5.681 6.560 128 HG22 VAL 17 HG22 VAL 17 2.619 6.349 5.924 129 HG23 VAL 17 HG23 VAL 17 3.040 6.580 7.621 130 H ARG 18 H ARG 18 4.617 9.547 9.093 131 HA ARG 18 HA ARG 18 4.388 7.376 11.086 132 HB2 ARG 18 HB2 ARG 18 3.650 9.197 12.614 133 HB3 ARG 18 HB3 ARG 18 5.219 9.530 11.896 134 HG2 ARG 18 HG2 ARG 18 4.068 11.044 10.243 135 HG3 ARG 18 HG3 ARG 18 2.565 10.796 11.143 136 HD2 ARG 18 HD2 ARG 18 5.133 12.007 12.220 137 HD3 ARG 18 HD3 ARG 18 3.652 12.881 11.820 138 HE ARG 18 HE ARG 18 2.911 10.953 13.654 139 HH11 ARG 18 HH11 ARG 18 5.114 13.689 13.685 140 HH12 ARG 18 HH12 ARG 18 4.954 13.948 15.392 141 HH21 ARG 18 HH21 ARG 18 2.754 11.261 15.883 142 HH22 ARG 18 HH22 ARG 18 3.614 12.567 16.640 143 H ASN 19 H ASN 19 2.214 6.882 12.022 144 HA ASN 19 HA ASN 19 0.254 6.718 9.917 145 HB2 ASN 19 HB2 ASN 19 0.165 5.742 12.795 146 HB3 ASN 19 HB3 ASN 19 -1.171 5.533 11.667 147 HD21 ASN 19 HD21 ASN 19 -1.102 3.304 11.501 148 HD22 ASN 19 HD22 ASN 19 0.241 2.422 10.863 149 H HIS 20 H HIS 20 0.104 9.017 9.634 150 HA HIS 20 HA HIS 20 -1.766 10.518 11.281 151 HB2 HIS 20 HB2 HIS 20 -0.017 11.822 10.198 152 HB3 HIS 20 HB3 HIS 20 -0.288 11.052 8.651 153 HD1 HIS 20 HD1 HIS 20 -1.389 13.922 10.735 154 HD2 HIS 20 HD2 HIS 20 -2.511 12.091 7.177 155 HE1 HIS 20 HE1 HIS 20 -2.937 15.537 9.588 156 HE2 HIS 20 HE2 HIS 20 -3.611 14.402 7.454 157 HA PRO 21 HA PRO 21 -5.546 8.928 9.360 158 HB2 PRO 21 HB2 PRO 21 -6.164 11.887 9.081 159 HB3 PRO 21 HB3 PRO 21 -7.215 10.562 9.636 160 HG2 PRO 21 HG2 PRO 21 -6.110 12.166 11.425 161 HG3 PRO 21 HG3 PRO 21 -6.163 10.414 11.731 162 HD2 PRO 21 HD2 PRO 21 -3.825 12.113 10.918 163 HD3 PRO 21 HD3 PRO 21 -3.867 10.668 11.956 164 H GLY 22 H GLY 22 -4.718 8.070 7.458 165 HA2 GLY 22 HA2 GLY 22 -5.337 7.768 5.239 166 HA3 GLY 22 HA3 GLY 22 -5.619 9.486 5.064 167 H VAL 23 H VAL 23 -2.531 8.313 6.377 168 HA VAL 23 HA VAL 23 -0.964 9.648 4.463 169 HB VAL 23 HB VAL 23 0.986 8.257 5.220 170 HG11 VAL 23 HG11 VAL 23 0.320 10.286 6.422 171 HG12 VAL 23 HG12 VAL 23 1.028 9.090 7.504 172 HG13 VAL 23 HG13 VAL 23 -0.720 9.328 7.474 173 HG21 VAL 23 HG21 VAL 23 0.733 6.642 7.059 174 HG22 VAL 23 HG22 VAL 23 -0.166 6.109 5.634 175 HG23 VAL 23 HG23 VAL 23 -1.028 6.825 6.997 176 H MET 24 H MET 24 -2.138 6.339 4.453 177 HA MET 24 HA MET 24 -0.757 5.442 2.141 178 HB2 MET 24 HB2 MET 24 -2.358 3.544 2.174 179 HB3 MET 24 HB3 MET 24 -1.628 3.833 3.743 180 HG2 MET 24 HG2 MET 24 -4.415 4.746 2.982 181 HG3 MET 24 HG3 MET 24 -4.057 3.246 3.833 182 HE1 MET 24 HE1 MET 24 -1.634 4.273 5.739 183 HE2 MET 24 HE2 MET 24 -2.924 3.198 6.290 184 HE3 MET 24 HE3 MET 24 -2.540 4.661 7.199 185 H THR 25 H THR 25 -3.849 7.084 2.642 186 HA THR 25 HA THR 25 -4.795 6.825 -0.052 187 HB THR 25 HB THR 25 -5.680 8.923 1.982 188 HG1 THR 25 HG1 THR 25 -7.296 6.974 2.280 189 HG21 THR 25 HG21 THR 25 -6.682 9.140 -0.286 190 HG22 THR 25 HG22 THR 25 -7.887 8.648 0.906 191 HG23 THR 25 HG23 THR 25 -7.214 7.455 -0.206 192 H HIS 26 H HIS 26 -2.752 9.078 1.676 193 HA HIS 26 HA HIS 26 -2.839 11.225 -0.226 194 HB2 HIS 26 HB2 HIS 26 -1.032 10.653 2.155 195 HB3 HIS 26 HB3 HIS 26 -0.766 12.039 1.100 196 HD1 HIS 26 HD1 HIS 26 -1.303 13.742 2.981 197 HD2 HIS 26 HD2 HIS 26 -4.415 11.089 2.251 198 HE1 HIS 26 HE1 HIS 26 -3.307 14.692 4.148 199 HE2 HIS 26 HE2 HIS 26 -5.162 13.072 3.702 200 H VAL 27 H VAL 27 -0.413 8.627 0.491 201 HA VAL 27 HA VAL 27 1.403 9.363 -1.543 202 HB VAL 27 HB VAL 27 2.421 7.122 -1.379 203 HG11 VAL 27 HG11 VAL 27 1.658 8.212 1.356 204 HG12 VAL 27 HG12 VAL 27 2.995 8.764 0.347 205 HG13 VAL 27 HG13 VAL 27 3.020 7.135 1.022 206 HG21 VAL 27 HG21 VAL 27 0.095 6.324 0.410 207 HG22 VAL 27 HG22 VAL 27 1.543 5.358 0.110 208 HG23 VAL 27 HG23 VAL 27 0.422 5.700 -1.208 209 H CYS 28 H CYS 28 -1.246 6.988 -1.575 210 HA CYS 28 HA CYS 28 -1.034 6.150 -4.239 211 HB2 CYS 28 HB2 CYS 28 -3.423 6.220 -2.359 212 HB3 CYS 28 HB3 CYS 28 -3.380 5.331 -3.879 213 HG CYS 28 HG CYS 28 -2.548 4.268 -0.971 214 H GLY 29 H GLY 29 -2.593 8.953 -2.796 215 HA2 GLY 29 HA2 GLY 29 -4.212 9.826 -4.921 216 HA3 GLY 29 HA3 GLY 29 -3.535 10.836 -3.655 217 H LEU 30 H LEU 30 -0.824 10.650 -4.090 218 HA LEU 30 HA LEU 30 -0.435 12.541 -6.162 219 HB2 LEU 30 HB2 LEU 30 1.423 11.047 -4.317 220 HB3 LEU 30 HB3 LEU 30 2.123 11.877 -5.694 221 HG LEU 30 HG LEU 30 2.303 13.320 -3.770 222 HD11 LEU 30 HD11 LEU 30 1.862 14.448 -5.883 223 HD12 LEU 30 HD12 LEU 30 1.173 15.345 -4.535 224 HD13 LEU 30 HD13 LEU 30 0.122 14.390 -5.585 225 HD21 LEU 30 HD21 LEU 30 0.538 12.411 -2.351 226 HD22 LEU 30 HD22 LEU 30 -0.700 13.108 -3.399 227 HD23 LEU 30 HD23 LEU 30 0.388 14.163 -2.489 228 H PHE 31 H PHE 31 0.202 9.037 -6.025 229 HA PHE 31 HA PHE 31 1.433 8.947 -8.644 230 HB2 PHE 31 HB2 PHE 31 0.380 6.683 -6.902 231 HB3 PHE 31 HB3 PHE 31 1.334 6.466 -8.373 232 HD1 PHE 31 HD2 PHE 31 3.646 7.757 -8.437 233 HD2 PHE 31 HD1 PHE 31 1.532 6.822 -4.840 234 HE1 PHE 31 HE2 PHE 31 5.708 8.062 -7.129 235 HE2 PHE 31 HE1 PHE 31 3.593 7.140 -3.545 236 HZ PHE 31 HZ PHE 31 5.680 7.761 -4.685 237 H ALA 32 H ALA 32 -1.847 8.598 -7.457 238 HA ALA 32 HA ALA 32 -3.027 7.479 -9.784 239 HB1 ALA 32 HB1 ALA 32 -5.172 8.252 -8.836 240 HB2 ALA 32 HB2 ALA 32 -4.303 9.251 -7.665 241 HB3 ALA 32 HB3 ALA 32 -4.166 7.494 -7.600 242 H ARG 33 H ARG 33 -2.458 10.834 -8.747 243 HA ARG 33 HA ARG 33 -3.692 11.965 -11.147 244 HB2 ARG 33 HB2 ARG 33 -3.349 14.127 -10.081 245 HB3 ARG 33 HB3 ARG 33 -4.047 13.008 -8.915 246 HG2 ARG 33 HG2 ARG 33 -1.762 12.652 -7.954 247 HG3 ARG 33 HG3 ARG 33 -1.140 13.869 -9.065 248 HD2 ARG 33 HD2 ARG 33 -3.210 14.337 -6.892 249 HD3 ARG 33 HD3 ARG 33 -1.515 14.834 -6.841 250 HE ARG 33 HE ARG 33 -2.394 16.037 -9.090 251 HH11 ARG 33 HH11 ARG 33 -3.689 16.054 -5.816 252 HH12 ARG 33 HH12 ARG 33 -4.393 17.630 -5.978 253 HH21 ARG 33 HH21 ARG 33 -3.325 18.089 -9.288 254 HH22 ARG 33 HH22 ARG 33 -4.189 18.784 -7.951 255 H ARG 34 H ARG 34 -0.733 10.633 -10.563 256 HA ARG 34 HA ARG 34 1.067 12.570 -11.661 257 HB2 ARG 34 HB2 ARG 34 1.761 10.763 -10.080 258 HB3 ARG 34 HB3 ARG 34 1.413 9.553 -11.303 259 HG2 ARG 34 HG2 ARG 34 3.445 11.709 -11.892 260 HG3 ARG 34 HG3 ARG 34 3.891 10.364 -10.847 261 HD2 ARG 34 HD2 ARG 34 2.854 10.082 -13.687 262 HD3 ARG 34 HD3 ARG 34 4.550 10.010 -13.211 263 HE ARG 34 HE ARG 34 2.824 8.108 -11.850 264 HH11 ARG 34 HH11 ARG 34 4.896 8.579 -14.668 265 HH12 ARG 34 HH12 ARG 34 5.155 6.881 -14.898 266 HH21 ARG 34 HH21 ARG 34 3.208 5.876 -12.192 267 HH22 ARG 34 HH22 ARG 34 4.212 5.367 -13.514 268 H ALA 35 H ALA 35 -0.007 9.416 -12.918 269 HA ALA 35 HA ALA 35 -0.786 10.168 -15.500 270 HB1 ALA 35 HB1 ALA 35 1.571 10.826 -15.887 271 HB2 ALA 35 HB2 ALA 35 1.150 9.435 -16.886 272 HB3 ALA 35 HB3 ALA 35 2.116 9.214 -15.421 273 H PHE 36 H PHE 36 1.307 7.729 -14.028 274 HA PHE 36 HA PHE 36 -0.756 5.651 -14.409 275 HB2 PHE 36 HB2 PHE 36 1.100 5.170 -15.957 276 HB3 PHE 36 HB3 PHE 36 2.278 5.374 -14.666 277 HD1 PHE 36 HD2 PHE 36 -0.787 3.294 -15.407 278 HD2 PHE 36 HD1 PHE 36 3.143 3.398 -13.707 279 HE1 PHE 36 HE2 PHE 36 -0.939 0.892 -14.887 280 HE2 PHE 36 HE1 PHE 36 2.976 0.997 -13.192 281 HZ PHE 36 HZ PHE 36 0.940 -0.256 -13.780 282 H ASN 37 H ASN 37 -0.897 4.180 -12.697 283 HA ASN 37 HA ASN 37 -0.445 5.328 -10.083 284 HB2 ASN 37 HB2 ASN 37 -1.741 2.702 -10.940 285 HB3 ASN 37 HB3 ASN 37 -1.825 3.400 -9.324 286 HD21 ASN 37 HD21 ASN 37 -3.123 5.240 -8.989 287 HD22 ASN 37 HD22 ASN 37 -4.323 5.733 -10.134 288 H VAL 38 H VAL 38 -0.052 3.242 -8.408 289 HA VAL 38 HA VAL 38 2.741 2.556 -8.754 290 HB VAL 38 HB VAL 38 0.882 1.665 -6.497 291 HG11 VAL 38 HG11 VAL 38 3.906 1.954 -6.604 292 HG12 VAL 38 HG12 VAL 38 3.002 0.435 -6.618 293 HG13 VAL 38 HG13 VAL 38 2.968 1.471 -5.186 294 HG21 VAL 38 HG21 VAL 38 2.555 4.204 -6.599 295 HG22 VAL 38 HG22 VAL 38 1.658 3.613 -5.197 296 HG23 VAL 38 HG23 VAL 38 0.790 4.122 -6.648 297 H GLU 39 H GLU 39 3.555 0.533 -9.164 298 HA GLU 39 HA GLU 39 1.837 -1.531 -10.248 299 HB2 GLU 39 HB2 GLU 39 4.081 -0.888 -11.225 300 HB3 GLU 39 HB3 GLU 39 4.860 -1.551 -9.795 301 HG2 GLU 39 HG2 GLU 39 4.971 -3.112 -11.685 302 HG3 GLU 39 HG3 GLU 39 4.026 -3.792 -10.356 303 H GLY 40 H GLY 40 4.084 -1.193 -7.467 304 HA2 GLY 40 HA2 GLY 40 2.567 -3.220 -5.945 305 HA3 GLY 40 HA3 GLY 40 4.284 -3.504 -6.209 306 H ILE 41 H ILE 41 2.870 -3.089 -3.667 307 HA ILE 41 HA ILE 41 4.212 -0.633 -2.645 308 HB ILE 41 HB ILE 41 1.395 -1.572 -1.850 309 HG12 ILE 41 HG12 ILE 41 2.195 0.908 -3.441 310 HG13 ILE 41 HG13 ILE 41 1.401 -0.515 -4.100 311 HG21 ILE 41 HG21 ILE 41 1.252 0.475 -0.482 312 HG22 ILE 41 HG22 ILE 41 2.906 0.900 -0.927 313 HG23 ILE 41 HG23 ILE 41 2.598 -0.539 0.046 314 HD11 ILE 41 HD11 ILE 41 -0.171 1.282 -3.800 315 HD12 ILE 41 HD12 ILE 41 0.226 1.400 -2.087 316 HD13 ILE 41 HD13 ILE 41 -0.567 -0.048 -2.714 317 H LEU 42 H LEU 42 5.100 -0.872 -0.553 318 HA LEU 42 HA LEU 42 4.317 -3.173 1.079 319 HB2 LEU 42 HB2 LEU 42 6.162 -4.085 -0.190 320 HB3 LEU 42 HB3 LEU 42 7.179 -2.701 0.163 321 HG LEU 42 HG LEU 42 7.516 -3.404 2.448 322 HD11 LEU 42 HD11 LEU 42 5.249 -4.117 3.025 323 HD12 LEU 42 HD12 LEU 42 6.439 -5.326 3.497 324 HD13 LEU 42 HD13 LEU 42 5.448 -5.580 2.060 325 HD21 LEU 42 HD21 LEU 42 8.891 -4.557 0.806 326 HD22 LEU 42 HD22 LEU 42 7.669 -5.821 0.624 327 HD23 LEU 42 HD23 LEU 42 8.530 -5.632 2.155 328 H CYS 43 H CYS 43 3.424 -1.822 2.524 329 HA CYS 43 HA CYS 43 4.960 0.249 3.905 330 HB2 CYS 43 HB2 CYS 43 2.619 0.719 3.349 331 HB3 CYS 43 HB3 CYS 43 2.086 -0.721 4.202 332 HG CYS 43 HG CYS 43 3.711 1.746 5.891 333 H LEU 44 H LEU 44 6.372 -0.533 5.357 334 HA LEU 44 HA LEU 44 5.755 -2.880 7.036 335 HB2 LEU 44 HB2 LEU 44 7.919 -2.765 5.711 336 HB3 LEU 44 HB3 LEU 44 8.388 -1.385 6.686 337 HG LEU 44 HG LEU 44 8.220 -2.946 8.741 338 HD11 LEU 44 HD11 LEU 44 6.875 -4.722 7.728 339 HD12 LEU 44 HD12 LEU 44 8.402 -5.354 8.343 340 HD13 LEU 44 HD13 LEU 44 8.191 -5.099 6.608 341 HD21 LEU 44 HD21 LEU 44 10.452 -3.908 8.390 342 HD22 LEU 44 HD22 LEU 44 10.377 -2.244 7.814 343 HD23 LEU 44 HD23 LEU 44 10.335 -3.577 6.657 344 HA PRO 45 HA PRO 45 4.911 0.541 10.043 345 HB2 PRO 45 HB2 PRO 45 3.356 -0.903 11.784 346 HB3 PRO 45 HB3 PRO 45 2.728 -0.263 10.252 347 HG2 PRO 45 HG2 PRO 45 3.640 -3.051 10.885 348 HG3 PRO 45 HG3 PRO 45 2.218 -2.514 9.962 349 HD2 PRO 45 HD2 PRO 45 4.529 -3.364 8.755 350 HD3 PRO 45 HD3 PRO 45 3.436 -2.172 8.018 351 H ILE 46 H ILE 46 6.367 1.095 11.559 352 HA ILE 46 HA ILE 46 8.228 -0.921 12.557 353 HB ILE 46 HB ILE 46 8.335 2.101 12.904 354 HG12 ILE 46 HG12 ILE 46 8.387 1.600 10.508 355 HG13 ILE 46 HG13 ILE 46 10.001 2.069 11.017 356 HG21 ILE 46 HG21 ILE 46 10.500 -0.003 13.298 357 HG22 ILE 46 HG22 ILE 46 9.704 0.934 14.567 358 HG23 ILE 46 HG23 ILE 46 10.741 1.745 13.393 359 HD11 ILE 46 HD11 ILE 46 9.044 -0.736 10.459 360 HD12 ILE 46 HD12 ILE 46 10.664 -0.303 11.011 361 HD13 ILE 46 HD13 ILE 46 10.089 0.253 9.440 362 H GLN 47 H GLN 47 8.428 -1.516 14.636 363 HA GLN 47 HA GLN 47 6.037 -1.746 16.059 364 HB2 GLN 47 HB2 GLN 47 7.670 -3.508 16.032 365 HB3 GLN 47 HB3 GLN 47 8.908 -2.464 16.716 366 HG2 GLN 47 HG2 GLN 47 7.743 -2.426 18.857 367 HG3 GLN 47 HG3 GLN 47 6.424 -3.382 18.185 368 HE21 GLN 47 HE21 GLN 47 8.191 -3.963 20.451 369 HE22 GLN 47 HE22 GLN 47 8.923 -5.487 20.096 370 H ASP 48 H ASP 48 8.938 0.179 16.894 371 HA ASP 48 HA ASP 48 7.623 1.031 19.429 372 HB2 ASP 48 HB2 ASP 48 9.843 1.036 20.450 373 HB3 ASP 48 HB3 ASP 48 9.530 -0.536 19.718 374 H SER 49 H SER 49 7.978 2.330 16.602 375 HA SER 49 HA SER 49 8.606 5.028 17.600 376 HB2 SER 49 HB2 SER 49 10.012 3.774 15.188 377 HB3 SER 49 HB3 SER 49 10.143 5.465 15.677 378 HG SER 49 HG SER 49 10.753 4.107 17.813 379 H ASP 50 H ASP 50 7.265 6.554 16.684 380 HA ASP 50 HA ASP 50 5.053 5.744 15.082 381 HB2 ASP 50 HB2 ASP 50 6.001 8.567 15.764 382 HB3 ASP 50 HB3 ASP 50 4.453 8.173 15.025 383 H LYS 51 H LYS 51 6.118 4.788 13.340 384 HA LYS 51 HA LYS 51 6.467 6.401 11.031 385 HB2 LYS 51 HB2 LYS 51 8.818 5.696 10.523 386 HB3 LYS 51 HB3 LYS 51 8.715 6.781 11.903 387 HG2 LYS 51 HG2 LYS 51 9.118 5.004 13.451 388 HG3 LYS 51 HG3 LYS 51 8.886 3.782 12.206 389 HD2 LYS 51 HD2 LYS 51 11.260 4.014 12.737 390 HD3 LYS 51 HD3 LYS 51 10.951 4.514 11.074 391 HE2 LYS 51 HE2 LYS 51 11.106 6.862 11.713 392 HE3 LYS 51 HE3 LYS 51 11.248 6.423 13.417 393 HZ1 LYS 51 HZ1 LYS 51 13.320 5.243 12.846 394 HZ2 LYS 51 HZ2 LYS 51 13.402 6.901 12.566 395 HZ3 LYS 51 HZ3 LYS 51 13.209 5.842 11.267 396 H SER 52 H SER 52 6.796 5.098 9.164 397 HA SER 52 HA SER 52 6.608 2.219 9.238 398 HB2 SER 52 HB2 SER 52 4.206 2.954 9.546 399 HB3 SER 52 HB3 SER 52 4.318 3.886 8.050 400 HG SER 52 HG SER 52 3.532 1.476 8.194 401 H HIS 53 H HIS 53 7.653 1.503 7.416 402 HA HIS 53 HA HIS 53 8.650 3.584 5.569 403 HB2 HIS 53 HB2 HIS 53 9.958 1.482 7.023 404 HB3 HIS 53 HB3 HIS 53 10.002 0.956 5.351 405 HD1 HIS 53 HD1 HIS 53 12.605 1.614 6.743 406 HD2 HIS 53 HD2 HIS 53 10.410 4.424 4.614 407 HE1 HIS 53 HE1 HIS 53 14.236 3.412 6.116 408 HE2 HIS 53 HE2 HIS 53 12.885 5.079 4.821 409 H ILE 54 H ILE 54 7.337 3.724 3.829 410 HA ILE 54 HA ILE 54 6.236 1.274 2.615 411 HB ILE 54 HB ILE 54 5.466 4.138 1.843 412 HG12 ILE 54 HG12 ILE 54 3.264 3.605 3.085 413 HG13 ILE 54 HG13 ILE 54 4.119 2.271 3.843 414 HG21 ILE 54 HG21 ILE 54 5.047 2.436 0.113 415 HG22 ILE 54 HG22 ILE 54 3.521 3.029 0.770 416 HG23 ILE 54 HG23 ILE 54 4.142 1.453 1.271 417 HD11 ILE 54 HD11 ILE 54 4.816 5.176 4.088 418 HD12 ILE 54 HD12 ILE 54 5.655 3.835 4.872 419 HD13 ILE 54 HD13 ILE 54 3.979 4.189 5.283 420 H TRP 55 H TRP 55 7.321 0.468 0.966 421 HA TRP 55 HA TRP 55 9.022 2.134 -0.759 422 HB2 TRP 55 HB2 TRP 55 8.718 -0.902 -0.524 423 HB3 TRP 55 HB3 TRP 55 9.842 -0.082 -1.609 424 HD1 TRP 55 HD1 TRP 55 11.948 1.217 -0.413 425 HE1 TRP 55 HE1 TRP 55 13.140 0.800 1.816 426 HE3 TRP 55 HE3 TRP 55 8.411 -1.631 1.873 427 HZ2 TRP 55 HZ2 TRP 55 12.645 -0.542 4.230 428 HZ3 TRP 55 HZ3 TRP 55 8.833 -2.436 4.152 429 HH2 TRP 55 HH2 TRP 55 10.916 -1.898 5.311 430 H LEU 56 H LEU 56 7.840 3.083 -2.326 431 HA LEU 56 HA LEU 56 5.541 1.758 -3.573 432 HB2 LEU 56 HB2 LEU 56 6.676 4.563 -3.943 433 HB3 LEU 56 HB3 LEU 56 5.307 3.941 -4.845 434 HG LEU 56 HG LEU 56 4.423 5.343 -3.133 435 HD11 LEU 56 HD11 LEU 56 3.133 3.318 -3.508 436 HD12 LEU 56 HD12 LEU 56 2.984 3.863 -1.841 437 HD13 LEU 56 HD13 LEU 56 4.019 2.486 -2.225 438 HD21 LEU 56 HD21 LEU 56 4.897 5.116 -0.739 439 HD22 LEU 56 HD22 LEU 56 6.359 5.466 -1.658 440 HD23 LEU 56 HD23 LEU 56 6.056 3.826 -1.081 441 H LEU 57 H LEU 57 6.003 0.405 -5.152 442 HA LEU 57 HA LEU 57 8.289 0.680 -6.941 443 HB2 LEU 57 HB2 LEU 57 6.099 -1.416 -6.676 444 HB3 LEU 57 HB3 LEU 57 7.269 -1.439 -7.983 445 HG LEU 57 HG LEU 57 9.095 -1.851 -6.421 446 HD11 LEU 57 HD11 LEU 57 8.707 -2.299 -4.027 447 HD12 LEU 57 HD12 LEU 57 7.051 -1.703 -4.197 448 HD13 LEU 57 HD13 LEU 57 8.421 -0.617 -4.475 449 HD21 LEU 57 HD21 LEU 57 6.753 -3.717 -5.980 450 HD22 LEU 57 HD22 LEU 57 8.455 -4.104 -5.700 451 HD23 LEU 57 HD23 LEU 57 7.891 -3.752 -7.332 452 H VAL 58 H VAL 58 7.818 2.462 -8.174 453 HA VAL 58 HA VAL 58 5.546 2.227 -10.074 454 HB VAL 58 HB VAL 58 5.011 3.903 -8.250 455 HG11 VAL 58 HG11 VAL 58 7.355 5.489 -9.339 456 HG12 VAL 58 HG12 VAL 58 7.256 4.725 -7.750 457 HG13 VAL 58 HG13 VAL 58 6.181 6.066 -8.149 458 HG21 VAL 58 HG21 VAL 58 5.304 5.117 -11.022 459 HG22 VAL 58 HG22 VAL 58 4.250 5.720 -9.740 460 HG23 VAL 58 HG23 VAL 58 3.952 4.134 -10.451 461 H ASN 59 H ASN 59 6.095 2.987 -12.203 462 HA ASN 59 HA ASN 59 8.940 3.077 -12.752 463 HB2 ASN 59 HB2 ASN 59 8.328 3.172 -15.113 464 HB3 ASN 59 HB3 ASN 59 7.409 1.917 -14.302 465 HD21 ASN 59 HD21 ASN 59 6.861 3.295 -16.806 466 HD22 ASN 59 HD22 ASN 59 5.284 3.976 -16.634 467 H ASP 60 H ASP 60 10.178 4.846 -13.137 468 HA ASP 60 HA ASP 60 9.435 7.295 -11.992 469 HB2 ASP 60 HB2 ASP 60 11.640 8.126 -12.642 470 HB3 ASP 60 HB3 ASP 60 11.789 6.469 -12.077 471 H ASP 61 H ASP 61 9.279 9.350 -12.886 472 HA ASP 61 HA ASP 61 8.632 9.717 -15.718 473 HB2 ASP 61 HB2 ASP 61 6.550 9.002 -14.266 474 HB3 ASP 61 HB3 ASP 61 6.679 10.589 -13.533 475 H GLN 62 H GLN 62 8.362 12.134 -16.118 476 HA GLN 62 HA GLN 62 10.352 13.684 -14.714 477 HB2 GLN 62 HB2 GLN 62 8.313 14.498 -16.831 478 HB3 GLN 62 HB3 GLN 62 9.668 15.493 -16.297 479 HG2 GLN 62 HG2 GLN 62 11.266 13.904 -17.193 480 HG3 GLN 62 HG3 GLN 62 9.984 12.759 -17.575 481 HE21 GLN 62 HE21 GLN 62 8.592 13.213 -19.345 482 HE22 GLN 62 HE22 GLN 62 9.047 14.329 -20.585 483 H ARG 63 H ARG 63 6.875 13.394 -14.692 484 HA ARG 63 HA ARG 63 6.350 15.599 -12.888 485 HB2 ARG 63 HB2 ARG 63 4.738 14.841 -14.662 486 HB3 ARG 63 HB3 ARG 63 4.494 13.342 -13.770 487 HG2 ARG 63 HG2 ARG 63 3.510 14.573 -11.892 488 HG3 ARG 63 HG3 ARG 63 3.879 16.116 -12.671 489 HD2 ARG 63 HD2 ARG 63 1.969 14.007 -13.732 490 HD3 ARG 63 HD3 ARG 63 1.498 15.509 -12.932 491 HE ARG 63 HE ARG 63 2.858 16.554 -14.898 492 HH11 ARG 63 HH11 ARG 63 0.707 13.783 -15.156 493 HH12 ARG 63 HH12 ARG 63 0.318 14.094 -16.818 494 HH21 ARG 63 HH21 ARG 63 2.359 16.935 -17.069 495 HH22 ARG 63 HH22 ARG 63 1.255 15.882 -17.899 496 H LEU 64 H LEU 64 7.009 12.179 -12.663 497 HA LEU 64 HA LEU 64 5.999 11.342 -10.237 498 HB2 LEU 64 HB2 LEU 64 7.618 10.218 -12.073 499 HB3 LEU 64 HB3 LEU 64 8.860 10.622 -10.926 500 HG LEU 64 HG LEU 64 8.249 8.298 -10.698 501 HD11 LEU 64 HD11 LEU 64 7.675 8.117 -8.361 502 HD12 LEU 64 HD12 LEU 64 7.154 9.803 -8.330 503 HD13 LEU 64 HD13 LEU 64 8.847 9.403 -8.633 504 HD21 LEU 64 HD21 LEU 64 6.018 7.512 -10.096 505 HD22 LEU 64 HD22 LEU 64 5.999 8.355 -11.644 506 HD23 LEU 64 HD23 LEU 64 5.389 9.160 -10.196 507 H GLU 65 H GLU 65 9.035 13.059 -10.862 508 HA GLU 65 HA GLU 65 10.062 13.112 -8.232 509 HB2 GLU 65 HB2 GLU 65 10.662 15.051 -10.505 510 HB3 GLU 65 HB3 GLU 65 11.693 14.703 -9.115 511 HG2 GLU 65 HG2 GLU 65 12.000 12.390 -9.913 512 HG3 GLU 65 HG3 GLU 65 10.955 12.720 -11.294 513 H GLN 66 H GLN 66 7.997 15.338 -10.033 514 HA GLN 66 HA GLN 66 7.993 17.493 -8.169 515 HB2 GLN 66 HB2 GLN 66 7.272 17.695 -10.571 516 HB3 GLN 66 HB3 GLN 66 5.842 16.737 -10.204 517 HG2 GLN 66 HG2 GLN 66 5.126 18.506 -8.585 518 HG3 GLN 66 HG3 GLN 66 6.519 19.474 -9.068 519 HE21 GLN 66 HE21 GLN 66 3.735 20.197 -9.249 520 HE22 GLN 66 HE22 GLN 66 3.396 20.480 -10.920 521 H MET 67 H MET 67 5.970 14.616 -8.626 522 HA MET 67 HA MET 67 4.022 15.143 -6.631 523 HB2 MET 67 HB2 MET 67 4.943 12.489 -7.830 524 HB3 MET 67 HB3 MET 67 3.531 12.674 -6.792 525 HG2 MET 67 HG2 MET 67 3.889 14.009 -9.489 526 HG3 MET 67 HG3 MET 67 2.928 12.560 -9.178 527 HE1 MET 67 HE1 MET 67 0.851 13.925 -10.411 528 HE2 MET 67 HE2 MET 67 1.885 15.347 -10.573 529 HE3 MET 67 HE3 MET 67 0.291 15.492 -9.833 530 H ILE 68 H ILE 68 7.155 13.481 -6.561 531 HA ILE 68 HA ILE 68 7.185 12.497 -3.924 532 HB ILE 68 HB ILE 68 9.486 13.432 -5.705 533 HG12 ILE 68 HG12 ILE 68 8.543 10.596 -5.080 534 HG13 ILE 68 HG13 ILE 68 8.170 11.473 -6.559 535 HG21 ILE 68 HG21 ILE 68 9.701 11.858 -3.113 536 HG22 ILE 68 HG22 ILE 68 10.261 13.509 -3.377 537 HG23 ILE 68 HG23 ILE 68 11.033 12.171 -4.228 538 HD11 ILE 68 HD11 ILE 68 9.950 9.901 -6.943 539 HD12 ILE 68 HD12 ILE 68 10.913 10.603 -5.644 540 HD13 ILE 68 HD13 ILE 68 10.574 11.542 -7.102 541 H SER 69 H SER 69 8.460 15.557 -5.253 542 HA SER 69 HA SER 69 9.435 16.619 -2.824 543 HB2 SER 69 HB2 SER 69 8.653 18.094 -5.367 544 HB3 SER 69 HB3 SER 69 9.724 18.702 -4.099 545 HG SER 69 HG SER 69 10.734 16.400 -4.780 546 H GLN 70 H GLN 70 6.295 16.788 -4.395 547 HA GLN 70 HA GLN 70 5.209 18.969 -2.911 548 HB2 GLN 70 HB2 GLN 70 4.374 18.091 -5.159 549 HB3 GLN 70 HB3 GLN 70 3.670 16.728 -4.307 550 HG2 GLN 70 HG2 GLN 70 2.922 19.608 -3.718 551 HG3 GLN 70 HG3 GLN 70 2.106 18.648 -4.938 552 HE21 GLN 70 HE21 GLN 70 2.100 16.178 -3.340 553 HE22 GLN 70 HE22 GLN 70 0.931 16.425 -2.094 554 H ILE 71 H ILE 71 4.775 15.408 -2.711 555 HA ILE 71 HA ILE 71 3.078 15.511 -0.440 556 HB ILE 71 HB ILE 71 3.093 13.606 -2.071 557 HG12 ILE 71 HG12 ILE 71 3.386 12.952 0.896 558 HG13 ILE 71 HG13 ILE 71 1.904 13.365 0.044 559 HG21 ILE 71 HG21 ILE 71 5.605 12.688 -0.631 560 HG22 ILE 71 HG22 ILE 71 5.536 13.296 -2.285 561 HG23 ILE 71 HG23 ILE 71 4.722 11.788 -1.871 562 HD11 ILE 71 HD11 ILE 71 3.527 10.859 -0.276 563 HD12 ILE 71 HD12 ILE 71 2.091 11.270 -1.223 564 HD13 ILE 71 HD13 ILE 71 1.961 11.034 0.518 565 H ASP 72 H ASP 72 6.529 15.371 -0.818 566 HA ASP 72 HA ASP 72 7.349 14.463 1.687 567 HB2 ASP 72 HB2 ASP 72 8.892 14.666 -0.193 568 HB3 ASP 72 HB3 ASP 72 8.670 16.411 -0.247 569 H LYS 73 H LYS 73 6.181 17.606 0.654 570 HA LYS 73 HA LYS 73 7.010 19.162 2.898 571 HB2 LYS 73 HB2 LYS 73 4.742 19.664 0.924 572 HB3 LYS 73 HB3 LYS 73 5.436 20.857 2.022 573 HG2 LYS 73 HG2 LYS 73 7.596 20.710 0.837 574 HG3 LYS 73 HG3 LYS 73 6.922 19.487 -0.244 575 HD2 LYS 73 HD2 LYS 73 6.926 21.684 -1.348 576 HD3 LYS 73 HD3 LYS 73 5.270 21.134 -1.086 577 HE2 LYS 73 HE2 LYS 73 5.098 22.597 0.897 578 HE3 LYS 73 HE3 LYS 73 6.762 23.128 0.649 579 HZ1 LYS 73 HZ1 LYS 73 6.152 24.175 -1.378 580 HZ2 LYS 73 HZ2 LYS 73 5.043 24.677 -0.206 581 HZ3 LYS 73 HZ3 LYS 73 4.600 23.512 -1.346 582 H LEU 74 H LEU 74 4.387 16.959 2.401 583 HA LEU 74 HA LEU 74 2.578 18.063 4.368 584 HB2 LEU 74 HB2 LEU 74 2.591 15.479 2.757 585 HB3 LEU 74 HB3 LEU 74 1.408 15.759 4.020 586 HG LEU 74 HG LEU 74 0.396 16.274 1.882 587 HD11 LEU 74 HD11 LEU 74 0.969 18.861 3.348 588 HD12 LEU 74 HD12 LEU 74 -0.276 17.684 3.760 589 HD13 LEU 74 HD13 LEU 74 -0.371 18.558 2.236 590 HD21 LEU 74 HD21 LEU 74 1.215 17.983 0.349 591 HD22 LEU 74 HD22 LEU 74 2.440 16.742 0.596 592 HD23 LEU 74 HD23 LEU 74 2.600 18.297 1.402 593 H GLU 75 H GLU 75 2.009 17.101 6.322 594 HA GLU 75 HA GLU 75 4.152 16.248 7.985 595 HB2 GLU 75 HB2 GLU 75 1.153 16.346 8.506 596 HB3 GLU 75 HB3 GLU 75 2.389 16.136 9.749 597 HG2 GLU 75 HG2 GLU 75 3.292 18.360 9.297 598 HG3 GLU 75 HG3 GLU 75 2.189 18.564 7.936 599 H ASP 76 H ASP 76 2.007 14.512 5.989 600 HA ASP 76 HA ASP 76 1.884 11.974 7.187 601 HB2 ASP 76 HB2 ASP 76 2.079 12.655 4.203 602 HB3 ASP 76 HB3 ASP 76 1.475 11.148 4.882 603 H VAL 77 H VAL 77 4.177 13.271 4.761 604 HA VAL 77 HA VAL 77 5.967 10.995 5.030 605 HB VAL 77 HB VAL 77 6.042 13.482 3.252 606 HG11 VAL 77 HG11 VAL 77 8.047 11.182 3.275 607 HG12 VAL 77 HG12 VAL 77 8.382 12.845 3.763 608 HG13 VAL 77 HG13 VAL 77 7.986 12.485 2.082 609 HG21 VAL 77 HG21 VAL 77 4.369 11.751 2.644 610 HG22 VAL 77 HG22 VAL 77 5.653 10.537 2.570 611 HG23 VAL 77 HG23 VAL 77 5.641 11.883 1.426 612 H VAL 78 H VAL 78 7.095 10.965 6.832 613 HA VAL 78 HA VAL 78 8.243 13.232 8.191 614 HB VAL 78 HB VAL 78 8.960 10.282 8.588 615 HG11 VAL 78 HG11 VAL 78 9.516 10.927 10.891 616 HG12 VAL 78 HG12 VAL 78 9.069 12.601 10.554 617 HG13 VAL 78 HG13 VAL 78 10.462 11.877 9.740 618 HG21 VAL 78 HG21 VAL 78 6.666 11.802 9.881 619 HG22 VAL 78 HG22 VAL 78 7.186 10.165 10.300 620 HG23 VAL 78 HG23 VAL 78 6.523 10.495 8.700 621 H LYS 79 H LYS 79 9.431 10.601 6.146 622 HA LYS 79 HA LYS 79 11.801 12.148 5.325 623 HB2 LYS 79 HB2 LYS 79 11.866 9.205 6.165 624 HB3 LYS 79 HB3 LYS 79 13.197 10.052 5.381 625 HG2 LYS 79 HG2 LYS 79 13.440 11.513 7.330 626 HG3 LYS 79 HG3 LYS 79 12.067 10.722 8.107 627 HD2 LYS 79 HD2 LYS 79 13.292 8.610 8.234 628 HD3 LYS 79 HD3 LYS 79 14.632 9.288 7.303 629 HE2 LYS 79 HE2 LYS 79 13.759 10.208 10.065 630 HE3 LYS 79 HE3 LYS 79 15.155 9.191 9.710 631 HZ1 LYS 79 HZ1 LYS 79 15.812 11.478 10.028 632 HZ2 LYS 79 HZ2 LYS 79 14.773 11.994 8.800 633 HZ3 LYS 79 HZ3 LYS 79 16.105 11.019 8.429 634 H VAL 80 H VAL 80 12.475 11.651 3.182 635 HA VAL 80 HA VAL 80 11.009 9.534 1.720 636 HB VAL 80 HB VAL 80 10.049 11.841 1.173 637 HG11 VAL 80 HG11 VAL 80 12.105 13.170 1.212 638 HG12 VAL 80 HG12 VAL 80 11.280 13.338 -0.338 639 HG13 VAL 80 HG13 VAL 80 12.712 12.312 -0.208 640 HG21 VAL 80 HG21 VAL 80 9.717 9.927 -0.330 641 HG22 VAL 80 HG22 VAL 80 11.234 10.289 -1.160 642 HG23 VAL 80 HG23 VAL 80 9.885 11.425 -1.251 643 H GLN 81 H GLN 81 12.224 8.471 0.124 644 HA GLN 81 HA GLN 81 14.967 9.280 -0.471 645 HB2 GLN 81 HB2 GLN 81 15.155 7.904 1.614 646 HB3 GLN 81 HB3 GLN 81 14.311 6.582 0.820 647 HG2 GLN 81 HG2 GLN 81 16.714 6.147 0.900 648 HG3 GLN 81 HG3 GLN 81 16.182 6.331 -0.771 649 HE21 GLN 81 HE21 GLN 81 18.009 7.791 1.829 650 HE22 GLN 81 HE22 GLN 81 18.840 8.956 0.857 651 H ARG 82 H ARG 82 15.632 8.523 -2.468 652 HA ARG 82 HA ARG 82 13.663 7.008 -4.090 653 HB2 ARG 82 HB2 ARG 82 15.798 9.011 -4.959 654 HB3 ARG 82 HB3 ARG 82 14.711 8.148 -6.046 655 HG2 ARG 82 HG2 ARG 82 12.775 9.294 -5.115 656 HG3 ARG 82 HG3 ARG 82 13.774 10.063 -3.880 657 HD2 ARG 82 HD2 ARG 82 13.231 11.622 -5.703 658 HD3 ARG 82 HD3 ARG 82 14.969 11.330 -5.606 659 HE ARG 82 HE ARG 82 13.978 9.519 -7.455 660 HH11 ARG 82 HH11 ARG 82 14.158 13.028 -7.198 661 HH12 ARG 82 HH12 ARG 82 14.216 13.260 -8.919 662 HH21 ARG 82 HH21 ARG 82 14.084 9.849 -9.699 663 HH22 ARG 82 HH22 ARG 82 14.175 11.465 -10.331 664 H ASN 83 H ASN 83 14.297 4.941 -3.954 665 HA ASN 83 HA ASN 83 17.137 4.152 -4.287 666 HB2 ASN 83 HB2 ASN 83 14.785 2.625 -3.064 667 HB3 ASN 83 HB3 ASN 83 16.387 1.934 -3.313 668 HD21 ASN 83 HD21 ASN 83 14.909 2.301 -0.828 669 HD22 ASN 83 HD22 ASN 83 15.915 3.261 0.192 670 H GLN 84 H GLN 84 17.645 2.429 -5.693 671 HA GLN 84 HA GLN 84 15.878 2.012 -7.994 672 HB2 GLN 84 HB2 GLN 84 18.721 1.024 -7.469 673 HB3 GLN 84 HB3 GLN 84 17.842 0.841 -8.988 674 HG2 GLN 84 HG2 GLN 84 17.752 3.318 -9.208 675 HG3 GLN 84 HG3 GLN 84 18.683 3.466 -7.717 676 HE21 GLN 84 HE21 GLN 84 20.374 4.560 -8.785 677 HE22 GLN 84 HE22 GLN 84 21.453 3.757 -9.875 678 H SER 85 H SER 85 15.358 -0.168 -8.745 679 HA SER 85 HA SER 85 14.322 -1.701 -6.543 680 HB2 SER 85 HB2 SER 85 12.879 -1.217 -8.428 681 HB3 SER 85 HB3 SER 85 13.979 -2.028 -9.524 682 HG SER 85 HG SER 85 12.878 -3.748 -9.118 683 H ASP 86 H ASP 86 14.366 -3.974 -6.350 684 HA ASP 86 HA ASP 86 16.735 -5.424 -7.230 685 HB2 ASP 86 HB2 ASP 86 17.582 -4.156 -5.300 686 HB3 ASP 86 HB3 ASP 86 16.212 -4.659 -4.318 687 HA PRO 87 HA PRO 87 13.465 -8.569 -7.260 688 HB2 PRO 87 HB2 PRO 87 15.780 -10.506 -7.178 689 HB3 PRO 87 HB3 PRO 87 14.426 -10.406 -8.327 690 HG2 PRO 87 HG2 PRO 87 16.838 -9.573 -9.063 691 HG3 PRO 87 HG3 PRO 87 15.390 -8.654 -9.538 692 HD2 PRO 87 HD2 PRO 87 17.369 -8.050 -7.344 693 HD3 PRO 87 HD3 PRO 87 16.601 -6.945 -8.508 694 H THR 88 H THR 88 16.170 -8.970 -4.954 695 HA THR 88 HA THR 88 14.592 -10.753 -3.230 696 HB THR 88 HB THR 88 16.702 -11.010 -1.910 697 HG1 THR 88 HG1 THR 88 17.482 -8.906 -3.500 698 HG21 THR 88 HG21 THR 88 16.248 -12.576 -3.775 699 HG22 THR 88 HG22 THR 88 17.977 -12.280 -3.605 700 HG23 THR 88 HG23 THR 88 17.074 -11.486 -4.897 701 H MET 89 H MET 89 14.796 -7.463 -3.526 702 HA MET 89 HA MET 89 15.281 -6.407 -1.013 703 HB2 MET 89 HB2 MET 89 14.996 -4.985 -2.977 704 HB3 MET 89 HB3 MET 89 13.304 -5.449 -3.127 705 HG2 MET 89 HG2 MET 89 13.604 -3.178 -2.164 706 HG3 MET 89 HG3 MET 89 12.754 -4.264 -1.063 707 HE1 MET 89 HE1 MET 89 13.183 -2.753 1.058 708 HE2 MET 89 HE2 MET 89 13.968 -1.543 0.041 709 HE3 MET 89 HE3 MET 89 14.763 -2.114 1.508 710 H PHE 90 H PHE 90 12.281 -7.830 -2.254 711 HA PHE 90 HA PHE 90 10.487 -7.062 -0.236 712 HB2 PHE 90 HB2 PHE 90 10.394 -9.689 -1.800 713 HB3 PHE 90 HB3 PHE 90 9.033 -8.882 -1.029 714 HD1 PHE 90 HD1 PHE 90 8.111 -6.769 -2.017 715 HD2 PHE 90 HD2 PHE 90 11.160 -9.031 -4.004 716 HE1 PHE 90 HE1 PHE 90 7.621 -5.603 -4.128 717 HE2 PHE 90 HE2 PHE 90 10.660 -7.856 -6.105 718 HZ PHE 90 HZ PHE 90 8.892 -6.146 -6.169 719 H ASN 91 H ASN 91 12.152 -10.179 -0.642 720 HA ASN 91 HA ASN 91 11.507 -11.332 1.840 721 HB2 ASN 91 HB2 ASN 91 12.244 -12.713 -0.016 722 HB3 ASN 91 HB3 ASN 91 13.776 -11.857 -0.126 723 HD21 ASN 91 HD21 ASN 91 11.873 -13.999 1.948 724 HD22 ASN 91 HD22 ASN 91 13.231 -14.745 2.710 725 H LYS 92 H LYS 92 14.058 -9.186 0.828 726 HA LYS 92 HA LYS 92 16.031 -9.581 2.731 727 HB2 LYS 92 HB2 LYS 92 16.176 -8.237 0.632 728 HB3 LYS 92 HB3 LYS 92 15.278 -6.945 1.413 729 HG2 LYS 92 HG2 LYS 92 17.100 -6.568 2.985 730 HG3 LYS 92 HG3 LYS 92 17.971 -7.976 2.366 731 HD2 LYS 92 HD2 LYS 92 17.339 -5.430 0.814 732 HD3 LYS 92 HD3 LYS 92 18.924 -5.908 1.430 733 HE2 LYS 92 HE2 LYS 92 18.899 -7.891 -0.068 734 HE3 LYS 92 HE3 LYS 92 17.320 -7.406 -0.683 735 HZ1 LYS 92 HZ1 LYS 92 19.890 -5.967 -1.022 736 HZ2 LYS 92 HZ2 LYS 92 18.389 -5.329 -1.457 737 HZ3 LYS 92 HZ3 LYS 92 18.961 -6.719 -2.225 738 H ILE 93 H ILE 93 13.482 -6.965 2.870 739 HA ILE 93 HA ILE 93 14.200 -6.511 5.682 740 HB ILE 93 HB ILE 93 12.642 -4.703 5.794 741 HG12 ILE 93 HG12 ILE 93 10.744 -5.827 4.489 742 HG13 ILE 93 HG13 ILE 93 10.960 -4.113 4.193 743 HG21 ILE 93 HG21 ILE 93 14.733 -4.189 4.657 744 HG22 ILE 93 HG22 ILE 93 13.426 -3.234 3.955 745 HG23 ILE 93 HG23 ILE 93 14.044 -4.648 3.097 746 HD11 ILE 93 HD11 ILE 93 11.850 -6.342 2.381 747 HD12 ILE 93 HD12 ILE 93 12.067 -4.615 2.081 748 HD13 ILE 93 HD13 ILE 93 10.452 -5.298 2.172 749 H ALA 94 H ALA 94 11.784 -8.291 3.913 750 HA ALA 94 HA ALA 94 9.772 -8.470 5.908 751 HB1 ALA 94 HB1 ALA 94 9.322 -8.835 3.526 752 HB2 ALA 94 HB2 ALA 94 8.794 -10.212 4.496 753 HB3 ALA 94 HB3 ALA 94 10.290 -10.311 3.561 754 H VAL 95 H VAL 95 12.699 -10.349 5.369 755 HA VAL 95 HA VAL 95 11.940 -12.681 6.796 756 HB VAL 95 HB VAL 95 13.862 -12.642 5.202 757 HG11 VAL 95 HG11 VAL 95 16.078 -11.823 5.895 758 HG12 VAL 95 HG12 VAL 95 15.370 -11.141 7.361 759 HG13 VAL 95 HG13 VAL 95 14.899 -10.514 5.782 760 HG21 VAL 95 HG21 VAL 95 15.347 -14.152 6.476 761 HG22 VAL 95 HG22 VAL 95 13.646 -14.498 6.792 762 HG23 VAL 95 HG23 VAL 95 14.600 -13.615 7.985 763 H PHE 96 H PHE 96 13.464 -9.648 7.782 764 HA PHE 96 HA PHE 96 13.622 -10.477 10.584 765 HB2 PHE 96 HB2 PHE 96 15.433 -9.111 9.380 766 HB3 PHE 96 HB3 PHE 96 14.310 -7.752 9.396 767 HD1 PHE 96 HD1 PHE 96 15.534 -10.333 11.857 768 HD2 PHE 96 HD2 PHE 96 14.775 -6.186 11.100 769 HE1 PHE 96 HE1 PHE 96 16.346 -9.769 14.108 770 HE2 PHE 96 HE2 PHE 96 15.587 -5.636 13.354 771 HZ PHE 96 HZ PHE 96 16.369 -7.422 14.861 772 H PHE 97 H PHE 97 11.556 -8.741 8.431 773 HA PHE 97 HA PHE 97 9.888 -7.236 8.587 774 HB2 PHE 97 HB2 PHE 97 7.875 -8.167 9.869 775 HB3 PHE 97 HB3 PHE 97 8.574 -9.183 8.629 776 HD1 PHE 97 HD1 PHE 97 8.121 -8.775 12.291 777 HD2 PHE 97 HD2 PHE 97 9.577 -11.331 9.180 778 HE1 PHE 97 HE1 PHE 97 8.239 -10.655 13.879 779 HE2 PHE 97 HE2 PHE 97 9.695 -13.202 10.778 780 HZ PHE 97 HZ PHE 97 9.021 -12.864 13.123 781 H GLN 98 H GLN 98 11.728 -5.996 9.820 782 HA GLN 98 HA GLN 98 10.405 -4.336 11.774 783 HB2 GLN 98 HB2 GLN 98 11.384 -6.214 13.176 784 HB3 GLN 98 HB3 GLN 98 12.977 -5.780 12.588 785 HG2 GLN 98 HG2 GLN 98 12.751 -4.842 14.778 786 HG3 GLN 98 HG3 GLN 98 12.661 -3.501 13.634 787 HE21 GLN 98 HE21 GLN 98 10.827 -5.555 15.784 788 HE22 GLN 98 HE22 GLN 98 9.444 -4.536 15.917 789 H1 GLY 1 H1 GLY 1 -1.007 3.427 15.101 790 H2 GLY 1 H2 GLY 1 0.105 4.689 14.901 791 H3 GLY 1 H3 GLY 1 -1.414 4.994 15.584 792 HA2 GLY 1 HA3 GLY 1 0.283 4.954 17.294 793 HA3 GLY 1 HA2 GLY 1 -0.892 3.662 17.503 794 H SER 2 H SER 2 2.143 4.296 15.768 795 HA SER 2 HA SER 2 2.888 1.489 15.749 796 HB2 SER 2 HB2 SER 2 4.442 3.905 14.729 797 HB3 SER 2 HB3 SER 2 4.643 2.222 14.239 798 HG SER 2 HG SER 2 2.625 2.304 13.243 799 H MET 3 H MET 3 2.789 1.942 18.330 800 HA MET 3 HA MET 3 5.556 2.372 19.312 801 HB2 MET 3 HB2 MET 3 2.994 3.387 20.622 802 HB3 MET 3 HB3 MET 3 4.585 3.444 21.369 803 HG2 MET 3 HG2 MET 3 5.363 5.010 19.679 804 HG3 MET 3 HG3 MET 3 3.826 4.892 18.819 805 HE1 MET 3 HE1 MET 3 1.507 5.808 19.803 806 HE2 MET 3 HE2 MET 3 1.357 6.581 21.379 807 HE3 MET 3 HE3 MET 3 1.720 4.859 21.278 808 H GLN 4 H GLN 4 3.265 0.134 18.864 809 HA GLN 4 HA GLN 4 3.575 -1.249 21.475 810 HB2 GLN 4 HB2 GLN 4 1.460 -1.674 19.311 811 HB3 GLN 4 HB3 GLN 4 1.553 -2.542 20.840 812 HG2 GLN 4 HG2 GLN 4 1.103 -0.456 22.062 813 HG3 GLN 4 HG3 GLN 4 1.025 0.431 20.539 814 HE21 GLN 4 HE21 GLN 4 -1.052 0.132 22.575 815 HE22 GLN 4 HE22 GLN 4 -2.406 -0.600 21.787 816 H ASN 5 H ASN 5 3.824 -3.597 21.378 817 HA ASN 5 HA ASN 5 5.723 -4.583 19.519 818 HB2 ASN 5 HB2 ASN 5 3.938 -6.165 21.425 819 HB3 ASN 5 HB3 ASN 5 5.370 -6.794 20.609 820 HD21 ASN 5 HD21 ASN 5 4.822 -6.605 23.468 821 HD22 ASN 5 HD22 ASN 5 6.101 -5.659 24.142 822 H THR 6 H THR 6 5.319 -6.702 18.239 823 HA THR 6 HA THR 6 3.339 -6.218 16.246 824 HB THR 6 HB THR 6 4.107 -8.476 15.310 825 HG1 THR 6 HG1 THR 6 4.779 -9.439 17.275 826 HG21 THR 6 HG21 THR 6 5.192 -6.347 14.597 827 HG22 THR 6 HG22 THR 6 6.343 -7.684 14.630 828 HG23 THR 6 HG23 THR 6 6.340 -6.492 15.932 829 H THR 7 H THR 7 1.371 -6.191 17.287 830 HA THR 7 HA THR 7 0.367 -8.435 18.837 831 HB THR 7 HB THR 7 -1.123 -5.908 17.973 832 HG1 THR 7 HG1 THR 7 0.767 -5.302 19.085 833 HG21 THR 7 HG21 THR 7 -2.563 -7.690 18.938 834 HG22 THR 7 HG22 THR 7 -2.466 -6.291 20.009 835 HG23 THR 7 HG23 THR 7 -1.531 -7.744 20.372 836 H HIS 8 H HIS 8 -1.548 -9.606 18.246 837 HA HIS 8 HA HIS 8 -1.901 -10.066 15.357 838 HB2 HIS 8 HB2 HIS 8 -2.923 -11.653 17.761 839 HB3 HIS 8 HB3 HIS 8 -3.060 -12.151 16.077 840 HD1 HIS 8 HD1 HIS 8 -1.293 -13.777 15.384 841 HD2 HIS 8 HD2 HIS 8 0.006 -11.353 18.506 842 HE1 HIS 8 HE1 HIS 8 1.000 -14.605 15.993 843 HE2 HIS 8 HE2 HIS 8 1.697 -13.209 17.957 844 H ASP 9 H ASP 9 -3.009 -7.758 16.972 845 HA ASP 9 HA ASP 9 -5.878 -7.921 17.018 846 HB2 ASP 9 HB2 ASP 9 -4.490 -6.490 18.545 847 HB3 ASP 9 HB3 ASP 9 -4.017 -5.508 17.166 848 H ASN 10 H ASN 10 -3.474 -7.152 14.675 849 HA ASN 10 HA ASN 10 -5.201 -5.784 12.807 850 HB2 ASN 10 HB2 ASN 10 -3.270 -5.941 11.255 851 HB3 ASN 10 HB3 ASN 10 -2.770 -5.302 12.816 852 HD21 ASN 10 HD21 ASN 10 -1.223 -6.688 10.685 853 HD22 ASN 10 HD22 ASN 10 -0.452 -8.018 11.464 854 H VAL 11 H VAL 11 -5.919 -6.670 10.820 855 HA VAL 11 HA VAL 11 -6.078 -9.618 10.620 856 HB VAL 11 HB VAL 11 -8.273 -9.507 9.608 857 HG11 VAL 11 HG11 VAL 11 -8.281 -7.799 12.120 858 HG12 VAL 11 HG12 VAL 11 -8.262 -9.561 12.054 859 HG13 VAL 11 HG13 VAL 11 -9.670 -8.676 11.469 860 HG21 VAL 11 HG21 VAL 11 -8.178 -6.469 9.810 861 HG22 VAL 11 HG22 VAL 11 -9.573 -7.415 9.296 862 HG23 VAL 11 HG23 VAL 11 -8.102 -7.417 8.326 863 H ILE 12 H ILE 12 -5.930 -10.426 8.508 864 HA ILE 12 HA ILE 12 -4.354 -8.723 6.689 865 HB ILE 12 HB ILE 12 -4.576 -11.765 6.813 866 HG12 ILE 12 HG12 ILE 12 -3.517 -10.842 8.854 867 HG13 ILE 12 HG13 ILE 12 -2.399 -11.805 7.903 868 HG21 ILE 12 HG21 ILE 12 -2.606 -10.036 5.308 869 HG22 ILE 12 HG22 ILE 12 -3.904 -10.998 4.595 870 HG23 ILE 12 HG23 ILE 12 -2.559 -11.797 5.413 871 HD11 ILE 12 HD11 ILE 12 -2.500 -8.799 8.053 872 HD12 ILE 12 HD12 ILE 12 -1.380 -9.736 7.060 873 HD13 ILE 12 HD13 ILE 12 -1.321 -9.864 8.817 874 H LEU 13 H LEU 13 -5.976 -7.731 5.465 875 HA LEU 13 HA LEU 13 -8.118 -9.336 4.302 876 HB2 LEU 13 HB2 LEU 13 -7.497 -6.378 4.000 877 HB3 LEU 13 HB3 LEU 13 -8.905 -7.197 3.325 878 HG LEU 13 HG LEU 13 -8.276 -6.822 6.279 879 HD11 LEU 13 HD11 LEU 13 -9.100 -4.821 5.152 880 HD12 LEU 13 HD12 LEU 13 -10.263 -5.451 6.309 881 HD13 LEU 13 HD13 LEU 13 -10.518 -5.711 4.583 882 HD21 LEU 13 HD21 LEU 13 -10.442 -7.912 6.742 883 HD22 LEU 13 HD22 LEU 13 -9.318 -9.022 5.965 884 HD23 LEU 13 HD23 LEU 13 -10.627 -8.297 5.028 885 H GLU 14 H GLU 14 -7.316 -10.643 2.891 886 HA GLU 14 HA GLU 14 -5.289 -9.902 0.947 887 HB2 GLU 14 HB2 GLU 14 -5.167 -12.057 2.167 888 HB3 GLU 14 HB3 GLU 14 -6.751 -12.517 1.552 889 HG2 GLU 14 HG2 GLU 14 -5.793 -12.488 -0.766 890 HG3 GLU 14 HG3 GLU 14 -4.207 -12.168 -0.061 891 H LEU 15 H LEU 15 -6.389 -8.473 -0.421 892 HA LEU 15 HA LEU 15 -8.580 -9.669 -2.024 893 HB2 LEU 15 HB2 LEU 15 -9.121 -7.207 -2.609 894 HB3 LEU 15 HB3 LEU 15 -9.577 -7.833 -1.040 895 HG LEU 15 HG LEU 15 -7.339 -6.707 -0.206 896 HD11 LEU 15 HD11 LEU 15 -6.715 -4.661 -1.404 897 HD12 LEU 15 HD12 LEU 15 -7.808 -5.092 -2.721 898 HD13 LEU 15 HD13 LEU 15 -6.408 -6.105 -2.368 899 HD21 LEU 15 HD21 LEU 15 -8.537 -4.619 0.269 900 HD22 LEU 15 HD22 LEU 15 -9.549 -6.035 0.538 901 HD23 LEU 15 HD23 LEU 15 -9.777 -5.053 -0.914 902 H THR 16 H THR 16 -8.295 -10.003 -4.061 903 HA THR 16 HA THR 16 -5.770 -9.397 -5.391 904 HB THR 16 HB THR 16 -8.177 -11.028 -6.341 905 HG1 THR 16 HG1 THR 16 -7.339 -12.180 -4.678 906 HG21 THR 16 HG21 THR 16 -6.636 -11.987 -7.987 907 HG22 THR 16 HG22 THR 16 -5.338 -10.943 -7.409 908 HG23 THR 16 HG23 THR 16 -6.753 -10.236 -8.198 909 H VAL 17 H VAL 17 -5.705 -7.413 -6.350 910 HA VAL 17 HA VAL 17 -8.082 -6.426 -7.810 911 HB VAL 17 HB VAL 17 -7.396 -4.214 -7.511 912 HG11 VAL 17 HG11 VAL 17 -7.054 -3.890 -5.081 913 HG12 VAL 17 HG12 VAL 17 -6.642 -5.607 -4.919 914 HG13 VAL 17 HG13 VAL 17 -8.269 -5.124 -5.427 915 HG21 VAL 17 HG21 VAL 17 -4.628 -5.163 -6.697 916 HG22 VAL 17 HG22 VAL 17 -5.166 -3.482 -6.632 917 HG23 VAL 17 HG23 VAL 17 -5.070 -4.319 -8.182 918 H ARG 18 H ARG 18 -7.850 -5.925 -9.967 919 HA ARG 18 HA ARG 18 -5.280 -6.467 -11.324 920 HB2 ARG 18 HB2 ARG 18 -6.561 -5.999 -13.400 921 HB3 ARG 18 HB3 ARG 18 -7.313 -7.261 -12.437 922 HG2 ARG 18 HG2 ARG 18 -8.936 -5.537 -11.571 923 HG3 ARG 18 HG3 ARG 18 -8.239 -4.383 -12.715 924 HD2 ARG 18 HD2 ARG 18 -9.609 -7.005 -13.398 925 HD3 ARG 18 HD3 ARG 18 -10.273 -5.386 -13.634 926 HE ARG 18 HE ARG 18 -7.878 -5.421 -15.015 927 HH11 ARG 18 HH11 ARG 18 -10.876 -7.251 -15.217 928 HH12 ARG 18 HH12 ARG 18 -10.703 -7.571 -16.910 929 HH21 ARG 18 HH21 ARG 18 -7.663 -5.851 -17.218 930 HH22 ARG 18 HH22 ARG 18 -8.873 -6.775 -18.049 931 H ASN 19 H ASN 19 -4.221 -4.692 -12.572 932 HA ASN 19 HA ASN 19 -4.232 -2.264 -11.023 933 HB2 ASN 19 HB2 ASN 19 -2.616 -3.034 -13.477 934 HB3 ASN 19 HB3 ASN 19 -2.461 -1.476 -12.672 935 HD21 ASN 19 HD21 ASN 19 -0.376 -1.702 -11.892 936 HD22 ASN 19 HD22 ASN 19 0.107 -2.917 -10.759 937 H HIS 20 H HIS 20 -6.466 -1.802 -11.399 938 HA HIS 20 HA HIS 20 -7.207 -0.311 -13.788 939 HB2 HIS 20 HB2 HIS 20 -9.012 -1.565 -12.735 940 HB3 HIS 20 HB3 HIS 20 -8.593 -0.985 -11.137 941 HD1 HIS 20 HD1 HIS 20 -10.669 -0.162 -14.108 942 HD2 HIS 20 HD2 HIS 20 -9.533 1.654 -10.542 943 HE1 HIS 20 HE1 HIS 20 -12.195 1.806 -13.821 944 HE2 HIS 20 HE2 HIS 20 -11.534 2.844 -11.632 945 HA PRO 21 HA PRO 21 -5.502 3.667 -12.454 946 HB2 PRO 21 HB2 PRO 21 -8.304 4.632 -13.111 947 HB3 PRO 21 HB3 PRO 21 -6.734 5.361 -13.526 948 HG2 PRO 21 HG2 PRO 21 -8.043 3.982 -15.365 949 HG3 PRO 21 HG3 PRO 21 -6.281 3.785 -15.204 950 HD2 PRO 21 HD2 PRO 21 -8.469 1.913 -14.358 951 HD3 PRO 21 HD3 PRO 21 -6.831 1.546 -14.943 952 H GLY 22 H GLY 22 -5.236 3.299 -10.262 953 HA2 GLY 22 HA2 GLY 22 -5.327 4.427 -8.238 954 HA3 GLY 22 HA3 GLY 22 -6.959 4.956 -8.587 955 H VAL 23 H VAL 23 -6.092 1.520 -8.795 956 HA VAL 23 HA VAL 23 -8.068 0.674 -6.987 957 HB VAL 23 HB VAL 23 -6.888 -1.538 -6.874 958 HG11 VAL 23 HG11 VAL 23 -8.446 -1.016 -8.692 959 HG12 VAL 23 HG12 VAL 23 -7.170 -2.109 -9.221 960 HG13 VAL 23 HG13 VAL 23 -7.111 -0.403 -9.667 961 HG21 VAL 23 HG21 VAL 23 -4.872 -1.958 -8.222 962 HG22 VAL 23 HG22 VAL 23 -4.539 -0.768 -6.958 963 HG23 VAL 23 HG23 VAL 23 -4.766 -0.237 -8.626 964 H MET 24 H MET 24 -4.701 1.472 -6.388 965 HA MET 24 HA MET 24 -4.600 0.689 -3.659 966 HB2 MET 24 HB2 MET 24 -2.504 2.012 -3.567 967 HB3 MET 24 HB3 MET 24 -2.544 0.921 -4.940 968 HG2 MET 24 HG2 MET 24 -3.123 3.888 -5.120 969 HG3 MET 24 HG3 MET 24 -1.552 3.159 -5.439 970 HE1 MET 24 HE1 MET 24 -2.502 0.437 -6.933 971 HE2 MET 24 HE2 MET 24 -1.134 1.418 -7.468 972 HE3 MET 24 HE3 MET 24 -2.394 0.957 -8.612 973 H THR 25 H THR 25 -5.551 3.671 -5.305 974 HA THR 25 HA THR 25 -5.764 5.288 -2.945 975 HB THR 25 HB THR 25 -7.180 5.801 -5.602 976 HG1 THR 25 HG1 THR 25 -4.909 7.057 -5.676 977 HG21 THR 25 HG21 THR 25 -7.704 7.398 -3.768 978 HG22 THR 25 HG22 THR 25 -6.764 8.176 -5.043 979 HG23 THR 25 HG23 THR 25 -5.977 7.697 -3.539 980 H HIS 26 H HIS 26 -7.862 3.081 -4.669 981 HA HIS 26 HA HIS 26 -10.345 3.889 -3.474 982 HB2 HIS 26 HB2 HIS 26 -9.546 1.454 -5.120 983 HB3 HIS 26 HB3 HIS 26 -11.157 1.617 -4.427 984 HD1 HIS 26 HD1 HIS 26 -12.288 1.769 -6.754 985 HD2 HIS 26 HD2 HIS 26 -9.412 4.703 -6.141 986 HE1 HIS 26 HE1 HIS 26 -12.629 3.445 -8.583 987 HE2 HIS 26 HE2 HIS 26 -10.801 5.138 -8.254 988 H VAL 27 H VAL 27 -8.077 1.113 -2.887 989 HA VAL 27 HA VAL 27 -9.550 -0.006 -0.757 990 HB VAL 27 HB VAL 27 -7.535 -1.248 -0.070 991 HG11 VAL 27 HG11 VAL 27 -7.826 -1.152 -3.096 992 HG12 VAL 27 HG12 VAL 27 -8.808 -2.102 -1.981 993 HG13 VAL 27 HG13 VAL 27 -7.096 -2.473 -2.174 994 HG21 VAL 27 HG21 VAL 27 -5.973 0.418 -2.080 995 HG22 VAL 27 HG22 VAL 27 -5.354 -0.987 -1.203 996 HG23 VAL 27 HG23 VAL 27 -5.802 0.476 -0.324 997 H CYS 28 H CYS 28 -6.851 2.311 -0.719 998 HA CYS 28 HA CYS 28 -6.690 2.721 2.047 999 HB2 CYS 28 HB2 CYS 28 -5.935 4.520 -0.284 1000 HB3 CYS 28 HB3 CYS 28 -5.435 4.795 1.383 1001 HG CYS 28 HG CYS 28 -3.880 3.122 -0.863 1002 H GLY 29 H GLY 29 -8.800 4.115 -0.391 1003 HA2 GLY 29 HA2 GLY 29 -9.833 6.340 0.990 1004 HA3 GLY 29 HA3 GLY 29 -10.631 5.466 -0.306 1005 H LEU 30 H LEU 30 -10.994 2.956 0.808 1006 HA LEU 30 HA LEU 30 -13.362 3.346 2.319 1007 HB2 LEU 30 HB2 LEU 30 -11.825 0.919 1.415 1008 HB3 LEU 30 HB3 LEU 30 -13.049 0.698 2.649 1009 HG LEU 30 HG LEU 30 -14.012 0.168 0.495 1010 HD11 LEU 30 HD11 LEU 30 -15.518 1.221 2.100 1011 HD12 LEU 30 HD12 LEU 30 -15.968 1.628 0.449 1012 HD13 LEU 30 HD13 LEU 30 -15.134 2.819 1.451 1013 HD21 LEU 30 HD21 LEU 30 -12.545 1.436 -0.990 1014 HD22 LEU 30 HD22 LEU 30 -13.270 2.954 -0.456 1015 HD23 LEU 30 HD23 LEU 30 -14.239 1.775 -1.347 1016 H PHE 31 H PHE 31 -10.081 2.390 3.285 1017 HA PHE 31 HA PHE 31 -10.799 1.862 6.038 1018 HB2 PHE 31 HB2 PHE 31 -8.056 2.167 4.748 1019 HB3 PHE 31 HB3 PHE 31 -8.335 1.627 6.406 1020 HD1 PHE 31 HD2 PHE 31 -9.973 -0.442 6.673 1021 HD2 PHE 31 HD1 PHE 31 -7.904 0.521 3.056 1022 HE1 PHE 31 HE2 PHE 31 -10.299 -2.741 5.856 1023 HE2 PHE 31 HE1 PHE 31 -8.246 -1.773 2.249 1024 HZ PHE 31 HZ PHE 31 -9.443 -3.402 3.645 1025 H ALA 32 H ALA 32 -9.648 4.646 4.244 1026 HA ALA 32 HA ALA 32 -8.902 6.281 6.447 1027 HB1 ALA 32 HB1 ALA 32 -9.041 8.163 4.855 1028 HB2 ALA 32 HB2 ALA 32 -9.877 7.125 3.694 1029 HB3 ALA 32 HB3 ALA 32 -8.205 6.782 4.138 1030 H ARG 33 H ARG 33 -11.972 5.808 4.716 1031 HA ARG 33 HA ARG 33 -13.410 7.742 6.382 1032 HB2 ARG 33 HB2 ARG 33 -15.294 7.346 4.889 1033 HB3 ARG 33 HB3 ARG 33 -13.838 7.597 3.930 1034 HG2 ARG 33 HG2 ARG 33 -13.642 5.114 3.659 1035 HG3 ARG 33 HG3 ARG 33 -15.169 4.933 4.521 1036 HD2 ARG 33 HD2 ARG 33 -14.778 6.393 1.889 1037 HD3 ARG 33 HD3 ARG 33 -15.513 4.800 2.098 1038 HE ARG 33 HE ARG 33 -17.034 6.370 3.694 1039 HH11 ARG 33 HH11 ARG 33 -16.119 6.679 0.312 1040 HH12 ARG 33 HH12 ARG 33 -17.569 7.531 -0.124 1041 HH21 ARG 33 HH21 ARG 33 -18.909 7.503 3.123 1042 HH22 ARG 33 HH22 ARG 33 -19.155 7.999 1.475 1043 H ARG 34 H ARG 34 -12.469 4.614 6.878 1044 HA ARG 34 HA ARG 34 -14.883 3.373 7.805 1045 HB2 ARG 34 HB2 ARG 34 -12.894 2.100 6.977 1046 HB3 ARG 34 HB3 ARG 34 -11.965 2.645 8.362 1047 HG2 ARG 34 HG2 ARG 34 -14.506 1.076 8.822 1048 HG3 ARG 34 HG3 ARG 34 -13.051 0.228 8.305 1049 HD2 ARG 34 HD2 ARG 34 -13.257 1.965 10.788 1050 HD3 ARG 34 HD3 ARG 34 -13.352 0.205 10.764 1051 HE ARG 34 HE ARG 34 -10.940 1.312 9.579 1052 HH11 ARG 34 HH11 ARG 34 -12.352 0.134 12.591 1053 HH12 ARG 34 HH12 ARG 34 -10.816 -0.226 13.303 1054 HH21 ARG 34 HH21 ARG 34 -8.941 0.803 10.546 1055 HH22 ARG 34 HH22 ARG 34 -8.895 0.151 12.153 1056 H ALA 35 H ALA 35 -11.975 4.425 9.563 1057 HA ALA 35 HA ALA 35 -13.152 5.951 11.591 1058 HB1 ALA 35 HB1 ALA 35 -14.260 3.864 12.361 1059 HB2 ALA 35 HB2 ALA 35 -13.075 4.402 13.552 1060 HB3 ALA 35 HB3 ALA 35 -12.698 3.053 12.472 1061 H PHE 36 H PHE 36 -10.832 3.287 11.384 1062 HA PHE 36 HA PHE 36 -8.574 5.152 11.778 1063 HB2 PHE 36 HB2 PHE 36 -8.778 3.736 13.787 1064 HB3 PHE 36 HB3 PHE 36 -8.866 2.282 12.798 1065 HD1 PHE 36 HD2 PHE 36 -6.541 5.226 13.298 1066 HD2 PHE 36 HD1 PHE 36 -6.890 1.005 12.648 1067 HE1 PHE 36 HE2 PHE 36 -4.090 4.997 13.403 1068 HE2 PHE 36 HE1 PHE 36 -4.441 0.792 12.754 1069 HZ PHE 36 HZ PHE 36 -3.042 2.783 13.131 1070 H ASN 37 H ASN 37 -6.745 4.664 10.532 1071 HA ASN 37 HA ASN 37 -7.325 3.648 7.888 1072 HB2 ASN 37 HB2 ASN 37 -4.789 4.853 9.079 1073 HB3 ASN 37 HB3 ASN 37 -5.073 4.570 7.362 1074 HD21 ASN 37 HD21 ASN 37 -6.554 5.898 6.261 1075 HD22 ASN 37 HD22 ASN 37 -7.090 7.405 6.919 1076 H VAL 38 H VAL 38 -5.026 2.603 6.955 1077 HA VAL 38 HA VAL 38 -4.895 -0.047 8.119 1078 HB VAL 38 HB VAL 38 -3.218 1.047 5.807 1079 HG11 VAL 38 HG11 VAL 38 -4.026 -1.791 6.533 1080 HG12 VAL 38 HG12 VAL 38 -2.422 -1.080 6.731 1081 HG13 VAL 38 HG13 VAL 38 -3.086 -1.323 5.112 1082 HG21 VAL 38 HG21 VAL 38 -5.960 -0.261 5.622 1083 HG22 VAL 38 HG22 VAL 38 -4.922 0.159 4.256 1084 HG23 VAL 38 HG23 VAL 38 -5.593 1.433 5.278 1085 H GLU 39 H GLU 39 -3.174 -0.900 9.253 1086 HA GLU 39 HA GLU 39 -1.151 0.852 10.371 1087 HB2 GLU 39 HB2 GLU 39 -2.348 -0.951 11.675 1088 HB3 GLU 39 HB3 GLU 39 -1.523 -2.162 10.704 1089 HG2 GLU 39 HG2 GLU 39 -0.456 -1.909 12.892 1090 HG3 GLU 39 HG3 GLU 39 0.645 -1.426 11.597 1091 H GLY 40 H GLY 40 -1.219 -2.034 8.229 1092 HA2 GLY 40 HA2 GLY 40 1.317 -1.202 6.964 1093 HA3 GLY 40 HA3 GLY 40 1.246 -2.801 7.694 1094 H ILE 41 H ILE 41 1.651 -2.096 4.875 1095 HA ILE 41 HA ILE 41 -0.687 -3.410 3.588 1096 HB ILE 41 HB ILE 41 0.863 -1.021 2.428 1097 HG12 ILE 41 HG12 ILE 41 -2.012 -1.105 3.451 1098 HG13 ILE 41 HG13 ILE 41 -0.664 -0.315 4.259 1099 HG21 ILE 41 HG21 ILE 41 -0.767 -1.042 0.577 1100 HG22 ILE 41 HG22 ILE 41 -1.551 -2.463 1.270 1101 HG23 ILE 41 HG23 ILE 41 0.101 -2.577 0.664 1102 HD11 ILE 41 HD11 ILE 41 -2.057 1.296 3.136 1103 HD12 ILE 41 HD12 ILE 41 -1.846 0.468 1.594 1104 HD13 ILE 41 HD13 ILE 41 -0.467 1.246 2.376 1105 H LEU 42 H LEU 42 -0.117 -4.814 1.866 1106 HA LEU 42 HA LEU 42 2.592 -4.770 0.795 1107 HB2 LEU 42 HB2 LEU 42 2.864 -6.286 2.661 1108 HB3 LEU 42 HB3 LEU 42 1.443 -7.210 2.204 1109 HG LEU 42 HG LEU 42 2.579 -8.221 0.329 1110 HD11 LEU 42 HD11 LEU 42 3.784 -6.285 -0.552 1111 HD12 LEU 42 HD12 LEU 42 4.848 -7.679 -0.392 1112 HD13 LEU 42 HD13 LEU 42 4.931 -6.369 0.787 1113 HD21 LEU 42 HD21 LEU 42 3.071 -9.223 2.488 1114 HD22 LEU 42 HD22 LEU 42 4.450 -8.139 2.713 1115 HD23 LEU 42 HD23 LEU 42 4.475 -9.351 1.428 1116 H CYS 43 H CYS 43 1.766 -4.161 -1.118 1117 HA CYS 43 HA CYS 43 -0.162 -5.792 -2.594 1118 HB2 CYS 43 HB2 CYS 43 -0.346 -3.351 -2.746 1119 HB3 CYS 43 HB3 CYS 43 1.317 -3.218 -3.295 1120 HG CYS 43 HG CYS 43 -0.927 -4.988 -5.139 1121 H LEU 44 H LEU 44 0.680 -7.613 -3.418 1122 HA LEU 44 HA LEU 44 3.417 -7.722 -4.519 1123 HB2 LEU 44 HB2 LEU 44 2.643 -9.420 -2.796 1124 HB3 LEU 44 HB3 LEU 44 1.463 -9.994 -3.959 1125 HG LEU 44 HG LEU 44 3.460 -10.547 -5.509 1126 HD11 LEU 44 HD11 LEU 44 5.152 -9.163 -4.411 1127 HD12 LEU 44 HD12 LEU 44 5.648 -10.854 -4.458 1128 HD13 LEU 44 HD13 LEU 44 5.042 -10.157 -2.953 1129 HD21 LEU 44 HD21 LEU 44 3.933 -12.690 -4.402 1130 HD22 LEU 44 HD22 LEU 44 2.216 -12.297 -4.322 1131 HD23 LEU 44 HD23 LEU 44 3.236 -12.081 -2.897 1132 HA PRO 45 HA PRO 45 0.950 -7.362 -8.433 1133 HB2 PRO 45 HB2 PRO 45 2.993 -6.487 -10.044 1134 HB3 PRO 45 HB3 PRO 45 2.137 -5.409 -8.922 1135 HG2 PRO 45 HG2 PRO 45 4.801 -6.749 -8.573 1136 HG3 PRO 45 HG3 PRO 45 4.320 -5.083 -8.178 1137 HD2 PRO 45 HD2 PRO 45 4.471 -7.061 -6.289 1138 HD3 PRO 45 HD3 PRO 45 3.342 -5.694 -6.167 1139 H ILE 46 H ILE 46 0.519 -9.110 -9.675 1140 HA ILE 46 HA ILE 46 2.381 -11.357 -9.636 1141 HB ILE 46 HB ILE 46 -0.468 -11.277 -10.706 1142 HG12 ILE 46 HG12 ILE 46 -0.511 -10.740 -8.310 1143 HG13 ILE 46 HG13 ILE 46 -1.123 -12.369 -8.541 1144 HG21 ILE 46 HG21 ILE 46 1.305 -13.658 -10.031 1145 HG22 ILE 46 HG22 ILE 46 0.814 -13.144 -11.648 1146 HG23 ILE 46 HG23 ILE 46 -0.393 -13.749 -10.511 1147 HD11 ILE 46 HD11 ILE 46 1.613 -11.613 -7.517 1148 HD12 ILE 46 HD12 ILE 46 1.039 -13.264 -7.766 1149 HD13 ILE 46 HD13 ILE 46 0.259 -12.228 -6.569 1150 H GLN 47 H GLN 47 3.367 -12.212 -11.395 1151 HA GLN 47 HA GLN 47 4.329 -10.297 -13.202 1152 HB2 GLN 47 HB2 GLN 47 5.769 -12.008 -12.318 1153 HB3 GLN 47 HB3 GLN 47 4.752 -13.291 -12.959 1154 HG2 GLN 47 HG2 GLN 47 5.397 -12.697 -15.244 1155 HG3 GLN 47 HG3 GLN 47 6.376 -11.359 -14.641 1156 HE21 GLN 47 HE21 GLN 47 7.098 -13.777 -16.203 1157 HE22 GLN 47 HE22 GLN 47 8.367 -14.532 -15.308 1158 H ASP 48 H ASP 48 2.162 -13.075 -13.820 1159 HA ASP 48 HA ASP 48 2.215 -12.449 -16.736 1160 HB2 ASP 48 HB2 ASP 48 2.059 -14.839 -17.164 1161 HB3 ASP 48 HB3 ASP 48 3.421 -14.532 -16.089 1162 H SER 49 H SER 49 0.236 -11.988 -14.289 1163 HA SER 49 HA SER 49 -2.227 -12.489 -15.840 1164 HB2 SER 49 HB2 SER 49 -1.825 -13.362 -12.936 1165 HB3 SER 49 HB3 SER 49 -3.372 -13.374 -13.785 1166 HG SER 49 HG SER 49 -1.579 -14.691 -15.265 1167 H ASP 50 H ASP 50 -3.679 -10.817 -15.666 1168 HA ASP 50 HA ASP 50 -2.902 -8.358 -14.465 1169 HB2 ASP 50 HB2 ASP 50 -5.583 -9.188 -15.664 1170 HB3 ASP 50 HB3 ASP 50 -5.165 -7.543 -15.193 1171 H LYS 51 H LYS 51 -2.561 -9.013 -12.323 1172 HA LYS 51 HA LYS 51 -4.702 -8.575 -10.505 1173 HB2 LYS 51 HB2 LYS 51 -4.537 -10.775 -9.317 1174 HB3 LYS 51 HB3 LYS 51 -5.229 -10.923 -10.927 1175 HG2 LYS 51 HG2 LYS 51 -3.241 -11.902 -11.805 1176 HG3 LYS 51 HG3 LYS 51 -2.309 -11.454 -10.384 1177 HD2 LYS 51 HD2 LYS 51 -2.774 -13.854 -10.371 1178 HD3 LYS 51 HD3 LYS 51 -3.579 -13.064 -9.015 1179 HE2 LYS 51 HE2 LYS 51 -5.717 -13.155 -10.193 1180 HE3 LYS 51 HE3 LYS 51 -4.932 -13.827 -11.624 1181 HZ1 LYS 51 HZ1 LYS 51 -4.272 -15.751 -10.236 1182 HZ2 LYS 51 HZ2 LYS 51 -5.944 -15.591 -10.403 1183 HZ3 LYS 51 HZ3 LYS 51 -5.194 -15.124 -8.964 1184 H SER 52 H SER 52 -3.938 -8.458 -8.355 1185 HA SER 52 HA SER 52 -1.120 -8.631 -7.708 1186 HB2 SER 52 HB2 SER 52 -1.354 -6.340 -8.755 1187 HB3 SER 52 HB3 SER 52 -2.609 -5.946 -7.577 1188 HG SER 52 HG SER 52 -0.137 -5.477 -7.258 1189 H HIS 53 H HIS 53 -1.032 -9.238 -5.575 1190 HA HIS 53 HA HIS 53 -3.613 -9.454 -4.155 1191 HB2 HIS 53 HB2 HIS 53 -1.494 -11.329 -4.640 1192 HB3 HIS 53 HB3 HIS 53 -1.387 -10.971 -2.926 1193 HD1 HIS 53 HD1 HIS 53 -2.152 -13.772 -3.814 1194 HD2 HIS 53 HD2 HIS 53 -4.949 -10.795 -3.039 1195 HE1 HIS 53 HE1 HIS 53 -4.304 -14.976 -3.324 1196 HE2 HIS 53 HE2 HIS 53 -5.976 -13.153 -2.878 1197 H ILE 54 H ILE 54 -3.916 -7.704 -2.876 1198 HA ILE 54 HA ILE 54 -1.651 -6.581 -1.358 1199 HB ILE 54 HB ILE 54 -4.443 -5.337 -1.565 1200 HG12 ILE 54 HG12 ILE 54 -3.283 -3.618 -3.102 1201 HG13 ILE 54 HG13 ILE 54 -1.974 -4.777 -3.260 1202 HG21 ILE 54 HG21 ILE 54 -3.136 -4.645 0.404 1203 HG22 ILE 54 HG22 ILE 54 -3.303 -3.301 -0.725 1204 HG23 ILE 54 HG23 ILE 54 -1.778 -4.190 -0.633 1205 HD11 ILE 54 HD11 ILE 54 -4.821 -5.211 -4.090 1206 HD12 ILE 54 HD12 ILE 54 -3.498 -6.364 -4.275 1207 HD13 ILE 54 HD13 ILE 54 -3.463 -4.833 -5.147 1208 H TRP 55 H TRP 55 -1.432 -7.238 0.665 1209 HA TRP 55 HA TRP 55 -3.708 -8.249 2.233 1210 HB2 TRP 55 HB2 TRP 55 -0.691 -8.325 2.738 1211 HB3 TRP 55 HB3 TRP 55 -1.906 -9.026 3.807 1212 HD1 TRP 55 HD1 TRP 55 -3.232 -11.238 2.844 1213 HE1 TRP 55 HE1 TRP 55 -2.512 -13.020 1.152 1214 HE3 TRP 55 HE3 TRP 55 0.603 -8.749 0.617 1215 HZ2 TRP 55 HZ2 TRP 55 -0.595 -13.337 -0.868 1216 HZ3 TRP 55 HZ3 TRP 55 1.826 -9.852 -1.201 1217 HH2 TRP 55 HH2 TRP 55 1.236 -12.108 -1.934 1218 H LEU 56 H LEU 56 -4.787 -6.589 3.168 1219 HA LEU 56 HA LEU 56 -3.413 -4.190 4.145 1220 HB2 LEU 56 HB2 LEU 56 -6.377 -4.888 4.023 1221 HB3 LEU 56 HB3 LEU 56 -5.757 -3.398 4.707 1222 HG LEU 56 HG LEU 56 -6.566 -2.871 2.529 1223 HD11 LEU 56 HD11 LEU 56 -4.493 -1.742 3.110 1224 HD12 LEU 56 HD12 LEU 56 -4.610 -1.993 1.371 1225 HD13 LEU 56 HD13 LEU 56 -3.550 -3.022 2.339 1226 HD21 LEU 56 HD21 LEU 56 -5.880 -3.994 0.461 1227 HD22 LEU 56 HD22 LEU 56 -6.668 -5.111 1.573 1228 HD23 LEU 56 HD23 LEU 56 -4.913 -5.142 1.393 1229 H LEU 57 H LEU 57 -2.554 -4.339 6.089 1230 HA LEU 57 HA LEU 57 -3.605 -6.020 8.228 1231 HB2 LEU 57 HB2 LEU 57 -1.173 -4.205 8.014 1232 HB3 LEU 57 HB3 LEU 57 -1.641 -4.972 9.520 1233 HG LEU 57 HG LEU 57 -1.189 -7.185 8.599 1234 HD11 LEU 57 HD11 LEU 57 -0.147 -7.508 6.387 1235 HD12 LEU 57 HD12 LEU 57 -0.482 -5.814 5.998 1236 HD13 LEU 57 HD13 LEU 57 -1.815 -6.940 6.294 1237 HD21 LEU 57 HD21 LEU 57 1.091 -5.249 8.128 1238 HD22 LEU 57 HD22 LEU 57 1.244 -6.993 8.368 1239 HD23 LEU 57 HD23 LEU 57 0.627 -5.977 9.669 1240 H VAL 58 H VAL 58 -5.524 -5.050 8.801 1241 HA VAL 58 HA VAL 58 -5.354 -2.390 10.104 1242 HB VAL 58 HB VAL 58 -6.447 -2.204 7.829 1243 HG11 VAL 58 HG11 VAL 58 -8.616 -3.987 8.971 1244 HG12 VAL 58 HG12 VAL 58 -7.501 -4.399 7.666 1245 HG13 VAL 58 HG13 VAL 58 -8.695 -3.122 7.432 1246 HG21 VAL 58 HG21 VAL 58 -8.295 -1.606 10.166 1247 HG22 VAL 58 HG22 VAL 58 -8.403 -0.884 8.558 1248 HG23 VAL 58 HG23 VAL 58 -6.995 -0.571 9.570 1249 H ASN 59 H ASN 59 -6.679 -2.250 12.010 1250 HA ASN 59 HA ASN 59 -7.350 -4.805 13.195 1251 HB2 ASN 59 HB2 ASN 59 -7.865 -3.558 15.219 1252 HB3 ASN 59 HB3 ASN 59 -6.340 -3.009 14.552 1253 HD21 ASN 59 HD21 ASN 59 -8.180 -1.670 16.400 1254 HD22 ASN 59 HD22 ASN 59 -8.550 -0.150 15.669 1255 H ASP 60 H ASP 60 -9.331 -5.709 13.409 1256 HA ASP 60 HA ASP 60 -11.312 -5.111 11.526 1257 HB2 ASP 60 HB2 ASP 60 -12.602 -6.950 12.510 1258 HB3 ASP 60 HB3 ASP 60 -10.908 -7.400 12.378 1259 H ASP 61 H ASP 61 -13.444 -4.482 11.762 1260 HA ASP 61 HA ASP 61 -14.351 -3.034 14.136 1261 HB2 ASP 61 HB2 ASP 61 -12.980 -1.530 12.448 1262 HB3 ASP 61 HB3 ASP 61 -14.365 -1.692 11.389 1263 H GLN 62 H GLN 62 -16.706 -2.457 13.817 1264 HA GLN 62 HA GLN 62 -18.202 -4.573 12.545 1265 HB2 GLN 62 HB2 GLN 62 -19.125 -1.978 13.858 1266 HB3 GLN 62 HB3 GLN 62 -20.187 -3.311 13.400 1267 HG2 GLN 62 HG2 GLN 62 -19.151 -4.781 15.020 1268 HG3 GLN 62 HG3 GLN 62 -17.905 -3.589 15.380 1269 HE21 GLN 62 HE21 GLN 62 -18.478 -1.733 16.615 1270 HE22 GLN 62 HE22 GLN 62 -19.903 -1.711 17.593 1271 H ARG 63 H ARG 63 -17.333 -1.277 11.800 1272 HA ARG 63 HA ARG 63 -18.948 -1.035 9.405 1273 HB2 ARG 63 HB2 ARG 63 -18.362 0.906 10.893 1274 HB3 ARG 63 HB3 ARG 63 -16.678 0.746 10.399 1275 HG2 ARG 63 HG2 ARG 63 -17.264 1.309 8.084 1276 HG3 ARG 63 HG3 ARG 63 -18.982 1.328 8.495 1277 HD2 ARG 63 HD2 ARG 63 -16.875 3.222 9.585 1278 HD3 ARG 63 HD3 ARG 63 -18.059 3.611 8.334 1279 HE ARG 63 HE ARG 63 -19.726 2.953 10.232 1280 HH11 ARG 63 HH11 ARG 63 -16.771 4.812 10.674 1281 HH12 ARG 63 HH12 ARG 63 -17.389 5.675 12.048 1282 HH21 ARG 63 HH21 ARG 63 -20.504 4.089 12.012 1283 HH22 ARG 63 HH22 ARG 63 -19.503 5.265 12.802 1284 H LEU 64 H LEU 64 -15.733 -2.097 10.251 1285 HA LEU 64 HA LEU 64 -14.204 -1.851 7.962 1286 HB2 LEU 64 HB2 LEU 64 -13.814 -3.024 10.357 1287 HB3 LEU 64 HB3 LEU 64 -14.146 -4.478 9.466 1288 HG LEU 64 HG LEU 64 -11.763 -4.190 9.729 1289 HD11 LEU 64 HD11 LEU 64 -10.956 -4.292 7.457 1290 HD12 LEU 64 HD12 LEU 64 -12.479 -3.633 6.855 1291 HD13 LEU 64 HD13 LEU 64 -12.445 -5.213 7.645 1292 HD21 LEU 64 HD21 LEU 64 -10.504 -2.296 8.845 1293 HD22 LEU 64 HD22 LEU 64 -11.663 -1.777 10.065 1294 HD23 LEU 64 HD23 LEU 64 -12.004 -1.501 8.355 1295 H GLU 65 H GLU 65 -16.475 -4.435 8.823 1296 HA GLU 65 HA GLU 65 -16.120 -6.121 6.595 1297 HB2 GLU 65 HB2 GLU 65 -18.603 -5.880 8.347 1298 HB3 GLU 65 HB3 GLU 65 -18.120 -7.280 7.392 1299 HG2 GLU 65 HG2 GLU 65 -16.149 -7.600 8.833 1300 HG3 GLU 65 HG3 GLU 65 -16.599 -6.182 9.782 1301 H GLN 66 H GLN 66 -18.318 -3.426 7.188 1302 HA GLN 66 HA GLN 66 -19.958 -3.705 4.872 1303 HB2 GLN 66 HB2 GLN 66 -20.580 -2.358 6.897 1304 HB3 GLN 66 HB3 GLN 66 -19.331 -1.189 6.484 1305 HG2 GLN 66 HG2 GLN 66 -20.527 -0.723 4.339 1306 HG3 GLN 66 HG3 GLN 66 -21.807 -1.830 4.840 1307 HE21 GLN 66 HE21 GLN 66 -22.045 0.986 4.218 1308 HE22 GLN 66 HE22 GLN 66 -22.639 1.763 5.643 1309 H MET 67 H MET 67 -16.968 -1.933 5.588 1310 HA MET 67 HA MET 67 -16.697 -0.551 3.128 1311 HB2 MET 67 HB2 MET 67 -14.585 -1.377 5.167 1312 HB3 MET 67 HB3 MET 67 -14.285 -0.289 3.814 1313 HG2 MET 67 HG2 MET 67 -16.234 0.229 6.075 1314 HG3 MET 67 HG3 MET 67 -14.625 0.940 5.910 1315 HE1 MET 67 HE1 MET 67 -15.876 3.374 6.208 1316 HE2 MET 67 HE2 MET 67 -17.456 2.589 6.248 1317 HE3 MET 67 HE3 MET 67 -17.157 3.918 5.128 1318 H ILE 68 H ILE 68 -15.620 -3.737 4.233 1319 HA ILE 68 HA ILE 68 -14.062 -4.569 2.040 1320 HB ILE 68 HB ILE 68 -15.752 -6.200 3.998 1321 HG12 ILE 68 HG12 ILE 68 -12.730 -5.758 3.938 1322 HG13 ILE 68 HG13 ILE 68 -13.846 -4.912 5.002 1323 HG21 ILE 68 HG21 ILE 68 -13.685 -7.264 2.036 1324 HG22 ILE 68 HG22 ILE 68 -15.422 -7.561 1.981 1325 HG23 ILE 68 HG23 ILE 68 -14.461 -8.208 3.310 1326 HD11 ILE 68 HD11 ILE 68 -12.727 -6.678 6.194 1327 HD12 ILE 68 HD12 ILE 68 -13.265 -7.875 5.018 1328 HD13 ILE 68 HD13 ILE 68 -14.442 -7.062 6.054 1329 H SER 69 H SER 69 -17.514 -5.141 2.767 1330 HA SER 69 HA SER 69 -18.121 -6.601 0.426 1331 HB2 SER 69 HB2 SER 69 -19.989 -5.058 2.265 1332 HB3 SER 69 HB3 SER 69 -20.466 -6.332 1.133 1333 HG SER 69 HG SER 69 -18.524 -7.322 2.636 1334 H GLN 70 H GLN 70 -18.152 -3.149 1.142 1335 HA GLN 70 HA GLN 70 -19.720 -2.297 -1.080 1336 HB2 GLN 70 HB2 GLN 70 -19.266 -0.977 1.059 1337 HB3 GLN 70 HB3 GLN 70 -17.647 -0.662 0.460 1338 HG2 GLN 70 HG2 GLN 70 -20.153 0.181 -1.031 1339 HG3 GLN 70 HG3 GLN 70 -19.376 1.198 0.170 1340 HE21 GLN 70 HE21 GLN 70 -16.640 0.529 -0.666 1341 HE22 GLN 70 HE22 GLN 70 -16.401 1.325 -2.175 1342 H ILE 71 H ILE 71 -16.186 -2.286 -0.437 1343 HA ILE 71 HA ILE 71 -15.483 -1.266 -2.991 1344 HB ILE 71 HB ILE 71 -14.031 -1.028 -0.957 1345 HG12 ILE 71 HG12 ILE 71 -12.774 -2.183 -3.489 1346 HG13 ILE 71 HG13 ILE 71 -13.116 -0.490 -3.153 1347 HG21 ILE 71 HG21 ILE 71 -13.234 -3.916 -1.464 1348 HG22 ILE 71 HG22 ILE 71 -14.185 -3.342 -0.095 1349 HG23 ILE 71 HG23 ILE 71 -12.509 -2.825 -0.277 1350 HD11 ILE 71 HD11 ILE 71 -11.057 -2.216 -1.807 1351 HD12 ILE 71 HD12 ILE 71 -11.427 -0.542 -1.370 1352 HD13 ILE 71 HD13 ILE 71 -10.782 -0.915 -2.966 1353 H ASP 72 H ASP 72 -15.989 -4.478 -1.771 1354 HA ASP 72 HA ASP 72 -14.695 -6.043 -3.671 1355 HB2 ASP 72 HB2 ASP 72 -15.570 -6.983 -1.611 1356 HB3 ASP 72 HB3 ASP 72 -17.216 -6.536 -2.039 1357 H LYS 73 H LYS 73 -17.782 -4.358 -3.802 1358 HA LYS 73 HA LYS 73 -18.876 -5.573 -6.133 1359 HB2 LYS 73 HB2 LYS 73 -19.426 -2.816 -4.960 1360 HB3 LYS 73 HB3 LYS 73 -20.437 -3.655 -6.137 1361 HG2 LYS 73 HG2 LYS 73 -20.938 -5.410 -4.480 1362 HG3 LYS 73 HG3 LYS 73 -19.890 -4.606 -3.306 1363 HD2 LYS 73 HD2 LYS 73 -22.248 -4.063 -2.851 1364 HD3 LYS 73 HD3 LYS 73 -21.370 -2.612 -3.343 1365 HE2 LYS 73 HE2 LYS 73 -22.301 -2.804 -5.615 1366 HE3 LYS 73 HE3 LYS 73 -23.126 -4.296 -5.164 1367 HZ1 LYS 73 HZ1 LYS 73 -24.501 -3.104 -3.653 1368 HZ2 LYS 73 HZ2 LYS 73 -24.563 -2.308 -5.144 1369 HZ3 LYS 73 HZ3 LYS 73 -23.636 -1.673 -3.884 1370 H LEU 74 H LEU 74 -16.440 -3.153 -5.704 1371 HA LEU 74 HA LEU 74 -16.747 -1.831 -8.257 1372 HB2 LEU 74 HB2 LEU 74 -14.642 -1.685 -6.066 1373 HB3 LEU 74 HB3 LEU 74 -14.397 -0.883 -7.605 1374 HG LEU 74 HG LEU 74 -15.191 0.739 -5.984 1375 HD11 LEU 74 HD11 LEU 74 -17.394 0.110 -7.969 1376 HD12 LEU 74 HD12 LEU 74 -15.936 1.054 -8.288 1377 HD13 LEU 74 HD13 LEU 74 -17.138 1.653 -7.147 1378 HD21 LEU 74 HD21 LEU 74 -17.354 0.590 -4.851 1379 HD22 LEU 74 HD22 LEU 74 -16.339 -0.790 -4.437 1380 HD23 LEU 74 HD23 LEU 74 -17.656 -0.987 -5.589 1381 H GLU 75 H GLU 75 -15.281 -1.904 -9.970 1382 HA GLU 75 HA GLU 75 -14.465 -4.490 -10.812 1383 HB2 GLU 75 HB2 GLU 75 -13.911 -1.746 -12.002 1384 HB3 GLU 75 HB3 GLU 75 -13.618 -3.276 -12.830 1385 HG2 GLU 75 HG2 GLU 75 -16.008 -3.789 -12.810 1386 HG3 GLU 75 HG3 GLU 75 -16.339 -2.330 -11.874 1387 H ASP 76 H ASP 76 -12.872 -2.089 -8.995 1388 HA ASP 76 HA ASP 76 -10.148 -2.563 -9.472 1389 HB2 ASP 76 HB2 ASP 76 -11.516 -1.864 -6.816 1390 HB3 ASP 76 HB3 ASP 76 -9.814 -1.618 -7.201 1391 H VAL 77 H VAL 77 -12.330 -3.964 -7.002 1392 HA VAL 77 HA VAL 77 -10.386 -5.982 -6.225 1393 HB VAL 77 HB VAL 77 -13.190 -5.311 -5.201 1394 HG11 VAL 77 HG11 VAL 77 -11.319 -7.479 -4.143 1395 HG12 VAL 77 HG12 VAL 77 -12.857 -7.758 -4.961 1396 HG13 VAL 77 HG13 VAL 77 -12.830 -6.962 -3.387 1397 HG21 VAL 77 HG21 VAL 77 -11.384 -3.730 -4.573 1398 HG22 VAL 77 HG22 VAL 77 -10.453 -5.066 -3.882 1399 HG23 VAL 77 HG23 VAL 77 -12.001 -4.603 -3.167 1400 H VAL 78 H VAL 78 -10.138 -7.537 -7.664 1401 HA VAL 78 HA VAL 78 -12.205 -8.773 -9.244 1402 HB VAL 78 HB VAL 78 -9.408 -9.888 -8.686 1403 HG11 VAL 78 HG11 VAL 78 -9.608 -10.961 -10.886 1404 HG12 VAL 78 HG12 VAL 78 -11.211 -10.258 -11.113 1405 HG13 VAL 78 HG13 VAL 78 -10.943 -11.456 -9.840 1406 HG21 VAL 78 HG21 VAL 78 -10.169 -7.870 -10.830 1407 HG22 VAL 78 HG22 VAL 78 -8.597 -8.659 -10.663 1408 HG23 VAL 78 HG23 VAL 78 -9.167 -7.556 -9.409 1409 H LYS 79 H LYS 79 -10.332 -9.627 -6.360 1410 HA LYS 79 HA LYS 79 -12.398 -11.514 -5.434 1411 HB2 LYS 79 HB2 LYS 79 -9.399 -12.107 -5.443 1412 HB3 LYS 79 HB3 LYS 79 -10.612 -13.083 -4.622 1413 HG2 LYS 79 HG2 LYS 79 -11.611 -13.699 -6.764 1414 HG3 LYS 79 HG3 LYS 79 -10.470 -12.654 -7.617 1415 HD2 LYS 79 HD2 LYS 79 -8.589 -14.052 -6.916 1416 HD3 LYS 79 HD3 LYS 79 -9.650 -15.034 -5.900 1417 HE2 LYS 79 HE2 LYS 79 -9.809 -14.839 -8.929 1418 HE3 LYS 79 HE3 LYS 79 -9.097 -16.170 -8.019 1419 HZ1 LYS 79 HZ1 LYS 79 -11.317 -16.718 -8.709 1420 HZ2 LYS 79 HZ2 LYS 79 -11.948 -15.346 -7.956 1421 HZ3 LYS 79 HZ3 LYS 79 -11.276 -16.588 -7.026 1422 H VAL 80 H VAL 80 -12.505 -11.654 -3.135 1423 HA VAL 80 HA VAL 80 -10.566 -10.068 -1.562 1424 HB VAL 80 HB VAL 80 -12.736 -8.752 -1.886 1425 HG11 VAL 80 HG11 VAL 80 -14.351 -10.585 -1.787 1426 HG12 VAL 80 HG12 VAL 80 -14.724 -9.358 -0.576 1427 HG13 VAL 80 HG13 VAL 80 -13.957 -10.873 -0.090 1428 HG21 VAL 80 HG21 VAL 80 -11.191 -8.221 -0.055 1429 HG22 VAL 80 HG22 VAL 80 -11.975 -9.414 0.985 1430 HG23 VAL 80 HG23 VAL 80 -12.864 -7.983 0.457 1431 H GLN 81 H GLN 81 -10.127 -10.899 0.506 1432 HA GLN 81 HA GLN 81 -11.479 -13.292 1.488 1433 HB2 GLN 81 HB2 GLN 81 -9.721 -14.179 -0.059 1434 HB3 GLN 81 HB3 GLN 81 -8.489 -13.283 0.824 1435 HG2 GLN 81 HG2 GLN 81 -8.438 -15.641 1.446 1436 HG3 GLN 81 HG3 GLN 81 -8.917 -14.661 2.830 1437 HE21 GLN 81 HE21 GLN 81 -9.996 -16.978 0.454 1438 HE22 GLN 81 HE22 GLN 81 -11.467 -17.412 1.249 1439 H ARG 82 H ARG 82 -11.295 -13.484 3.712 1440 HA ARG 82 HA ARG 82 -9.917 -11.289 5.161 1441 HB2 ARG 82 HB2 ARG 82 -12.389 -12.911 5.932 1442 HB3 ARG 82 HB3 ARG 82 -11.634 -11.678 6.940 1443 HG2 ARG 82 HG2 ARG 82 -12.184 -9.940 5.320 1444 HG3 ARG 82 HG3 ARG 82 -12.818 -11.141 4.193 1445 HD2 ARG 82 HD2 ARG 82 -14.627 -9.965 5.370 1446 HD3 ARG 82 HD3 ARG 82 -14.625 -11.686 5.762 1447 HE ARG 82 HE ARG 82 -13.145 -10.458 7.749 1448 HH11 ARG 82 HH11 ARG 82 -16.479 -10.254 6.600 1449 HH12 ARG 82 HH12 ARG 82 -17.103 -9.809 8.165 1450 HH21 ARG 82 HH21 ARG 82 -13.987 -9.896 9.778 1451 HH22 ARG 82 HH22 ARG 82 -15.694 -9.609 9.952 1452 H ASN 83 H ASN 83 -7.997 -12.139 5.722 1453 HA ASN 83 HA ASN 83 -7.790 -14.845 6.916 1454 HB2 ASN 83 HB2 ASN 83 -5.644 -13.084 5.635 1455 HB3 ASN 83 HB3 ASN 83 -5.320 -14.633 6.411 1456 HD21 ASN 83 HD21 ASN 83 -4.819 -13.838 3.671 1457 HD22 ASN 83 HD22 ASN 83 -5.690 -14.944 2.672 1458 H GLN 84 H GLN 84 -6.554 -15.119 8.813 1459 HA GLN 84 HA GLN 84 -6.391 -12.844 10.651 1460 HB2 GLN 84 HB2 GLN 84 -5.800 -15.807 11.086 1461 HB3 GLN 84 HB3 GLN 84 -5.816 -14.575 12.350 1462 HG2 GLN 84 HG2 GLN 84 -8.229 -14.164 11.887 1463 HG3 GLN 84 HG3 GLN 84 -8.191 -15.442 10.670 1464 HE21 GLN 84 HE21 GLN 84 -9.747 -16.683 11.767 1465 HE22 GLN 84 HE22 GLN 84 -9.395 -17.503 13.249 1466 H SER 85 H SER 85 -4.388 -12.364 11.812 1467 HA SER 85 HA SER 85 -2.237 -12.105 9.928 1468 HB2 SER 85 HB2 SER 85 -2.879 -10.190 11.270 1469 HB3 SER 85 HB3 SER 85 -2.530 -11.064 12.746 1470 HG SER 85 HG SER 85 -0.643 -10.167 12.537 1471 H ASP 86 H ASP 86 -0.023 -12.451 10.349 1472 HA ASP 86 HA ASP 86 0.775 -14.625 12.109 1473 HB2 ASP 86 HB2 ASP 86 -0.147 -15.844 10.175 1474 HB3 ASP 86 HB3 ASP 86 0.798 -14.862 9.063 1475 HA PRO 87 HA PRO 87 4.314 -11.811 12.191 1476 HB2 PRO 87 HB2 PRO 87 5.832 -14.244 13.138 1477 HB3 PRO 87 HB3 PRO 87 5.682 -12.638 13.890 1478 HG2 PRO 87 HG2 PRO 87 4.347 -14.694 14.903 1479 HG3 PRO 87 HG3 PRO 87 3.573 -13.095 14.787 1480 HD2 PRO 87 HD2 PRO 87 3.197 -15.504 13.008 1481 HD3 PRO 87 HD3 PRO 87 1.984 -14.370 13.650 1482 H THR 88 H THR 88 4.794 -15.056 10.774 1483 HA THR 88 HA THR 88 7.170 -14.185 9.291 1484 HB THR 88 HB THR 88 7.344 -16.605 8.620 1485 HG1 THR 88 HG1 THR 88 4.828 -16.673 9.647 1486 HG21 THR 88 HG21 THR 88 8.509 -15.810 10.654 1487 HG22 THR 88 HG22 THR 88 7.972 -17.479 10.833 1488 HG23 THR 88 HG23 THR 88 7.077 -16.177 11.621 1489 H MET 89 H MET 89 3.915 -13.969 8.730 1490 HA MET 89 HA MET 89 3.394 -15.026 6.221 1491 HB2 MET 89 HB2 MET 89 1.617 -14.094 7.614 1492 HB3 MET 89 HB3 MET 89 2.296 -12.476 7.481 1493 HG2 MET 89 HG2 MET 89 0.300 -12.784 6.048 1494 HG3 MET 89 HG3 MET 89 1.739 -12.404 5.097 1495 HE1 MET 89 HE1 MET 89 0.741 -13.241 2.822 1496 HE2 MET 89 HE2 MET 89 -0.806 -13.563 3.610 1497 HE3 MET 89 HE3 MET 89 -0.054 -14.800 2.601 1498 H PHE 90 H PHE 90 4.966 -11.962 7.046 1499 HA PHE 90 HA PHE 90 4.986 -10.719 4.528 1500 HB2 PHE 90 HB2 PHE 90 7.168 -10.479 6.660 1501 HB3 PHE 90 HB3 PHE 90 6.802 -9.303 5.403 1502 HD1 PHE 90 HD1 PHE 90 4.706 -7.935 5.543 1503 HD2 PHE 90 HD2 PHE 90 5.905 -10.543 8.724 1504 HE1 PHE 90 HE1 PHE 90 3.184 -6.773 7.090 1505 HE2 PHE 90 HE2 PHE 90 4.381 -9.375 10.256 1506 HZ PHE 90 HZ PHE 90 3.022 -7.492 9.441 1507 H ASN 91 H ASN 91 7.616 -12.517 6.113 1508 HA ASN 91 HA ASN 91 9.371 -12.687 3.928 1509 HB2 ASN 91 HB2 ASN 91 10.170 -13.033 6.190 1510 HB3 ASN 91 HB3 ASN 91 9.074 -14.386 6.438 1511 HD21 ASN 91 HD21 ASN 91 11.923 -13.336 4.629 1512 HD22 ASN 91 HD22 ASN 91 12.574 -14.923 4.408 1513 H LYS 92 H LYS 92 6.612 -14.593 4.820 1514 HA LYS 92 HA LYS 92 7.163 -17.077 3.686 1515 HB2 LYS 92 HB2 LYS 92 5.377 -16.513 5.332 1516 HB3 LYS 92 HB3 LYS 92 4.454 -15.743 4.051 1517 HG2 LYS 92 HG2 LYS 92 4.142 -17.877 2.926 1518 HG3 LYS 92 HG3 LYS 92 5.218 -18.683 4.073 1519 HD2 LYS 92 HD2 LYS 92 2.532 -17.399 4.727 1520 HD3 LYS 92 HD3 LYS 92 2.866 -19.132 4.649 1521 HE2 LYS 92 HE2 LYS 92 4.433 -18.909 6.563 1522 HE3 LYS 92 HE3 LYS 92 4.100 -17.179 6.635 1523 HZ1 LYS 92 HZ1 LYS 92 2.210 -19.394 7.189 1524 HZ2 LYS 92 HZ2 LYS 92 1.744 -17.777 7.050 1525 HZ3 LYS 92 HZ3 LYS 92 2.802 -18.241 8.280 1526 H ILE 93 H ILE 93 5.142 -14.421 2.237 1527 HA ILE 93 HA ILE 93 5.189 -15.820 -0.336 1528 HB ILE 93 HB ILE 93 3.749 -14.153 -1.266 1529 HG12 ILE 93 HG12 ILE 93 4.864 -12.115 -0.180 1530 HG13 ILE 93 HG13 ILE 93 3.116 -12.052 -0.308 1531 HG21 ILE 93 HG21 ILE 93 2.635 -15.797 0.148 1532 HG22 ILE 93 HG22 ILE 93 1.787 -14.253 0.249 1533 HG23 ILE 93 HG23 ILE 93 2.840 -14.769 1.569 1534 HD11 ILE 93 HD11 ILE 93 4.683 -12.671 2.185 1535 HD12 ILE 93 HD12 ILE 93 2.922 -12.611 2.060 1536 HD13 ILE 93 HD13 ILE 93 3.876 -11.161 1.786 1537 H ALA 94 H ALA 94 6.910 -13.231 1.245 1538 HA ALA 94 HA ALA 94 7.875 -11.854 -1.049 1539 HB1 ALA 94 HB1 ALA 94 7.744 -10.813 1.167 1540 HB2 ALA 94 HB2 ALA 94 9.376 -10.706 0.503 1541 HB3 ALA 94 HB3 ALA 94 9.009 -11.893 1.760 1542 H VAL 95 H VAL 95 9.061 -14.700 0.652 1543 HA VAL 95 HA VAL 95 11.754 -14.598 -0.245 1544 HB VAL 95 HB VAL 95 11.036 -16.000 1.685 1545 HG11 VAL 95 HG11 VAL 95 10.018 -18.222 1.350 1546 HG12 VAL 95 HG12 VAL 95 9.809 -17.868 -0.368 1547 HG13 VAL 95 HG13 VAL 95 8.939 -16.920 0.839 1548 HG21 VAL 95 HG21 VAL 95 12.514 -17.928 1.235 1549 HG22 VAL 95 HG22 VAL 95 13.205 -16.422 0.624 1550 HG23 VAL 95 HG23 VAL 95 12.462 -17.565 -0.495 1551 H PHE 96 H PHE 96 8.820 -16.042 -1.597 1552 HA PHE 96 HA PHE 96 10.209 -16.986 -3.989 1553 HB2 PHE 96 HB2 PHE 96 8.308 -18.242 -2.783 1554 HB3 PHE 96 HB3 PHE 96 7.208 -17.033 -3.439 1555 HD1 PHE 96 HD1 PHE 96 10.043 -19.160 -4.739 1556 HD2 PHE 96 HD2 PHE 96 6.030 -17.800 -5.326 1557 HE1 PHE 96 HE1 PHE 96 9.883 -20.500 -6.791 1558 HE2 PHE 96 HE2 PHE 96 5.884 -19.141 -7.377 1559 HZ PHE 96 HZ PHE 96 7.807 -20.489 -8.119 1560 H PHE 97 H PHE 97 8.453 -14.281 -2.822 1561 HA PHE 97 HA PHE 97 7.686 -12.330 -3.557 1562 HB2 PHE 97 HB2 PHE 97 9.250 -10.979 -4.946 1563 HB3 PHE 97 HB3 PHE 97 10.027 -11.807 -3.612 1564 HD1 PHE 97 HD1 PHE 97 9.599 -11.837 -7.328 1565 HD2 PHE 97 HD2 PHE 97 11.843 -13.346 -4.005 1566 HE1 PHE 97 HE1 PHE 97 11.295 -12.742 -8.872 1567 HE2 PHE 97 HE2 PHE 97 13.526 -14.248 -5.560 1568 HZ PHE 97 HZ PHE 97 13.253 -13.944 -7.990 1569 H GLN 98 H GLN 98 6.712 -14.686 -5.191 1570 HA GLN 98 HA GLN 98 5.062 -13.366 -7.032 1571 HB2 GLN 98 HB2 GLN 98 7.364 -13.148 -8.190 1572 HB3 GLN 98 HB3 GLN 98 7.343 -14.893 -8.390 1573 HG2 GLN 98 HG2 GLN 98 6.665 -13.613 -10.428 1574 HG3 GLN 98 HG3 GLN 98 5.454 -14.773 -9.875 1575 HE21 GLN 98 HE21 GLN 98 6.290 -11.365 -10.033 1576 HE22 GLN 98 HE22 GLN 98 4.692 -10.766 -9.763 Start of MODEL 12 1 H1 GLY 1 H1 GLY 1 6.058 2.722 -19.496 2 H2 GLY 1 H2 GLY 1 6.517 3.652 -18.161 3 H3 GLY 1 H3 GLY 1 6.132 2.019 -17.959 4 HA2 GLY 1 HA3 GLY 1 8.505 2.353 -17.871 5 HA3 GLY 1 HA2 GLY 1 8.032 1.358 -19.243 6 H SER 2 H SER 2 9.904 3.941 -18.313 7 HA SER 2 HA SER 2 9.828 5.517 -20.748 8 HB2 SER 2 HB2 SER 2 10.453 6.547 -18.567 9 HB3 SER 2 HB3 SER 2 11.859 5.490 -18.459 10 HG SER 2 HG SER 2 12.686 6.519 -20.318 11 H MET 3 H MET 3 11.779 2.958 -19.347 12 HA MET 3 HA MET 3 13.429 2.677 -21.785 13 HB2 MET 3 HB2 MET 3 14.399 2.707 -18.884 14 HB3 MET 3 HB3 MET 3 15.403 2.285 -20.259 15 HG2 MET 3 HG2 MET 3 14.104 4.988 -20.231 16 HG3 MET 3 HG3 MET 3 15.485 4.702 -19.180 17 HE1 MET 3 HE1 MET 3 15.677 4.784 -23.816 18 HE2 MET 3 HE2 MET 3 14.304 5.363 -22.876 19 HE3 MET 3 HE3 MET 3 14.618 3.632 -23.004 20 H GLN 4 H GLN 4 14.982 0.539 -20.894 21 HA GLN 4 HA GLN 4 13.388 -1.707 -21.366 22 HB2 GLN 4 HB2 GLN 4 15.793 -1.640 -21.841 23 HB3 GLN 4 HB3 GLN 4 16.170 -1.519 -20.129 24 HG2 GLN 4 HG2 GLN 4 16.600 -3.768 -21.019 25 HG3 GLN 4 HG3 GLN 4 15.378 -3.796 -19.755 26 HE21 GLN 4 HE21 GLN 4 15.927 -4.104 -23.215 27 HE22 GLN 4 HE22 GLN 4 14.439 -4.901 -23.581 28 H ASN 5 H ASN 5 11.804 -2.343 -20.090 29 HA ASN 5 HA ASN 5 11.882 -2.026 -17.184 30 HB2 ASN 5 HB2 ASN 5 9.405 -2.685 -17.375 31 HB3 ASN 5 HB3 ASN 5 9.876 -1.168 -18.128 32 HD21 ASN 5 HD21 ASN 5 9.743 -0.954 -20.349 33 HD22 ASN 5 HD22 ASN 5 8.986 -2.133 -21.361 34 H THR 6 H THR 6 13.618 -4.043 -18.202 35 HA THR 6 HA THR 6 12.605 -6.634 -17.541 36 HB THR 6 HB THR 6 15.468 -5.567 -17.502 37 HG1 THR 6 HG1 THR 6 13.781 -6.218 -19.516 38 HG21 THR 6 HG21 THR 6 16.188 -7.926 -17.662 39 HG22 THR 6 HG22 THR 6 14.514 -8.456 -17.507 40 HG23 THR 6 HG23 THR 6 15.308 -7.637 -16.159 41 H THR 7 H THR 7 14.326 -4.081 -15.746 42 HA THR 7 HA THR 7 13.094 -4.848 -13.237 43 HB THR 7 HB THR 7 16.147 -4.872 -13.473 44 HG1 THR 7 HG1 THR 7 14.205 -6.898 -13.303 45 HG21 THR 7 HG21 THR 7 14.388 -5.279 -11.016 46 HG22 THR 7 HG22 THR 7 15.440 -3.897 -11.316 47 HG23 THR 7 HG23 THR 7 16.145 -5.491 -11.067 48 H HIS 8 H HIS 8 15.896 -2.830 -14.362 49 HA HIS 8 HA HIS 8 15.775 -1.146 -12.116 50 HB2 HIS 8 HB2 HIS 8 17.523 0.189 -13.165 51 HB3 HIS 8 HB3 HIS 8 17.818 -1.516 -13.474 52 HD1 HIS 8 HD1 HIS 8 18.296 -2.103 -15.860 53 HD2 HIS 8 HD2 HIS 8 16.322 1.537 -15.560 54 HE1 HIS 8 HE1 HIS 8 18.245 -1.174 -18.185 55 HE2 HIS 8 HE2 HIS 8 17.207 1.101 -17.946 56 H ASP 9 H ASP 9 13.878 -0.920 -14.923 57 HA ASP 9 HA ASP 9 13.449 1.835 -15.237 58 HB2 ASP 9 HB2 ASP 9 12.854 0.169 -16.931 59 HB3 ASP 9 HB3 ASP 9 11.682 -0.565 -15.847 60 H ASN 10 H ASN 10 11.877 -0.579 -13.136 61 HA ASN 10 HA ASN 10 10.113 1.365 -11.892 62 HB2 ASN 10 HB2 ASN 10 9.265 -0.403 -10.533 63 HB3 ASN 10 HB3 ASN 10 9.522 -1.109 -12.120 64 HD21 ASN 10 HD21 ASN 10 9.251 -2.526 -9.651 65 HD22 ASN 10 HD22 ASN 10 10.715 -3.404 -9.394 66 H VAL 11 H VAL 11 10.260 1.956 -9.619 67 HA VAL 11 HA VAL 11 13.010 1.953 -8.551 68 HB VAL 11 HB VAL 11 12.832 4.264 -7.805 69 HG11 VAL 11 HG11 VAL 11 12.224 4.050 -10.771 70 HG12 VAL 11 HG12 VAL 11 13.805 3.881 -10.008 71 HG13 VAL 11 HG13 VAL 11 12.973 5.434 -9.966 72 HG21 VAL 11 HG21 VAL 11 10.397 4.477 -7.442 73 HG22 VAL 11 HG22 VAL 11 10.118 4.447 -9.183 74 HG23 VAL 11 HG23 VAL 11 10.999 5.790 -8.458 75 H ILE 12 H ILE 12 13.216 1.745 -6.442 76 HA ILE 12 HA ILE 12 10.950 0.968 -4.778 77 HB ILE 12 HB ILE 12 13.909 1.129 -4.000 78 HG12 ILE 12 HG12 ILE 12 13.623 -0.320 -6.046 79 HG13 ILE 12 HG13 ILE 12 14.247 -1.187 -4.652 80 HG21 ILE 12 HG21 ILE 12 13.324 -0.575 -2.306 81 HG22 ILE 12 HG22 ILE 12 11.638 -0.519 -2.827 82 HG23 ILE 12 HG23 ILE 12 12.385 0.905 -2.101 83 HD11 ILE 12 HD11 ILE 12 11.434 -1.283 -5.723 84 HD12 ILE 12 HD12 ILE 12 11.992 -2.116 -4.272 85 HD13 ILE 12 HD13 ILE 12 12.664 -2.539 -5.845 86 H LEU 13 H LEU 13 9.895 2.967 -4.514 87 HA LEU 13 HA LEU 13 11.344 5.270 -3.426 88 HB2 LEU 13 HB2 LEU 13 9.527 5.393 -5.275 89 HB3 LEU 13 HB3 LEU 13 8.355 5.091 -4.009 90 HG LEU 13 HG LEU 13 8.564 7.513 -4.644 91 HD11 LEU 13 HD11 LEU 13 8.624 8.488 -2.410 92 HD12 LEU 13 HD12 LEU 13 9.366 7.026 -1.760 93 HD13 LEU 13 HD13 LEU 13 7.722 6.974 -2.397 94 HD21 LEU 13 HD21 LEU 13 10.534 8.808 -4.006 95 HD22 LEU 13 HD22 LEU 13 10.956 7.551 -5.164 96 HD23 LEU 13 HD23 LEU 13 11.345 7.339 -3.454 97 H GLU 14 H GLU 14 11.859 4.776 -1.338 98 HA GLU 14 HA GLU 14 9.828 3.765 0.524 99 HB2 GLU 14 HB2 GLU 14 12.158 2.857 0.604 100 HB3 GLU 14 HB3 GLU 14 12.775 4.466 0.966 101 HG2 GLU 14 HG2 GLU 14 11.240 4.400 3.039 102 HG3 GLU 14 HG3 GLU 14 11.071 2.676 2.720 103 H LEU 15 H LEU 15 8.419 5.414 0.998 104 HA LEU 15 HA LEU 15 9.588 7.861 2.186 105 HB2 LEU 15 HB2 LEU 15 7.126 8.671 2.145 106 HB3 LEU 15 HB3 LEU 15 8.045 8.627 0.657 107 HG LEU 15 HG LEU 15 6.864 6.307 0.266 108 HD11 LEU 15 HD11 LEU 15 4.867 7.521 2.179 109 HD12 LEU 15 HD12 LEU 15 5.819 6.058 2.447 110 HD13 LEU 15 HD13 LEU 15 4.617 6.097 1.162 111 HD21 LEU 15 HD21 LEU 15 6.519 8.244 -1.166 112 HD22 LEU 15 HD22 LEU 15 5.319 8.898 -0.048 113 HD23 LEU 15 HD23 LEU 15 5.005 7.385 -0.908 114 H THR 16 H THR 16 9.869 7.841 4.244 115 HA THR 16 HA THR 16 8.492 6.049 6.076 116 HB THR 16 HB THR 16 10.578 8.237 6.564 117 HG1 THR 16 HG1 THR 16 11.269 6.354 5.374 118 HG21 THR 16 HG21 THR 16 10.856 7.264 8.805 119 HG22 THR 16 HG22 THR 16 9.562 6.108 8.489 120 HG23 THR 16 HG23 THR 16 9.200 7.834 8.590 121 H VAL 17 H VAL 17 6.441 6.680 6.447 122 HA VAL 17 HA VAL 17 5.864 9.512 7.092 123 HB VAL 17 HB VAL 17 3.620 9.200 6.420 124 HG11 VAL 17 HG11 VAL 17 5.349 7.747 4.388 125 HG12 VAL 17 HG12 VAL 17 5.145 9.498 4.532 126 HG13 VAL 17 HG13 VAL 17 3.778 8.491 4.051 127 HG21 VAL 17 HG21 VAL 17 4.103 6.203 6.221 128 HG22 VAL 17 HG22 VAL 17 2.625 7.017 5.710 129 HG23 VAL 17 HG23 VAL 17 3.094 7.029 7.409 130 H ARG 18 H ARG 18 4.754 9.959 8.991 131 HA ARG 18 HA ARG 18 4.381 7.739 10.894 132 HB2 ARG 18 HB2 ARG 18 3.953 9.506 12.562 133 HB3 ARG 18 HB3 ARG 18 5.524 9.669 11.792 134 HG2 ARG 18 HG2 ARG 18 4.516 11.468 10.326 135 HG3 ARG 18 HG3 ARG 18 3.066 11.378 11.336 136 HD2 ARG 18 HD2 ARG 18 5.871 12.116 12.229 137 HD3 ARG 18 HD3 ARG 18 4.476 13.189 12.139 138 HE ARG 18 HE ARG 18 3.993 10.956 13.870 139 HH11 ARG 18 HH11 ARG 18 5.621 14.087 13.821 140 HH12 ARG 18 HH12 ARG 18 5.530 14.284 15.539 141 HH21 ARG 18 HH21 ARG 18 3.889 11.220 16.098 142 HH22 ARG 18 HH22 ARG 18 4.543 12.649 16.846 143 H ASN 19 H ASN 19 2.223 7.519 11.938 144 HA ASN 19 HA ASN 19 0.422 7.219 9.695 145 HB2 ASN 19 HB2 ASN 19 0.960 5.402 11.445 146 HB3 ASN 19 HB3 ASN 19 -0.127 6.255 12.536 147 HD21 ASN 19 HD21 ASN 19 -0.380 3.530 11.409 148 HD22 ASN 19 HD22 ASN 19 -1.873 3.497 10.552 149 H HIS 20 H HIS 20 -0.017 9.466 9.415 150 HA HIS 20 HA HIS 20 -1.926 10.871 11.060 151 HB2 HIS 20 HB2 HIS 20 -0.943 11.278 8.191 152 HB3 HIS 20 HB3 HIS 20 -2.130 12.326 8.934 153 HD1 HIS 20 HD1 HIS 20 -1.234 14.273 10.193 154 HD2 HIS 20 HD2 HIS 20 1.660 11.400 9.507 155 HE1 HIS 20 HE1 HIS 20 0.920 15.323 10.914 156 HE2 HIS 20 HE2 HIS 20 2.677 13.623 10.336 157 HA PRO 21 HA PRO 21 -5.845 9.178 9.509 158 HB2 PRO 21 HB2 PRO 21 -6.518 12.008 8.654 159 HB3 PRO 21 HB3 PRO 21 -7.484 10.848 9.597 160 HG2 PRO 21 HG2 PRO 21 -6.265 12.836 10.836 161 HG3 PRO 21 HG3 PRO 21 -6.265 11.209 11.560 162 HD2 PRO 21 HD2 PRO 21 -4.051 12.628 10.102 163 HD3 PRO 21 HD3 PRO 21 -3.971 11.575 11.530 164 H GLY 22 H GLY 22 -5.116 7.963 7.795 165 HA2 GLY 22 HA2 GLY 22 -5.413 7.169 5.674 166 HA3 GLY 22 HA3 GLY 22 -6.237 8.663 5.272 167 H VAL 23 H VAL 23 -2.836 8.081 6.328 168 HA VAL 23 HA VAL 23 -1.695 9.779 4.365 169 HB VAL 23 HB VAL 23 -0.152 7.402 5.498 170 HG11 VAL 23 HG11 VAL 23 1.781 8.927 5.268 171 HG12 VAL 23 HG12 VAL 23 0.720 10.196 4.657 172 HG13 VAL 23 HG13 VAL 23 0.952 8.712 3.726 173 HG21 VAL 23 HG21 VAL 23 -1.218 8.481 7.419 174 HG22 VAL 23 HG22 VAL 23 -0.589 10.049 6.911 175 HG23 VAL 23 HG23 VAL 23 0.524 8.773 7.416 176 H MET 24 H MET 24 -2.554 6.402 4.350 177 HA MET 24 HA MET 24 -1.204 5.447 2.093 178 HB2 MET 24 HB2 MET 24 -4.007 4.601 2.928 179 HB3 MET 24 HB3 MET 24 -2.825 3.643 2.047 180 HG2 MET 24 HG2 MET 24 -2.834 2.754 4.226 181 HG3 MET 24 HG3 MET 24 -1.385 3.756 4.173 182 HE1 MET 24 HE1 MET 24 -5.301 4.964 6.340 183 HE2 MET 24 HE2 MET 24 -5.077 3.420 5.515 184 HE3 MET 24 HE3 MET 24 -5.182 4.914 4.581 185 H THR 25 H THR 25 -4.191 7.294 2.416 186 HA THR 25 HA THR 25 -4.986 7.175 -0.339 187 HB THR 25 HB THR 25 -5.946 9.263 1.660 188 HG1 THR 25 HG1 THR 25 -7.167 6.720 1.448 189 HG21 THR 25 HG21 THR 25 -7.377 7.777 -0.595 190 HG22 THR 25 HG22 THR 25 -6.809 9.448 -0.674 191 HG23 THR 25 HG23 THR 25 -8.095 9.009 0.449 192 H HIS 26 H HIS 26 -3.002 9.312 1.602 193 HA HIS 26 HA HIS 26 -2.890 11.538 -0.205 194 HB2 HIS 26 HB2 HIS 26 -0.910 10.755 1.986 195 HB3 HIS 26 HB3 HIS 26 -1.001 12.328 1.196 196 HD1 HIS 26 HD1 HIS 26 -1.200 12.468 4.128 197 HD2 HIS 26 HD2 HIS 26 -4.562 11.744 1.819 198 HE1 HIS 26 HE1 HIS 26 -3.153 13.087 5.583 199 HE2 HIS 26 HE2 HIS 26 -5.156 12.824 4.083 200 H VAL 27 H VAL 27 -0.710 8.805 0.492 201 HA VAL 27 HA VAL 27 1.345 9.588 -1.296 202 HB VAL 27 HB VAL 27 2.413 7.435 -0.860 203 HG11 VAL 27 HG11 VAL 27 1.165 8.560 1.679 204 HG12 VAL 27 HG12 VAL 27 2.629 9.140 0.884 205 HG13 VAL 27 HG13 VAL 27 2.603 7.534 1.607 206 HG21 VAL 27 HG21 VAL 27 -0.149 6.551 0.535 207 HG22 VAL 27 HG22 VAL 27 1.371 5.651 0.505 208 HG23 VAL 27 HG23 VAL 27 0.476 5.916 -0.989 209 H CYS 28 H CYS 28 -1.356 7.270 -1.575 210 HA CYS 28 HA CYS 28 -0.700 6.347 -4.201 211 HB2 CYS 28 HB2 CYS 28 -2.953 5.383 -4.208 212 HB3 CYS 28 HB3 CYS 28 -2.193 5.111 -2.639 213 HG CYS 28 HG CYS 28 -4.144 6.012 -1.322 214 H GLY 29 H GLY 29 -2.500 9.064 -2.910 215 HA2 GLY 29 HA2 GLY 29 -3.904 10.017 -5.116 216 HA3 GLY 29 HA3 GLY 29 -3.238 11.014 -3.829 217 H LEU 30 H LEU 30 -0.538 10.760 -4.123 218 HA LEU 30 HA LEU 30 0.075 12.422 -6.359 219 HB2 LEU 30 HB2 LEU 30 1.789 10.994 -4.317 220 HB3 LEU 30 HB3 LEU 30 2.553 11.742 -5.709 221 HG LEU 30 HG LEU 30 2.699 13.282 -3.864 222 HD11 LEU 30 HD11 LEU 30 1.622 15.287 -4.765 223 HD12 LEU 30 HD12 LEU 30 0.576 14.293 -5.781 224 HD13 LEU 30 HD13 LEU 30 2.318 14.308 -6.054 225 HD21 LEU 30 HD21 LEU 30 -0.319 13.153 -3.556 226 HD22 LEU 30 HD22 LEU 30 0.785 14.190 -2.648 227 HD23 LEU 30 HD23 LEU 30 0.867 12.441 -2.457 228 H PHE 31 H PHE 31 0.998 9.008 -5.749 229 HA PHE 31 HA PHE 31 2.490 8.734 -8.140 230 HB2 PHE 31 HB2 PHE 31 1.365 6.692 -6.203 231 HB3 PHE 31 HB3 PHE 31 2.335 6.221 -7.598 232 HD1 PHE 31 HD2 PHE 31 2.482 8.540 -4.632 233 HD2 PHE 31 HD1 PHE 31 4.678 6.091 -7.349 234 HE1 PHE 31 HE2 PHE 31 4.524 8.958 -3.347 235 HE2 PHE 31 HE1 PHE 31 6.729 6.524 -6.066 236 HZ PHE 31 HZ PHE 31 6.648 7.955 -4.064 237 H ALA 32 H ALA 32 -0.904 8.121 -7.499 238 HA ALA 32 HA ALA 32 -1.459 6.628 -9.891 239 HB1 ALA 32 HB1 ALA 32 -2.881 6.432 -7.890 240 HB2 ALA 32 HB2 ALA 32 -3.825 6.940 -9.290 241 HB3 ALA 32 HB3 ALA 32 -3.365 8.124 -8.059 242 H ARG 33 H ARG 33 -1.702 10.070 -8.964 243 HA ARG 33 HA ARG 33 -3.322 10.853 -11.206 244 HB2 ARG 33 HB2 ARG 33 -3.221 13.077 -10.349 245 HB3 ARG 33 HB3 ARG 33 -3.255 12.021 -8.943 246 HG2 ARG 33 HG2 ARG 33 -0.754 12.287 -8.773 247 HG3 ARG 33 HG3 ARG 33 -0.839 13.470 -10.072 248 HD2 ARG 33 HD2 ARG 33 -2.207 13.686 -7.375 249 HD3 ARG 33 HD3 ARG 33 -0.743 14.550 -7.862 250 HE ARG 33 HE ARG 33 -2.589 15.235 -9.760 251 HH11 ARG 33 HH11 ARG 33 -2.508 15.495 -6.261 252 HH12 ARG 33 HH12 ARG 33 -3.517 16.900 -6.217 253 HH21 ARG 33 HH21 ARG 33 -3.920 17.065 -9.706 254 HH22 ARG 33 HH22 ARG 33 -4.323 17.798 -8.188 255 H ARG 34 H ARG 34 -0.001 10.147 -11.010 256 HA ARG 34 HA ARG 34 1.201 12.111 -12.589 257 HB2 ARG 34 HB2 ARG 34 2.255 10.193 -11.192 258 HB3 ARG 34 HB3 ARG 34 1.972 9.169 -12.591 259 HG2 ARG 34 HG2 ARG 34 3.312 10.978 -13.906 260 HG3 ARG 34 HG3 ARG 34 3.846 11.523 -12.314 261 HD2 ARG 34 HD2 ARG 34 5.524 10.033 -12.978 262 HD3 ARG 34 HD3 ARG 34 4.511 9.035 -11.928 263 HE ARG 34 HE ARG 34 3.867 8.958 -14.763 264 HH11 ARG 34 HH11 ARG 34 5.668 7.417 -12.180 265 HH12 ARG 34 HH12 ARG 34 5.846 5.923 -13.041 266 HH21 ARG 34 HH21 ARG 34 4.209 7.051 -15.914 267 HH22 ARG 34 HH22 ARG 34 5.019 5.719 -15.154 268 H ALA 35 H ALA 35 0.296 8.820 -13.552 269 HA ALA 35 HA ALA 35 -1.093 9.296 -15.908 270 HB1 ALA 35 HB1 ALA 35 0.992 10.243 -16.822 271 HB2 ALA 35 HB2 ALA 35 0.597 8.738 -17.652 272 HB3 ALA 35 HB3 ALA 35 1.866 8.765 -16.420 273 H PHE 36 H PHE 36 1.496 7.277 -14.597 274 HA PHE 36 HA PHE 36 -0.055 4.809 -15.065 275 HB2 PHE 36 HB2 PHE 36 2.250 4.847 -16.001 276 HB3 PHE 36 HB3 PHE 36 2.903 5.210 -14.406 277 HD1 PHE 36 HD1 PHE 36 0.529 2.639 -15.840 278 HD2 PHE 36 HD2 PHE 36 4.002 3.370 -13.447 279 HE1 PHE 36 HE1 PHE 36 0.749 0.228 -15.412 280 HE2 PHE 36 HE2 PHE 36 4.214 0.959 -13.024 281 HZ PHE 36 HZ PHE 36 2.589 -0.617 -14.004 282 H ASN 37 H ASN 37 -0.379 3.382 -13.347 283 HA ASN 37 HA ASN 37 -0.664 4.528 -10.693 284 HB2 ASN 37 HB2 ASN 37 -1.258 1.733 -11.784 285 HB3 ASN 37 HB3 ASN 37 -1.766 2.334 -10.208 286 HD21 ASN 37 HD21 ASN 37 -3.202 1.458 -12.765 287 HD22 ASN 37 HD22 ASN 37 -4.366 2.697 -13.028 288 H VAL 38 H VAL 38 -0.155 2.338 -9.028 289 HA VAL 38 HA VAL 38 2.780 2.114 -9.114 290 HB VAL 38 HB VAL 38 0.903 1.303 -6.831 291 HG11 VAL 38 HG11 VAL 38 3.920 1.729 -6.883 292 HG12 VAL 38 HG12 VAL 38 3.089 0.177 -6.754 293 HG13 VAL 38 HG13 VAL 38 2.963 1.353 -5.446 294 HG21 VAL 38 HG21 VAL 38 1.572 3.415 -5.724 295 HG22 VAL 38 HG22 VAL 38 0.720 3.723 -7.237 296 HG23 VAL 38 HG23 VAL 38 2.477 3.888 -7.166 297 H GLU 39 H GLU 39 3.814 0.186 -9.246 298 HA GLU 39 HA GLU 39 2.467 -2.092 -10.390 299 HB2 GLU 39 HB2 GLU 39 4.642 -1.369 -11.243 300 HB3 GLU 39 HB3 GLU 39 5.359 -1.471 -9.639 301 HG2 GLU 39 HG2 GLU 39 4.903 -3.983 -9.743 302 HG3 GLU 39 HG3 GLU 39 4.517 -3.751 -11.448 303 H GLY 40 H GLY 40 4.499 -1.489 -7.499 304 HA2 GLY 40 HA2 GLY 40 3.113 -3.651 -5.999 305 HA3 GLY 40 HA3 GLY 40 4.866 -3.704 -6.171 306 H ILE 41 H ILE 41 3.297 -3.459 -3.708 307 HA ILE 41 HA ILE 41 4.449 -0.945 -2.638 308 HB ILE 41 HB ILE 41 1.586 -1.886 -2.017 309 HG12 ILE 41 HG12 ILE 41 2.485 0.597 -3.554 310 HG13 ILE 41 HG13 ILE 41 1.729 -0.825 -4.261 311 HG21 ILE 41 HG21 ILE 41 1.354 0.171 -0.658 312 HG22 ILE 41 HG22 ILE 41 3.039 0.587 -0.981 313 HG23 ILE 41 HG23 ILE 41 2.651 -0.853 -0.040 314 HD11 ILE 41 HD11 ILE 41 0.445 1.086 -2.315 315 HD12 ILE 41 HD12 ILE 41 -0.321 -0.351 -3.000 316 HD13 ILE 41 HD13 ILE 41 0.152 0.985 -4.049 317 H LEU 42 H LEU 42 5.103 -1.110 -0.486 318 HA LEU 42 HA LEU 42 4.281 -3.370 1.169 319 HB2 LEU 42 HB2 LEU 42 6.351 -4.197 0.120 320 HB3 LEU 42 HB3 LEU 42 7.210 -2.742 0.587 321 HG LEU 42 HG LEU 42 7.157 -3.379 2.935 322 HD11 LEU 42 HD11 LEU 42 4.932 -4.434 3.018 323 HD12 LEU 42 HD12 LEU 42 6.169 -5.433 3.767 324 HD13 LEU 42 HD13 LEU 42 5.568 -5.836 2.162 325 HD21 LEU 42 HD21 LEU 42 7.976 -5.766 1.254 326 HD22 LEU 42 HD22 LEU 42 8.540 -5.384 2.884 327 HD23 LEU 42 HD23 LEU 42 8.949 -4.324 1.541 328 H CYS 43 H CYS 43 4.467 -2.845 3.406 329 HA CYS 43 HA CYS 43 5.317 -0.185 4.209 330 HB2 CYS 43 HB2 CYS 43 3.052 0.258 3.439 331 HB3 CYS 43 HB3 CYS 43 2.424 -1.135 4.309 332 HG CYS 43 HG CYS 43 3.726 1.639 5.824 333 H LEU 44 H LEU 44 6.694 -0.938 5.704 334 HA LEU 44 HA LEU 44 5.917 -2.971 7.676 335 HB2 LEU 44 HB2 LEU 44 8.515 -1.792 6.746 336 HB3 LEU 44 HB3 LEU 44 8.455 -2.248 8.437 337 HG LEU 44 HG LEU 44 8.164 -4.560 7.939 338 HD11 LEU 44 HD11 LEU 44 7.631 -3.854 5.049 339 HD12 LEU 44 HD12 LEU 44 6.462 -4.457 6.227 340 HD13 LEU 44 HD13 LEU 44 7.788 -5.490 5.703 341 HD21 LEU 44 HD21 LEU 44 10.098 -5.133 6.538 342 HD22 LEU 44 HD22 LEU 44 10.468 -3.783 7.604 343 HD23 LEU 44 HD23 LEU 44 10.141 -3.486 5.895 344 HA PRO 45 HA PRO 45 4.674 0.577 10.317 345 HB2 PRO 45 HB2 PRO 45 3.478 -0.983 12.266 346 HB3 PRO 45 HB3 PRO 45 2.669 -0.536 10.753 347 HG2 PRO 45 HG2 PRO 45 4.062 -3.098 11.450 348 HG3 PRO 45 HG3 PRO 45 2.507 -2.846 10.619 349 HD2 PRO 45 HD2 PRO 45 4.769 -3.407 9.248 350 HD3 PRO 45 HD3 PRO 45 3.514 -2.341 8.588 351 H ILE 46 H ILE 46 6.329 1.438 11.390 352 HA ILE 46 HA ILE 46 8.377 -0.012 12.739 353 HB ILE 46 HB ILE 46 7.701 2.965 12.924 354 HG12 ILE 46 HG12 ILE 46 8.077 2.393 10.585 355 HG13 ILE 46 HG13 ILE 46 9.492 3.256 11.167 356 HG21 ILE 46 HG21 ILE 46 10.071 3.270 13.576 357 HG22 ILE 46 HG22 ILE 46 10.285 1.518 13.599 358 HG23 ILE 46 HG23 ILE 46 9.182 2.287 14.742 359 HD11 ILE 46 HD11 ILE 46 9.266 0.273 10.724 360 HD12 ILE 46 HD12 ILE 46 10.687 1.100 11.368 361 HD13 ILE 46 HD13 ILE 46 10.143 1.431 9.725 362 H GLN 47 H GLN 47 8.069 -1.025 14.595 363 HA GLN 47 HA GLN 47 5.894 -0.469 16.419 364 HB2 GLN 47 HB2 GLN 47 6.768 -2.408 17.694 365 HB3 GLN 47 HB3 GLN 47 6.563 -2.766 15.994 366 HG2 GLN 47 HG2 GLN 47 9.048 -2.320 15.703 367 HG3 GLN 47 HG3 GLN 47 9.156 -2.293 17.460 368 HE21 GLN 47 HE21 GLN 47 8.606 -4.281 14.644 369 HE22 GLN 47 HE22 GLN 47 8.781 -5.808 15.430 370 H ASP 48 H ASP 48 9.083 0.648 16.104 371 HA ASP 48 HA ASP 48 9.820 1.096 18.790 372 HB2 ASP 48 HB2 ASP 48 11.565 1.121 17.160 373 HB3 ASP 48 HB3 ASP 48 10.706 2.249 16.125 374 H SER 49 H SER 49 8.112 3.049 16.406 375 HA SER 49 HA SER 49 6.907 4.812 18.367 376 HB2 SER 49 HB2 SER 49 7.810 6.906 17.260 377 HB3 SER 49 HB3 SER 49 9.050 5.968 18.094 378 HG SER 49 HG SER 49 9.690 5.119 16.107 379 H ASP 50 H ASP 50 5.431 6.464 17.122 380 HA ASP 50 HA ASP 50 3.831 4.994 15.261 381 HB2 ASP 50 HB2 ASP 50 2.413 7.054 15.130 382 HB3 ASP 50 HB3 ASP 50 2.692 6.504 16.773 383 H LYS 51 H LYS 51 5.398 4.514 13.672 384 HA LYS 51 HA LYS 51 5.443 6.406 11.452 385 HB2 LYS 51 HB2 LYS 51 8.001 5.071 12.478 386 HB3 LYS 51 HB3 LYS 51 7.859 5.919 10.944 387 HG2 LYS 51 HG2 LYS 51 7.401 8.031 12.186 388 HG3 LYS 51 HG3 LYS 51 7.634 7.158 13.706 389 HD2 LYS 51 HD2 LYS 51 9.974 6.571 12.919 390 HD3 LYS 51 HD3 LYS 51 9.713 7.629 11.527 391 HE2 LYS 51 HE2 LYS 51 10.961 8.807 13.257 392 HE3 LYS 51 HE3 LYS 51 9.367 9.540 13.075 393 HZ1 LYS 51 HZ1 LYS 51 10.126 7.587 15.187 394 HZ2 LYS 51 HZ2 LYS 51 8.631 8.358 15.029 395 HZ3 LYS 51 HZ3 LYS 51 10.007 9.263 15.399 396 H SER 52 H SER 52 6.215 5.274 9.470 397 HA SER 52 HA SER 52 6.343 2.425 9.335 398 HB2 SER 52 HB2 SER 52 3.847 2.838 9.454 399 HB3 SER 52 HB3 SER 52 3.968 3.782 7.966 400 HG SER 52 HG SER 52 3.483 1.334 7.969 401 H HIS 53 H HIS 53 7.491 1.852 7.487 402 HA HIS 53 HA HIS 53 8.173 4.017 5.550 403 HB2 HIS 53 HB2 HIS 53 9.542 1.329 6.087 404 HB3 HIS 53 HB3 HIS 53 10.026 2.456 4.828 405 HD1 HIS 53 HD1 HIS 53 12.318 3.038 5.694 406 HD2 HIS 53 HD2 HIS 53 9.385 3.503 8.591 407 HE1 HIS 53 HE1 HIS 53 13.472 4.109 7.647 408 HE2 HIS 53 HE2 HIS 53 11.722 4.190 9.450 409 H ILE 54 H ILE 54 7.264 3.897 3.549 410 HA ILE 54 HA ILE 54 5.973 1.361 2.723 411 HB ILE 54 HB ILE 54 5.044 4.174 1.940 412 HG12 ILE 54 HG12 ILE 54 2.906 3.510 3.237 413 HG13 ILE 54 HG13 ILE 54 3.855 2.224 3.965 414 HG21 ILE 54 HG21 ILE 54 4.634 2.515 0.172 415 HG22 ILE 54 HG22 ILE 54 3.115 3.043 0.890 416 HG23 ILE 54 HG23 ILE 54 3.793 1.471 1.321 417 HD11 ILE 54 HD11 ILE 54 4.409 5.177 4.198 418 HD12 ILE 54 HD12 ILE 54 5.320 3.884 4.981 419 HD13 ILE 54 HD13 ILE 54 3.636 4.164 5.415 420 H TRP 55 H TRP 55 7.047 0.439 1.117 421 HA TRP 55 HA TRP 55 8.732 1.956 -0.750 422 HB2 TRP 55 HB2 TRP 55 8.386 -1.053 -0.330 423 HB3 TRP 55 HB3 TRP 55 9.543 -0.310 -1.436 424 HD1 TRP 55 HD1 TRP 55 11.766 0.697 -0.370 425 HE1 TRP 55 HE1 TRP 55 12.835 0.533 1.947 426 HE3 TRP 55 HE3 TRP 55 7.805 -1.207 2.230 427 HZ2 TRP 55 HZ2 TRP 55 12.135 -0.286 4.529 428 HZ3 TRP 55 HZ3 TRP 55 8.089 -1.659 4.629 429 HH2 TRP 55 HH2 TRP 55 10.213 -1.208 5.758 430 H LEU 56 H LEU 56 7.507 2.816 -2.366 431 HA LEU 56 HA LEU 56 5.480 1.181 -3.734 432 HB2 LEU 56 HB2 LEU 56 6.135 4.132 -4.168 433 HB3 LEU 56 HB3 LEU 56 4.810 3.238 -4.892 434 HG LEU 56 HG LEU 56 4.080 2.853 -2.351 435 HD11 LEU 56 HD11 LEU 56 6.058 3.852 -1.336 436 HD12 LEU 56 HD12 LEU 56 4.605 4.739 -0.886 437 HD13 LEU 56 HD13 LEU 56 5.700 5.405 -2.101 438 HD21 LEU 56 HD21 LEU 56 2.707 4.016 -4.022 439 HD22 LEU 56 HD22 LEU 56 3.612 5.508 -3.753 440 HD23 LEU 56 HD23 LEU 56 2.628 4.822 -2.456 441 H LEU 57 H LEU 57 6.218 0.001 -5.323 442 HA LEU 57 HA LEU 57 8.523 0.639 -6.952 443 HB2 LEU 57 HB2 LEU 57 6.655 -1.751 -6.806 444 HB3 LEU 57 HB3 LEU 57 7.749 -1.550 -8.166 445 HG LEU 57 HG LEU 57 9.687 -1.584 -6.592 446 HD11 LEU 57 HD11 LEU 57 8.610 -0.807 -4.536 447 HD12 LEU 57 HD12 LEU 57 9.426 -2.346 -4.285 448 HD13 LEU 57 HD13 LEU 57 7.667 -2.300 -4.441 449 HD21 LEU 57 HD21 LEU 57 9.604 -4.019 -6.157 450 HD22 LEU 57 HD22 LEU 57 9.039 -3.605 -7.777 451 HD23 LEU 57 HD23 LEU 57 7.872 -4.015 -6.516 452 H VAL 58 H VAL 58 8.222 2.099 -8.434 453 HA VAL 58 HA VAL 58 6.033 1.889 -10.399 454 HB VAL 58 HB VAL 58 5.204 3.468 -8.631 455 HG11 VAL 58 HG11 VAL 58 7.316 4.318 -7.783 456 HG12 VAL 58 HG12 VAL 58 6.285 5.660 -8.276 457 HG13 VAL 58 HG13 VAL 58 7.629 5.159 -9.308 458 HG21 VAL 58 HG21 VAL 58 4.569 5.355 -10.114 459 HG22 VAL 58 HG22 VAL 58 4.427 3.807 -10.946 460 HG23 VAL 58 HG23 VAL 58 5.804 4.861 -11.279 461 H ASN 59 H ASN 59 6.651 2.858 -12.422 462 HA ASN 59 HA ASN 59 9.492 2.948 -12.827 463 HB2 ASN 59 HB2 ASN 59 8.837 3.522 -15.228 464 HB3 ASN 59 HB3 ASN 59 8.324 1.969 -14.595 465 HD21 ASN 59 HD21 ASN 59 6.689 1.731 -16.030 466 HD22 ASN 59 HD22 ASN 59 5.238 2.669 -15.985 467 H ASP 60 H ASP 60 10.804 4.608 -12.793 468 HA ASP 60 HA ASP 60 10.212 7.141 -11.825 469 HB2 ASP 60 HB2 ASP 60 12.431 6.191 -11.617 470 HB3 ASP 60 HB3 ASP 60 12.648 6.170 -13.357 471 H ASP 61 H ASP 61 9.633 9.029 -12.684 472 HA ASP 61 HA ASP 61 9.775 9.567 -15.558 473 HB2 ASP 61 HB2 ASP 61 7.599 8.580 -15.427 474 HB3 ASP 61 HB3 ASP 61 7.221 9.370 -13.904 475 H GLN 62 H GLN 62 9.350 11.816 -16.020 476 HA GLN 62 HA GLN 62 10.863 13.645 -14.583 477 HB2 GLN 62 HB2 GLN 62 8.564 14.278 -16.493 478 HB3 GLN 62 HB3 GLN 62 9.904 15.354 -16.089 479 HG2 GLN 62 HG2 GLN 62 11.488 13.879 -17.218 480 HG3 GLN 62 HG3 GLN 62 10.218 12.686 -17.500 481 HE21 GLN 62 HE21 GLN 62 8.642 13.112 -19.076 482 HE22 GLN 62 HE22 GLN 62 8.859 14.312 -20.299 483 H ARG 63 H ARG 63 7.371 13.146 -14.556 484 HA ARG 63 HA ARG 63 6.820 15.407 -12.807 485 HB2 ARG 63 HB2 ARG 63 4.872 13.296 -13.835 486 HB3 ARG 63 HB3 ARG 63 4.443 14.788 -13.009 487 HG2 ARG 63 HG2 ARG 63 3.996 15.247 -15.275 488 HG3 ARG 63 HG3 ARG 63 5.562 16.015 -15.004 489 HD2 ARG 63 HD2 ARG 63 6.694 14.094 -16.020 490 HD3 ARG 63 HD3 ARG 63 5.152 13.268 -16.227 491 HE ARG 63 HE ARG 63 5.134 15.766 -17.563 492 HH11 ARG 63 HH11 ARG 63 6.471 12.505 -17.800 493 HH12 ARG 63 HH12 ARG 63 6.597 12.562 -19.528 494 HH21 ARG 63 HH21 ARG 63 5.303 15.802 -19.823 495 HH22 ARG 63 HH22 ARG 63 5.932 14.433 -20.675 496 H LEU 64 H LEU 64 7.195 11.936 -12.625 497 HA LEU 64 HA LEU 64 6.064 11.340 -10.146 498 HB2 LEU 64 HB2 LEU 64 7.088 9.691 -11.799 499 HB3 LEU 64 HB3 LEU 64 8.663 10.164 -11.194 500 HG LEU 64 HG LEU 64 7.843 9.386 -8.866 501 HD11 LEU 64 HD11 LEU 64 6.036 7.753 -8.803 502 HD12 LEU 64 HD12 LEU 64 5.718 7.994 -10.522 503 HD13 LEU 64 HD13 LEU 64 5.427 9.307 -9.373 504 HD21 LEU 64 HD21 LEU 64 8.386 7.057 -9.306 505 HD22 LEU 64 HD22 LEU 64 9.451 8.114 -10.228 506 HD23 LEU 64 HD23 LEU 64 8.109 7.292 -11.034 507 H GLU 65 H GLU 65 9.356 12.394 -10.908 508 HA GLU 65 HA GLU 65 10.441 12.529 -8.309 509 HB2 GLU 65 HB2 GLU 65 11.187 14.129 -10.791 510 HB3 GLU 65 HB3 GLU 65 12.208 13.912 -9.366 511 HG2 GLU 65 HG2 GLU 65 12.390 11.529 -9.795 512 HG3 GLU 65 HG3 GLU 65 11.249 11.643 -11.135 513 H GLN 66 H GLN 66 8.754 14.918 -10.264 514 HA GLN 66 HA GLN 66 9.037 17.182 -8.588 515 HB2 GLN 66 HB2 GLN 66 8.420 17.355 -10.947 516 HB3 GLN 66 HB3 GLN 66 6.936 16.450 -10.668 517 HG2 GLN 66 HG2 GLN 66 6.063 18.299 -9.291 518 HG3 GLN 66 HG3 GLN 66 7.560 19.199 -9.550 519 HE21 GLN 66 HE21 GLN 66 6.400 20.914 -10.526 520 HE22 GLN 66 HE22 GLN 66 5.758 20.790 -12.125 521 H MET 67 H MET 67 6.632 14.592 -8.731 522 HA MET 67 HA MET 67 4.873 15.665 -6.730 523 HB2 MET 67 HB2 MET 67 5.126 12.829 -7.793 524 HB3 MET 67 HB3 MET 67 3.846 13.382 -6.719 525 HG2 MET 67 HG2 MET 67 3.114 14.984 -8.482 526 HG3 MET 67 HG3 MET 67 4.335 14.303 -9.558 527 HE1 MET 67 HE1 MET 67 4.441 11.517 -9.827 528 HE2 MET 67 HE2 MET 67 3.030 10.495 -9.562 529 HE3 MET 67 HE3 MET 67 3.911 11.152 -8.183 530 H ILE 68 H ILE 68 7.662 13.498 -6.695 531 HA ILE 68 HA ILE 68 7.546 12.647 -3.989 532 HB ILE 68 HB ILE 68 9.972 13.058 -5.812 533 HG12 ILE 68 HG12 ILE 68 8.564 10.438 -5.098 534 HG13 ILE 68 HG13 ILE 68 8.241 11.348 -6.566 535 HG21 ILE 68 HG21 ILE 68 11.231 11.578 -4.277 536 HG22 ILE 68 HG22 ILE 68 9.852 11.542 -3.175 537 HG23 ILE 68 HG23 ILE 68 10.709 13.055 -3.468 538 HD11 ILE 68 HD11 ILE 68 10.874 10.090 -5.807 539 HD12 ILE 68 HD12 ILE 68 10.569 11.024 -7.273 540 HD13 ILE 68 HD13 ILE 68 9.726 9.500 -7.007 541 H SER 69 H SER 69 8.879 15.508 -5.582 542 HA SER 69 HA SER 69 10.071 16.767 -3.331 543 HB2 SER 69 HB2 SER 69 8.940 18.035 -5.867 544 HB3 SER 69 HB3 SER 69 10.066 18.804 -4.742 545 HG SER 69 HG SER 69 10.586 16.418 -6.196 546 H GLN 70 H GLN 70 6.796 16.759 -4.658 547 HA GLN 70 HA GLN 70 5.762 18.966 -3.140 548 HB2 GLN 70 HB2 GLN 70 4.926 18.079 -5.405 549 HB3 GLN 70 HB3 GLN 70 4.185 16.748 -4.539 550 HG2 GLN 70 HG2 GLN 70 3.494 19.661 -4.053 551 HG3 GLN 70 HG3 GLN 70 2.646 18.639 -5.206 552 HE21 GLN 70 HE21 GLN 70 1.393 16.867 -4.375 553 HE22 GLN 70 HE22 GLN 70 0.816 16.867 -2.749 554 H ILE 71 H ILE 71 5.354 15.426 -2.944 555 HA ILE 71 HA ILE 71 3.607 15.407 -0.729 556 HB ILE 71 HB ILE 71 3.770 13.552 -2.403 557 HG12 ILE 71 HG12 ILE 71 4.092 12.746 0.528 558 HG13 ILE 71 HG13 ILE 71 2.584 13.115 -0.301 559 HG21 ILE 71 HG21 ILE 71 5.521 11.847 -2.248 560 HG22 ILE 71 HG22 ILE 71 6.321 12.753 -0.961 561 HG23 ILE 71 HG23 ILE 71 6.225 13.428 -2.587 562 HD11 ILE 71 HD11 ILE 71 4.378 10.748 -0.810 563 HD12 ILE 71 HD12 ILE 71 2.897 11.111 -1.702 564 HD13 ILE 71 HD13 ILE 71 2.826 10.744 0.021 565 H ASP 72 H ASP 72 7.105 15.317 -0.991 566 HA ASP 72 HA ASP 72 7.814 14.415 1.570 567 HB2 ASP 72 HB2 ASP 72 9.465 14.571 -0.208 568 HB3 ASP 72 HB3 ASP 72 9.235 16.308 -0.349 569 H LYS 73 H LYS 73 6.654 17.534 0.488 570 HA LYS 73 HA LYS 73 7.570 19.152 2.662 571 HB2 LYS 73 HB2 LYS 73 5.225 19.703 0.797 572 HB3 LYS 73 HB3 LYS 73 6.068 20.888 1.785 573 HG2 LYS 73 HG2 LYS 73 7.217 19.402 -0.597 574 HG3 LYS 73 HG3 LYS 73 6.660 21.071 -0.581 575 HD2 LYS 73 HD2 LYS 73 8.942 21.428 -0.357 576 HD3 LYS 73 HD3 LYS 73 8.503 21.326 1.345 577 HE2 LYS 73 HE2 LYS 73 9.221 18.955 1.381 578 HE3 LYS 73 HE3 LYS 73 9.641 19.056 -0.329 579 HZ1 LYS 73 HZ1 LYS 73 11.299 20.732 0.222 580 HZ2 LYS 73 HZ2 LYS 73 11.579 19.297 1.071 581 HZ3 LYS 73 HZ3 LYS 73 10.895 20.627 1.864 582 H LEU 74 H LEU 74 4.852 17.048 2.210 583 HA LEU 74 HA LEU 74 3.125 18.113 4.212 584 HB2 LEU 74 HB2 LEU 74 3.232 15.424 2.806 585 HB3 LEU 74 HB3 LEU 74 2.089 15.716 4.104 586 HG LEU 74 HG LEU 74 0.931 16.014 2.015 587 HD11 LEU 74 HD11 LEU 74 1.462 18.746 3.225 588 HD12 LEU 74 HD12 LEU 74 0.283 17.566 3.798 589 HD13 LEU 74 HD13 LEU 74 0.082 18.310 2.214 590 HD21 LEU 74 HD21 LEU 74 3.038 18.045 1.199 591 HD22 LEU 74 HD22 LEU 74 1.577 17.639 0.293 592 HD23 LEU 74 HD23 LEU 74 2.833 16.427 0.524 593 H GLU 75 H GLU 75 2.823 17.533 6.288 594 HA GLU 75 HA GLU 75 5.028 16.598 7.842 595 HB2 GLU 75 HB2 GLU 75 3.400 16.833 9.764 596 HB3 GLU 75 HB3 GLU 75 3.587 18.271 8.767 597 HG2 GLU 75 HG2 GLU 75 1.468 17.677 7.565 598 HG3 GLU 75 HG3 GLU 75 1.270 16.313 8.666 599 H ASP 76 H ASP 76 2.643 14.887 6.156 600 HA ASP 76 HA ASP 76 2.472 12.493 7.639 601 HB2 ASP 76 HB2 ASP 76 2.529 12.891 4.611 602 HB3 ASP 76 HB3 ASP 76 2.002 11.426 5.429 603 H VAL 77 H VAL 77 4.656 13.486 5.017 604 HA VAL 77 HA VAL 77 6.310 11.129 5.235 605 HB VAL 77 HB VAL 77 6.499 13.631 3.482 606 HG11 VAL 77 HG11 VAL 77 8.770 12.755 3.820 607 HG12 VAL 77 HG12 VAL 77 8.233 12.466 2.168 608 HG13 VAL 77 HG13 VAL 77 8.245 11.140 3.336 609 HG21 VAL 77 HG21 VAL 77 5.715 10.770 2.788 610 HG22 VAL 77 HG22 VAL 77 5.790 12.129 1.662 611 HG23 VAL 77 HG23 VAL 77 4.605 12.132 2.968 612 H VAL 78 H VAL 78 7.436 11.072 7.081 613 HA VAL 78 HA VAL 78 8.809 13.233 8.345 614 HB VAL 78 HB VAL 78 9.482 10.259 8.645 615 HG11 VAL 78 HG11 VAL 78 10.175 10.863 10.924 616 HG12 VAL 78 HG12 VAL 78 9.729 12.547 10.638 617 HG13 VAL 78 HG13 VAL 78 11.059 11.817 9.731 618 HG21 VAL 78 HG21 VAL 78 7.799 10.098 10.438 619 HG22 VAL 78 HG22 VAL 78 7.044 10.499 8.897 620 HG23 VAL 78 HG23 VAL 78 7.274 11.754 10.118 621 H LYS 79 H LYS 79 9.773 10.550 6.239 622 HA LYS 79 HA LYS 79 12.123 12.017 5.224 623 HB2 LYS 79 HB2 LYS 79 12.178 9.068 6.056 624 HB3 LYS 79 HB3 LYS 79 13.498 9.934 5.274 625 HG2 LYS 79 HG2 LYS 79 13.824 11.319 7.248 626 HG3 LYS 79 HG3 LYS 79 12.403 10.610 8.014 627 HD2 LYS 79 HD2 LYS 79 13.532 8.390 8.033 628 HD3 LYS 79 HD3 LYS 79 14.960 9.121 7.295 629 HE2 LYS 79 HE2 LYS 79 15.231 10.568 9.298 630 HE3 LYS 79 HE3 LYS 79 13.817 9.804 10.030 631 HZ1 LYS 79 HZ1 LYS 79 16.308 8.386 9.248 632 HZ2 LYS 79 HZ2 LYS 79 14.975 7.700 10.036 633 HZ3 LYS 79 HZ3 LYS 79 15.919 8.867 10.819 634 H VAL 80 H VAL 80 12.581 11.518 3.033 635 HA VAL 80 HA VAL 80 11.027 9.351 1.750 636 HB VAL 80 HB VAL 80 10.006 11.611 1.154 637 HG11 VAL 80 HG11 VAL 80 11.120 13.046 -0.509 638 HG12 VAL 80 HG12 VAL 80 12.579 12.057 -0.396 639 HG13 VAL 80 HG13 VAL 80 12.026 12.978 1.003 640 HG21 VAL 80 HG21 VAL 80 11.094 9.945 -1.154 641 HG22 VAL 80 HG22 VAL 80 9.728 11.058 -1.247 642 HG23 VAL 80 HG23 VAL 80 9.623 9.621 -0.232 643 H GLN 81 H GLN 81 12.178 8.141 0.332 644 HA GLN 81 HA GLN 81 14.975 8.805 -0.300 645 HB2 GLN 81 HB2 GLN 81 13.991 6.238 1.038 646 HB3 GLN 81 HB3 GLN 81 15.571 6.375 0.276 647 HG2 GLN 81 HG2 GLN 81 14.630 8.050 2.626 648 HG3 GLN 81 HG3 GLN 81 15.638 6.606 2.749 649 HE21 GLN 81 HE21 GLN 81 17.796 6.707 1.965 650 HE22 GLN 81 HE22 GLN 81 18.612 8.211 1.728 651 H ARG 82 H ARG 82 14.840 8.888 -2.492 652 HA ARG 82 HA ARG 82 13.343 6.840 -3.952 653 HB2 ARG 82 HB2 ARG 82 14.086 8.143 -6.023 654 HB3 ARG 82 HB3 ARG 82 12.975 8.944 -4.935 655 HG2 ARG 82 HG2 ARG 82 14.456 10.625 -5.616 656 HG3 ARG 82 HG3 ARG 82 15.007 10.200 -3.998 657 HD2 ARG 82 HD2 ARG 82 16.840 10.550 -5.681 658 HD3 ARG 82 HD3 ARG 82 16.883 8.979 -4.879 659 HE ARG 82 HE ARG 82 15.666 9.297 -7.550 660 HH11 ARG 82 HH11 ARG 82 18.092 7.759 -5.520 661 HH12 ARG 82 HH12 ARG 82 18.565 6.623 -6.743 662 HH21 ARG 82 HH21 ARG 82 16.256 7.774 -9.121 663 HH22 ARG 82 HH22 ARG 82 17.519 6.632 -8.788 664 H ASN 83 H ASN 83 14.203 5.048 -4.670 665 HA ASN 83 HA ASN 83 17.052 4.871 -5.433 666 HB2 ASN 83 HB2 ASN 83 15.608 2.960 -3.510 667 HB3 ASN 83 HB3 ASN 83 17.127 2.559 -4.302 668 HD21 ASN 83 HD21 ASN 83 15.597 4.606 -1.897 669 HD22 ASN 83 HD22 ASN 83 17.051 5.084 -1.098 670 H GLN 84 H GLN 84 17.358 3.337 -7.144 671 HA GLN 84 HA GLN 84 14.944 1.836 -8.051 672 HB2 GLN 84 HB2 GLN 84 15.795 1.930 -10.352 673 HB3 GLN 84 HB3 GLN 84 15.580 3.544 -9.706 674 HG2 GLN 84 HG2 GLN 84 17.613 3.949 -10.616 675 HG3 GLN 84 HG3 GLN 84 18.241 3.156 -9.176 676 HE21 GLN 84 HE21 GLN 84 19.441 3.361 -11.830 677 HE22 GLN 84 HE22 GLN 84 19.701 1.748 -12.382 678 H SER 85 H SER 85 15.129 -0.353 -7.939 679 HA SER 85 HA SER 85 17.633 -1.760 -7.967 680 HB2 SER 85 HB2 SER 85 17.682 -0.682 -5.680 681 HB3 SER 85 HB3 SER 85 16.193 -1.534 -5.278 682 HG SER 85 HG SER 85 18.799 -2.487 -5.527 683 H ASP 86 H ASP 86 17.229 -4.066 -7.088 684 HA ASP 86 HA ASP 86 15.140 -5.321 -8.550 685 HB2 ASP 86 HB2 ASP 86 17.025 -6.425 -6.410 686 HB3 ASP 86 HB3 ASP 86 15.993 -7.416 -7.442 687 HA PRO 87 HA PRO 87 11.889 -5.481 -5.390 688 HB2 PRO 87 HB2 PRO 87 10.528 -7.737 -6.131 689 HB3 PRO 87 HB3 PRO 87 10.485 -6.247 -7.099 690 HG2 PRO 87 HG2 PRO 87 12.188 -8.690 -7.494 691 HG3 PRO 87 HG3 PRO 87 11.223 -7.788 -8.687 692 HD2 PRO 87 HD2 PRO 87 13.888 -7.407 -8.448 693 HD3 PRO 87 HD3 PRO 87 12.789 -6.072 -8.863 694 H THR 88 H THR 88 14.500 -7.591 -5.457 695 HA THR 88 HA THR 88 13.953 -9.488 -3.447 696 HB THR 88 HB THR 88 16.445 -9.507 -3.102 697 HG1 THR 88 HG1 THR 88 17.696 -8.055 -4.301 698 HG21 THR 88 HG21 THR 88 15.589 -9.473 -6.025 699 HG22 THR 88 HG22 THR 88 15.484 -10.860 -4.934 700 HG23 THR 88 HG23 THR 88 17.060 -10.211 -5.393 701 H MET 89 H MET 89 14.459 -6.070 -3.274 702 HA MET 89 HA MET 89 15.066 -5.592 -0.623 703 HB2 MET 89 HB2 MET 89 13.153 -4.097 -2.458 704 HB3 MET 89 HB3 MET 89 13.644 -3.493 -0.875 705 HG2 MET 89 HG2 MET 89 15.499 -4.051 -3.201 706 HG3 MET 89 HG3 MET 89 14.950 -2.460 -2.663 707 HE1 MET 89 HE1 MET 89 18.030 -3.149 -3.046 708 HE2 MET 89 HE2 MET 89 18.754 -2.517 -1.568 709 HE3 MET 89 HE3 MET 89 17.520 -1.582 -2.412 710 H PHE 90 H PHE 90 11.900 -6.513 -2.000 711 HA PHE 90 HA PHE 90 10.207 -6.293 0.180 712 HB2 PHE 90 HB2 PHE 90 10.260 -8.407 -2.009 713 HB3 PHE 90 HB3 PHE 90 9.022 -8.430 -0.764 714 HD1 PHE 90 HD1 PHE 90 7.811 -5.988 -0.468 715 HD2 PHE 90 HD2 PHE 90 9.588 -7.476 -4.059 716 HE1 PHE 90 HE1 PHE 90 6.333 -4.546 -1.800 717 HE2 PHE 90 HE2 PHE 90 8.114 -6.026 -5.383 718 HZ PHE 90 HZ PHE 90 6.480 -4.556 -4.260 719 H ASN 91 H ASN 91 12.061 -9.211 -0.712 720 HA ASN 91 HA ASN 91 11.320 -10.747 1.566 721 HB2 ASN 91 HB2 ASN 91 12.031 -11.784 -0.567 722 HB3 ASN 91 HB3 ASN 91 13.654 -11.133 -0.363 723 HD21 ASN 91 HD21 ASN 91 15.035 -12.092 1.190 724 HD22 ASN 91 HD22 ASN 91 14.703 -13.635 1.892 725 H LYS 92 H LYS 92 14.129 -8.799 0.770 726 HA LYS 92 HA LYS 92 15.961 -9.463 2.731 727 HB2 LYS 92 HB2 LYS 92 16.463 -8.047 0.790 728 HB3 LYS 92 HB3 LYS 92 15.436 -6.767 1.420 729 HG2 LYS 92 HG2 LYS 92 16.989 -6.383 3.275 730 HG3 LYS 92 HG3 LYS 92 17.988 -7.743 2.747 731 HD2 LYS 92 HD2 LYS 92 18.479 -6.572 0.619 732 HD3 LYS 92 HD3 LYS 92 17.467 -5.215 1.120 733 HE2 LYS 92 HE2 LYS 92 19.979 -6.128 2.561 734 HE3 LYS 92 HE3 LYS 92 19.901 -4.789 1.417 735 HZ1 LYS 92 HZ1 LYS 92 19.785 -3.960 3.642 736 HZ2 LYS 92 HZ2 LYS 92 18.490 -4.974 4.022 737 HZ3 LYS 92 HZ3 LYS 92 18.282 -3.720 2.907 738 H ILE 93 H ILE 93 13.551 -6.829 2.857 739 HA ILE 93 HA ILE 93 14.176 -6.175 5.630 740 HB ILE 93 HB ILE 93 12.454 -4.403 5.384 741 HG12 ILE 93 HG12 ILE 93 11.917 -5.844 2.767 742 HG13 ILE 93 HG13 ILE 93 10.766 -5.273 3.963 743 HG21 ILE 93 HG21 ILE 93 14.424 -4.486 3.063 744 HG22 ILE 93 HG22 ILE 93 14.788 -3.954 4.707 745 HG23 ILE 93 HG23 ILE 93 13.652 -3.038 3.721 746 HD11 ILE 93 HD11 ILE 93 10.645 -4.017 1.891 747 HD12 ILE 93 HD12 ILE 93 12.323 -3.534 2.055 748 HD13 ILE 93 HD13 ILE 93 11.125 -2.981 3.227 749 H ALA 94 H ALA 94 11.779 -8.072 3.925 750 HA ALA 94 HA ALA 94 9.773 -8.278 5.908 751 HB1 ALA 94 HB1 ALA 94 9.413 -8.972 3.576 752 HB2 ALA 94 HB2 ALA 94 9.010 -10.274 4.695 753 HB3 ALA 94 HB3 ALA 94 10.531 -10.320 3.796 754 H VAL 95 H VAL 95 12.858 -9.948 5.532 755 HA VAL 95 HA VAL 95 12.534 -11.999 7.447 756 HB VAL 95 HB VAL 95 15.067 -10.475 6.676 757 HG11 VAL 95 HG11 VAL 95 16.368 -12.364 7.616 758 HG12 VAL 95 HG12 VAL 95 14.880 -13.094 8.225 759 HG13 VAL 95 HG13 VAL 95 15.428 -11.544 8.863 760 HG21 VAL 95 HG21 VAL 95 14.005 -13.161 5.718 761 HG22 VAL 95 HG22 VAL 95 15.548 -12.437 5.251 762 HG23 VAL 95 HG23 VAL 95 14.038 -11.657 4.794 763 H PHE 96 H PHE 96 13.397 -8.592 7.792 764 HA PHE 96 HA PHE 96 13.909 -8.786 10.665 765 HB2 PHE 96 HB2 PHE 96 14.008 -6.409 8.757 766 HB3 PHE 96 HB3 PHE 96 14.516 -6.370 10.446 767 HD1 PHE 96 HD2 PHE 96 16.507 -7.763 11.175 768 HD2 PHE 96 HD1 PHE 96 15.488 -7.271 7.052 769 HE1 PHE 96 HE2 PHE 96 18.757 -8.516 10.527 770 HE2 PHE 96 HE1 PHE 96 17.735 -8.040 6.411 771 HZ PHE 96 HZ PHE 96 19.376 -8.659 8.145 772 H PHE 97 H PHE 97 11.340 -7.827 8.529 773 HA PHE 97 HA PHE 97 9.216 -7.117 8.765 774 HB2 PHE 97 HB2 PHE 97 9.561 -7.990 11.661 775 HB3 PHE 97 HB3 PHE 97 8.021 -7.515 10.954 776 HD1 PHE 97 HD2 PHE 97 7.203 -8.855 8.876 777 HD2 PHE 97 HD1 PHE 97 10.244 -10.266 11.531 778 HE1 PHE 97 HE2 PHE 97 6.811 -11.157 8.112 779 HE2 PHE 97 HE1 PHE 97 9.842 -12.563 10.759 780 HZ PHE 97 HZ PHE 97 8.124 -13.015 9.054 781 H GLN 98 H GLN 98 11.599 -5.336 9.569 782 HA GLN 98 HA GLN 98 10.188 -2.910 9.855 783 HB2 GLN 98 HB2 GLN 98 9.995 -3.493 12.230 784 HB3 GLN 98 HB3 GLN 98 11.709 -3.882 12.328 785 HG2 GLN 98 HG2 GLN 98 12.299 -1.533 11.988 786 HG3 GLN 98 HG3 GLN 98 10.607 -1.111 11.766 787 HE21 GLN 98 HE21 GLN 98 13.005 -2.152 14.108 788 HE22 GLN 98 HE22 GLN 98 12.136 -1.635 15.507 789 H1 GLY 1 H1 GLY 1 -10.387 -4.899 15.803 790 H2 GLY 1 H2 GLY 1 -10.316 -5.718 17.282 791 H3 GLY 1 H3 GLY 1 -9.183 -4.514 16.936 792 HA2 GLY 1 HA3 GLY 1 -10.961 -2.853 16.903 793 HA3 GLY 1 HA2 GLY 1 -12.097 -4.130 17.321 794 H SER 2 H SER 2 -12.578 -4.213 19.463 795 HA SER 2 HA SER 2 -10.989 -2.639 21.348 796 HB2 SER 2 HB2 SER 2 -13.463 -2.357 21.204 797 HB3 SER 2 HB3 SER 2 -13.679 -4.033 21.707 798 HG SER 2 HG SER 2 -12.590 -1.879 23.187 799 H MET 3 H MET 3 -9.298 -4.477 20.932 800 HA MET 3 HA MET 3 -9.344 -6.265 23.290 801 HB2 MET 3 HB2 MET 3 -8.196 -7.022 20.554 802 HB3 MET 3 HB3 MET 3 -8.125 -8.006 22.010 803 HG2 MET 3 HG2 MET 3 -10.637 -7.281 20.487 804 HG3 MET 3 HG3 MET 3 -9.796 -8.832 20.432 805 HE1 MET 3 HE1 MET 3 -11.947 -10.219 21.062 806 HE2 MET 3 HE2 MET 3 -12.893 -8.728 21.040 807 HE3 MET 3 HE3 MET 3 -13.006 -9.823 22.417 808 H GLN 4 H GLN 4 -6.987 -6.979 23.747 809 HA GLN 4 HA GLN 4 -5.196 -4.797 23.927 810 HB2 GLN 4 HB2 GLN 4 -5.116 -6.733 25.477 811 HB3 GLN 4 HB3 GLN 4 -4.681 -7.802 24.154 812 HG2 GLN 4 HG2 GLN 4 -2.747 -7.286 25.554 813 HG3 GLN 4 HG3 GLN 4 -2.525 -6.680 23.916 814 HE21 GLN 4 HE21 GLN 4 -3.119 -5.758 27.254 815 HE22 GLN 4 HE22 GLN 4 -2.678 -4.098 27.072 816 H ASN 5 H ASN 5 -3.473 -4.203 22.627 817 HA ASN 5 HA ASN 5 -3.721 -4.795 19.834 818 HB2 ASN 5 HB2 ASN 5 -1.709 -3.222 19.601 819 HB3 ASN 5 HB3 ASN 5 -3.166 -2.542 20.311 820 HD21 ASN 5 HD21 ASN 5 -3.169 -2.047 22.552 821 HD22 ASN 5 HD22 ASN 5 -1.706 -1.894 23.455 822 H THR 6 H THR 6 -3.360 -7.030 19.796 823 HA THR 6 HA THR 6 -0.563 -7.983 19.988 824 HB THR 6 HB THR 6 -1.630 -10.225 20.724 825 HG1 THR 6 HG1 THR 6 -3.838 -8.627 21.526 826 HG21 THR 6 HG21 THR 6 -1.906 -7.893 22.657 827 HG22 THR 6 HG22 THR 6 -0.429 -8.809 22.359 828 HG23 THR 6 HG23 THR 6 -1.818 -9.598 23.106 829 H THR 7 H THR 7 -0.373 -10.149 18.827 830 HA THR 7 HA THR 7 -1.156 -9.742 16.082 831 HB THR 7 HB THR 7 0.492 -11.987 17.334 832 HG1 THR 7 HG1 THR 7 1.057 -9.402 16.965 833 HG21 THR 7 HG21 THR 7 0.211 -11.101 14.437 834 HG22 THR 7 HG22 THR 7 -0.360 -12.625 15.122 835 HG23 THR 7 HG23 THR 7 1.369 -12.296 15.029 836 H HIS 8 H HIS 8 -3.408 -9.961 16.443 837 HA HIS 8 HA HIS 8 -4.464 -12.140 15.166 838 HB2 HIS 8 HB2 HIS 8 -6.025 -13.145 16.884 839 HB3 HIS 8 HB3 HIS 8 -4.335 -13.549 17.127 840 HD1 HIS 8 HD1 HIS 8 -3.541 -13.332 19.438 841 HD2 HIS 8 HD2 HIS 8 -6.877 -10.950 18.782 842 HE1 HIS 8 HE1 HIS 8 -4.149 -12.407 21.687 843 HE2 HIS 8 HE2 HIS 8 -6.235 -11.052 21.287 844 H ASP 9 H ASP 9 -4.845 -9.391 17.245 845 HA ASP 9 HA ASP 9 -7.585 -8.812 16.697 846 HB2 ASP 9 HB2 ASP 9 -6.342 -7.930 18.697 847 HB3 ASP 9 HB3 ASP 9 -5.396 -6.901 17.627 848 H ASN 10 H ASN 10 -4.496 -7.887 15.218 849 HA ASN 10 HA ASN 10 -5.740 -6.363 13.090 850 HB2 ASN 10 HB2 ASN 10 -3.544 -6.145 12.121 851 HB3 ASN 10 HB3 ASN 10 -3.367 -5.945 13.856 852 HD21 ASN 10 HD21 ASN 10 -1.368 -6.668 11.833 853 HD22 ASN 10 HD22 ASN 10 -0.693 -8.176 12.339 854 H VAL 11 H VAL 11 -5.801 -7.057 10.851 855 HA VAL 11 HA VAL 11 -5.998 -9.982 10.499 856 HB VAL 11 HB VAL 11 -8.009 -9.764 9.140 857 HG11 VAL 11 HG11 VAL 11 -8.372 -8.407 11.830 858 HG12 VAL 11 HG12 VAL 11 -8.311 -10.145 11.528 859 HG13 VAL 11 HG13 VAL 11 -9.644 -9.188 10.886 860 HG21 VAL 11 HG21 VAL 11 -7.718 -7.510 8.177 861 HG22 VAL 11 HG22 VAL 11 -8.029 -6.777 9.751 862 HG23 VAL 11 HG23 VAL 11 -9.308 -7.670 8.928 863 H ILE 12 H ILE 12 -5.344 -10.781 8.619 864 HA ILE 12 HA ILE 12 -3.827 -9.124 6.758 865 HB ILE 12 HB ILE 12 -4.297 -12.151 6.672 866 HG12 ILE 12 HG12 ILE 12 -3.333 -11.475 8.903 867 HG13 ILE 12 HG13 ILE 12 -2.279 -12.530 7.975 868 HG21 ILE 12 HG21 ILE 12 -2.173 -12.215 5.408 869 HG22 ILE 12 HG22 ILE 12 -2.071 -10.454 5.484 870 HG23 ILE 12 HG23 ILE 12 -3.390 -11.224 4.600 871 HD11 ILE 12 HD11 ILE 12 -1.979 -9.554 8.348 872 HD12 ILE 12 HD12 ILE 12 -0.931 -10.559 7.343 873 HD13 ILE 12 HD13 ILE 12 -1.002 -10.825 9.084 874 H LEU 13 H LEU 13 -5.528 -7.966 5.748 875 HA LEU 13 HA LEU 13 -7.713 -9.418 4.445 876 HB2 LEU 13 HB2 LEU 13 -7.975 -7.177 5.723 877 HB3 LEU 13 HB3 LEU 13 -7.199 -6.411 4.351 878 HG LEU 13 HG LEU 13 -9.706 -6.212 4.344 879 HD11 LEU 13 HD11 LEU 13 -10.128 -6.762 2.007 880 HD12 LEU 13 HD12 LEU 13 -8.696 -7.790 1.958 881 HD13 LEU 13 HD13 LEU 13 -8.525 -6.051 2.189 882 HD21 LEU 13 HD21 LEU 13 -11.112 -8.149 3.846 883 HD22 LEU 13 HD22 LEU 13 -10.251 -8.367 5.367 884 HD23 LEU 13 HD23 LEU 13 -9.703 -9.212 3.917 885 H GLU 14 H GLU 14 -6.833 -10.511 2.749 886 HA GLU 14 HA GLU 14 -5.114 -9.159 0.796 887 HB2 GLU 14 HB2 GLU 14 -4.613 -11.501 1.503 888 HB3 GLU 14 HB3 GLU 14 -6.182 -12.023 0.894 889 HG2 GLU 14 HG2 GLU 14 -5.402 -11.137 -1.394 890 HG3 GLU 14 HG3 GLU 14 -3.789 -11.049 -0.689 891 H LEU 15 H LEU 15 -6.334 -7.783 -0.445 892 HA LEU 15 HA LEU 15 -8.609 -8.983 -1.914 893 HB2 LEU 15 HB2 LEU 15 -8.992 -6.530 -2.677 894 HB3 LEU 15 HB3 LEU 15 -9.453 -7.017 -1.062 895 HG LEU 15 HG LEU 15 -7.129 -6.008 -0.345 896 HD11 LEU 15 HD11 LEU 15 -7.513 -4.475 -2.918 897 HD12 LEU 15 HD12 LEU 15 -6.208 -5.608 -2.561 898 HD13 LEU 15 HD13 LEU 15 -6.345 -4.114 -1.642 899 HD21 LEU 15 HD21 LEU 15 -9.266 -5.112 0.396 900 HD22 LEU 15 HD22 LEU 15 -9.437 -4.191 -1.100 901 HD23 LEU 15 HD23 LEU 15 -8.139 -3.808 0.037 902 H THR 16 H THR 16 -8.157 -9.814 -3.774 903 HA THR 16 HA THR 16 -5.797 -9.149 -5.341 904 HB THR 16 HB THR 16 -8.123 -11.064 -5.891 905 HG1 THR 16 HG1 THR 16 -6.695 -11.589 -4.134 906 HG21 THR 16 HG21 THR 16 -6.723 -12.028 -7.671 907 HG22 THR 16 HG22 THR 16 -5.471 -10.818 -7.376 908 HG23 THR 16 HG23 THR 16 -7.045 -10.324 -8.008 909 H VAL 17 H VAL 17 -5.983 -7.214 -6.318 910 HA VAL 17 HA VAL 17 -8.454 -6.552 -7.809 911 HB VAL 17 HB VAL 17 -7.937 -4.253 -7.620 912 HG11 VAL 17 HG11 VAL 17 -7.298 -5.516 -4.931 913 HG12 VAL 17 HG12 VAL 17 -8.910 -5.185 -5.578 914 HG13 VAL 17 HG13 VAL 17 -7.833 -3.846 -5.178 915 HG21 VAL 17 HG21 VAL 17 -5.190 -4.969 -6.525 916 HG22 VAL 17 HG22 VAL 17 -5.842 -3.332 -6.608 917 HG23 VAL 17 HG23 VAL 17 -5.538 -4.234 -8.091 918 H ARG 18 H ARG 18 -8.267 -5.956 -9.971 919 HA ARG 18 HA ARG 18 -5.641 -6.328 -11.258 920 HB2 ARG 18 HB2 ARG 18 -6.882 -6.173 -13.385 921 HB3 ARG 18 HB3 ARG 18 -7.484 -7.454 -12.347 922 HG2 ARG 18 HG2 ARG 18 -9.370 -5.909 -11.677 923 HG3 ARG 18 HG3 ARG 18 -8.805 -4.792 -12.926 924 HD2 ARG 18 HD2 ARG 18 -9.802 -7.631 -13.322 925 HD3 ARG 18 HD3 ARG 18 -10.606 -6.149 -13.840 926 HE ARG 18 HE ARG 18 -7.997 -6.366 -14.991 927 HH11 ARG 18 HH11 ARG 18 -11.263 -7.656 -15.379 928 HH12 ARG 18 HH12 ARG 18 -11.028 -8.029 -17.056 929 HH21 ARG 18 HH21 ARG 18 -7.701 -6.924 -17.148 930 HH22 ARG 18 HH22 ARG 18 -9.007 -7.615 -18.057 931 H ASN 19 H ASN 19 -4.828 -4.554 -12.670 932 HA ASN 19 HA ASN 19 -4.760 -2.269 -10.900 933 HB2 ASN 19 HB2 ASN 19 -2.705 -3.429 -11.946 934 HB3 ASN 19 HB3 ASN 19 -3.097 -2.575 -13.435 935 HD21 ASN 19 HD21 ASN 19 -0.701 -2.318 -11.700 936 HD22 ASN 19 HD22 ASN 19 -0.629 -0.665 -11.227 937 H HIS 20 H HIS 20 -6.902 -1.530 -11.327 938 HA HIS 20 HA HIS 20 -7.564 -0.004 -13.685 939 HB2 HIS 20 HB2 HIS 20 -8.769 -0.131 -10.878 940 HB3 HIS 20 HB3 HIS 20 -9.417 0.902 -12.134 941 HD1 HIS 20 HD1 HIS 20 -11.088 -0.129 -13.673 942 HD2 HIS 20 HD2 HIS 20 -9.021 -2.962 -11.485 943 HE1 HIS 20 HE1 HIS 20 -12.286 -2.284 -14.084 944 HE2 HIS 20 HE2 HIS 20 -11.109 -3.955 -12.627 945 HA PRO 21 HA PRO 21 -5.669 4.008 -12.716 946 HB2 PRO 21 HB2 PRO 21 -8.466 5.174 -12.799 947 HB3 PRO 21 HB3 PRO 21 -6.984 5.726 -13.615 948 HG2 PRO 21 HG2 PRO 21 -8.827 4.429 -14.997 949 HG3 PRO 21 HG3 PRO 21 -7.103 4.069 -15.262 950 HD2 PRO 21 HD2 PRO 21 -9.151 2.482 -13.734 951 HD3 PRO 21 HD3 PRO 21 -7.836 1.916 -14.787 952 H GLY 22 H GLY 22 -4.995 3.642 -10.636 953 HA2 GLY 22 HA2 GLY 22 -4.658 4.363 -8.494 954 HA3 GLY 22 HA3 GLY 22 -6.030 5.434 -8.691 955 H VAL 23 H VAL 23 -5.818 1.833 -8.738 956 HA VAL 23 HA VAL 23 -8.095 1.449 -7.087 957 HB VAL 23 HB VAL 23 -5.812 -0.576 -7.155 958 HG11 VAL 23 HG11 VAL 23 -7.647 -2.209 -6.892 959 HG12 VAL 23 HG12 VAL 23 -8.830 -0.901 -6.908 960 HG13 VAL 23 HG13 VAL 23 -7.661 -1.023 -5.588 961 HG21 VAL 23 HG21 VAL 23 -6.225 0.042 -9.486 962 HG22 VAL 23 HG22 VAL 23 -7.951 -0.268 -9.281 963 HG23 VAL 23 HG23 VAL 23 -6.793 -1.596 -9.153 964 H MET 24 H MET 24 -4.720 1.942 -6.382 965 HA MET 24 HA MET 24 -4.552 1.158 -3.700 966 HB2 MET 24 HB2 MET 24 -3.068 3.523 -4.911 967 HB3 MET 24 HB3 MET 24 -2.556 2.526 -3.560 968 HG2 MET 24 HG2 MET 24 -1.203 1.855 -5.363 969 HG3 MET 24 HG3 MET 24 -2.424 0.589 -5.245 970 HE1 MET 24 HE1 MET 24 -2.419 3.896 -8.495 971 HE2 MET 24 HE2 MET 24 -1.169 3.740 -7.260 972 HE3 MET 24 HE3 MET 24 -2.799 4.241 -6.808 973 H THR 25 H THR 25 -5.778 4.104 -5.199 974 HA THR 25 HA THR 25 -6.153 5.600 -2.767 975 HB THR 25 HB THR 25 -7.540 6.204 -5.413 976 HG1 THR 25 HG1 THR 25 -4.927 7.129 -4.804 977 HG21 THR 25 HG21 THR 25 -6.388 8.024 -3.246 978 HG22 THR 25 HG22 THR 25 -8.103 7.672 -3.478 979 HG23 THR 25 HG23 THR 25 -7.213 8.559 -4.714 980 H HIS 26 H HIS 26 -8.069 3.383 -4.685 981 HA HIS 26 HA HIS 26 -10.646 3.986 -3.565 982 HB2 HIS 26 HB2 HIS 26 -9.718 1.430 -4.953 983 HB3 HIS 26 HB3 HIS 26 -11.392 1.885 -4.649 984 HD1 HIS 26 HD1 HIS 26 -10.799 1.307 -7.474 985 HD2 HIS 26 HD2 HIS 26 -10.121 5.081 -5.901 986 HE1 HIS 26 HE1 HIS 26 -10.738 2.851 -9.451 987 HE2 HIS 26 HE2 HIS 26 -10.542 5.146 -8.445 988 H VAL 27 H VAL 27 -8.209 1.448 -2.980 989 HA VAL 27 HA VAL 27 -9.724 0.024 -1.046 990 HB VAL 27 HB VAL 27 -7.734 -1.329 -0.627 991 HG11 VAL 27 HG11 VAL 27 -8.022 -0.705 -3.593 992 HG12 VAL 27 HG12 VAL 27 -8.999 -1.839 -2.658 993 HG13 VAL 27 HG13 VAL 27 -7.287 -2.163 -2.915 994 HG21 VAL 27 HG21 VAL 27 -6.142 0.666 -2.293 995 HG22 VAL 27 HG22 VAL 27 -5.535 -0.872 -1.672 996 HG23 VAL 27 HG23 VAL 27 -5.991 0.411 -0.554 997 H CYS 28 H CYS 28 -7.137 2.453 -0.791 998 HA CYS 28 HA CYS 28 -6.949 2.424 2.059 999 HB2 CYS 28 HB2 CYS 28 -5.665 4.497 1.798 1000 HB3 CYS 28 HB3 CYS 28 -5.165 3.326 0.577 1001 HG CYS 28 HG CYS 28 -5.397 4.956 -1.332 1002 H GLY 29 H GLY 29 -8.987 4.066 -0.263 1003 HA2 GLY 29 HA2 GLY 29 -10.148 6.112 1.230 1004 HA3 GLY 29 HA3 GLY 29 -10.932 5.243 -0.082 1005 H LEU 30 H LEU 30 -11.200 2.709 0.904 1006 HA LEU 30 HA LEU 30 -13.419 2.877 2.677 1007 HB2 LEU 30 HB2 LEU 30 -11.849 0.555 1.540 1008 HB3 LEU 30 HB3 LEU 30 -13.015 0.261 2.816 1009 HG LEU 30 HG LEU 30 -14.084 -0.221 0.715 1010 HD11 LEU 30 HD11 LEU 30 -16.040 1.249 0.768 1011 HD12 LEU 30 HD12 LEU 30 -15.155 2.425 1.741 1012 HD13 LEU 30 HD13 LEU 30 -15.517 0.829 2.397 1013 HD21 LEU 30 HD21 LEU 30 -13.390 2.574 -0.245 1014 HD22 LEU 30 HD22 LEU 30 -14.362 1.379 -1.110 1015 HD23 LEU 30 HD23 LEU 30 -12.655 1.069 -0.807 1016 H PHE 31 H PHE 31 -10.159 1.490 3.220 1017 HA PHE 31 HA PHE 31 -10.678 0.683 5.881 1018 HB2 PHE 31 HB2 PHE 31 -8.090 1.031 4.340 1019 HB3 PHE 31 HB3 PHE 31 -8.121 0.428 5.995 1020 HD1 PHE 31 HD2 PHE 31 -9.686 -0.273 2.641 1021 HD2 PHE 31 HD1 PHE 31 -8.323 -1.898 6.344 1022 HE1 PHE 31 HE2 PHE 31 -10.124 -2.532 1.804 1023 HE2 PHE 31 HE1 PHE 31 -8.777 -4.163 5.505 1024 HZ PHE 31 HZ PHE 31 -9.676 -4.477 3.236 1025 H ALA 32 H ALA 32 -9.402 3.703 4.630 1026 HA ALA 32 HA ALA 32 -8.421 4.737 7.133 1027 HB1 ALA 32 HB1 ALA 32 -7.536 5.540 4.977 1028 HB2 ALA 32 HB2 ALA 32 -8.192 6.873 5.927 1029 HB3 ALA 32 HB3 ALA 32 -9.118 6.215 4.570 1030 H ARG 33 H ARG 33 -11.475 5.022 5.304 1031 HA ARG 33 HA ARG 33 -12.468 7.270 6.803 1032 HB2 ARG 33 HB2 ARG 33 -14.426 7.157 5.450 1033 HB3 ARG 33 HB3 ARG 33 -13.084 6.719 4.402 1034 HG2 ARG 33 HG2 ARG 33 -13.695 4.292 4.768 1035 HG3 ARG 33 HG3 ARG 33 -15.127 4.842 5.632 1036 HD2 ARG 33 HD2 ARG 33 -14.457 5.466 2.740 1037 HD3 ARG 33 HD3 ARG 33 -15.625 4.256 3.291 1038 HE ARG 33 HE ARG 33 -16.461 6.569 4.468 1039 HH11 ARG 33 HH11 ARG 33 -15.891 5.624 1.136 1040 HH12 ARG 33 HH12 ARG 33 -17.083 6.708 0.506 1041 HH21 ARG 33 HH21 ARG 33 -18.033 7.964 3.647 1042 HH22 ARG 33 HH22 ARG 33 -18.306 8.044 1.934 1043 H ARG 34 H ARG 34 -12.304 3.954 7.580 1044 HA ARG 34 HA ARG 34 -14.752 3.438 8.815 1045 HB2 ARG 34 HB2 ARG 34 -12.777 1.840 8.288 1046 HB3 ARG 34 HB3 ARG 34 -12.062 2.400 9.792 1047 HG2 ARG 34 HG2 ARG 34 -14.303 1.667 10.892 1048 HG3 ARG 34 HG3 ARG 34 -14.587 0.785 9.386 1049 HD2 ARG 34 HD2 ARG 34 -13.575 -0.812 10.767 1050 HD3 ARG 34 HD3 ARG 34 -12.216 -0.229 9.798 1051 HE ARG 34 HE ARG 34 -12.648 1.139 12.328 1052 HH11 ARG 34 HH11 ARG 34 -10.898 -1.442 10.703 1053 HH12 ARG 34 HH12 ARG 34 -9.686 -1.541 11.941 1054 HH21 ARG 34 HH21 ARG 34 -11.140 0.904 13.975 1055 HH22 ARG 34 HH22 ARG 34 -9.819 -0.211 13.799 1056 H ALA 35 H ALA 35 -11.677 4.212 10.395 1057 HA ALA 35 HA ALA 35 -12.436 6.262 12.117 1058 HB1 ALA 35 HB1 ALA 35 -13.911 4.616 13.212 1059 HB2 ALA 35 HB2 ALA 35 -12.596 5.072 14.298 1060 HB3 ALA 35 HB3 ALA 35 -12.546 3.524 13.445 1061 H PHE 36 H PHE 36 -10.638 3.214 12.053 1062 HA PHE 36 HA PHE 36 -8.118 4.569 12.792 1063 HB2 PHE 36 HB2 PHE 36 -8.755 2.625 14.211 1064 HB3 PHE 36 HB3 PHE 36 -8.854 1.599 12.782 1065 HD1 PHE 36 HD1 PHE 36 -6.306 3.990 14.231 1066 HD2 PHE 36 HD2 PHE 36 -7.057 0.095 12.625 1067 HE1 PHE 36 HE1 PHE 36 -3.931 3.415 14.499 1068 HE2 PHE 36 HE2 PHE 36 -4.681 -0.471 12.897 1069 HZ PHE 36 HZ PHE 36 -3.114 1.186 13.831 1070 H ASN 37 H ASN 37 -6.280 4.250 11.500 1071 HA ASN 37 HA ASN 37 -6.719 3.942 8.641 1072 HB2 ASN 37 HB2 ASN 37 -4.192 4.518 10.268 1073 HB3 ASN 37 HB3 ASN 37 -4.310 4.626 8.514 1074 HD21 ASN 37 HD21 ASN 37 -3.856 6.609 10.831 1075 HD22 ASN 37 HD22 ASN 37 -4.892 7.925 10.429 1076 H VAL 38 H VAL 38 -4.327 2.788 7.779 1077 HA VAL 38 HA VAL 38 -4.608 -0.023 8.602 1078 HB VAL 38 HB VAL 38 -2.995 1.094 6.246 1079 HG11 VAL 38 HG11 VAL 38 -3.907 -1.745 6.876 1080 HG12 VAL 38 HG12 VAL 38 -2.254 -1.136 6.976 1081 HG13 VAL 38 HG13 VAL 38 -3.058 -1.243 5.410 1082 HG21 VAL 38 HG21 VAL 38 -4.871 0.369 4.802 1083 HG22 VAL 38 HG22 VAL 38 -5.379 1.617 5.939 1084 HG23 VAL 38 HG23 VAL 38 -5.808 -0.069 6.233 1085 H GLU 39 H GLU 39 -2.946 -1.169 9.476 1086 HA GLU 39 HA GLU 39 -0.814 0.218 10.837 1087 HB2 GLU 39 HB2 GLU 39 -2.056 -1.566 11.960 1088 HB3 GLU 39 HB3 GLU 39 -1.692 -2.700 10.664 1089 HG2 GLU 39 HG2 GLU 39 0.756 -2.488 11.323 1090 HG3 GLU 39 HG3 GLU 39 0.213 -1.594 12.743 1091 H GLY 40 H GLY 40 -1.038 -2.435 8.443 1092 HA2 GLY 40 HA2 GLY 40 1.601 -1.730 7.292 1093 HA3 GLY 40 HA3 GLY 40 1.329 -3.368 7.883 1094 H ILE 41 H ILE 41 1.914 -2.510 5.145 1095 HA ILE 41 HA ILE 41 -0.443 -3.646 3.749 1096 HB ILE 41 HB ILE 41 1.072 -1.162 2.750 1097 HG12 ILE 41 HG12 ILE 41 -1.814 -1.367 3.736 1098 HG13 ILE 41 HG13 ILE 41 -0.490 -0.593 4.599 1099 HG21 ILE 41 HG21 ILE 41 -0.550 -1.099 0.879 1100 HG22 ILE 41 HG22 ILE 41 -1.299 -2.586 1.465 1101 HG23 ILE 41 HG23 ILE 41 0.363 -2.608 0.876 1102 HD11 ILE 41 HD11 ILE 41 -1.658 0.305 1.969 1103 HD12 ILE 41 HD12 ILE 41 -0.316 1.080 2.816 1104 HD13 ILE 41 HD13 ILE 41 -1.920 1.040 3.548 1105 H LEU 42 H LEU 42 0.103 -4.866 1.933 1106 HA LEU 42 HA LEU 42 2.786 -4.741 0.788 1107 HB2 LEU 42 HB2 LEU 42 2.998 -6.526 2.472 1108 HB3 LEU 42 HB3 LEU 42 1.571 -7.332 1.849 1109 HG LEU 42 HG LEU 42 2.737 -7.969 -0.192 1110 HD11 LEU 42 HD11 LEU 42 4.130 -5.963 -0.505 1111 HD12 LEU 42 HD12 LEU 42 5.062 -7.446 -0.651 1112 HD13 LEU 42 HD13 LEU 42 5.170 -6.481 0.819 1113 HD21 LEU 42 HD21 LEU 42 4.503 -8.541 2.206 1114 HD22 LEU 42 HD22 LEU 42 4.419 -9.480 0.712 1115 HD23 LEU 42 HD23 LEU 42 3.026 -9.407 1.783 1116 H CYS 43 H CYS 43 2.770 -5.466 -1.401 1117 HA CYS 43 HA CYS 43 0.265 -6.225 -2.663 1118 HB2 CYS 43 HB2 CYS 43 0.037 -3.805 -2.587 1119 HB3 CYS 43 HB3 CYS 43 1.679 -3.576 -3.177 1120 HG CYS 43 HG CYS 43 -0.847 -4.950 -5.027 1121 H LEU 44 H LEU 44 1.100 -8.020 -3.546 1122 HA LEU 44 HA LEU 44 3.637 -8.010 -5.025 1123 HB2 LEU 44 HB2 LEU 44 1.858 -10.129 -3.865 1124 HB3 LEU 44 HB3 LEU 44 2.699 -10.572 -5.337 1125 HG LEU 44 HG LEU 44 4.846 -10.391 -4.320 1126 HD11 LEU 44 HD11 LEU 44 3.584 -9.034 -1.932 1127 HD12 LEU 44 HD12 LEU 44 4.632 -8.292 -3.144 1128 HD13 LEU 44 HD13 LEU 44 5.278 -9.525 -2.068 1129 HD21 LEU 44 HD21 LEU 44 4.747 -11.928 -2.406 1130 HD22 LEU 44 HD22 LEU 44 3.642 -12.432 -3.679 1131 HD23 LEU 44 HD23 LEU 44 3.012 -11.632 -2.239 1132 HA PRO 45 HA PRO 45 1.052 -7.155 -8.728 1133 HB2 PRO 45 HB2 PRO 45 3.196 -6.680 -10.414 1134 HB3 PRO 45 HB3 PRO 45 2.550 -5.459 -9.302 1135 HG2 PRO 45 HG2 PRO 45 4.937 -7.239 -8.953 1136 HG3 PRO 45 HG3 PRO 45 4.761 -5.503 -8.598 1137 HD2 PRO 45 HD2 PRO 45 4.609 -7.369 -6.648 1138 HD3 PRO 45 HD3 PRO 45 3.640 -5.883 -6.598 1139 H ILE 46 H ILE 46 0.204 -8.959 -9.553 1140 HA ILE 46 HA ILE 46 1.579 -11.420 -9.959 1141 HB ILE 46 HB ILE 46 -1.123 -10.527 -11.078 1142 HG12 ILE 46 HG12 ILE 46 -1.174 -10.325 -8.652 1143 HG13 ILE 46 HG13 ILE 46 -2.095 -11.754 -9.095 1144 HG21 ILE 46 HG21 ILE 46 -1.649 -12.942 -11.222 1145 HG22 ILE 46 HG22 ILE 46 0.003 -13.327 -10.732 1146 HG23 ILE 46 HG23 ILE 46 -0.294 -12.494 -12.259 1147 HD11 ILE 46 HD11 ILE 46 0.701 -11.705 -7.943 1148 HD12 ILE 46 HD12 ILE 46 -0.169 -13.160 -8.434 1149 HD13 ILE 46 HD13 ILE 46 -0.783 -12.170 -7.112 1150 H GLN 47 H GLN 47 3.031 -11.737 -11.512 1151 HA GLN 47 HA GLN 47 3.268 -10.060 -13.861 1152 HB2 GLN 47 HB2 GLN 47 5.280 -11.419 -14.354 1153 HB3 GLN 47 HB3 GLN 47 5.269 -10.819 -12.709 1154 HG2 GLN 47 HG2 GLN 47 4.369 -13.089 -12.001 1155 HG3 GLN 47 HG3 GLN 47 4.734 -13.640 -13.630 1156 HE21 GLN 47 HE21 GLN 47 6.060 -12.602 -10.582 1157 HE22 GLN 47 HE22 GLN 47 7.684 -13.100 -10.873 1158 H ASP 48 H ASP 48 1.577 -12.897 -13.137 1159 HA ASP 48 HA ASP 48 1.659 -14.275 -15.599 1160 HB2 ASP 48 HB2 ASP 48 0.969 -15.493 -13.663 1161 HB3 ASP 48 HB3 ASP 48 -0.240 -14.296 -13.232 1162 H SER 49 H SER 49 -0.504 -11.826 -14.285 1163 HA SER 49 HA SER 49 -1.528 -11.012 -16.877 1164 HB2 SER 49 HB2 SER 49 -3.946 -11.356 -16.178 1165 HB3 SER 49 HB3 SER 49 -3.065 -12.867 -16.420 1166 HG SER 49 HG SER 49 -2.841 -13.074 -14.205 1167 H ASP 50 H ASP 50 -3.171 -9.101 -16.484 1168 HA ASP 50 HA ASP 50 -1.906 -7.221 -14.728 1169 HB2 ASP 50 HB2 ASP 50 -3.674 -5.613 -15.458 1170 HB3 ASP 50 HB3 ASP 50 -2.851 -6.387 -16.803 1171 H LYS 51 H LYS 51 -2.062 -8.356 -12.746 1172 HA LYS 51 HA LYS 51 -4.395 -7.629 -11.153 1173 HB2 LYS 51 HB2 LYS 51 -3.290 -10.485 -11.180 1174 HB3 LYS 51 HB3 LYS 51 -4.435 -9.863 -9.999 1175 HG2 LYS 51 HG2 LYS 51 -6.100 -9.535 -11.824 1176 HG3 LYS 51 HG3 LYS 51 -4.950 -10.241 -12.965 1177 HD2 LYS 51 HD2 LYS 51 -4.952 -12.342 -11.542 1178 HD3 LYS 51 HD3 LYS 51 -6.246 -11.620 -10.579 1179 HE2 LYS 51 HE2 LYS 51 -7.176 -13.154 -12.236 1180 HE3 LYS 51 HE3 LYS 51 -7.666 -11.502 -12.608 1181 HZ1 LYS 51 HZ1 LYS 51 -5.437 -12.971 -13.924 1182 HZ2 LYS 51 HZ2 LYS 51 -5.952 -11.407 -14.302 1183 HZ3 LYS 51 HZ3 LYS 51 -6.976 -12.720 -14.581 1184 H SER 52 H SER 52 -3.896 -7.942 -8.822 1185 HA SER 52 HA SER 52 -1.217 -8.320 -7.910 1186 HB2 SER 52 HB2 SER 52 -1.171 -5.921 -8.720 1187 HB3 SER 52 HB3 SER 52 -2.439 -5.539 -7.551 1188 HG SER 52 HG SER 52 -0.021 -5.307 -7.012 1189 H HIS 53 H HIS 53 -1.281 -8.975 -5.758 1190 HA HIS 53 HA HIS 53 -3.917 -8.899 -4.365 1191 HB2 HIS 53 HB2 HIS 53 -1.436 -10.619 -3.837 1192 HB3 HIS 53 HB3 HIS 53 -2.884 -10.632 -2.838 1193 HD1 HIS 53 HD1 HIS 53 -3.623 -12.996 -3.257 1194 HD2 HIS 53 HD2 HIS 53 -2.936 -10.923 -6.782 1195 HE1 HIS 53 HE1 HIS 53 -4.382 -14.524 -5.089 1196 HE2 HIS 53 HE2 HIS 53 -3.803 -13.315 -7.208 1197 H ILE 54 H ILE 54 -4.117 -7.503 -2.675 1198 HA ILE 54 HA ILE 54 -1.667 -6.302 -1.522 1199 HB ILE 54 HB ILE 54 -4.393 -4.921 -1.757 1200 HG12 ILE 54 HG12 ILE 54 -3.105 -3.284 -3.291 1201 HG13 ILE 54 HG13 ILE 54 -1.859 -4.518 -3.410 1202 HG21 ILE 54 HG21 ILE 54 -3.145 -4.222 0.243 1203 HG22 ILE 54 HG22 ILE 54 -3.234 -2.904 -0.924 1204 HG23 ILE 54 HG23 ILE 54 -1.739 -3.828 -0.750 1205 HD11 ILE 54 HD11 ILE 54 -4.729 -4.814 -4.285 1206 HD12 ILE 54 HD12 ILE 54 -3.460 -6.029 -4.460 1207 HD13 ILE 54 HD13 ILE 54 -3.346 -4.503 -5.334 1208 H TRP 55 H TRP 55 -1.336 -6.995 0.479 1209 HA TRP 55 HA TRP 55 -3.508 -7.957 2.209 1210 HB2 TRP 55 HB2 TRP 55 -0.471 -8.046 2.553 1211 HB3 TRP 55 HB3 TRP 55 -1.638 -8.785 3.651 1212 HD1 TRP 55 HD1 TRP 55 -2.713 -11.105 2.895 1213 HE1 TRP 55 HE1 TRP 55 -2.180 -12.755 1.016 1214 HE3 TRP 55 HE3 TRP 55 0.367 -8.168 0.071 1215 HZ2 TRP 55 HZ2 TRP 55 -0.678 -12.831 -1.329 1216 HZ3 TRP 55 HZ3 TRP 55 1.318 -9.117 -1.988 1217 HH2 TRP 55 HH2 TRP 55 0.806 -11.403 -2.673 1218 H LEU 56 H LEU 56 -4.499 -6.269 3.218 1219 HA LEU 56 HA LEU 56 -2.913 -4.121 4.451 1220 HB2 LEU 56 HB2 LEU 56 -5.950 -4.342 4.222 1221 HB3 LEU 56 HB3 LEU 56 -5.046 -2.964 4.827 1222 HG LEU 56 HG LEU 56 -3.965 -2.988 2.383 1223 HD11 LEU 56 HD11 LEU 56 -5.014 -5.055 1.629 1224 HD12 LEU 56 HD12 LEU 56 -5.520 -3.693 0.633 1225 HD13 LEU 56 HD13 LEU 56 -6.620 -4.351 1.848 1226 HD21 LEU 56 HD21 LEU 56 -5.238 -1.107 3.312 1227 HD22 LEU 56 HD22 LEU 56 -6.756 -1.896 2.876 1228 HD23 LEU 56 HD23 LEU 56 -5.634 -1.372 1.616 1229 H LEU 57 H LEU 57 -2.272 -4.518 6.430 1230 HA LEU 57 HA LEU 57 -3.647 -6.232 8.318 1231 HB2 LEU 57 HB2 LEU 57 -1.011 -4.721 8.380 1232 HB3 LEU 57 HB3 LEU 57 -1.696 -5.386 9.855 1233 HG LEU 57 HG LEU 57 -1.622 -7.670 8.835 1234 HD11 LEU 57 HD11 LEU 57 -1.708 -7.099 6.455 1235 HD12 LEU 57 HD12 LEU 57 -0.314 -8.108 6.818 1236 HD13 LEU 57 HD13 LEU 57 -0.096 -6.375 6.549 1237 HD21 LEU 57 HD21 LEU 57 0.827 -7.955 9.065 1238 HD22 LEU 57 HD22 LEU 57 0.147 -6.940 10.338 1239 HD23 LEU 57 HD23 LEU 57 1.028 -6.199 8.999 1240 H VAL 58 H VAL 58 -5.341 -5.387 9.259 1241 HA VAL 58 HA VAL 58 -5.228 -2.796 10.628 1242 HB VAL 58 HB VAL 58 -6.201 -2.318 8.363 1243 HG11 VAL 58 HG11 VAL 58 -7.163 -4.491 7.845 1244 HG12 VAL 58 HG12 VAL 58 -8.397 -3.239 7.707 1245 HG13 VAL 58 HG13 VAL 58 -8.370 -4.297 9.121 1246 HG21 VAL 58 HG21 VAL 58 -8.255 -1.137 9.108 1247 HG22 VAL 58 HG22 VAL 58 -6.936 -0.926 10.258 1248 HG23 VAL 58 HG23 VAL 58 -8.242 -2.057 10.617 1249 H ASN 59 H ASN 59 -6.698 -2.753 12.425 1250 HA ASN 59 HA ASN 59 -7.351 -5.359 13.438 1251 HB2 ASN 59 HB2 ASN 59 -8.348 -4.056 15.389 1252 HB3 ASN 59 HB3 ASN 59 -6.632 -3.865 15.089 1253 HD21 ASN 59 HD21 ASN 59 -6.517 -1.933 16.178 1254 HD22 ASN 59 HD22 ASN 59 -7.188 -0.465 15.562 1255 H ASP 60 H ASP 60 -9.142 -6.466 13.235 1256 HA ASP 60 HA ASP 60 -11.249 -5.880 11.536 1257 HB2 ASP 60 HB2 ASP 60 -10.662 -8.164 12.114 1258 HB3 ASP 60 HB3 ASP 60 -11.108 -7.907 13.791 1259 H ASP 61 H ASP 61 -13.171 -4.935 11.710 1260 HA ASP 61 HA ASP 61 -14.384 -4.261 14.284 1261 HB2 ASP 61 HB2 ASP 61 -13.057 -2.298 13.910 1262 HB3 ASP 61 HB3 ASP 61 -13.439 -2.253 12.195 1263 H GLN 62 H GLN 62 -16.587 -3.503 14.013 1264 HA GLN 62 HA GLN 62 -18.256 -5.145 12.516 1265 HB2 GLN 62 HB2 GLN 62 -18.947 -2.372 13.601 1266 HB3 GLN 62 HB3 GLN 62 -20.084 -3.684 13.270 1267 HG2 GLN 62 HG2 GLN 62 -19.145 -5.020 15.079 1268 HG3 GLN 62 HG3 GLN 62 -17.879 -3.821 15.353 1269 HE21 GLN 62 HE21 GLN 62 -18.423 -1.870 16.384 1270 HE22 GLN 62 HE22 GLN 62 -19.895 -1.666 17.258 1271 H ARG 63 H ARG 63 -17.176 -1.844 11.841 1272 HA ARG 63 HA ARG 63 -18.861 -1.555 9.480 1273 HB2 ARG 63 HB2 ARG 63 -16.752 0.385 10.535 1274 HB3 ARG 63 HB3 ARG 63 -17.925 0.719 9.267 1275 HG2 ARG 63 HG2 ARG 63 -18.809 1.806 11.162 1276 HG3 ARG 63 HG3 ARG 63 -19.745 0.312 11.072 1277 HD2 ARG 63 HD2 ARG 63 -18.302 -0.696 12.787 1278 HD3 ARG 63 HD3 ARG 63 -17.337 0.778 12.860 1279 HE ARG 63 HE ARG 63 -20.048 1.336 13.429 1280 HH11 ARG 63 HH11 ARG 63 -17.193 -0.166 14.847 1281 HH12 ARG 63 HH12 ARG 63 -17.694 0.160 16.475 1282 HH21 ARG 63 HH21 ARG 63 -20.682 1.747 15.583 1283 HH22 ARG 63 HH22 ARG 63 -19.664 1.240 16.893 1284 H LEU 64 H LEU 64 -15.550 -2.318 10.304 1285 HA LEU 64 HA LEU 64 -14.225 -1.961 7.877 1286 HB2 LEU 64 HB2 LEU 64 -13.199 -2.666 10.102 1287 HB3 LEU 64 HB3 LEU 64 -13.769 -4.291 9.775 1288 HG LEU 64 HG LEU 64 -12.350 -4.199 7.614 1289 HD11 LEU 64 HD11 LEU 64 -10.471 -2.647 7.570 1290 HD12 LEU 64 HD12 LEU 64 -11.048 -1.862 9.043 1291 HD13 LEU 64 HD13 LEU 64 -11.992 -1.755 7.551 1292 HD21 LEU 64 HD21 LEU 64 -10.310 -4.840 8.767 1293 HD22 LEU 64 HD22 LEU 64 -11.712 -5.507 9.600 1294 HD23 LEU 64 HD23 LEU 64 -10.884 -4.090 10.259 1295 H GLU 65 H GLU 65 -15.956 -4.820 9.073 1296 HA GLU 65 HA GLU 65 -15.663 -6.525 6.841 1297 HB2 GLU 65 HB2 GLU 65 -17.891 -6.451 8.915 1298 HB3 GLU 65 HB3 GLU 65 -17.515 -7.820 7.867 1299 HG2 GLU 65 HG2 GLU 65 -15.344 -8.095 8.932 1300 HG3 GLU 65 HG3 GLU 65 -15.603 -6.661 9.921 1301 H GLN 66 H GLN 66 -18.114 -4.145 7.657 1302 HA GLN 66 HA GLN 66 -19.962 -4.644 5.566 1303 HB2 GLN 66 HB2 GLN 66 -20.556 -3.396 7.591 1304 HB3 GLN 66 HB3 GLN 66 -19.388 -2.137 7.199 1305 HG2 GLN 66 HG2 GLN 66 -20.716 -1.508 5.222 1306 HG3 GLN 66 HG3 GLN 66 -21.876 -2.789 5.594 1307 HE21 GLN 66 HE21 GLN 66 -23.569 -1.253 5.780 1308 HE22 GLN 66 HE22 GLN 66 -23.705 -0.203 7.144 1309 H MET 67 H MET 67 -17.117 -2.556 5.818 1310 HA MET 67 HA MET 67 -17.390 -1.309 3.248 1311 HB2 MET 67 HB2 MET 67 -14.959 -1.545 5.056 1312 HB3 MET 67 HB3 MET 67 -15.033 -0.552 3.605 1313 HG2 MET 67 HG2 MET 67 -16.855 0.782 4.653 1314 HG3 MET 67 HG3 MET 67 -16.660 -0.169 6.126 1315 HE1 MET 67 HE1 MET 67 -14.065 -0.474 7.155 1316 HE2 MET 67 HE2 MET 67 -12.793 0.705 6.847 1317 HE3 MET 67 HE3 MET 67 -13.248 -0.445 5.592 1318 H ILE 68 H ILE 68 -15.767 -4.208 4.451 1319 HA ILE 68 HA ILE 68 -14.297 -4.915 2.129 1320 HB ILE 68 HB ILE 68 -15.520 -6.695 4.297 1321 HG12 ILE 68 HG12 ILE 68 -12.607 -5.815 3.980 1322 HG13 ILE 68 HG13 ILE 68 -13.759 -5.015 5.039 1323 HG21 ILE 68 HG21 ILE 68 -13.971 -8.483 3.552 1324 HG22 ILE 68 HG22 ILE 68 -13.451 -7.473 2.202 1325 HG23 ILE 68 HG23 ILE 68 -15.116 -8.049 2.284 1326 HD11 ILE 68 HD11 ILE 68 -12.818 -7.870 5.279 1327 HD12 ILE 68 HD12 ILE 68 -13.996 -7.087 6.336 1328 HD13 ILE 68 HD13 ILE 68 -12.332 -6.508 6.286 1329 H SER 69 H SER 69 -17.635 -5.462 3.139 1330 HA SER 69 HA SER 69 -18.494 -7.091 0.967 1331 HB2 SER 69 HB2 SER 69 -20.129 -5.223 2.743 1332 HB3 SER 69 HB3 SER 69 -20.781 -6.521 1.735 1333 HG SER 69 HG SER 69 -18.914 -6.897 3.846 1334 H GLN 70 H GLN 70 -18.273 -3.599 1.464 1335 HA GLN 70 HA GLN 70 -19.871 -2.781 -0.776 1336 HB2 GLN 70 HB2 GLN 70 -19.410 -1.475 1.390 1337 HB3 GLN 70 HB3 GLN 70 -17.809 -1.124 0.765 1338 HG2 GLN 70 HG2 GLN 70 -20.370 -0.296 -0.635 1339 HG3 GLN 70 HG3 GLN 70 -19.544 0.714 0.544 1340 HE21 GLN 70 HE21 GLN 70 -17.443 1.541 -0.021 1341 HE22 GLN 70 HE22 GLN 70 -16.958 1.681 -1.668 1342 H ILE 71 H ILE 71 -16.368 -2.794 -0.115 1343 HA ILE 71 HA ILE 71 -15.542 -1.697 -2.586 1344 HB ILE 71 HB ILE 71 -14.176 -1.603 -0.487 1345 HG12 ILE 71 HG12 ILE 71 -12.783 -2.772 -2.943 1346 HG13 ILE 71 HG13 ILE 71 -13.077 -1.069 -2.613 1347 HG21 ILE 71 HG21 ILE 71 -12.804 -3.500 0.232 1348 HG22 ILE 71 HG22 ILE 71 -13.506 -4.517 -1.029 1349 HG23 ILE 71 HG23 ILE 71 -14.517 -3.920 0.287 1350 HD11 ILE 71 HD11 ILE 71 -11.230 -2.895 -1.092 1351 HD12 ILE 71 HD12 ILE 71 -11.538 -1.199 -0.699 1352 HD13 ILE 71 HD13 ILE 71 -10.773 -1.629 -2.228 1353 H ASP 72 H ASP 72 -16.110 -4.976 -1.514 1354 HA ASP 72 HA ASP 72 -14.763 -6.432 -3.499 1355 HB2 ASP 72 HB2 ASP 72 -15.571 -7.521 -1.485 1356 HB3 ASP 72 HB3 ASP 72 -17.240 -7.099 -1.856 1357 H LYS 73 H LYS 73 -17.829 -4.746 -3.562 1358 HA LYS 73 HA LYS 73 -19.006 -6.052 -5.813 1359 HB2 LYS 73 HB2 LYS 73 -19.591 -3.252 -4.787 1360 HB3 LYS 73 HB3 LYS 73 -20.632 -4.216 -5.823 1361 HG2 LYS 73 HG2 LYS 73 -19.955 -4.793 -2.922 1362 HG3 LYS 73 HG3 LYS 73 -21.462 -4.114 -3.524 1363 HD2 LYS 73 HD2 LYS 73 -22.107 -6.321 -3.251 1364 HD3 LYS 73 HD3 LYS 73 -21.563 -6.386 -4.923 1365 HE2 LYS 73 HE2 LYS 73 -19.389 -7.299 -4.163 1366 HE3 LYS 73 HE3 LYS 73 -19.942 -7.222 -2.492 1367 HZ1 LYS 73 HZ1 LYS 73 -21.662 -8.815 -3.014 1368 HZ2 LYS 73 HZ2 LYS 73 -20.148 -9.441 -3.436 1369 HZ3 LYS 73 HZ3 LYS 73 -21.180 -8.856 -4.635 1370 H LEU 74 H LEU 74 -16.661 -3.511 -5.475 1371 HA LEU 74 HA LEU 74 -16.935 -2.305 -8.044 1372 HB2 LEU 74 HB2 LEU 74 -14.695 -2.282 -5.992 1373 HB3 LEU 74 HB3 LEU 74 -14.499 -1.506 -7.554 1374 HG LEU 74 HG LEU 74 -15.077 0.187 -5.941 1375 HD11 LEU 74 HD11 LEU 74 -17.501 -0.365 -7.688 1376 HD12 LEU 74 HD12 LEU 74 -16.040 0.496 -8.176 1377 HD13 LEU 74 HD13 LEU 74 -17.091 1.183 -6.941 1378 HD21 LEU 74 HD21 LEU 74 -17.562 -1.416 -5.235 1379 HD22 LEU 74 HD22 LEU 74 -17.142 0.182 -4.614 1380 HD23 LEU 74 HD23 LEU 74 -16.134 -1.204 -4.218 1381 H GLU 75 H GLU 75 -15.817 -2.624 -9.901 1382 HA GLU 75 HA GLU 75 -14.934 -5.251 -10.573 1383 HB2 GLU 75 HB2 GLU 75 -14.428 -4.206 -12.815 1384 HB3 GLU 75 HB3 GLU 75 -16.067 -3.950 -12.230 1385 HG2 GLU 75 HG2 GLU 75 -15.407 -1.661 -11.464 1386 HG3 GLU 75 HG3 GLU 75 -13.811 -1.923 -12.169 1387 H ASP 76 H ASP 76 -13.282 -2.688 -9.109 1388 HA ASP 76 HA ASP 76 -10.614 -3.153 -9.882 1389 HB2 ASP 76 HB2 ASP 76 -11.702 -2.386 -7.129 1390 HB3 ASP 76 HB3 ASP 76 -10.030 -2.218 -7.649 1391 H VAL 77 H VAL 77 -12.538 -4.436 -7.193 1392 HA VAL 77 HA VAL 77 -10.520 -6.330 -6.384 1393 HB VAL 77 HB VAL 77 -13.355 -5.788 -5.371 1394 HG11 VAL 77 HG11 VAL 77 -12.803 -8.147 -4.939 1395 HG12 VAL 77 HG12 VAL 77 -12.826 -7.228 -3.437 1396 HG13 VAL 77 HG13 VAL 77 -11.282 -7.672 -4.175 1397 HG21 VAL 77 HG21 VAL 77 -10.641 -5.144 -4.142 1398 HG22 VAL 77 HG22 VAL 77 -12.217 -4.780 -3.432 1399 HG23 VAL 77 HG23 VAL 77 -11.723 -3.987 -4.926 1400 H VAL 78 H VAL 78 -10.225 -7.886 -7.849 1401 HA VAL 78 HA VAL 78 -12.228 -9.327 -9.284 1402 HB VAL 78 HB VAL 78 -9.409 -10.326 -8.619 1403 HG11 VAL 78 HG11 VAL 78 -9.564 -11.543 -10.747 1404 HG12 VAL 78 HG12 VAL 78 -11.181 -10.891 -11.024 1405 HG13 VAL 78 HG13 VAL 78 -10.891 -11.994 -9.672 1406 HG21 VAL 78 HG21 VAL 78 -8.587 -9.215 -10.664 1407 HG22 VAL 78 HG22 VAL 78 -9.196 -8.041 -9.498 1408 HG23 VAL 78 HG23 VAL 78 -10.170 -8.468 -10.909 1409 H LYS 79 H LYS 79 -10.281 -9.960 -6.385 1410 HA LYS 79 HA LYS 79 -12.290 -11.795 -5.260 1411 HB2 LYS 79 HB2 LYS 79 -9.286 -12.358 -5.258 1412 HB3 LYS 79 HB3 LYS 79 -10.511 -13.323 -4.439 1413 HG2 LYS 79 HG2 LYS 79 -11.457 -14.023 -6.570 1414 HG3 LYS 79 HG3 LYS 79 -10.359 -12.950 -7.441 1415 HD2 LYS 79 HD2 LYS 79 -8.424 -14.267 -6.600 1416 HD3 LYS 79 HD3 LYS 79 -9.538 -15.350 -5.761 1417 HE2 LYS 79 HE2 LYS 79 -10.516 -16.006 -7.951 1418 HE3 LYS 79 HE3 LYS 79 -9.362 -14.946 -8.770 1419 HZ1 LYS 79 HZ1 LYS 79 -8.642 -17.263 -7.051 1420 HZ2 LYS 79 HZ2 LYS 79 -7.556 -16.272 -7.886 1421 HZ3 LYS 79 HZ3 LYS 79 -8.629 -17.258 -8.743 1422 H VAL 80 H VAL 80 -12.389 -11.721 -2.983 1423 HA VAL 80 HA VAL 80 -10.374 -10.097 -1.554 1424 HB VAL 80 HB VAL 80 -12.502 -8.722 -1.856 1425 HG11 VAL 80 HG11 VAL 80 -14.463 -9.196 -0.446 1426 HG12 VAL 80 HG12 VAL 80 -13.743 -10.730 0.049 1427 HG13 VAL 80 HG13 VAL 80 -14.190 -10.471 -1.637 1428 HG21 VAL 80 HG21 VAL 80 -11.651 -9.328 1.007 1429 HG22 VAL 80 HG22 VAL 80 -12.510 -7.879 0.480 1430 HG23 VAL 80 HG23 VAL 80 -10.875 -8.191 -0.099 1431 H GLN 81 H GLN 81 -9.764 -10.929 0.369 1432 HA GLN 81 HA GLN 81 -10.983 -13.383 1.425 1433 HB2 GLN 81 HB2 GLN 81 -8.059 -13.044 0.601 1434 HB3 GLN 81 HB3 GLN 81 -8.597 -14.326 1.680 1435 HG2 GLN 81 HG2 GLN 81 -9.560 -13.953 -1.172 1436 HG3 GLN 81 HG3 GLN 81 -8.278 -15.059 -0.683 1437 HE21 GLN 81 HE21 GLN 81 -8.838 -16.900 0.574 1438 HE22 GLN 81 HE22 GLN 81 -10.455 -17.504 0.627 1439 H ARG 82 H ARG 82 -11.562 -12.651 3.412 1440 HA ARG 82 HA ARG 82 -9.690 -11.034 4.981 1441 HB2 ARG 82 HB2 ARG 82 -11.540 -11.063 6.744 1442 HB3 ARG 82 HB3 ARG 82 -11.880 -10.217 5.250 1443 HG2 ARG 82 HG2 ARG 82 -13.885 -11.295 5.795 1444 HG3 ARG 82 HG3 ARG 82 -13.193 -12.296 4.524 1445 HD2 ARG 82 HD2 ARG 82 -14.213 -13.570 6.435 1446 HD3 ARG 82 HD3 ARG 82 -12.530 -13.979 6.099 1447 HE ARG 82 HE ARG 82 -13.230 -12.068 8.245 1448 HH11 ARG 82 HH11 ARG 82 -11.720 -15.101 7.293 1449 HH12 ARG 82 HH12 ARG 82 -10.985 -15.361 8.842 1450 HH21 ARG 82 HH21 ARG 82 -12.247 -12.426 10.276 1451 HH22 ARG 82 HH22 ARG 82 -11.285 -13.848 10.529 1452 H ASN 83 H ASN 83 -8.334 -11.822 6.383 1453 HA ASN 83 HA ASN 83 -8.731 -14.395 7.749 1454 HB2 ASN 83 HB2 ASN 83 -6.251 -13.655 6.096 1455 HB3 ASN 83 HB3 ASN 83 -6.254 -14.943 7.294 1456 HD21 ASN 83 HD21 ASN 83 -7.450 -13.952 4.150 1457 HD22 ASN 83 HD22 ASN 83 -7.935 -15.526 3.630 1458 H GLN 84 H GLN 84 -7.691 -14.386 9.811 1459 HA GLN 84 HA GLN 84 -6.094 -11.970 10.519 1460 HB2 GLN 84 HB2 GLN 84 -6.877 -12.175 12.836 1461 HB3 GLN 84 HB3 GLN 84 -8.234 -11.985 11.747 1462 HG2 GLN 84 HG2 GLN 84 -9.169 -13.669 12.938 1463 HG3 GLN 84 HG3 GLN 84 -8.142 -14.728 11.976 1464 HE21 GLN 84 HE21 GLN 84 -9.192 -15.169 14.645 1465 HE22 GLN 84 HE22 GLN 84 -7.836 -15.396 15.688 1466 H SER 85 H SER 85 -3.995 -12.404 11.037 1467 HA SER 85 HA SER 85 -3.075 -14.939 12.027 1468 HB2 SER 85 HB2 SER 85 -3.594 -15.491 9.614 1469 HB3 SER 85 HB3 SER 85 -2.440 -14.255 9.115 1470 HG SER 85 HG SER 85 -2.022 -16.808 10.030 1471 H ASP 86 H ASP 86 -0.585 -15.032 11.691 1472 HA ASP 86 HA ASP 86 0.641 -12.779 12.893 1473 HB2 ASP 86 HB2 ASP 86 1.881 -15.263 11.625 1474 HB3 ASP 86 HB3 ASP 86 2.757 -14.103 12.620 1475 HA PRO 87 HA PRO 87 2.060 -10.501 9.248 1476 HB2 PRO 87 HB2 PRO 87 4.273 -9.230 10.241 1477 HB3 PRO 87 HB3 PRO 87 2.628 -8.783 10.736 1478 HG2 PRO 87 HG2 PRO 87 4.593 -10.560 12.154 1479 HG3 PRO 87 HG3 PRO 87 3.603 -9.233 12.807 1480 HD2 PRO 87 HD2 PRO 87 2.860 -11.816 13.079 1481 HD3 PRO 87 HD3 PRO 87 1.665 -10.517 12.861 1482 H THR 88 H THR 88 3.638 -13.190 10.498 1483 HA THR 88 HA THR 88 6.002 -13.409 9.005 1484 HB THR 88 HB THR 88 5.671 -15.893 9.241 1485 HG1 THR 88 HG1 THR 88 3.790 -16.623 10.264 1486 HG21 THR 88 HG21 THR 88 5.111 -14.304 11.778 1487 HG22 THR 88 HG22 THR 88 6.709 -14.632 11.099 1488 HG23 THR 88 HG23 THR 88 5.720 -15.958 11.712 1489 H MET 89 H MET 89 2.676 -13.599 8.038 1490 HA MET 89 HA MET 89 2.732 -14.827 5.568 1491 HB2 MET 89 HB2 MET 89 1.190 -12.351 6.443 1492 HB3 MET 89 HB3 MET 89 0.895 -13.189 4.919 1493 HG2 MET 89 HG2 MET 89 0.579 -14.383 7.683 1494 HG3 MET 89 HG3 MET 89 -0.726 -13.862 6.612 1495 HE1 MET 89 HE1 MET 89 -0.675 -16.782 7.892 1496 HE2 MET 89 HE2 MET 89 -1.051 -17.800 6.504 1497 HE3 MET 89 HE3 MET 89 -1.931 -16.292 6.752 1498 H PHE 90 H PHE 90 3.802 -11.508 6.358 1499 HA PHE 90 HA PHE 90 4.383 -10.450 3.870 1500 HB2 PHE 90 HB2 PHE 90 5.897 -10.130 6.491 1501 HB3 PHE 90 HB3 PHE 90 6.409 -9.276 5.045 1502 HD1 PHE 90 HD1 PHE 90 4.335 -7.950 3.839 1503 HD2 PHE 90 HD2 PHE 90 4.637 -8.847 8.007 1504 HE1 PHE 90 HE1 PHE 90 2.885 -6.036 4.360 1505 HE2 PHE 90 HE2 PHE 90 3.180 -6.937 8.517 1506 HZ PHE 90 HZ PHE 90 2.299 -5.525 6.697 1507 H ASN 91 H ASN 91 6.658 -12.297 5.907 1508 HA ASN 91 HA ASN 91 8.781 -12.332 4.012 1509 HB2 ASN 91 HB2 ASN 91 9.171 -12.553 6.446 1510 HB3 ASN 91 HB3 ASN 91 8.334 -14.099 6.458 1511 HD21 ASN 91 HD21 ASN 91 9.399 -15.936 5.600 1512 HD22 ASN 91 HD22 ASN 91 11.091 -15.945 5.250 1513 H LYS 92 H LYS 92 6.245 -14.597 4.846 1514 HA LYS 92 HA LYS 92 7.073 -16.959 3.659 1515 HB2 LYS 92 HB2 LYS 92 5.176 -16.792 5.205 1516 HB3 LYS 92 HB3 LYS 92 4.261 -15.851 4.034 1517 HG2 LYS 92 HG2 LYS 92 4.090 -17.800 2.553 1518 HG3 LYS 92 HG3 LYS 92 5.104 -18.746 3.650 1519 HD2 LYS 92 HD2 LYS 92 3.389 -18.526 5.430 1520 HD3 LYS 92 HD3 LYS 92 2.369 -17.583 4.340 1521 HE2 LYS 92 HE2 LYS 92 3.218 -20.460 3.865 1522 HE3 LYS 92 HE3 LYS 92 1.667 -19.961 4.537 1523 HZ1 LYS 92 HZ1 LYS 92 1.438 -20.397 2.215 1524 HZ2 LYS 92 HZ2 LYS 92 2.698 -19.342 1.828 1525 HZ3 LYS 92 HZ3 LYS 92 1.255 -18.736 2.466 1526 H ILE 93 H ILE 93 4.968 -14.433 2.279 1527 HA ILE 93 HA ILE 93 4.882 -15.700 -0.345 1528 HB ILE 93 HB ILE 93 3.411 -13.800 -0.981 1529 HG12 ILE 93 HG12 ILE 93 4.278 -12.740 1.728 1530 HG13 ILE 93 HG13 ILE 93 4.198 -11.895 0.192 1531 HG21 ILE 93 HG21 ILE 93 2.626 -15.080 1.667 1532 HG22 ILE 93 HG22 ILE 93 2.439 -15.813 0.072 1533 HG23 ILE 93 HG23 ILE 93 1.520 -14.370 0.487 1534 HD11 ILE 93 HD11 ILE 93 2.536 -11.099 1.771 1535 HD12 ILE 93 HD12 ILE 93 1.832 -12.703 1.876 1536 HD13 ILE 93 HD13 ILE 93 1.772 -11.808 0.355 1537 H ALA 94 H ALA 94 6.701 -13.145 1.211 1538 HA ALA 94 HA ALA 94 7.685 -11.766 -1.053 1539 HB1 ALA 94 HB1 ALA 94 7.870 -10.869 1.229 1540 HB2 ALA 94 HB2 ALA 94 9.444 -10.910 0.433 1541 HB3 ALA 94 HB3 ALA 94 9.031 -12.133 1.641 1542 H VAL 95 H VAL 95 8.704 -14.790 0.462 1543 HA VAL 95 HA VAL 95 11.173 -15.193 -0.851 1544 HB VAL 95 HB VAL 95 9.102 -17.270 0.025 1545 HG11 VAL 95 HG11 VAL 95 10.923 -18.958 -0.046 1546 HG12 VAL 95 HG12 VAL 95 12.012 -17.758 -0.750 1547 HG13 VAL 95 HG13 VAL 95 10.591 -18.297 -1.648 1548 HG21 VAL 95 HG21 VAL 95 11.618 -16.285 1.426 1549 HG22 VAL 95 HG22 VAL 95 10.549 -17.565 2.008 1550 HG23 VAL 95 HG23 VAL 95 9.952 -15.913 1.882 1551 H PHE 96 H PHE 96 7.848 -15.811 -1.881 1552 HA PHE 96 HA PHE 96 8.629 -17.055 -4.409 1553 HB2 PHE 96 HB2 PHE 96 5.877 -16.414 -3.251 1554 HB3 PHE 96 HB3 PHE 96 6.168 -17.349 -4.717 1555 HD1 PHE 96 HD2 PHE 96 7.291 -19.599 -4.559 1556 HD2 PHE 96 HD1 PHE 96 6.099 -17.443 -1.065 1557 HE1 PHE 96 HE2 PHE 96 7.480 -21.655 -3.225 1558 HE2 PHE 96 HE1 PHE 96 6.306 -19.499 0.267 1559 HZ PHE 96 HZ PHE 96 6.992 -21.609 -0.809 1560 H PHE 97 H PHE 97 7.694 -13.946 -3.214 1561 HA PHE 97 HA PHE 97 7.304 -11.905 -4.077 1562 HB2 PHE 97 HB2 PHE 97 8.781 -13.020 -6.500 1563 HB3 PHE 97 HB3 PHE 97 8.388 -11.317 -6.281 1564 HD1 PHE 97 HD2 PHE 97 9.404 -10.053 -4.323 1565 HD2 PHE 97 HD1 PHE 97 10.719 -13.974 -5.416 1566 HE1 PHE 97 HE2 PHE 97 11.472 -9.728 -3.039 1567 HE2 PHE 97 HE1 PHE 97 12.783 -13.633 -4.122 1568 HZ PHE 97 HZ PHE 97 13.161 -11.509 -2.937 1569 H GLN 98 H GLN 98 5.491 -14.298 -4.766 1570 HA GLN 98 HA GLN 98 3.346 -12.938 -5.935 1571 HB2 GLN 98 HB2 GLN 98 4.585 -13.232 -8.078 1572 HB3 GLN 98 HB3 GLN 98 4.721 -14.961 -7.784 1573 HG2 GLN 98 HG2 GLN 98 2.258 -15.175 -7.926 1574 HG3 GLN 98 HG3 GLN 98 2.128 -13.447 -8.226 1575 HE21 GLN 98 HE21 GLN 98 3.226 -16.507 -9.547 1576 HE22 GLN 98 HE22 GLN 98 3.255 -16.006 -11.201 Start of MODEL 13 1 H1 GLY 1 H1 GLY 1 8.958 4.147 -17.496 2 H2 GLY 1 H2 GLY 1 8.824 3.079 -18.791 3 H3 GLY 1 H3 GLY 1 8.164 2.669 -17.294 4 HA2 GLY 1 HA3 GLY 1 6.581 4.492 -17.463 5 HA3 GLY 1 HA2 GLY 1 7.268 4.898 -19.032 6 H SER 2 H SER 2 4.879 4.585 -19.569 7 HA SER 2 HA SER 2 3.955 1.904 -20.018 8 HB2 SER 2 HB2 SER 2 2.363 3.809 -19.889 9 HB3 SER 2 HB3 SER 2 3.082 4.521 -21.334 10 HG SER 2 HG SER 2 2.287 2.865 -22.553 11 H MET 3 H MET 3 5.797 0.964 -20.906 12 HA MET 3 HA MET 3 6.179 0.953 -23.725 13 HB2 MET 3 HB2 MET 3 8.488 1.825 -23.815 14 HB3 MET 3 HB3 MET 3 7.412 3.069 -23.207 15 HG2 MET 3 HG2 MET 3 8.208 2.634 -20.906 16 HG3 MET 3 HG3 MET 3 9.300 1.391 -21.530 17 HE1 MET 3 HE1 MET 3 10.457 3.712 -19.736 18 HE2 MET 3 HE2 MET 3 11.850 4.254 -20.670 19 HE3 MET 3 HE3 MET 3 11.510 2.530 -20.519 20 H GLN 4 H GLN 4 8.812 -0.182 -23.718 21 HA GLN 4 HA GLN 4 8.560 -2.786 -22.749 22 HB2 GLN 4 HB2 GLN 4 10.228 -2.136 -24.448 23 HB3 GLN 4 HB3 GLN 4 11.085 -1.145 -23.274 24 HG2 GLN 4 HG2 GLN 4 11.671 -3.193 -21.994 25 HG3 GLN 4 HG3 GLN 4 10.812 -4.167 -23.192 26 HE21 GLN 4 HE21 GLN 4 12.722 -5.324 -23.707 27 HE22 GLN 4 HE22 GLN 4 14.004 -4.608 -24.614 28 H ASN 5 H ASN 5 8.170 -3.270 -20.640 29 HA ASN 5 HA ASN 5 9.311 -1.703 -18.444 30 HB2 ASN 5 HB2 ASN 5 7.374 -4.060 -18.436 31 HB3 ASN 5 HB3 ASN 5 7.893 -3.200 -16.990 32 HD21 ASN 5 HD21 ASN 5 7.802 -0.546 -18.064 33 HD22 ASN 5 HD22 ASN 5 6.143 -0.156 -18.324 34 H THR 6 H THR 6 11.198 -2.210 -17.615 35 HA THR 6 HA THR 6 12.162 -5.006 -17.492 36 HB THR 6 HB THR 6 14.478 -4.049 -17.431 37 HG1 THR 6 HG1 THR 6 13.292 -1.563 -18.167 38 HG21 THR 6 HG21 THR 6 14.663 -3.404 -19.808 39 HG22 THR 6 HG22 THR 6 12.914 -3.185 -19.894 40 HG23 THR 6 HG23 THR 6 13.589 -4.792 -19.615 41 H THR 7 H THR 7 13.771 -5.239 -15.572 42 HA THR 7 HA THR 7 12.456 -4.407 -13.153 43 HB THR 7 HB THR 7 14.360 -5.709 -12.047 44 HG1 THR 7 HG1 THR 7 15.973 -5.582 -13.585 45 HG21 THR 7 HG21 THR 7 12.198 -6.810 -12.568 46 HG22 THR 7 HG22 THR 7 13.547 -7.926 -12.788 47 HG23 THR 7 HG23 THR 7 12.779 -7.187 -14.194 48 H HIS 8 H HIS 8 14.691 -2.774 -15.094 49 HA HIS 8 HA HIS 8 15.508 -1.053 -12.828 50 HB2 HIS 8 HB2 HIS 8 17.168 -0.033 -14.282 51 HB3 HIS 8 HB3 HIS 8 17.348 -1.777 -14.340 52 HD1 HIS 8 HD1 HIS 8 17.542 -2.760 -16.622 53 HD2 HIS 8 HD2 HIS 8 15.823 1.023 -16.712 54 HE1 HIS 8 HE1 HIS 8 17.379 -2.148 -19.052 55 HE2 HIS 8 HE2 HIS 8 16.214 0.075 -19.084 56 H ASP 9 H ASP 9 13.102 -1.290 -15.165 57 HA ASP 9 HA ASP 9 12.728 1.470 -15.873 58 HB2 ASP 9 HB2 ASP 9 11.884 -0.416 -17.254 59 HB3 ASP 9 HB3 ASP 9 10.758 -0.859 -15.980 60 H ASN 10 H ASN 10 11.471 -0.611 -13.302 61 HA ASN 10 HA ASN 10 9.766 1.467 -12.182 62 HB2 ASN 10 HB2 ASN 10 9.200 -0.154 -10.444 63 HB3 ASN 10 HB3 ASN 10 9.094 -0.933 -12.017 64 HD21 ASN 10 HD21 ASN 10 9.401 -2.147 -9.393 65 HD22 ASN 10 HD22 ASN 10 10.857 -3.068 -9.446 66 H VAL 11 H VAL 11 10.032 2.033 -9.819 67 HA VAL 11 HA VAL 11 12.850 2.255 -8.957 68 HB VAL 11 HB VAL 11 12.527 4.516 -8.087 69 HG11 VAL 11 HG11 VAL 11 11.777 4.393 -11.022 70 HG12 VAL 11 HG12 VAL 11 13.408 4.322 -10.352 71 HG13 VAL 11 HG13 VAL 11 12.453 5.795 -10.184 72 HG21 VAL 11 HG21 VAL 11 9.728 4.472 -9.285 73 HG22 VAL 11 HG22 VAL 11 10.514 5.886 -8.581 74 HG23 VAL 11 HG23 VAL 11 10.134 4.493 -7.568 75 H ILE 12 H ILE 12 13.148 2.297 -6.773 76 HA ILE 12 HA ILE 12 11.038 1.194 -5.071 77 HB ILE 12 HB ILE 12 14.020 1.526 -4.482 78 HG12 ILE 12 HG12 ILE 12 13.677 0.045 -6.478 79 HG13 ILE 12 HG13 ILE 12 14.385 -0.810 -5.118 80 HG21 ILE 12 HG21 ILE 12 13.644 -0.145 -2.727 81 HG22 ILE 12 HG22 ILE 12 11.931 -0.214 -3.135 82 HG23 ILE 12 HG23 ILE 12 12.625 1.273 -2.485 83 HD11 ILE 12 HD11 ILE 12 11.516 -0.949 -6.031 84 HD12 ILE 12 HD12 ILE 12 12.184 -1.796 -4.633 85 HD13 ILE 12 HD13 ILE 12 12.762 -2.177 -6.254 86 H LEU 13 H LEU 13 9.846 3.066 -4.632 87 HA LEU 13 HA LEU 13 11.172 5.488 -3.663 88 HB2 LEU 13 HB2 LEU 13 9.168 5.364 -5.357 89 HB3 LEU 13 HB3 LEU 13 8.167 5.110 -3.943 90 HG LEU 13 HG LEU 13 8.139 7.470 -4.720 91 HD11 LEU 13 HD11 LEU 13 8.511 8.626 -2.613 92 HD12 LEU 13 HD12 LEU 13 9.449 7.264 -1.995 93 HD13 LEU 13 HD13 LEU 13 7.729 7.070 -2.336 94 HD21 LEU 13 HD21 LEU 13 10.387 7.595 -5.669 95 HD22 LEU 13 HD22 LEU 13 11.097 7.527 -4.055 96 HD23 LEU 13 HD23 LEU 13 10.112 8.912 -4.530 97 H GLU 14 H GLU 14 11.936 4.928 -1.622 98 HA GLU 14 HA GLU 14 10.145 3.748 0.374 99 HB2 GLU 14 HB2 GLU 14 12.495 2.925 0.190 100 HB3 GLU 14 HB3 GLU 14 13.092 4.541 0.551 101 HG2 GLU 14 HG2 GLU 14 11.972 4.392 2.797 102 HG3 GLU 14 HG3 GLU 14 11.547 2.719 2.432 103 H LEU 15 H LEU 15 8.669 5.353 0.936 104 HA LEU 15 HA LEU 15 9.793 7.832 2.091 105 HB2 LEU 15 HB2 LEU 15 7.274 8.514 2.203 106 HB3 LEU 15 HB3 LEU 15 8.125 8.545 0.677 107 HG LEU 15 HG LEU 15 7.071 6.168 0.297 108 HD11 LEU 15 HD11 LEU 15 4.877 5.825 1.289 109 HD12 LEU 15 HD12 LEU 15 5.098 7.240 2.320 110 HD13 LEU 15 HD13 LEU 15 6.137 5.829 2.521 111 HD21 LEU 15 HD21 LEU 15 5.108 7.167 -0.771 112 HD22 LEU 15 HD22 LEU 15 6.566 8.103 -1.072 113 HD23 LEU 15 HD23 LEU 15 5.385 8.674 0.110 114 H THR 16 H THR 16 10.135 7.927 4.125 115 HA THR 16 HA THR 16 9.134 5.971 6.035 116 HB THR 16 HB THR 16 11.052 8.314 6.395 117 HG1 THR 16 HG1 THR 16 11.810 6.638 4.950 118 HG21 THR 16 HG21 THR 16 10.518 5.938 8.212 119 HG22 THR 16 HG22 THR 16 9.988 7.596 8.513 120 HG23 THR 16 HG23 THR 16 11.714 7.211 8.486 121 H VAL 17 H VAL 17 7.071 6.430 6.581 122 HA VAL 17 HA VAL 17 6.314 9.191 7.353 123 HB VAL 17 HB VAL 17 4.097 8.771 6.705 124 HG11 VAL 17 HG11 VAL 17 5.837 7.500 4.573 125 HG12 VAL 17 HG12 VAL 17 5.554 9.225 4.805 126 HG13 VAL 17 HG13 VAL 17 4.225 8.177 4.314 127 HG21 VAL 17 HG21 VAL 17 3.687 6.554 7.612 128 HG22 VAL 17 HG22 VAL 17 4.738 5.815 6.407 129 HG23 VAL 17 HG23 VAL 17 3.216 6.558 5.911 130 H ARG 18 H ARG 18 5.155 9.465 9.290 131 HA ARG 18 HA ARG 18 4.918 7.084 11.036 132 HB2 ARG 18 HB2 ARG 18 4.525 8.664 12.895 133 HB3 ARG 18 HB3 ARG 18 6.093 8.875 12.137 134 HG2 ARG 18 HG2 ARG 18 5.311 10.894 11.012 135 HG3 ARG 18 HG3 ARG 18 3.685 10.644 11.650 136 HD2 ARG 18 HD2 ARG 18 6.189 11.244 13.262 137 HD3 ARG 18 HD3 ARG 18 4.821 12.328 12.991 138 HE ARG 18 HE ARG 18 4.319 9.766 14.346 139 HH11 ARG 18 HH11 ARG 18 4.591 13.268 14.674 140 HH12 ARG 18 HH12 ARG 18 3.827 13.278 16.229 141 HH21 ARG 18 HH21 ARG 18 3.389 9.807 16.383 142 HH22 ARG 18 HH22 ARG 18 3.147 11.321 17.201 143 H ASN 19 H ASN 19 2.873 6.764 12.186 144 HA ASN 19 HA ASN 19 0.868 6.549 10.184 145 HB2 ASN 19 HB2 ASN 19 1.433 4.778 11.932 146 HB3 ASN 19 HB3 ASN 19 0.574 5.753 13.117 147 HD21 ASN 19 HD21 ASN 19 0.085 3.000 11.864 148 HD22 ASN 19 HD22 ASN 19 -1.560 3.053 11.348 149 H HIS 20 H HIS 20 0.302 8.579 9.694 150 HA HIS 20 HA HIS 20 -1.418 10.175 11.491 151 HB2 HIS 20 HB2 HIS 20 0.062 10.761 8.904 152 HB3 HIS 20 HB3 HIS 20 -1.301 11.770 9.351 153 HD1 HIS 20 HD1 HIS 20 -0.988 13.387 11.307 154 HD2 HIS 20 HD2 HIS 20 2.359 11.084 10.484 155 HE1 HIS 20 HE1 HIS 20 0.885 14.450 12.585 156 HE2 HIS 20 HE2 HIS 20 2.933 13.170 11.897 157 HA PRO 21 HA PRO 21 -5.331 9.048 9.570 158 HB2 PRO 21 HB2 PRO 21 -5.722 11.986 8.965 159 HB3 PRO 21 HB3 PRO 21 -6.825 10.837 9.756 160 HG2 PRO 21 HG2 PRO 21 -5.498 12.599 11.219 161 HG3 PRO 21 HG3 PRO 21 -5.688 10.925 11.793 162 HD2 PRO 21 HD2 PRO 21 -3.268 12.241 10.583 163 HD3 PRO 21 HD3 PRO 21 -3.370 11.055 11.904 164 H GLY 22 H GLY 22 -4.698 7.921 7.763 165 HA2 GLY 22 HA2 GLY 22 -5.111 7.395 5.573 166 HA3 GLY 22 HA3 GLY 22 -5.638 9.045 5.302 167 H VAL 23 H VAL 23 -2.407 7.918 6.405 168 HA VAL 23 HA VAL 23 -1.005 9.562 4.567 169 HB VAL 23 HB VAL 23 0.195 7.025 5.768 170 HG11 VAL 23 HG11 VAL 23 1.434 9.663 4.897 171 HG12 VAL 23 HG12 VAL 23 1.546 8.123 4.037 172 HG13 VAL 23 HG13 VAL 23 2.303 8.309 5.615 173 HG21 VAL 23 HG21 VAL 23 0.963 8.379 7.683 174 HG22 VAL 23 HG22 VAL 23 -0.798 8.265 7.625 175 HG23 VAL 23 HG23 VAL 23 0.006 9.745 7.100 176 H MET 24 H MET 24 -1.771 6.099 4.514 177 HA MET 24 HA MET 24 -0.552 5.386 2.097 178 HB2 MET 24 HB2 MET 24 -2.051 3.417 2.114 179 HB3 MET 24 HB3 MET 24 -1.329 3.708 3.688 180 HG2 MET 24 HG2 MET 24 -4.152 4.481 2.934 181 HG3 MET 24 HG3 MET 24 -3.705 3.010 3.796 182 HE1 MET 24 HE1 MET 24 -5.918 5.087 4.835 183 HE2 MET 24 HE2 MET 24 -5.506 5.177 6.547 184 HE3 MET 24 HE3 MET 24 -5.483 3.622 5.715 185 H THR 25 H THR 25 -3.590 7.029 2.722 186 HA THR 25 HA THR 25 -4.639 6.879 0.056 187 HB THR 25 HB THR 25 -5.413 8.964 2.140 188 HG1 THR 25 HG1 THR 25 -6.698 6.453 2.011 189 HG21 THR 25 HG21 THR 25 -7.051 7.523 0.005 190 HG22 THR 25 HG22 THR 25 -6.479 9.191 -0.101 191 HG23 THR 25 HG23 THR 25 -7.662 8.743 1.128 192 H HIS 26 H HIS 26 -2.544 9.131 1.810 193 HA HIS 26 HA HIS 26 -2.485 11.265 -0.077 194 HB2 HIS 26 HB2 HIS 26 -0.357 10.408 1.944 195 HB3 HIS 26 HB3 HIS 26 -0.301 11.905 1.022 196 HD1 HIS 26 HD1 HIS 26 -0.119 12.680 3.672 197 HD2 HIS 26 HD2 HIS 26 -3.846 11.530 2.256 198 HE1 HIS 26 HE1 HIS 26 -1.782 13.634 5.290 199 HE2 HIS 26 HE2 HIS 26 -4.021 13.014 4.353 200 H VAL 27 H VAL 27 -0.274 8.518 0.496 201 HA VAL 27 HA VAL 27 1.610 9.229 -1.478 202 HB VAL 27 HB VAL 27 2.718 7.125 -1.064 203 HG11 VAL 27 HG11 VAL 27 2.925 8.777 0.721 204 HG12 VAL 27 HG12 VAL 27 2.945 7.153 1.403 205 HG13 VAL 27 HG13 VAL 27 1.488 8.142 1.526 206 HG21 VAL 27 HG21 VAL 27 0.214 6.118 0.346 207 HG22 VAL 27 HG22 VAL 27 1.765 5.276 0.276 208 HG23 VAL 27 HG23 VAL 27 0.841 5.545 -1.202 209 H CYS 28 H CYS 28 -1.177 6.987 -1.549 210 HA CYS 28 HA CYS 28 -0.681 5.919 -4.142 211 HB2 CYS 28 HB2 CYS 28 -2.994 5.089 -4.017 212 HB3 CYS 28 HB3 CYS 28 -2.167 4.834 -2.483 213 HG CYS 28 HG CYS 28 -3.989 5.879 -1.094 214 H GLY 29 H GLY 29 -2.512 8.723 -2.942 215 HA2 GLY 29 HA2 GLY 29 -3.665 9.599 -5.369 216 HA3 GLY 29 HA3 GLY 29 -3.297 10.610 -3.977 217 H LEU 30 H LEU 30 -0.417 10.063 -4.034 218 HA LEU 30 HA LEU 30 0.420 12.161 -5.764 219 HB2 LEU 30 HB2 LEU 30 1.715 10.412 -3.745 220 HB3 LEU 30 HB3 LEU 30 2.799 10.937 -5.014 221 HG LEU 30 HG LEU 30 2.961 12.439 -3.108 222 HD11 LEU 30 HD11 LEU 30 1.595 13.828 -5.430 223 HD12 LEU 30 HD12 LEU 30 3.305 13.406 -5.322 224 HD13 LEU 30 HD13 LEU 30 2.624 14.590 -4.213 225 HD21 LEU 30 HD21 LEU 30 0.738 12.160 -2.116 226 HD22 LEU 30 HD22 LEU 30 0.008 13.054 -3.452 227 HD23 LEU 30 HD23 LEU 30 1.123 13.866 -2.346 228 H PHE 31 H PHE 31 0.802 8.624 -5.964 229 HA PHE 31 HA PHE 31 2.286 8.774 -8.467 230 HB2 PHE 31 HB2 PHE 31 1.115 6.354 -7.025 231 HB3 PHE 31 HB3 PHE 31 2.203 6.283 -8.413 232 HD1 PHE 31 HD2 PHE 31 4.552 7.303 -8.180 233 HD2 PHE 31 HD1 PHE 31 2.021 6.598 -4.814 234 HE1 PHE 31 HE2 PHE 31 6.489 7.508 -6.673 235 HE2 PHE 31 HE1 PHE 31 3.957 6.821 -3.316 236 HZ PHE 31 HZ PHE 31 6.188 7.276 -4.241 237 H ALA 32 H ALA 32 -1.051 8.247 -7.526 238 HA ALA 32 HA ALA 32 -2.045 7.233 -10.001 239 HB1 ALA 32 HB1 ALA 32 -3.222 6.882 -7.868 240 HB2 ALA 32 HB2 ALA 32 -4.277 7.660 -9.048 241 HB3 ALA 32 HB3 ALA 32 -3.548 8.612 -7.747 242 H ARG 33 H ARG 33 -1.595 10.496 -8.724 243 HA ARG 33 HA ARG 33 -3.368 11.853 -10.522 244 HB2 ARG 33 HB2 ARG 33 -2.587 13.892 -9.533 245 HB3 ARG 33 HB3 ARG 33 -2.652 12.696 -8.246 246 HG2 ARG 33 HG2 ARG 33 -0.112 12.354 -8.717 247 HG3 ARG 33 HG3 ARG 33 -0.222 13.876 -9.601 248 HD2 ARG 33 HD2 ARG 33 -0.818 13.413 -6.665 249 HD3 ARG 33 HD3 ARG 33 0.535 14.324 -7.351 250 HE ARG 33 HE ARG 33 -1.260 15.864 -8.261 251 HH11 ARG 33 HH11 ARG 33 -1.679 14.091 -5.252 252 HH12 ARG 33 HH12 ARG 33 -2.771 15.252 -4.571 253 HH21 ARG 33 HH21 ARG 33 -2.700 17.390 -7.363 254 HH22 ARG 33 HH22 ARG 33 -3.354 17.130 -5.780 255 H ARG 34 H ARG 34 -0.184 10.643 -10.888 256 HA ARG 34 HA ARG 34 0.739 12.451 -12.900 257 HB2 ARG 34 HB2 ARG 34 2.414 11.172 -11.696 258 HB3 ARG 34 HB3 ARG 34 1.646 9.643 -12.119 259 HG2 ARG 34 HG2 ARG 34 3.716 10.067 -13.429 260 HG3 ARG 34 HG3 ARG 34 2.290 9.896 -14.453 261 HD2 ARG 34 HD2 ARG 34 2.209 12.520 -14.365 262 HD3 ARG 34 HD3 ARG 34 3.884 12.388 -13.821 263 HE ARG 34 HE ARG 34 4.207 11.021 -15.939 264 HH11 ARG 34 HH11 ARG 34 1.804 13.583 -15.778 265 HH12 ARG 34 HH12 ARG 34 1.877 13.909 -17.481 266 HH21 ARG 34 HH21 ARG 34 4.342 11.521 -18.153 267 HH22 ARG 34 HH22 ARG 34 3.309 12.746 -18.821 268 H ALA 35 H ALA 35 -0.228 9.003 -13.188 269 HA ALA 35 HA ALA 35 -1.902 9.211 -15.429 270 HB1 ALA 35 HB1 ALA 35 -0.408 8.498 -17.279 271 HB2 ALA 35 HB2 ALA 35 0.991 8.621 -16.205 272 HB3 ALA 35 HB3 ALA 35 0.078 10.067 -16.634 273 H PHE 36 H PHE 36 0.878 7.237 -14.351 274 HA PHE 36 HA PHE 36 -0.659 4.764 -14.807 275 HB2 PHE 36 HB2 PHE 36 1.670 5.091 -15.833 276 HB3 PHE 36 HB3 PHE 36 2.330 5.009 -14.203 277 HD1 PHE 36 HD2 PHE 36 0.264 3.068 -16.662 278 HD2 PHE 36 HD1 PHE 36 2.855 2.864 -13.265 279 HE1 PHE 36 HE2 PHE 36 0.275 0.612 -16.811 280 HE2 PHE 36 HE1 PHE 36 2.855 0.406 -13.420 281 HZ PHE 36 HZ PHE 36 1.564 -0.722 -15.188 282 H ASN 37 H ASN 37 -0.415 3.029 -13.217 283 HA ASN 37 HA ASN 37 -0.960 3.966 -10.495 284 HB2 ASN 37 HB2 ASN 37 -1.313 1.210 -11.773 285 HB3 ASN 37 HB3 ASN 37 -1.983 1.733 -10.225 286 HD21 ASN 37 HD21 ASN 37 -3.048 0.946 -13.061 287 HD22 ASN 37 HD22 ASN 37 -4.289 2.113 -13.326 288 H VAL 38 H VAL 38 -0.315 1.865 -8.919 289 HA VAL 38 HA VAL 38 2.621 1.750 -9.023 290 HB VAL 38 HB VAL 38 0.796 0.894 -6.718 291 HG11 VAL 38 HG11 VAL 38 3.025 -0.141 -6.644 292 HG12 VAL 38 HG12 VAL 38 2.853 1.041 -5.343 293 HG13 VAL 38 HG13 VAL 38 3.789 1.444 -6.786 294 HG21 VAL 38 HG21 VAL 38 0.508 3.302 -7.157 295 HG22 VAL 38 HG22 VAL 38 2.255 3.542 -7.080 296 HG23 VAL 38 HG23 VAL 38 1.367 3.042 -5.638 297 H GLU 39 H GLU 39 3.750 -0.144 -9.039 298 HA GLU 39 HA GLU 39 2.523 -2.512 -10.196 299 HB2 GLU 39 HB2 GLU 39 4.621 -1.636 -11.107 300 HB3 GLU 39 HB3 GLU 39 5.382 -1.690 -9.524 301 HG2 GLU 39 HG2 GLU 39 5.149 -4.221 -9.618 302 HG3 GLU 39 HG3 GLU 39 4.654 -4.035 -11.301 303 H GLY 40 H GLY 40 4.501 -1.703 -7.322 304 HA2 GLY 40 HA2 GLY 40 3.275 -3.888 -5.757 305 HA3 GLY 40 HA3 GLY 40 5.025 -3.896 -5.964 306 H ILE 41 H ILE 41 3.478 -3.616 -3.489 307 HA ILE 41 HA ILE 41 4.544 -1.038 -2.485 308 HB ILE 41 HB ILE 41 1.739 -2.106 -1.809 309 HG12 ILE 41 HG12 ILE 41 2.489 0.383 -3.409 310 HG13 ILE 41 HG13 ILE 41 1.805 -1.092 -4.076 311 HG21 ILE 41 HG21 ILE 41 2.775 -0.982 0.129 312 HG22 ILE 41 HG22 ILE 41 1.424 -0.037 -0.492 313 HG23 ILE 41 HG23 ILE 41 3.081 0.455 -0.851 314 HD11 ILE 41 HD11 ILE 41 0.426 0.794 -2.166 315 HD12 ILE 41 HD12 ILE 41 -0.260 -0.699 -2.815 316 HD13 ILE 41 HD13 ILE 41 0.131 0.636 -3.897 317 H LEU 42 H LEU 42 5.331 -1.172 -0.367 318 HA LEU 42 HA LEU 42 4.584 -3.448 1.328 319 HB2 LEU 42 HB2 LEU 42 6.604 -4.278 0.238 320 HB3 LEU 42 HB3 LEU 42 7.465 -2.787 0.588 321 HG LEU 42 HG LEU 42 7.432 -3.312 3.007 322 HD11 LEU 42 HD11 LEU 42 6.719 -5.501 3.840 323 HD12 LEU 42 HD12 LEU 42 6.070 -5.902 2.246 324 HD13 LEU 42 HD13 LEU 42 5.373 -4.573 3.178 325 HD21 LEU 42 HD21 LEU 42 8.543 -5.561 1.316 326 HD22 LEU 42 HD22 LEU 42 9.024 -5.170 2.971 327 HD23 LEU 42 HD23 LEU 42 9.333 -4.022 1.672 328 H CYS 43 H CYS 43 3.598 -2.149 2.851 329 HA CYS 43 HA CYS 43 5.111 0.004 4.162 330 HB2 CYS 43 HB2 CYS 43 2.706 0.394 3.787 331 HB3 CYS 43 HB3 CYS 43 2.298 -1.058 4.694 332 HG CYS 43 HG CYS 43 2.632 -0.078 7.124 333 H LEU 44 H LEU 44 6.662 -0.794 5.430 334 HA LEU 44 HA LEU 44 6.251 -3.167 7.111 335 HB2 LEU 44 HB2 LEU 44 8.350 -2.693 5.613 336 HB3 LEU 44 HB3 LEU 44 8.812 -1.552 6.861 337 HG LEU 44 HG LEU 44 8.782 -3.475 8.520 338 HD11 LEU 44 HD11 LEU 44 8.835 -5.763 7.635 339 HD12 LEU 44 HD12 LEU 44 8.479 -5.156 6.016 340 HD13 LEU 44 HD13 LEU 44 7.290 -4.980 7.312 341 HD21 LEU 44 HD21 LEU 44 10.694 -3.757 6.173 342 HD22 LEU 44 HD22 LEU 44 10.940 -4.411 7.797 343 HD23 LEU 44 HD23 LEU 44 10.892 -2.669 7.550 344 HA PRO 45 HA PRO 45 5.369 0.026 10.292 345 HB2 PRO 45 HB2 PRO 45 4.170 -1.608 12.126 346 HB3 PRO 45 HB3 PRO 45 3.343 -1.074 10.651 347 HG2 PRO 45 HG2 PRO 45 4.686 -3.692 11.200 348 HG3 PRO 45 HG3 PRO 45 3.127 -3.372 10.409 349 HD2 PRO 45 HD2 PRO 45 5.427 -3.893 9.007 350 HD3 PRO 45 HD3 PRO 45 4.107 -2.885 8.368 351 H ILE 46 H ILE 46 6.445 0.672 12.089 352 HA ILE 46 HA ILE 46 8.687 -0.933 13.105 353 HB ILE 46 HB ILE 46 8.125 2.067 13.152 354 HG12 ILE 46 HG12 ILE 46 10.450 2.163 12.065 355 HG13 ILE 46 HG13 ILE 46 10.394 0.414 11.936 356 HG21 ILE 46 HG21 ILE 46 8.984 1.521 15.378 357 HG22 ILE 46 HG22 ILE 46 10.204 2.401 14.460 358 HG23 ILE 46 HG23 ILE 46 10.350 0.655 14.669 359 HD11 ILE 46 HD11 ILE 46 8.549 2.363 10.576 360 HD12 ILE 46 HD12 ILE 46 8.442 0.606 10.461 361 HD13 ILE 46 HD13 ILE 46 9.860 1.444 9.837 362 H GLN 47 H GLN 47 8.647 -1.678 15.139 363 HA GLN 47 HA GLN 47 6.253 -1.659 16.703 364 HB2 GLN 47 HB2 GLN 47 7.545 -3.668 16.697 365 HB3 GLN 47 HB3 GLN 47 9.043 -2.816 17.052 366 HG2 GLN 47 HG2 GLN 47 8.327 -4.087 18.994 367 HG3 GLN 47 HG3 GLN 47 8.255 -2.349 19.329 368 HE21 GLN 47 HE21 GLN 47 6.770 -2.645 21.028 369 HE22 GLN 47 HE22 GLN 47 5.120 -3.076 20.759 370 H ASP 48 H ASP 48 9.472 -0.248 17.112 371 HA ASP 48 HA ASP 48 9.341 0.534 19.784 372 HB2 ASP 48 HB2 ASP 48 11.441 0.323 18.575 373 HB3 ASP 48 HB3 ASP 48 10.978 1.595 17.462 374 H SER 49 H SER 49 8.331 2.258 16.887 375 HA SER 49 HA SER 49 6.951 4.330 18.458 376 HB2 SER 49 HB2 SER 49 8.923 4.999 16.217 377 HB3 SER 49 HB3 SER 49 7.885 6.162 17.046 378 HG SER 49 HG SER 49 9.804 4.554 18.389 379 H ASP 50 H ASP 50 5.337 5.544 17.095 380 HA ASP 50 HA ASP 50 4.001 3.834 15.223 381 HB2 ASP 50 HB2 ASP 50 2.431 5.850 14.892 382 HB3 ASP 50 HB3 ASP 50 2.517 5.175 16.504 383 H LYS 51 H LYS 51 5.639 3.491 13.673 384 HA LYS 51 HA LYS 51 6.024 5.618 11.667 385 HB2 LYS 51 HB2 LYS 51 7.979 5.536 13.355 386 HB3 LYS 51 HB3 LYS 51 8.325 3.921 12.763 387 HG2 LYS 51 HG2 LYS 51 9.845 5.424 11.685 388 HG3 LYS 51 HG3 LYS 51 8.674 4.904 10.472 389 HD2 LYS 51 HD2 LYS 51 9.112 7.302 10.248 390 HD3 LYS 51 HD3 LYS 51 7.443 7.037 10.747 391 HE2 LYS 51 HE2 LYS 51 8.374 8.916 11.981 392 HE3 LYS 51 HE3 LYS 51 8.111 7.575 13.101 393 HZ1 LYS 51 HZ1 LYS 51 10.244 8.594 13.488 394 HZ2 LYS 51 HZ2 LYS 51 10.688 8.376 11.875 395 HZ3 LYS 51 HZ3 LYS 51 10.478 7.035 12.876 396 H SER 52 H SER 52 6.707 4.748 9.621 397 HA SER 52 HA SER 52 6.527 1.929 9.047 398 HB2 SER 52 HB2 SER 52 4.317 3.815 8.061 399 HB3 SER 52 HB3 SER 52 4.556 2.160 7.511 400 HG SER 52 HG SER 52 4.405 1.846 10.021 401 H HIS 53 H HIS 53 8.156 1.726 7.553 402 HA HIS 53 HA HIS 53 8.607 3.877 5.545 403 HB2 HIS 53 HB2 HIS 53 10.091 1.239 5.988 404 HB3 HIS 53 HB3 HIS 53 10.496 2.413 4.741 405 HD1 HIS 53 HD1 HIS 53 12.537 3.611 5.402 406 HD2 HIS 53 HD2 HIS 53 10.141 2.822 8.685 407 HE1 HIS 53 HE1 HIS 53 13.808 4.480 7.373 408 HE2 HIS 53 HE2 HIS 53 12.445 3.766 9.355 409 H ILE 54 H ILE 54 7.704 3.719 3.494 410 HA ILE 54 HA ILE 54 6.520 1.117 2.704 411 HB ILE 54 HB ILE 54 5.424 3.837 1.836 412 HG12 ILE 54 HG12 ILE 54 3.342 3.111 3.211 413 HG13 ILE 54 HG13 ILE 54 4.399 1.952 4.002 414 HG21 ILE 54 HG21 ILE 54 5.090 2.049 0.190 415 HG22 ILE 54 HG22 ILE 54 3.549 2.509 0.912 416 HG23 ILE 54 HG23 ILE 54 4.352 1.023 1.424 417 HD11 ILE 54 HD11 ILE 54 4.714 4.944 4.034 418 HD12 ILE 54 HD12 ILE 54 5.756 3.785 4.860 419 HD13 ILE 54 HD13 ILE 54 4.068 3.945 5.334 420 H TRP 55 H TRP 55 7.479 0.243 0.982 421 HA TRP 55 HA TRP 55 9.088 1.882 -0.872 422 HB2 TRP 55 HB2 TRP 55 8.899 -1.154 -0.523 423 HB3 TRP 55 HB3 TRP 55 9.948 -0.340 -1.681 424 HD1 TRP 55 HD1 TRP 55 12.264 0.558 -0.758 425 HE1 TRP 55 HE1 TRP 55 13.460 0.470 1.500 426 HE3 TRP 55 HE3 TRP 55 8.435 -1.134 2.088 427 HZ2 TRP 55 HZ2 TRP 55 12.861 -0.220 4.157 428 HZ3 TRP 55 HZ3 TRP 55 8.802 -1.460 4.474 429 HH2 TRP 55 HH2 TRP 55 10.971 -1.021 5.509 430 H LEU 56 H LEU 56 7.843 2.728 -2.419 431 HA LEU 56 HA LEU 56 5.659 1.238 -3.689 432 HB2 LEU 56 HB2 LEU 56 6.553 4.134 -4.043 433 HB3 LEU 56 HB3 LEU 56 5.211 3.397 -4.895 434 HG LEU 56 HG LEU 56 4.254 4.723 -3.183 435 HD11 LEU 56 HD11 LEU 56 4.158 1.872 -2.192 436 HD12 LEU 56 HD12 LEU 56 3.150 2.585 -3.453 437 HD13 LEU 56 HD13 LEU 56 3.012 3.157 -1.794 438 HD21 LEU 56 HD21 LEU 56 4.830 4.626 -0.802 439 HD22 LEU 56 HD22 LEU 56 6.217 5.089 -1.783 440 HD23 LEU 56 HD23 LEU 56 6.101 3.447 -1.145 441 H LEU 57 H LEU 57 6.308 -0.061 -5.235 442 HA LEU 57 HA LEU 57 8.555 0.464 -7.008 443 HB2 LEU 57 HB2 LEU 57 6.678 -1.887 -6.603 444 HB3 LEU 57 HB3 LEU 57 7.694 -1.791 -8.030 445 HG LEU 57 HG LEU 57 9.722 -1.853 -6.636 446 HD11 LEU 57 HD11 LEU 57 8.956 -0.739 -4.621 447 HD12 LEU 57 HD12 LEU 57 9.647 -2.311 -4.232 448 HD13 LEU 57 HD13 LEU 57 7.892 -2.097 -4.235 449 HD21 LEU 57 HD21 LEU 57 8.800 -3.948 -7.470 450 HD22 LEU 57 HD22 LEU 57 7.785 -4.110 -6.035 451 HD23 LEU 57 HD23 LEU 57 9.544 -4.193 -5.888 452 H VAL 58 H VAL 58 8.122 1.904 -8.561 453 HA VAL 58 HA VAL 58 5.833 1.538 -10.355 454 HB VAL 58 HB VAL 58 4.977 3.073 -8.555 455 HG11 VAL 58 HG11 VAL 58 7.153 4.996 -9.435 456 HG12 VAL 58 HG12 VAL 58 7.055 4.160 -7.882 457 HG13 VAL 58 HG13 VAL 58 5.840 5.364 -8.308 458 HG21 VAL 58 HG21 VAL 58 5.271 4.432 -11.263 459 HG22 VAL 58 HG22 VAL 58 4.066 4.833 -10.034 460 HG23 VAL 58 HG23 VAL 58 4.035 3.254 -10.815 461 H ASN 59 H ASN 59 6.314 2.288 -12.459 462 HA ASN 59 HA ASN 59 8.991 3.184 -13.027 463 HB2 ASN 59 HB2 ASN 59 8.118 3.472 -15.398 464 HB3 ASN 59 HB3 ASN 59 8.005 1.856 -14.728 465 HD21 ASN 59 HD21 ASN 59 6.012 0.918 -14.435 466 HD22 ASN 59 HD22 ASN 59 4.547 1.620 -15.017 467 H ASP 60 H ASP 60 9.670 5.175 -12.606 468 HA ASP 60 HA ASP 60 7.885 7.222 -11.711 469 HB2 ASP 60 HB2 ASP 60 9.836 8.416 -11.007 470 HB3 ASP 60 HB3 ASP 60 10.175 6.717 -10.717 471 H ASP 61 H ASP 61 8.580 9.584 -12.405 472 HA ASP 61 HA ASP 61 8.805 9.875 -15.305 473 HB2 ASP 61 HB2 ASP 61 6.326 9.649 -14.639 474 HB3 ASP 61 HB3 ASP 61 6.497 11.184 -13.791 475 H GLN 62 H GLN 62 9.151 12.141 -15.913 476 HA GLN 62 HA GLN 62 11.063 13.532 -14.399 477 HB2 GLN 62 HB2 GLN 62 9.249 14.649 -16.577 478 HB3 GLN 62 HB3 GLN 62 10.786 15.334 -16.058 479 HG2 GLN 62 HG2 GLN 62 11.975 13.354 -16.898 480 HG3 GLN 62 HG3 GLN 62 10.441 12.631 -17.395 481 HE21 GLN 62 HE21 GLN 62 9.346 13.529 -19.214 482 HE22 GLN 62 HE22 GLN 62 10.155 14.561 -20.342 483 H ARG 63 H ARG 63 7.601 13.928 -14.723 484 HA ARG 63 HA ARG 63 7.330 16.260 -13.049 485 HB2 ARG 63 HB2 ARG 63 5.238 14.298 -14.090 486 HB3 ARG 63 HB3 ARG 63 4.897 15.859 -13.348 487 HG2 ARG 63 HG2 ARG 63 6.021 17.006 -15.221 488 HG3 ARG 63 HG3 ARG 63 6.389 15.443 -15.957 489 HD2 ARG 63 HD2 ARG 63 3.993 14.977 -16.213 490 HD3 ARG 63 HD3 ARG 63 3.598 16.508 -15.418 491 HE ARG 63 HE ARG 63 5.285 16.867 -17.697 492 HH11 ARG 63 HH11 ARG 63 1.927 16.400 -16.735 493 HH12 ARG 63 HH12 ARG 63 1.291 17.165 -18.158 494 HH21 ARG 63 HH21 ARG 63 4.447 17.858 -19.551 495 HH22 ARG 63 HH22 ARG 63 2.729 17.991 -19.758 496 H LEU 64 H LEU 64 7.198 12.771 -12.641 497 HA LEU 64 HA LEU 64 5.832 12.646 -10.169 498 HB2 LEU 64 HB2 LEU 64 6.394 10.683 -11.742 499 HB3 LEU 64 HB3 LEU 64 7.992 10.690 -11.030 500 HG LEU 64 HG LEU 64 6.318 10.581 -8.770 501 HD11 LEU 64 HD11 LEU 64 4.689 8.823 -9.122 502 HD12 LEU 64 HD12 LEU 64 5.063 8.773 -10.845 503 HD13 LEU 64 HD13 LEU 64 4.328 10.218 -10.137 504 HD21 LEU 64 HD21 LEU 64 7.557 8.193 -10.167 505 HD22 LEU 64 HD22 LEU 64 7.075 8.284 -8.471 506 HD23 LEU 64 HD23 LEU 64 8.392 9.290 -9.068 507 H GLU 65 H GLU 65 9.223 13.172 -11.014 508 HA GLU 65 HA GLU 65 10.448 13.010 -8.494 509 HB2 GLU 65 HB2 GLU 65 11.113 14.860 -10.826 510 HB3 GLU 65 HB3 GLU 65 12.192 14.505 -9.478 511 HG2 GLU 65 HG2 GLU 65 12.322 12.161 -10.149 512 HG3 GLU 65 HG3 GLU 65 11.153 12.437 -11.438 513 H GLN 66 H GLN 66 8.740 15.680 -10.049 514 HA GLN 66 HA GLN 66 9.166 17.642 -8.001 515 HB2 GLN 66 HB2 GLN 66 6.992 17.524 -10.138 516 HB3 GLN 66 HB3 GLN 66 7.435 18.947 -9.204 517 HG2 GLN 66 HG2 GLN 66 9.180 17.512 -11.221 518 HG3 GLN 66 HG3 GLN 66 8.373 19.063 -11.452 519 HE21 GLN 66 HE21 GLN 66 9.200 20.903 -10.373 520 HE22 GLN 66 HE22 GLN 66 10.790 20.930 -9.691 521 H MET 67 H MET 67 6.747 15.175 -8.602 522 HA MET 67 HA MET 67 4.878 15.918 -6.567 523 HB2 MET 67 HB2 MET 67 5.317 13.254 -7.993 524 HB3 MET 67 HB3 MET 67 3.943 13.609 -6.954 525 HG2 MET 67 HG2 MET 67 3.168 15.329 -8.484 526 HG3 MET 67 HG3 MET 67 4.605 15.124 -9.488 527 HE1 MET 67 HE1 MET 67 1.729 15.107 -10.736 528 HE2 MET 67 HE2 MET 67 1.818 13.714 -11.811 529 HE3 MET 67 HE3 MET 67 3.190 14.813 -11.682 530 H ILE 68 H ILE 68 7.752 13.893 -6.650 531 HA ILE 68 HA ILE 68 7.589 12.764 -4.026 532 HB ILE 68 HB ILE 68 10.006 13.247 -5.846 533 HG12 ILE 68 HG12 ILE 68 8.550 10.605 -5.346 534 HG13 ILE 68 HG13 ILE 68 8.182 11.666 -6.696 535 HG21 ILE 68 HG21 ILE 68 11.240 11.602 -4.463 536 HG22 ILE 68 HG22 ILE 68 9.878 11.521 -3.344 537 HG23 ILE 68 HG23 ILE 68 10.777 13.026 -3.527 538 HD11 ILE 68 HD11 ILE 68 10.820 10.301 -6.192 539 HD12 ILE 68 HD12 ILE 68 10.470 11.396 -7.533 540 HD13 ILE 68 HD13 ILE 68 9.612 9.862 -7.399 541 H SER 69 H SER 69 9.043 15.681 -5.411 542 HA SER 69 HA SER 69 10.269 16.729 -3.082 543 HB2 SER 69 HB2 SER 69 10.847 17.512 -5.358 544 HB3 SER 69 HB3 SER 69 9.230 18.182 -5.557 545 HG SER 69 HG SER 69 9.724 19.818 -4.247 546 H GLN 70 H GLN 70 6.962 16.822 -4.300 547 HA GLN 70 HA GLN 70 6.047 18.972 -2.601 548 HB2 GLN 70 HB2 GLN 70 5.070 18.500 -4.850 549 HB3 GLN 70 HB3 GLN 70 4.469 16.957 -4.273 550 HG2 GLN 70 HG2 GLN 70 3.601 19.565 -3.011 551 HG3 GLN 70 HG3 GLN 70 2.827 18.947 -4.460 552 HE21 GLN 70 HE21 GLN 70 2.932 16.134 -3.615 553 HE22 GLN 70 HE22 GLN 70 1.757 15.980 -2.359 554 H ILE 71 H ILE 71 5.690 15.413 -2.676 555 HA ILE 71 HA ILE 71 3.979 15.202 -0.426 556 HB ILE 71 HB ILE 71 4.206 13.429 -2.211 557 HG12 ILE 71 HG12 ILE 71 4.444 12.578 0.707 558 HG13 ILE 71 HG13 ILE 71 2.966 12.901 -0.186 559 HG21 ILE 71 HG21 ILE 71 6.665 13.341 -2.352 560 HG22 ILE 71 HG22 ILE 71 5.975 11.742 -2.082 561 HG23 ILE 71 HG23 ILE 71 6.736 12.613 -0.747 562 HD11 ILE 71 HD11 ILE 71 4.848 10.590 -0.604 563 HD12 ILE 71 HD12 ILE 71 3.407 10.915 -1.574 564 HD13 ILE 71 HD13 ILE 71 3.251 10.544 0.142 565 H ASP 72 H ASP 72 7.429 15.331 -0.780 566 HA ASP 72 HA ASP 72 8.377 14.382 1.655 567 HB2 ASP 72 HB2 ASP 72 9.852 14.916 -0.222 568 HB3 ASP 72 HB3 ASP 72 9.412 16.616 -0.151 569 H LYS 73 H LYS 73 6.740 17.374 0.899 570 HA LYS 73 HA LYS 73 7.581 18.768 3.322 571 HB2 LYS 73 HB2 LYS 73 5.595 19.733 1.229 572 HB3 LYS 73 HB3 LYS 73 6.478 20.709 2.400 573 HG2 LYS 73 HG2 LYS 73 7.606 19.265 -0.010 574 HG3 LYS 73 HG3 LYS 73 7.470 21.009 0.215 575 HD2 LYS 73 HD2 LYS 73 9.173 20.958 1.970 576 HD3 LYS 73 HD3 LYS 73 9.224 19.193 1.922 577 HE2 LYS 73 HE2 LYS 73 10.038 19.334 -0.445 578 HE3 LYS 73 HE3 LYS 73 10.108 21.092 -0.273 579 HZ1 LYS 73 HZ1 LYS 73 12.262 20.085 0.129 580 HZ2 LYS 73 HZ2 LYS 73 11.617 19.124 1.360 581 HZ3 LYS 73 HZ3 LYS 73 11.684 20.801 1.550 582 H LEU 74 H LEU 74 5.162 16.562 2.590 583 HA LEU 74 HA LEU 74 3.074 17.546 4.328 584 HB2 LEU 74 HB2 LEU 74 3.574 14.948 2.850 585 HB3 LEU 74 HB3 LEU 74 2.373 14.983 4.124 586 HG LEU 74 HG LEU 74 1.320 15.242 1.920 587 HD11 LEU 74 HD11 LEU 74 -0.051 17.232 2.356 588 HD12 LEU 74 HD12 LEU 74 1.119 17.787 3.557 589 HD13 LEU 74 HD13 LEU 74 0.217 16.295 3.826 590 HD21 LEU 74 HD21 LEU 74 2.908 17.814 1.609 591 HD22 LEU 74 HD22 LEU 74 1.659 17.221 0.509 592 HD23 LEU 74 HD23 LEU 74 3.163 16.326 0.698 593 H GLU 75 H GLU 75 2.622 16.902 6.429 594 HA GLU 75 HA GLU 75 4.939 16.464 8.090 595 HB2 GLU 75 HB2 GLU 75 2.007 16.781 8.856 596 HB3 GLU 75 HB3 GLU 75 3.366 16.835 9.979 597 HG2 GLU 75 HG2 GLU 75 4.232 18.850 8.813 598 HG3 GLU 75 HG3 GLU 75 2.842 18.803 7.729 599 H ASP 76 H ASP 76 2.587 14.383 6.748 600 HA ASP 76 HA ASP 76 2.910 12.232 8.630 601 HB2 ASP 76 HB2 ASP 76 1.935 10.821 6.707 602 HB3 ASP 76 HB3 ASP 76 0.915 12.076 7.386 603 H VAL 77 H VAL 77 4.228 12.897 5.360 604 HA VAL 77 HA VAL 77 6.209 10.846 5.458 605 HB VAL 77 HB VAL 77 5.951 13.311 3.682 606 HG11 VAL 77 HG11 VAL 77 8.331 12.692 3.768 607 HG12 VAL 77 HG12 VAL 77 7.644 12.310 2.191 608 HG13 VAL 77 HG13 VAL 77 7.928 11.021 3.365 609 HG21 VAL 77 HG21 VAL 77 4.199 11.604 3.387 610 HG22 VAL 77 HG22 VAL 77 5.439 10.373 3.111 611 HG23 VAL 77 HG23 VAL 77 5.244 11.706 1.968 612 H VAL 78 H VAL 78 7.521 10.901 7.144 613 HA VAL 78 HA VAL 78 8.716 13.236 8.301 614 HB VAL 78 HB VAL 78 9.740 10.382 8.671 615 HG11 VAL 78 HG11 VAL 78 9.733 12.769 10.557 616 HG12 VAL 78 HG12 VAL 78 11.129 12.134 9.681 617 HG13 VAL 78 HG13 VAL 78 10.357 11.160 10.932 618 HG21 VAL 78 HG21 VAL 78 7.315 10.279 8.962 619 HG22 VAL 78 HG22 VAL 78 7.369 11.617 10.112 620 HG23 VAL 78 HG23 VAL 78 8.128 10.076 10.516 621 H LYS 79 H LYS 79 9.728 10.699 6.093 622 HA LYS 79 HA LYS 79 11.867 12.331 4.945 623 HB2 LYS 79 HB2 LYS 79 12.303 9.447 5.870 624 HB3 LYS 79 HB3 LYS 79 13.445 10.381 4.914 625 HG2 LYS 79 HG2 LYS 79 13.828 11.911 6.763 626 HG3 LYS 79 HG3 LYS 79 12.564 11.130 7.712 627 HD2 LYS 79 HD2 LYS 79 13.899 9.053 7.819 628 HD3 LYS 79 HD3 LYS 79 15.151 9.794 6.813 629 HE2 LYS 79 HE2 LYS 79 14.324 10.710 9.592 630 HE3 LYS 79 HE3 LYS 79 15.794 9.826 9.180 631 HZ1 LYS 79 HZ1 LYS 79 16.244 12.174 9.417 632 HZ2 LYS 79 HZ2 LYS 79 15.096 12.554 8.240 633 HZ3 LYS 79 HZ3 LYS 79 16.488 11.702 7.812 634 H VAL 80 H VAL 80 12.256 11.800 2.737 635 HA VAL 80 HA VAL 80 10.736 9.526 1.593 636 HB VAL 80 HB VAL 80 9.672 11.814 1.037 637 HG11 VAL 80 HG11 VAL 80 11.695 13.114 0.611 638 HG12 VAL 80 HG12 VAL 80 10.623 13.140 -0.789 639 HG13 VAL 80 HG13 VAL 80 12.064 12.119 -0.801 640 HG21 VAL 80 HG21 VAL 80 9.143 11.170 -1.292 641 HG22 VAL 80 HG22 VAL 80 9.091 9.790 -0.196 642 HG23 VAL 80 HG23 VAL 80 10.472 10.007 -1.272 643 H GLN 81 H GLN 81 11.815 8.376 -0.000 644 HA GLN 81 HA GLN 81 14.581 9.124 -0.716 645 HB2 GLN 81 HB2 GLN 81 13.680 6.416 0.364 646 HB3 GLN 81 HB3 GLN 81 15.273 6.736 -0.312 647 HG2 GLN 81 HG2 GLN 81 16.027 7.802 1.580 648 HG3 GLN 81 HG3 GLN 81 14.455 8.502 1.951 649 HE21 GLN 81 HE21 GLN 81 16.442 5.633 2.238 650 HE22 GLN 81 HE22 GLN 81 15.522 4.879 3.489 651 H ARG 82 H ARG 82 14.800 9.012 -2.837 652 HA ARG 82 HA ARG 82 13.035 7.299 -4.478 653 HB2 ARG 82 HB2 ARG 82 12.835 9.701 -4.930 654 HB3 ARG 82 HB3 ARG 82 14.567 9.862 -5.132 655 HG2 ARG 82 HG2 ARG 82 13.145 7.995 -7.005 656 HG3 ARG 82 HG3 ARG 82 12.852 9.718 -7.208 657 HD2 ARG 82 HD2 ARG 82 15.395 10.008 -7.298 658 HD3 ARG 82 HD3 ARG 82 15.500 8.252 -7.410 659 HE ARG 82 HE ARG 82 14.479 8.339 -9.545 660 HH11 ARG 82 HH11 ARG 82 15.068 11.557 -8.236 661 HH12 ARG 82 HH12 ARG 82 14.928 12.331 -9.782 662 HH21 ARG 82 HH21 ARG 82 14.322 9.380 -11.565 663 HH22 ARG 82 HH22 ARG 82 14.509 11.106 -11.657 664 H ASN 83 H ASN 83 14.106 5.393 -4.504 665 HA ASN 83 HA ASN 83 16.996 5.329 -5.198 666 HB2 ASN 83 HB2 ASN 83 15.286 3.342 -3.621 667 HB3 ASN 83 HB3 ASN 83 16.932 3.009 -4.147 668 HD21 ASN 83 HD21 ASN 83 17.628 2.718 -2.008 669 HD22 ASN 83 HD22 ASN 83 17.813 4.032 -0.903 670 H GLN 84 H GLN 84 17.183 4.883 -7.356 671 HA GLN 84 HA GLN 84 15.268 3.108 -8.698 672 HB2 GLN 84 HB2 GLN 84 16.646 3.578 -10.759 673 HB3 GLN 84 HB3 GLN 84 15.965 5.021 -10.022 674 HG2 GLN 84 HG2 GLN 84 18.133 5.617 -9.089 675 HG3 GLN 84 HG3 GLN 84 18.838 4.113 -9.668 676 HE21 GLN 84 HE21 GLN 84 17.470 4.249 -12.267 677 HE22 GLN 84 HE22 GLN 84 18.259 5.491 -13.163 678 H SER 85 H SER 85 15.525 1.009 -8.188 679 HA SER 85 HA SER 85 18.130 -0.292 -8.343 680 HB2 SER 85 HB2 SER 85 17.947 0.648 -5.992 681 HB3 SER 85 HB3 SER 85 16.521 -0.358 -5.747 682 HG SER 85 HG SER 85 19.193 -1.193 -6.218 683 H ASP 86 H ASP 86 17.812 -2.675 -7.637 684 HA ASP 86 HA ASP 86 15.973 -3.864 -9.443 685 HB2 ASP 86 HB2 ASP 86 18.265 -4.775 -8.811 686 HB3 ASP 86 HB3 ASP 86 17.598 -5.243 -7.250 687 HA PRO 87 HA PRO 87 12.124 -4.064 -7.107 688 HB2 PRO 87 HB2 PRO 87 12.080 -6.884 -8.234 689 HB3 PRO 87 HB3 PRO 87 10.777 -5.674 -8.171 690 HG2 PRO 87 HG2 PRO 87 12.100 -6.054 -10.424 691 HG3 PRO 87 HG3 PRO 87 11.668 -4.405 -9.908 692 HD2 PRO 87 HD2 PRO 87 14.334 -5.765 -9.852 693 HD3 PRO 87 HD3 PRO 87 13.947 -4.049 -10.101 694 H THR 88 H THR 88 14.409 -6.809 -6.761 695 HA THR 88 HA THR 88 13.143 -8.178 -4.641 696 HB THR 88 HB THR 88 15.346 -9.305 -4.267 697 HG1 THR 88 HG1 THR 88 16.242 -7.326 -6.115 698 HG21 THR 88 HG21 THR 88 14.642 -9.011 -7.211 699 HG22 THR 88 HG22 THR 88 13.881 -10.138 -6.083 700 HG23 THR 88 HG23 THR 88 15.587 -10.317 -6.495 701 H MET 89 H MET 89 14.659 -5.165 -4.443 702 HA MET 89 HA MET 89 15.640 -4.964 -1.879 703 HB2 MET 89 HB2 MET 89 15.644 -3.072 -3.416 704 HB3 MET 89 HB3 MET 89 13.884 -3.013 -3.427 705 HG2 MET 89 HG2 MET 89 14.810 -1.216 -2.060 706 HG3 MET 89 HG3 MET 89 13.883 -2.333 -1.062 707 HE1 MET 89 HE1 MET 89 14.975 -1.320 1.171 708 HE2 MET 89 HE2 MET 89 15.839 -0.162 0.155 709 HE3 MET 89 HE3 MET 89 16.715 -1.099 1.365 710 H PHE 90 H PHE 90 12.177 -5.019 -2.904 711 HA PHE 90 HA PHE 90 11.074 -4.436 -0.363 712 HB2 PHE 90 HB2 PHE 90 8.916 -4.875 -1.227 713 HB3 PHE 90 HB3 PHE 90 9.814 -4.346 -2.635 714 HD1 PHE 90 HD1 PHE 90 8.134 -7.227 -1.019 715 HD2 PHE 90 HD2 PHE 90 10.256 -5.919 -4.494 716 HE1 PHE 90 HE1 PHE 90 7.453 -9.270 -2.212 717 HE2 PHE 90 HE2 PHE 90 9.574 -7.964 -5.677 718 HZ PHE 90 HZ PHE 90 8.176 -9.637 -4.536 719 H ASN 91 H ASN 91 11.869 -7.510 -1.950 720 HA ASN 91 HA ASN 91 10.836 -9.292 0.014 721 HB2 ASN 91 HB2 ASN 91 11.467 -9.892 -2.376 722 HB3 ASN 91 HB3 ASN 91 13.158 -9.771 -1.919 723 HD21 ASN 91 HD21 ASN 91 11.863 -12.040 -3.010 724 HD22 ASN 91 HD22 ASN 91 11.963 -13.321 -1.860 725 H LYS 92 H LYS 92 13.922 -7.660 -0.437 726 HA LYS 92 HA LYS 92 15.597 -9.009 1.317 727 HB2 LYS 92 HB2 LYS 92 16.361 -7.328 -0.361 728 HB3 LYS 92 HB3 LYS 92 15.685 -6.033 0.608 729 HG2 LYS 92 HG2 LYS 92 17.828 -7.840 1.758 730 HG3 LYS 92 HG3 LYS 92 18.268 -6.507 0.693 731 HD2 LYS 92 HD2 LYS 92 17.262 -4.893 2.246 732 HD3 LYS 92 HD3 LYS 92 16.698 -6.201 3.287 733 HE2 LYS 92 HE2 LYS 92 18.699 -5.169 4.236 734 HE3 LYS 92 HE3 LYS 92 19.060 -6.825 3.746 735 HZ1 LYS 92 HZ1 LYS 92 19.729 -4.371 2.216 736 HZ2 LYS 92 HZ2 LYS 92 20.079 -5.951 1.734 737 HZ3 LYS 92 HZ3 LYS 92 20.815 -5.306 3.110 738 H ILE 93 H ILE 93 13.749 -5.974 2.051 739 HA ILE 93 HA ILE 93 14.478 -6.195 4.860 740 HB ILE 93 HB ILE 93 13.238 -4.192 5.321 741 HG12 ILE 93 HG12 ILE 93 11.288 -4.799 3.675 742 HG13 ILE 93 HG13 ILE 93 11.675 -3.118 3.961 743 HG21 ILE 93 HG21 ILE 93 15.440 -3.863 4.347 744 HG22 ILE 93 HG22 ILE 93 14.354 -2.580 3.813 745 HG23 ILE 93 HG23 ILE 93 14.766 -3.898 2.714 746 HD11 ILE 93 HD11 ILE 93 12.519 -4.713 1.560 747 HD12 ILE 93 HD12 ILE 93 12.841 -2.998 1.843 748 HD13 ILE 93 HD13 ILE 93 11.186 -3.564 1.638 749 H ALA 94 H ALA 94 11.756 -7.205 2.933 750 HA ALA 94 HA ALA 94 9.702 -7.292 4.855 751 HB1 ALA 94 HB1 ALA 94 9.299 -7.511 2.441 752 HB2 ALA 94 HB2 ALA 94 8.570 -8.849 3.331 753 HB3 ALA 94 HB3 ALA 94 10.078 -9.094 2.444 754 H VAL 95 H VAL 95 12.188 -9.713 4.015 755 HA VAL 95 HA VAL 95 11.222 -11.770 5.742 756 HB VAL 95 HB VAL 95 12.799 -12.202 3.827 757 HG11 VAL 95 HG11 VAL 95 14.360 -10.359 4.126 758 HG12 VAL 95 HG12 VAL 95 15.227 -11.894 4.132 759 HG13 VAL 95 HG13 VAL 95 14.925 -11.045 5.650 760 HG21 VAL 95 HG21 VAL 95 12.437 -13.936 5.532 761 HG22 VAL 95 HG22 VAL 95 13.744 -13.273 6.515 762 HG23 VAL 95 HG23 VAL 95 14.100 -13.993 4.943 763 H PHE 96 H PHE 96 13.414 -9.022 6.261 764 HA PHE 96 HA PHE 96 14.203 -9.792 8.930 765 HB2 PHE 96 HB2 PHE 96 14.435 -7.134 7.453 766 HB3 PHE 96 HB3 PHE 96 15.089 -7.416 9.064 767 HD1 PHE 96 HD2 PHE 96 16.648 -9.608 9.236 768 HD2 PHE 96 HD1 PHE 96 15.930 -7.388 5.653 769 HE1 PHE 96 HE2 PHE 96 18.722 -10.493 8.261 770 HE2 PHE 96 HE1 PHE 96 18.008 -8.287 4.681 771 HZ PHE 96 HZ PHE 96 19.403 -9.843 5.986 772 H PHE 97 H PHE 97 11.493 -8.247 7.530 773 HA PHE 97 HA PHE 97 9.545 -7.437 8.212 774 HB2 PHE 97 HB2 PHE 97 8.363 -8.590 10.013 775 HB3 PHE 97 HB3 PHE 97 9.268 -9.732 9.041 776 HD1 PHE 97 HD1 PHE 97 9.169 -8.009 12.349 777 HD2 PHE 97 HD2 PHE 97 10.942 -11.159 10.056 778 HE1 PHE 97 HE1 PHE 97 10.193 -8.924 14.389 779 HE2 PHE 97 HE2 PHE 97 11.965 -12.064 12.105 780 HZ PHE 97 HZ PHE 97 11.595 -10.948 14.270 781 H GLN 98 H GLN 98 12.037 -6.026 9.326 782 HA GLN 98 HA GLN 98 10.667 -3.992 10.818 783 HB2 GLN 98 HB2 GLN 98 11.119 -5.641 12.639 784 HB3 GLN 98 HB3 GLN 98 12.832 -5.614 12.240 785 HG2 GLN 98 HG2 GLN 98 12.299 -4.261 14.236 786 HG3 GLN 98 HG3 GLN 98 13.009 -3.290 12.945 787 HE21 GLN 98 HE21 GLN 98 11.697 -1.780 11.866 788 HE22 GLN 98 HE22 GLN 98 10.175 -1.279 12.490 789 H1 GLY 1 H1 GLY 1 -8.917 -3.229 17.352 790 H2 GLY 1 H2 GLY 1 -8.085 -3.347 18.817 791 H3 GLY 1 H3 GLY 1 -7.245 -2.974 17.405 792 HA2 GLY 1 HA3 GLY 1 -8.428 -0.875 17.216 793 HA3 GLY 1 HA2 GLY 1 -9.303 -1.271 18.690 794 H SER 2 H SER 2 -8.235 0.966 19.097 795 HA SER 2 HA SER 2 -5.480 0.999 19.928 796 HB2 SER 2 HB2 SER 2 -6.608 3.075 19.207 797 HB3 SER 2 HB3 SER 2 -7.757 2.944 20.538 798 HG SER 2 HG SER 2 -5.064 2.885 21.212 799 H MET 3 H MET 3 -5.223 -0.698 21.319 800 HA MET 3 HA MET 3 -5.815 -0.492 24.088 801 HB2 MET 3 HB2 MET 3 -7.325 -2.451 24.326 802 HB3 MET 3 HB3 MET 3 -8.092 -1.191 23.377 803 HG2 MET 3 HG2 MET 3 -7.576 -2.462 21.306 804 HG3 MET 3 HG3 MET 3 -6.863 -3.742 22.296 805 HE1 MET 3 HE1 MET 3 -8.506 -5.578 21.213 806 HE2 MET 3 HE2 MET 3 -9.190 -4.321 20.181 807 HE3 MET 3 HE3 MET 3 -10.254 -5.370 21.119 808 H GLN 4 H GLN 4 -5.559 -3.323 24.676 809 HA GLN 4 HA GLN 4 -2.894 -4.003 24.136 810 HB2 GLN 4 HB2 GLN 4 -4.171 -5.017 25.978 811 HB3 GLN 4 HB3 GLN 4 -5.265 -5.793 24.842 812 HG2 GLN 4 HG2 GLN 4 -3.467 -7.255 24.057 813 HG3 GLN 4 HG3 GLN 4 -2.301 -6.400 25.063 814 HE21 GLN 4 HE21 GLN 4 -1.721 -8.323 26.150 815 HE22 GLN 4 HE22 GLN 4 -2.760 -9.067 27.311 816 H ASN 5 H ASN 5 -2.449 -3.679 21.939 817 HA ASN 5 HA ASN 5 -3.916 -4.932 19.800 818 HB2 ASN 5 HB2 ASN 5 -1.237 -3.483 19.812 819 HB3 ASN 5 HB3 ASN 5 -1.984 -4.127 18.350 820 HD21 ASN 5 HD21 ASN 5 -3.832 -3.093 17.520 821 HD22 ASN 5 HD22 ASN 5 -4.290 -1.507 18.024 822 H THR 6 H THR 6 -3.940 -7.097 20.271 823 HA THR 6 HA THR 6 -1.553 -8.702 20.582 824 HB THR 6 HB THR 6 -3.176 -10.606 20.544 825 HG1 THR 6 HG1 THR 6 -5.319 -8.790 20.469 826 HG21 THR 6 HG21 THR 6 -4.431 -10.027 22.588 827 HG22 THR 6 HG22 THR 6 -4.052 -8.320 22.349 828 HG23 THR 6 HG23 THR 6 -2.759 -9.471 22.698 829 H THR 7 H THR 7 -1.559 -10.800 19.087 830 HA THR 7 HA THR 7 -1.087 -9.963 16.374 831 HB THR 7 HB THR 7 -0.428 -12.376 16.024 832 HG1 THR 7 HG1 THR 7 -0.253 -13.578 18.114 833 HG21 THR 7 HG21 THR 7 1.259 -10.728 16.795 834 HG22 THR 7 HG22 THR 7 1.571 -12.330 17.461 835 HG23 THR 7 HG23 THR 7 0.843 -11.081 18.476 836 H HIS 8 H HIS 8 -3.905 -10.889 17.969 837 HA HIS 8 HA HIS 8 -5.253 -11.678 15.447 838 HB2 HIS 8 HB2 HIS 8 -7.059 -12.615 16.817 839 HB3 HIS 8 HB3 HIS 8 -5.521 -13.323 17.275 840 HD1 HIS 8 HD1 HIS 8 -4.922 -13.242 19.717 841 HD2 HIS 8 HD2 HIS 8 -8.100 -10.720 18.796 842 HE1 HIS 8 HE1 HIS 8 -5.830 -12.460 21.923 843 HE2 HIS 8 HE2 HIS 8 -7.761 -10.963 21.348 844 H ASP 9 H ASP 9 -4.643 -9.011 17.292 845 HA ASP 9 HA ASP 9 -7.165 -7.681 17.429 846 HB2 ASP 9 HB2 ASP 9 -5.174 -7.052 18.819 847 HB3 ASP 9 HB3 ASP 9 -4.349 -6.491 17.374 848 H ASN 10 H ASN 10 -4.389 -7.443 15.235 849 HA ASN 10 HA ASN 10 -5.833 -5.931 13.231 850 HB2 ASN 10 HB2 ASN 10 -3.763 -6.006 11.927 851 HB3 ASN 10 HB3 ASN 10 -3.394 -5.547 13.582 852 HD21 ASN 10 HD21 ASN 10 -1.655 -6.691 11.513 853 HD22 ASN 10 HD22 ASN 10 -0.998 -8.133 12.188 854 H VAL 11 H VAL 11 -5.889 -6.762 10.958 855 HA VAL 11 HA VAL 11 -6.350 -9.671 10.756 856 HB VAL 11 HB VAL 11 -8.276 -9.361 9.277 857 HG11 VAL 11 HG11 VAL 11 -8.681 -7.861 11.883 858 HG12 VAL 11 HG12 VAL 11 -8.732 -9.612 11.666 859 HG13 VAL 11 HG13 VAL 11 -9.953 -8.594 10.901 860 HG21 VAL 11 HG21 VAL 11 -8.030 -6.362 9.760 861 HG22 VAL 11 HG22 VAL 11 -9.358 -7.156 8.912 862 HG23 VAL 11 HG23 VAL 11 -7.729 -7.205 8.239 863 H ILE 12 H ILE 12 -5.923 -10.540 8.781 864 HA ILE 12 HA ILE 12 -4.133 -9.077 6.987 865 HB ILE 12 HB ILE 12 -4.802 -12.058 7.051 866 HG12 ILE 12 HG12 ILE 12 -3.778 -11.337 9.228 867 HG13 ILE 12 HG13 ILE 12 -2.762 -12.465 8.346 868 HG21 ILE 12 HG21 ILE 12 -2.737 -12.332 5.761 869 HG22 ILE 12 HG22 ILE 12 -2.482 -10.588 5.765 870 HG23 ILE 12 HG23 ILE 12 -3.873 -11.276 4.923 871 HD11 ILE 12 HD11 ILE 12 -2.368 -9.483 8.558 872 HD12 ILE 12 HD12 ILE 12 -1.344 -10.584 7.634 873 HD13 ILE 12 HD13 ILE 12 -1.446 -10.736 9.387 874 H LEU 13 H LEU 13 -5.636 -7.860 5.808 875 HA LEU 13 HA LEU 13 -7.952 -9.150 4.571 876 HB2 LEU 13 HB2 LEU 13 -7.899 -6.793 5.722 877 HB3 LEU 13 HB3 LEU 13 -7.166 -6.231 4.234 878 HG LEU 13 HG LEU 13 -9.606 -5.769 4.332 879 HD11 LEU 13 HD11 LEU 13 -10.289 -6.569 2.140 880 HD12 LEU 13 HD12 LEU 13 -8.993 -7.767 2.136 881 HD13 LEU 13 HD13 LEU 13 -8.606 -6.046 2.109 882 HD21 LEU 13 HD21 LEU 13 -10.307 -7.661 5.706 883 HD22 LEU 13 HD22 LEU 13 -9.982 -8.777 4.378 884 HD23 LEU 13 HD23 LEU 13 -11.263 -7.571 4.228 885 H GLU 14 H GLU 14 -7.077 -10.479 2.989 886 HA GLU 14 HA GLU 14 -5.192 -9.410 1.016 887 HB2 GLU 14 HB2 GLU 14 -4.829 -11.691 1.953 888 HB3 GLU 14 HB3 GLU 14 -6.393 -12.203 1.327 889 HG2 GLU 14 HG2 GLU 14 -5.558 -11.741 -0.990 890 HG3 GLU 14 HG3 GLU 14 -3.967 -11.391 -0.311 891 H LEU 15 H LEU 15 -6.350 -8.006 -0.302 892 HA LEU 15 HA LEU 15 -8.656 -9.154 -1.759 893 HB2 LEU 15 HB2 LEU 15 -8.870 -6.704 -2.643 894 HB3 LEU 15 HB3 LEU 15 -9.397 -7.104 -1.026 895 HG LEU 15 HG LEU 15 -7.031 -6.229 -0.284 896 HD11 LEU 15 HD11 LEU 15 -6.111 -4.428 -1.631 897 HD12 LEU 15 HD12 LEU 15 -7.264 -4.775 -2.922 898 HD13 LEU 15 HD13 LEU 15 -6.036 -5.966 -2.488 899 HD21 LEU 15 HD21 LEU 15 -7.907 -3.961 -0.007 900 HD22 LEU 15 HD22 LEU 15 -9.117 -5.182 0.369 901 HD23 LEU 15 HD23 LEU 15 -9.199 -4.308 -1.162 902 H THR 16 H THR 16 -8.347 -10.009 -3.614 903 HA THR 16 HA THR 16 -5.863 -9.758 -5.120 904 HB THR 16 HB THR 16 -8.336 -11.474 -5.610 905 HG1 THR 16 HG1 THR 16 -7.169 -11.958 -3.650 906 HG21 THR 16 HG21 THR 16 -5.557 -11.687 -6.828 907 HG22 THR 16 HG22 THR 16 -6.995 -11.098 -7.666 908 HG23 THR 16 HG23 THR 16 -6.916 -12.781 -7.127 909 H VAL 17 H VAL 17 -5.844 -7.887 -6.225 910 HA VAL 17 HA VAL 17 -8.186 -7.095 -7.860 911 HB VAL 17 HB VAL 17 -7.565 -4.841 -7.659 912 HG11 VAL 17 HG11 VAL 17 -7.121 -6.064 -4.920 913 HG12 VAL 17 HG12 VAL 17 -8.677 -5.683 -5.660 914 HG13 VAL 17 HG13 VAL 17 -7.566 -4.382 -5.235 915 HG21 VAL 17 HG21 VAL 17 -5.163 -4.915 -8.019 916 HG22 VAL 17 HG22 VAL 17 -4.903 -5.670 -6.448 917 HG23 VAL 17 HG23 VAL 17 -5.480 -4.005 -6.540 918 H ARG 18 H ARG 18 -7.806 -6.478 -10.011 919 HA ARG 18 HA ARG 18 -5.082 -6.959 -11.070 920 HB2 ARG 18 HB2 ARG 18 -6.110 -6.925 -13.318 921 HB3 ARG 18 HB3 ARG 18 -6.746 -8.201 -12.296 922 HG2 ARG 18 HG2 ARG 18 -8.808 -6.950 -11.955 923 HG3 ARG 18 HG3 ARG 18 -8.154 -5.580 -12.856 924 HD2 ARG 18 HD2 ARG 18 -8.766 -8.341 -13.957 925 HD3 ARG 18 HD3 ARG 18 -9.654 -6.850 -14.292 926 HE ARG 18 HE ARG 18 -6.809 -6.958 -15.023 927 HH11 ARG 18 HH11 ARG 18 -10.144 -7.036 -16.157 928 HH12 ARG 18 HH12 ARG 18 -9.702 -6.718 -17.802 929 HH21 ARG 18 HH21 ARG 18 -6.260 -6.544 -17.151 930 HH22 ARG 18 HH22 ARG 18 -7.496 -6.439 -18.368 931 H ASN 19 H ASN 19 -4.187 -5.334 -12.557 932 HA ASN 19 HA ASN 19 -4.106 -2.902 -11.086 933 HB2 ASN 19 HB2 ASN 19 -2.100 -4.087 -12.108 934 HB3 ASN 19 HB3 ASN 19 -2.614 -3.489 -13.680 935 HD21 ASN 19 HD21 ASN 19 -0.190 -2.950 -11.875 936 HD22 ASN 19 HD22 ASN 19 -0.094 -1.232 -11.789 937 H HIS 20 H HIS 20 -6.089 -2.042 -11.302 938 HA HIS 20 HA HIS 20 -6.920 -0.701 -13.797 939 HB2 HIS 20 HB2 HIS 20 -8.322 -1.369 -11.188 940 HB3 HIS 20 HB3 HIS 20 -8.968 -0.083 -12.190 941 HD1 HIS 20 HD1 HIS 20 -10.124 -0.757 -14.378 942 HD2 HIS 20 HD2 HIS 20 -8.643 -3.967 -12.214 943 HE1 HIS 20 HE1 HIS 20 -11.117 -2.794 -15.436 944 HE2 HIS 20 HE2 HIS 20 -10.405 -4.688 -13.957 945 HA PRO 21 HA PRO 21 -5.614 3.447 -12.626 946 HB2 PRO 21 HB2 PRO 21 -8.501 4.277 -12.963 947 HB3 PRO 21 HB3 PRO 21 -7.028 5.006 -13.642 948 HG2 PRO 21 HG2 PRO 21 -8.580 3.514 -15.179 949 HG3 PRO 21 HG3 PRO 21 -6.809 3.369 -15.295 950 HD2 PRO 21 HD2 PRO 21 -8.771 1.521 -13.957 951 HD3 PRO 21 HD3 PRO 21 -7.302 1.134 -14.882 952 H GLY 22 H GLY 22 -5.072 3.208 -10.481 953 HA2 GLY 22 HA2 GLY 22 -5.010 4.159 -8.395 954 HA3 GLY 22 HA3 GLY 22 -6.572 4.892 -8.706 955 H VAL 23 H VAL 23 -5.752 1.390 -8.684 956 HA VAL 23 HA VAL 23 -7.984 0.697 -7.072 957 HB VAL 23 HB VAL 23 -5.468 -1.025 -7.247 958 HG11 VAL 23 HG11 VAL 23 -8.402 -1.722 -6.833 959 HG12 VAL 23 HG12 VAL 23 -7.140 -1.745 -5.596 960 HG13 VAL 23 HG13 VAL 23 -7.077 -2.878 -6.940 961 HG21 VAL 23 HG21 VAL 23 -6.458 -2.141 -9.212 962 HG22 VAL 23 HG22 VAL 23 -6.076 -0.450 -9.542 963 HG23 VAL 23 HG23 VAL 23 -7.748 -0.935 -9.249 964 H MET 24 H MET 24 -4.548 1.094 -6.295 965 HA MET 24 HA MET 24 -4.615 0.515 -3.558 966 HB2 MET 24 HB2 MET 24 -2.479 1.754 -3.409 967 HB3 MET 24 HB3 MET 24 -2.509 0.662 -4.783 968 HG2 MET 24 HG2 MET 24 -2.964 3.646 -4.953 969 HG3 MET 24 HG3 MET 24 -1.430 2.840 -5.267 970 HE1 MET 24 HE1 MET 24 -2.828 4.888 -7.304 971 HE2 MET 24 HE2 MET 24 -2.590 4.045 -8.834 972 HE3 MET 24 HE3 MET 24 -1.290 4.092 -7.644 973 H THR 25 H THR 25 -5.566 3.406 -5.300 974 HA THR 25 HA THR 25 -5.851 5.116 -3.009 975 HB THR 25 HB THR 25 -7.220 5.523 -5.702 976 HG1 THR 25 HG1 THR 25 -4.641 6.543 -5.214 977 HG21 THR 25 HG21 THR 25 -6.047 7.515 -3.710 978 HG22 THR 25 HG22 THR 25 -7.769 7.170 -3.909 979 HG23 THR 25 HG23 THR 25 -6.863 7.919 -5.224 980 H HIS 26 H HIS 26 -7.953 2.854 -4.749 981 HA HIS 26 HA HIS 26 -10.443 3.541 -3.531 982 HB2 HIS 26 HB2 HIS 26 -9.527 0.860 -4.684 983 HB3 HIS 26 HB3 HIS 26 -11.181 1.220 -4.206 984 HD1 HIS 26 HD1 HIS 26 -11.340 0.391 -6.855 985 HD2 HIS 26 HD2 HIS 26 -9.947 4.224 -6.098 986 HE1 HIS 26 HE1 HIS 26 -11.598 1.643 -9.017 987 HE2 HIS 26 HE2 HIS 26 -10.843 3.978 -8.499 988 H VAL 27 H VAL 27 -8.040 0.992 -2.828 989 HA VAL 27 HA VAL 27 -9.480 -0.219 -0.728 990 HB VAL 27 HB VAL 27 -7.546 -1.599 -0.299 991 HG11 VAL 27 HG11 VAL 27 -8.754 -2.116 -2.356 992 HG12 VAL 27 HG12 VAL 27 -7.041 -2.476 -2.561 993 HG13 VAL 27 HG13 VAL 27 -7.725 -1.016 -3.278 994 HG21 VAL 27 HG21 VAL 27 -5.850 0.326 -1.937 995 HG22 VAL 27 HG22 VAL 27 -5.308 -1.224 -1.286 996 HG23 VAL 27 HG23 VAL 27 -5.758 0.083 -0.191 997 H CYS 28 H CYS 28 -6.915 2.254 -0.712 998 HA CYS 28 HA CYS 28 -6.531 2.347 2.109 999 HB2 CYS 28 HB2 CYS 28 -5.342 4.462 1.667 1000 HB3 CYS 28 HB3 CYS 28 -4.881 3.234 0.491 1001 HG CYS 28 HG CYS 28 -5.277 4.712 -1.507 1002 H GLY 29 H GLY 29 -8.679 4.025 -0.139 1003 HA2 GLY 29 HA2 GLY 29 -9.851 5.904 1.622 1004 HA3 GLY 29 HA3 GLY 29 -10.567 5.281 0.139 1005 H LEU 30 H LEU 30 -10.540 2.488 1.001 1006 HA LEU 30 HA LEU 30 -13.087 2.361 2.257 1007 HB2 LEU 30 HB2 LEU 30 -11.157 0.403 1.135 1008 HB3 LEU 30 HB3 LEU 30 -12.139 -0.243 2.433 1009 HG LEU 30 HG LEU 30 -13.160 -0.753 0.286 1010 HD11 LEU 30 HD11 LEU 30 -14.806 1.323 1.760 1011 HD12 LEU 30 HD12 LEU 30 -14.662 -0.386 2.176 1012 HD13 LEU 30 HD13 LEU 30 -15.421 0.084 0.661 1013 HD21 LEU 30 HD21 LEU 30 -12.290 1.080 -1.087 1014 HD22 LEU 30 HD22 LEU 30 -13.335 2.229 -0.249 1015 HD23 LEU 30 HD23 LEU 30 -14.043 0.947 -1.237 1016 H PHE 31 H PHE 31 -9.813 1.725 3.486 1017 HA PHE 31 HA PHE 31 -10.764 0.962 6.125 1018 HB2 PHE 31 HB2 PHE 31 -7.923 1.465 5.126 1019 HB3 PHE 31 HB3 PHE 31 -8.342 0.784 6.701 1020 HD1 PHE 31 HD2 PHE 31 -9.656 -1.433 6.762 1021 HD2 PHE 31 HD1 PHE 31 -7.790 0.028 3.211 1022 HE1 PHE 31 HE2 PHE 31 -9.818 -3.671 5.748 1023 HE2 PHE 31 HE1 PHE 31 -7.971 -2.205 2.200 1024 HZ PHE 31 HZ PHE 31 -8.982 -4.054 3.464 1025 H ALA 32 H ALA 32 -9.478 3.840 4.593 1026 HA ALA 32 HA ALA 32 -8.905 5.369 6.926 1027 HB1 ALA 32 HB1 ALA 32 -7.894 5.875 4.739 1028 HB2 ALA 32 HB2 ALA 32 -8.734 7.283 5.390 1029 HB3 ALA 32 HB3 ALA 32 -9.476 6.328 4.099 1030 H ARG 33 H ARG 33 -11.824 4.918 4.979 1031 HA ARG 33 HA ARG 33 -13.235 7.245 5.880 1032 HB2 ARG 33 HB2 ARG 33 -15.106 6.425 4.625 1033 HB3 ARG 33 HB3 ARG 33 -13.663 6.022 3.705 1034 HG2 ARG 33 HG2 ARG 33 -13.844 3.685 4.843 1035 HG3 ARG 33 HG3 ARG 33 -15.481 4.179 5.264 1036 HD2 ARG 33 HD2 ARG 33 -14.310 3.888 2.484 1037 HD3 ARG 33 HD3 ARG 33 -15.558 2.882 3.231 1038 HE ARG 33 HE ARG 33 -16.949 4.986 3.258 1039 HH11 ARG 33 HH11 ARG 33 -14.514 4.425 0.798 1040 HH12 ARG 33 HH12 ARG 33 -15.302 5.420 -0.379 1041 HH21 ARG 33 HH21 ARG 33 -17.955 6.322 1.722 1042 HH22 ARG 33 HH22 ARG 33 -17.260 6.501 0.143 1043 H ARG 34 H ARG 34 -12.686 4.169 7.290 1044 HA ARG 34 HA ARG 34 -15.027 4.010 8.911 1045 HB2 ARG 34 HB2 ARG 34 -13.797 1.957 8.529 1046 HB3 ARG 34 HB3 ARG 34 -12.304 2.656 9.150 1047 HG2 ARG 34 HG2 ARG 34 -13.356 1.068 10.747 1048 HG3 ARG 34 HG3 ARG 34 -13.191 2.691 11.416 1049 HD2 ARG 34 HD2 ARG 34 -15.674 3.007 10.617 1050 HD3 ARG 34 HD3 ARG 34 -15.700 1.243 10.545 1051 HE ARG 34 HE ARG 34 -14.919 1.388 12.957 1052 HH11 ARG 34 HH11 ARG 34 -16.980 3.873 11.563 1053 HH12 ARG 34 HH12 ARG 34 -17.701 4.285 13.086 1054 HH21 ARG 34 HH21 ARG 34 -15.933 1.859 14.913 1055 HH22 ARG 34 HH22 ARG 34 -17.107 3.139 14.988 1056 H ALA 35 H ALA 35 -11.639 4.679 9.884 1057 HA ALA 35 HA ALA 35 -12.076 6.917 11.513 1058 HB1 ALA 35 HB1 ALA 35 -12.070 5.928 13.796 1059 HB2 ALA 35 HB2 ALA 35 -12.180 4.308 13.099 1060 HB3 ALA 35 HB3 ALA 35 -13.509 5.445 12.896 1061 H PHE 36 H PHE 36 -10.410 3.755 11.687 1062 HA PHE 36 HA PHE 36 -7.882 5.089 12.387 1063 HB2 PHE 36 HB2 PHE 36 -8.806 3.165 13.812 1064 HB3 PHE 36 HB3 PHE 36 -8.455 2.088 12.463 1065 HD1 PHE 36 HD2 PHE 36 -6.826 4.558 14.777 1066 HD2 PHE 36 HD1 PHE 36 -6.264 1.126 12.290 1067 HE1 PHE 36 HE2 PHE 36 -4.503 4.360 15.568 1068 HE2 PHE 36 HE1 PHE 36 -3.939 0.940 13.081 1069 HZ PHE 36 HZ PHE 36 -3.055 2.556 14.717 1070 H ASN 37 H ASN 37 -5.903 4.252 11.418 1071 HA ASN 37 HA ASN 37 -6.086 4.150 8.497 1072 HB2 ASN 37 HB2 ASN 37 -3.680 4.548 10.340 1073 HB3 ASN 37 HB3 ASN 37 -3.728 4.863 8.603 1074 HD21 ASN 37 HD21 ASN 37 -3.416 6.519 11.210 1075 HD22 ASN 37 HD22 ASN 37 -4.419 7.890 10.913 1076 H VAL 38 H VAL 38 -3.806 2.906 7.736 1077 HA VAL 38 HA VAL 38 -4.202 0.106 8.551 1078 HB VAL 38 HB VAL 38 -2.557 1.150 6.187 1079 HG11 VAL 38 HG11 VAL 38 -1.909 -1.107 6.914 1080 HG12 VAL 38 HG12 VAL 38 -2.718 -1.176 5.348 1081 HG13 VAL 38 HG13 VAL 38 -3.586 -1.645 6.813 1082 HG21 VAL 38 HG21 VAL 38 -4.920 1.785 5.898 1083 HG22 VAL 38 HG22 VAL 38 -5.420 0.113 6.172 1084 HG23 VAL 38 HG23 VAL 38 -4.464 0.526 4.745 1085 H GLU 39 H GLU 39 -2.566 -1.150 9.330 1086 HA GLU 39 HA GLU 39 -0.363 0.111 10.748 1087 HB2 GLU 39 HB2 GLU 39 -1.760 -1.561 11.865 1088 HB3 GLU 39 HB3 GLU 39 -1.469 -2.726 10.581 1089 HG2 GLU 39 HG2 GLU 39 0.973 -2.732 11.292 1090 HG3 GLU 39 HG3 GLU 39 0.485 -1.783 12.696 1091 H GLY 40 H GLY 40 -0.797 -2.480 8.309 1092 HA2 GLY 40 HA2 GLY 40 1.858 -1.954 7.138 1093 HA3 GLY 40 HA3 GLY 40 1.534 -3.573 7.753 1094 H ILE 41 H ILE 41 2.079 -2.744 5.000 1095 HA ILE 41 HA ILE 41 -0.339 -3.772 3.627 1096 HB ILE 41 HB ILE 41 1.304 -1.371 2.621 1097 HG12 ILE 41 HG12 ILE 41 -1.574 -1.410 3.638 1098 HG13 ILE 41 HG13 ILE 41 -0.200 -0.720 4.489 1099 HG21 ILE 41 HG21 ILE 41 0.498 -2.771 0.756 1100 HG22 ILE 41 HG22 ILE 41 -0.328 -1.214 0.770 1101 HG23 ILE 41 HG23 ILE 41 -1.154 -2.657 1.365 1102 HD11 ILE 41 HD11 ILE 41 -1.346 0.270 1.879 1103 HD12 ILE 41 HD12 ILE 41 0.048 0.956 2.716 1104 HD13 ILE 41 HD13 ILE 41 -1.545 1.004 3.470 1105 H LEU 42 H LEU 42 0.157 -5.056 1.817 1106 HA LEU 42 HA LEU 42 2.852 -5.068 0.698 1107 HB2 LEU 42 HB2 LEU 42 3.059 -6.787 2.422 1108 HB3 LEU 42 HB3 LEU 42 1.567 -7.557 1.903 1109 HG LEU 42 HG LEU 42 2.633 -8.236 -0.226 1110 HD11 LEU 42 HD11 LEU 42 5.043 -7.996 -0.592 1111 HD12 LEU 42 HD12 LEU 42 5.166 -6.981 0.848 1112 HD13 LEU 42 HD13 LEU 42 4.221 -6.437 -0.541 1113 HD21 LEU 42 HD21 LEU 42 4.220 -9.063 2.212 1114 HD22 LEU 42 HD22 LEU 42 4.146 -9.933 0.676 1115 HD23 LEU 42 HD23 LEU 42 2.696 -9.764 1.661 1116 H CYS 43 H CYS 43 2.111 -4.401 -1.296 1117 HA CYS 43 HA CYS 43 0.099 -5.988 -2.736 1118 HB2 CYS 43 HB2 CYS 43 0.036 -3.543 -3.049 1119 HB3 CYS 43 HB3 CYS 43 1.706 -3.542 -3.610 1120 HG CYS 43 HG CYS 43 1.264 -4.423 -6.064 1121 H LEU 44 H LEU 44 0.899 -7.899 -3.352 1122 HA LEU 44 HA LEU 44 3.636 -8.192 -4.379 1123 HB2 LEU 44 HB2 LEU 44 2.495 -9.755 -2.614 1124 HB3 LEU 44 HB3 LEU 44 1.607 -10.418 -3.972 1125 HG LEU 44 HG LEU 44 3.841 -11.018 -5.029 1126 HD11 LEU 44 HD11 LEU 44 5.821 -11.066 -3.571 1127 HD12 LEU 44 HD12 LEU 44 4.919 -10.229 -2.308 1128 HD13 LEU 44 HD13 LEU 44 5.249 -9.422 -3.844 1129 HD21 LEU 44 HD21 LEU 44 3.252 -12.280 -2.324 1130 HD22 LEU 44 HD22 LEU 44 4.210 -13.005 -3.618 1131 HD23 LEU 44 HD23 LEU 44 2.490 -12.712 -3.857 1132 HA PRO 45 HA PRO 45 1.451 -7.879 -8.411 1133 HB2 PRO 45 HB2 PRO 45 3.641 -7.381 -9.975 1134 HB3 PRO 45 HB3 PRO 45 2.920 -6.138 -8.934 1135 HG2 PRO 45 HG2 PRO 45 5.338 -7.832 -8.435 1136 HG3 PRO 45 HG3 PRO 45 5.104 -6.093 -8.146 1137 HD2 PRO 45 HD2 PRO 45 4.906 -7.969 -6.156 1138 HD3 PRO 45 HD3 PRO 45 4.004 -6.436 -6.136 1139 H ILE 46 H ILE 46 1.040 -9.369 -9.959 1140 HA ILE 46 HA ILE 46 2.478 -11.932 -9.977 1141 HB ILE 46 HB ILE 46 -0.302 -11.108 -10.941 1142 HG12 ILE 46 HG12 ILE 46 -1.020 -13.039 -9.408 1143 HG13 ILE 46 HG13 ILE 46 0.637 -13.121 -8.837 1144 HG21 ILE 46 HG21 ILE 46 0.585 -12.574 -12.689 1145 HG22 ILE 46 HG22 ILE 46 -0.669 -13.412 -11.777 1146 HG23 ILE 46 HG23 ILE 46 1.030 -13.787 -11.485 1147 HD11 ILE 46 HD11 ILE 46 -1.245 -10.794 -8.525 1148 HD12 ILE 46 HD12 ILE 46 0.432 -10.830 -7.976 1149 HD13 ILE 46 HD13 ILE 46 -0.749 -11.934 -7.274 1150 H GLN 47 H GLN 47 3.646 -12.517 -11.720 1151 HA GLN 47 HA GLN 47 4.386 -10.613 -13.727 1152 HB2 GLN 47 HB2 GLN 47 6.106 -12.052 -12.903 1153 HB3 GLN 47 HB3 GLN 47 5.120 -13.494 -13.099 1154 HG2 GLN 47 HG2 GLN 47 6.899 -13.465 -14.751 1155 HG3 GLN 47 HG3 GLN 47 5.314 -13.332 -15.526 1156 HE21 GLN 47 HE21 GLN 47 6.207 -12.453 -17.399 1157 HE22 GLN 47 HE22 GLN 47 6.822 -10.840 -17.476 1158 H ASP 48 H ASP 48 2.606 -13.668 -13.753 1159 HA ASP 48 HA ASP 48 2.474 -14.186 -16.482 1160 HB2 ASP 48 HB2 ASP 48 2.051 -15.886 -14.800 1161 HB3 ASP 48 HB3 ASP 48 0.664 -15.007 -14.186 1162 H SER 49 H SER 49 0.284 -12.307 -14.453 1163 HA SER 49 HA SER 49 -1.082 -11.180 -16.803 1164 HB2 SER 49 HB2 SER 49 -2.582 -12.418 -14.442 1165 HB3 SER 49 HB3 SER 49 -3.325 -11.534 -15.777 1166 HG SER 49 HG SER 49 -1.774 -13.889 -16.131 1167 H ASP 50 H ASP 50 -2.309 -9.145 -16.221 1168 HA ASP 50 HA ASP 50 -0.854 -7.555 -14.325 1169 HB2 ASP 50 HB2 ASP 50 -2.566 -5.719 -14.906 1170 HB3 ASP 50 HB3 ASP 50 -1.558 -6.304 -16.212 1171 H LYS 51 H LYS 51 -1.158 -8.711 -12.411 1172 HA LYS 51 HA LYS 51 -3.717 -8.326 -11.003 1173 HB2 LYS 51 HB2 LYS 51 -3.575 -10.663 -12.105 1174 HB3 LYS 51 HB3 LYS 51 -2.223 -10.997 -11.037 1175 HG2 LYS 51 HG2 LYS 51 -4.157 -12.009 -10.066 1176 HG3 LYS 51 HG3 LYS 51 -3.758 -10.603 -9.078 1177 HD2 LYS 51 HD2 LYS 51 -6.174 -10.740 -9.399 1178 HD3 LYS 51 HD3 LYS 51 -5.544 -9.308 -10.208 1179 HE2 LYS 51 HE2 LYS 51 -7.210 -10.366 -11.621 1180 HE3 LYS 51 HE3 LYS 51 -5.628 -10.552 -12.379 1181 HZ1 LYS 51 HZ1 LYS 51 -6.867 -12.596 -12.490 1182 HZ2 LYS 51 HZ2 LYS 51 -7.081 -12.608 -10.813 1183 HZ3 LYS 51 HZ3 LYS 51 -5.538 -12.807 -11.466 1184 H SER 52 H SER 52 -3.462 -8.524 -8.707 1185 HA SER 52 HA SER 52 -0.865 -8.478 -7.456 1186 HB2 SER 52 HB2 SER 52 -2.537 -5.906 -7.553 1187 HB3 SER 52 HB3 SER 52 -1.113 -6.154 -6.549 1188 HG SER 52 HG SER 52 -0.199 -6.712 -8.831 1189 H HIS 53 H HIS 53 -1.324 -9.685 -5.639 1190 HA HIS 53 HA HIS 53 -3.898 -9.321 -4.218 1191 HB2 HIS 53 HB2 HIS 53 -1.522 -11.135 -3.582 1192 HB3 HIS 53 HB3 HIS 53 -3.010 -11.071 -2.644 1193 HD1 HIS 53 HD1 HIS 53 -4.282 -13.123 -3.104 1194 HD2 HIS 53 HD2 HIS 53 -2.452 -11.718 -6.541 1195 HE1 HIS 53 HE1 HIS 53 -4.854 -14.781 -4.888 1196 HE2 HIS 53 HE2 HIS 53 -3.554 -14.020 -6.891 1197 H ILE 54 H ILE 54 -4.053 -7.931 -2.462 1198 HA ILE 54 HA ILE 54 -1.534 -6.849 -1.328 1199 HB ILE 54 HB ILE 54 -4.163 -5.292 -1.490 1200 HG12 ILE 54 HG12 ILE 54 -2.809 -3.739 -3.072 1201 HG13 ILE 54 HG13 ILE 54 -1.690 -5.079 -3.260 1202 HG21 ILE 54 HG21 ILE 54 -2.773 -4.705 0.443 1203 HG22 ILE 54 HG22 ILE 54 -2.797 -3.378 -0.718 1204 HG23 ILE 54 HG23 ILE 54 -1.383 -4.431 -0.612 1205 HD11 ILE 54 HD11 ILE 54 -4.607 -5.091 -4.001 1206 HD12 ILE 54 HD12 ILE 54 -3.478 -6.429 -4.224 1207 HD13 ILE 54 HD13 ILE 54 -3.245 -4.922 -5.108 1208 H TRP 55 H TRP 55 -1.249 -7.378 0.751 1209 HA TRP 55 HA TRP 55 -3.515 -8.269 2.421 1210 HB2 TRP 55 HB2 TRP 55 -0.492 -8.482 2.856 1211 HB3 TRP 55 HB3 TRP 55 -1.711 -9.099 3.970 1212 HD1 TRP 55 HD1 TRP 55 -2.739 -11.478 3.408 1213 HE1 TRP 55 HE1 TRP 55 -2.320 -13.235 1.601 1214 HE3 TRP 55 HE3 TRP 55 0.166 -8.730 0.307 1215 HZ2 TRP 55 HZ2 TRP 55 -0.954 -13.437 -0.843 1216 HZ3 TRP 55 HZ3 TRP 55 0.972 -9.749 -1.754 1217 HH2 TRP 55 HH2 TRP 55 0.435 -12.061 -2.332 1218 H LEU 56 H LEU 56 -4.486 -6.564 3.344 1219 HA LEU 56 HA LEU 56 -2.984 -4.285 4.413 1220 HB2 LEU 56 HB2 LEU 56 -5.992 -4.755 4.193 1221 HB3 LEU 56 HB3 LEU 56 -5.258 -3.315 4.869 1222 HG LEU 56 HG LEU 56 -5.979 -2.727 2.691 1223 HD11 LEU 56 HD11 LEU 56 -3.001 -3.188 2.497 1224 HD12 LEU 56 HD12 LEU 56 -3.807 -1.812 3.253 1225 HD13 LEU 56 HD13 LEU 56 -3.953 -2.066 1.517 1226 HD21 LEU 56 HD21 LEU 56 -5.432 -3.932 0.627 1227 HD22 LEU 56 HD22 LEU 56 -6.328 -4.951 1.750 1228 HD23 LEU 56 HD23 LEU 56 -4.587 -5.172 1.562 1229 H LEU 57 H LEU 57 -2.195 -4.622 6.357 1230 HA LEU 57 HA LEU 57 -3.480 -6.236 8.412 1231 HB2 LEU 57 HB2 LEU 57 -0.821 -4.780 8.211 1232 HB3 LEU 57 HB3 LEU 57 -1.407 -5.362 9.758 1233 HG LEU 57 HG LEU 57 -1.357 -7.687 8.946 1234 HD11 LEU 57 HD11 LEU 57 -1.839 -7.380 6.588 1235 HD12 LEU 57 HD12 LEU 57 -0.357 -8.306 6.798 1236 HD13 LEU 57 HD13 LEU 57 -0.273 -6.602 6.334 1237 HD21 LEU 57 HD21 LEU 57 0.614 -6.786 10.062 1238 HD22 LEU 57 HD22 LEU 57 1.264 -6.216 8.522 1239 HD23 LEU 57 HD23 LEU 57 1.090 -7.949 8.822 1240 H VAL 58 H VAL 58 -5.139 -5.251 9.391 1241 HA VAL 58 HA VAL 58 -4.827 -2.617 10.613 1242 HB VAL 58 HB VAL 58 -5.749 -2.135 8.323 1243 HG11 VAL 58 HG11 VAL 58 -8.148 -3.797 9.152 1244 HG12 VAL 58 HG12 VAL 58 -6.972 -4.203 7.899 1245 HG13 VAL 58 HG13 VAL 58 -8.029 -2.808 7.692 1246 HG21 VAL 58 HG21 VAL 58 -7.724 -1.557 10.566 1247 HG22 VAL 58 HG22 VAL 58 -7.630 -0.695 9.027 1248 HG23 VAL 58 HG23 VAL 58 -6.290 -0.607 10.168 1249 H ASN 59 H ASN 59 -6.092 -2.453 12.503 1250 HA ASN 59 HA ASN 59 -7.529 -4.768 13.418 1251 HB2 ASN 59 HB2 ASN 59 -8.210 -3.269 15.348 1252 HB3 ASN 59 HB3 ASN 59 -6.489 -3.503 15.125 1253 HD21 ASN 59 HD21 ASN 59 -5.196 -1.758 14.600 1254 HD22 ASN 59 HD22 ASN 59 -5.766 -0.129 14.643 1255 H ASP 60 H ASP 60 -9.463 -5.332 12.717 1256 HA ASP 60 HA ASP 60 -10.951 -3.685 10.902 1257 HB2 ASP 60 HB2 ASP 60 -12.215 -5.645 10.406 1258 HB3 ASP 60 HB3 ASP 60 -10.567 -6.194 10.672 1259 H ASP 61 H ASP 61 -13.458 -3.905 11.082 1260 HA ASP 61 HA ASP 61 -14.455 -3.298 13.768 1261 HB2 ASP 61 HB2 ASP 61 -13.624 -1.162 12.609 1262 HB3 ASP 61 HB3 ASP 61 -14.894 -1.399 11.415 1263 H GLN 62 H GLN 62 -16.836 -3.231 13.800 1264 HA GLN 62 HA GLN 62 -18.118 -5.349 12.468 1265 HB2 GLN 62 HB2 GLN 62 -19.412 -2.927 13.800 1266 HB3 GLN 62 HB3 GLN 62 -20.206 -4.462 13.463 1267 HG2 GLN 62 HG2 GLN 62 -18.693 -5.603 15.043 1268 HG3 GLN 62 HG3 GLN 62 -17.878 -4.075 15.370 1269 HE21 GLN 62 HE21 GLN 62 -18.995 -2.478 16.601 1270 HE22 GLN 62 HE22 GLN 62 -20.375 -2.871 17.560 1271 H ARG 63 H ARG 63 -18.003 -1.912 11.823 1272 HA ARG 63 HA ARG 63 -19.814 -1.884 9.577 1273 HB2 ARG 63 HB2 ARG 63 -17.829 0.220 10.561 1274 HB3 ARG 63 HB3 ARG 63 -19.113 0.492 9.384 1275 HG2 ARG 63 HG2 ARG 63 -20.808 0.033 11.115 1276 HG3 ARG 63 HG3 ARG 63 -19.528 -0.276 12.290 1277 HD2 ARG 63 HD2 ARG 63 -18.759 2.051 12.086 1278 HD3 ARG 63 HD3 ARG 63 -20.006 2.367 10.870 1279 HE ARG 63 HE ARG 63 -21.096 1.366 13.323 1280 HH11 ARG 63 HH11 ARG 63 -19.945 4.304 11.748 1281 HH12 ARG 63 HH12 ARG 63 -20.886 5.353 12.757 1282 HH21 ARG 63 HH21 ARG 63 -22.311 2.764 14.641 1283 HH22 ARG 63 HH22 ARG 63 -22.231 4.480 14.395 1284 H LEU 64 H LEU 64 -16.352 -2.199 10.099 1285 HA LEU 64 HA LEU 64 -15.429 -1.574 7.503 1286 HB2 LEU 64 HB2 LEU 64 -14.012 -1.893 9.634 1287 HB3 LEU 64 HB3 LEU 64 -14.122 -3.614 9.339 1288 HG LEU 64 HG LEU 64 -13.210 -2.635 6.866 1289 HD11 LEU 64 HD11 LEU 64 -11.339 -1.155 7.278 1290 HD12 LEU 64 HD12 LEU 64 -11.751 -1.052 8.990 1291 HD13 LEU 64 HD13 LEU 64 -12.852 -0.397 7.771 1292 HD21 LEU 64 HD21 LEU 64 -11.452 -3.684 9.103 1293 HD22 LEU 64 HD22 LEU 64 -11.067 -3.672 7.380 1294 HD23 LEU 64 HD23 LEU 64 -12.389 -4.670 7.981 1295 H GLU 65 H GLU 65 -16.687 -4.541 8.948 1296 HA GLU 65 HA GLU 65 -16.159 -6.417 6.928 1297 HB2 GLU 65 HB2 GLU 65 -18.577 -6.242 8.782 1298 HB3 GLU 65 HB3 GLU 65 -18.095 -7.678 7.881 1299 HG2 GLU 65 HG2 GLU 65 -16.010 -7.815 9.155 1300 HG3 GLU 65 HG3 GLU 65 -16.411 -6.331 10.014 1301 H GLN 66 H GLN 66 -18.802 -4.104 7.287 1302 HA GLN 66 HA GLN 66 -20.284 -4.876 4.960 1303 HB2 GLN 66 HB2 GLN 66 -20.314 -2.229 6.474 1304 HB3 GLN 66 HB3 GLN 66 -21.543 -2.780 5.342 1305 HG2 GLN 66 HG2 GLN 66 -20.880 -4.034 8.019 1306 HG3 GLN 66 HG3 GLN 66 -22.303 -3.059 7.644 1307 HE21 GLN 66 HE21 GLN 66 -23.944 -3.980 6.340 1308 HE22 GLN 66 HE22 GLN 66 -24.074 -5.686 6.105 1309 H MET 67 H MET 67 -17.654 -2.644 5.590 1310 HA MET 67 HA MET 67 -17.626 -1.312 3.052 1311 HB2 MET 67 HB2 MET 67 -15.458 -1.614 5.183 1312 HB3 MET 67 HB3 MET 67 -15.334 -0.547 3.791 1313 HG2 MET 67 HG2 MET 67 -17.194 0.792 4.588 1314 HG3 MET 67 HG3 MET 67 -17.477 -0.335 5.916 1315 HE1 MET 67 HE1 MET 67 -17.257 2.744 6.430 1316 HE2 MET 67 HE2 MET 67 -16.179 2.800 7.824 1317 HE3 MET 67 HE3 MET 67 -17.435 1.565 7.731 1318 H ILE 68 H ILE 68 -16.143 -4.237 4.337 1319 HA ILE 68 HA ILE 68 -14.435 -4.898 2.142 1320 HB ILE 68 HB ILE 68 -15.709 -6.676 4.288 1321 HG12 ILE 68 HG12 ILE 68 -12.823 -5.674 4.159 1322 HG13 ILE 68 HG13 ILE 68 -14.087 -4.858 5.065 1323 HG21 ILE 68 HG21 ILE 68 -14.016 -8.395 3.716 1324 HG22 ILE 68 HG22 ILE 68 -13.462 -7.401 2.368 1325 HG23 ILE 68 HG23 ILE 68 -15.096 -8.064 2.358 1326 HD11 ILE 68 HD11 ILE 68 -13.084 -7.656 5.558 1327 HD12 ILE 68 HD12 ILE 68 -14.383 -6.856 6.448 1328 HD13 ILE 68 HD13 ILE 68 -12.742 -6.218 6.521 1329 H SER 69 H SER 69 -17.779 -5.641 3.018 1330 HA SER 69 HA SER 69 -18.438 -7.346 0.855 1331 HB2 SER 69 HB2 SER 69 -19.783 -7.223 2.930 1332 HB3 SER 69 HB3 SER 69 -20.245 -5.566 2.550 1333 HG SER 69 HG SER 69 -21.608 -6.268 1.061 1334 H GLN 70 H GLN 70 -18.283 -3.840 1.185 1335 HA GLN 70 HA GLN 70 -19.813 -3.214 -1.189 1336 HB2 GLN 70 HB2 GLN 70 -19.724 -1.714 0.813 1337 HB3 GLN 70 HB3 GLN 70 -18.014 -1.440 0.537 1338 HG2 GLN 70 HG2 GLN 70 -20.090 -0.701 -1.537 1339 HG3 GLN 70 HG3 GLN 70 -19.696 0.378 -0.208 1340 HE21 GLN 70 HE21 GLN 70 -16.832 -0.216 -0.209 1341 HE22 GLN 70 HE22 GLN 70 -16.190 0.521 -1.632 1342 H ILE 71 H ILE 71 -16.354 -3.200 -0.258 1343 HA ILE 71 HA ILE 71 -15.360 -2.174 -2.711 1344 HB ILE 71 HB ILE 71 -14.103 -2.084 -0.521 1345 HG12 ILE 71 HG12 ILE 71 -12.653 -3.182 -2.967 1346 HG13 ILE 71 HG13 ILE 71 -12.929 -1.493 -2.568 1347 HG21 ILE 71 HG21 ILE 71 -14.449 -4.410 0.212 1348 HG22 ILE 71 HG22 ILE 71 -12.741 -3.978 0.219 1349 HG23 ILE 71 HG23 ILE 71 -13.393 -4.981 -1.080 1350 HD11 ILE 71 HD11 ILE 71 -11.115 -3.411 -1.122 1351 HD12 ILE 71 HD12 ILE 71 -11.416 -1.737 -0.639 1352 HD13 ILE 71 HD13 ILE 71 -10.639 -2.085 -2.183 1353 H ASP 72 H ASP 72 -16.107 -5.368 -1.598 1354 HA ASP 72 HA ASP 72 -14.802 -7.025 -3.399 1355 HB2 ASP 72 HB2 ASP 72 -15.987 -7.874 -1.435 1356 HB3 ASP 72 HB3 ASP 72 -17.531 -7.305 -2.059 1357 H LYS 73 H LYS 73 -17.578 -4.962 -3.883 1358 HA LYS 73 HA LYS 73 -18.485 -6.288 -6.321 1359 HB2 LYS 73 HB2 LYS 73 -19.589 -3.736 -5.087 1360 HB3 LYS 73 HB3 LYS 73 -20.393 -4.810 -6.226 1361 HG2 LYS 73 HG2 LYS 73 -19.733 -5.379 -3.326 1362 HG3 LYS 73 HG3 LYS 73 -21.338 -5.138 -4.020 1363 HD2 LYS 73 HD2 LYS 73 -21.163 -7.243 -5.256 1364 HD3 LYS 73 HD3 LYS 73 -19.486 -7.447 -4.739 1365 HE2 LYS 73 HE2 LYS 73 -20.287 -7.584 -2.372 1366 HE3 LYS 73 HE3 LYS 73 -21.949 -7.527 -2.971 1367 HZ1 LYS 73 HZ1 LYS 73 -21.249 -9.794 -2.587 1368 HZ2 LYS 73 HZ2 LYS 73 -19.930 -9.605 -3.624 1369 HZ3 LYS 73 HZ3 LYS 73 -21.504 -9.552 -4.242 1370 H LEU 74 H LEU 74 -16.128 -4.022 -5.632 1371 HA LEU 74 HA LEU 74 -16.348 -2.355 -7.990 1372 HB2 LEU 74 HB2 LEU 74 -14.294 -2.685 -5.792 1373 HB3 LEU 74 HB3 LEU 74 -13.823 -1.879 -7.273 1374 HG LEU 74 HG LEU 74 -14.420 -0.245 -5.557 1375 HD11 LEU 74 HD11 LEU 74 -16.002 1.127 -6.833 1376 HD12 LEU 74 HD12 LEU 74 -16.445 -0.274 -7.810 1377 HD13 LEU 74 HD13 LEU 74 -14.805 0.371 -7.885 1378 HD21 LEU 74 HD21 LEU 74 -17.213 -1.438 -5.559 1379 HD22 LEU 74 HD22 LEU 74 -16.695 0.001 -4.676 1380 HD23 LEU 74 HD23 LEU 74 -16.034 -1.576 -4.255 1381 H GLU 75 H GLU 75 -15.228 -2.570 -9.912 1382 HA GLU 75 HA GLU 75 -14.788 -5.275 -10.771 1383 HB2 GLU 75 HB2 GLU 75 -14.409 -2.657 -12.281 1384 HB3 GLU 75 HB3 GLU 75 -14.425 -4.257 -13.017 1385 HG2 GLU 75 HG2 GLU 75 -16.773 -4.566 -12.283 1386 HG3 GLU 75 HG3 GLU 75 -16.750 -2.957 -11.563 1387 H ASP 76 H ASP 76 -12.689 -2.850 -9.566 1388 HA ASP 76 HA ASP 76 -10.246 -3.891 -10.649 1389 HB2 ASP 76 HB2 ASP 76 -9.177 -2.567 -8.725 1390 HB3 ASP 76 HB3 ASP 76 -10.082 -1.651 -9.916 1391 H VAL 77 H VAL 77 -11.838 -4.195 -7.448 1392 HA VAL 77 HA VAL 77 -10.187 -6.335 -6.530 1393 HB VAL 77 HB VAL 77 -12.912 -5.351 -5.578 1394 HG11 VAL 77 HG11 VAL 77 -12.699 -7.715 -4.930 1395 HG12 VAL 77 HG12 VAL 77 -12.578 -6.668 -3.517 1396 HG13 VAL 77 HG13 VAL 77 -11.121 -7.392 -4.207 1397 HG21 VAL 77 HG21 VAL 77 -11.052 -3.767 -5.269 1398 HG22 VAL 77 HG22 VAL 77 -10.139 -5.001 -4.392 1399 HG23 VAL 77 HG23 VAL 77 -11.645 -4.371 -3.721 1400 H VAL 78 H VAL 78 -10.084 -8.032 -7.831 1401 HA VAL 78 HA VAL 78 -12.278 -9.235 -9.235 1402 HB VAL 78 HB VAL 78 -9.620 -10.611 -8.630 1403 HG11 VAL 78 HG11 VAL 78 -11.490 -10.836 -11.019 1404 HG12 VAL 78 HG12 VAL 78 -11.312 -12.015 -9.716 1405 HG13 VAL 78 HG13 VAL 78 -9.966 -11.705 -10.812 1406 HG21 VAL 78 HG21 VAL 78 -9.051 -8.368 -9.422 1407 HG22 VAL 78 HG22 VAL 78 -10.091 -8.574 -10.836 1408 HG23 VAL 78 HG23 VAL 78 -8.648 -9.575 -10.647 1409 H LYS 79 H LYS 79 -10.510 -9.860 -6.268 1410 HA LYS 79 HA LYS 79 -12.681 -11.452 -5.121 1411 HB2 LYS 79 HB2 LYS 79 -9.771 -12.410 -5.131 1412 HB3 LYS 79 HB3 LYS 79 -11.077 -13.154 -4.217 1413 HG2 LYS 79 HG2 LYS 79 -12.178 -13.862 -6.269 1414 HG3 LYS 79 HG3 LYS 79 -10.986 -12.995 -7.239 1415 HD2 LYS 79 HD2 LYS 79 -9.204 -14.512 -6.442 1416 HD3 LYS 79 HD3 LYS 79 -10.366 -15.356 -5.415 1417 HE2 LYS 79 HE2 LYS 79 -10.440 -15.234 -8.450 1418 HE3 LYS 79 HE3 LYS 79 -9.925 -16.615 -7.478 1419 HZ1 LYS 79 HZ1 LYS 79 -12.187 -16.894 -8.220 1420 HZ2 LYS 79 HZ2 LYS 79 -12.649 -15.430 -7.516 1421 HZ3 LYS 79 HZ3 LYS 79 -12.162 -16.719 -6.538 1422 H VAL 80 H VAL 80 -12.702 -11.304 -2.815 1423 HA VAL 80 HA VAL 80 -10.534 -9.746 -1.526 1424 HB VAL 80 HB VAL 80 -12.690 -8.359 -1.839 1425 HG11 VAL 80 HG11 VAL 80 -14.356 -10.070 -1.318 1426 HG12 VAL 80 HG12 VAL 80 -14.535 -8.668 -0.262 1427 HG13 VAL 80 HG13 VAL 80 -13.786 -10.144 0.352 1428 HG21 VAL 80 HG21 VAL 80 -12.524 -7.293 0.385 1429 HG22 VAL 80 HG22 VAL 80 -10.936 -7.669 -0.284 1430 HG23 VAL 80 HG23 VAL 80 -11.617 -8.686 0.987 1431 H GLN 81 H GLN 81 -9.978 -10.458 0.548 1432 HA GLN 81 HA GLN 81 -11.307 -12.853 1.657 1433 HB2 GLN 81 HB2 GLN 81 -8.310 -12.564 1.130 1434 HB3 GLN 81 HB3 GLN 81 -9.035 -13.872 2.055 1435 HG2 GLN 81 HG2 GLN 81 -9.754 -14.999 0.185 1436 HG3 GLN 81 HG3 GLN 81 -10.094 -13.521 -0.712 1437 HE21 GLN 81 HE21 GLN 81 -7.598 -15.806 0.192 1438 HE22 GLN 81 HE22 GLN 81 -6.453 -15.330 -1.010 1439 H ARG 82 H ARG 82 -11.734 -12.482 3.714 1440 HA ARG 82 HA ARG 82 -10.177 -10.528 5.292 1441 HB2 ARG 82 HB2 ARG 82 -12.549 -9.970 5.035 1442 HB3 ARG 82 HB3 ARG 82 -13.038 -11.562 5.575 1443 HG2 ARG 82 HG2 ARG 82 -11.454 -9.890 7.504 1444 HG3 ARG 82 HG3 ARG 82 -13.108 -9.391 7.168 1445 HD2 ARG 82 HD2 ARG 82 -13.818 -11.778 7.764 1446 HD3 ARG 82 HD3 ARG 82 -12.173 -12.023 8.354 1447 HE ARG 82 HE ARG 82 -12.575 -10.473 10.097 1448 HH11 ARG 82 HH11 ARG 82 -15.465 -11.066 8.175 1449 HH12 ARG 82 HH12 ARG 82 -16.535 -10.443 9.389 1450 HH21 ARG 82 HH21 ARG 82 -14.005 -9.656 11.672 1451 HH22 ARG 82 HH22 ARG 82 -15.713 -9.652 11.356 1452 H ASN 83 H ASN 83 -8.533 -11.741 6.072 1453 HA ASN 83 HA ASN 83 -9.118 -14.319 7.428 1454 HB2 ASN 83 HB2 ASN 83 -6.564 -13.312 6.081 1455 HB3 ASN 83 HB3 ASN 83 -6.641 -14.773 7.058 1456 HD21 ASN 83 HD21 ASN 83 -5.987 -16.057 5.344 1457 HD22 ASN 83 HD22 ASN 83 -7.009 -16.424 4.002 1458 H GLN 84 H GLN 84 -9.206 -13.967 9.617 1459 HA GLN 84 HA GLN 84 -7.488 -11.949 10.877 1460 HB2 GLN 84 HB2 GLN 84 -8.634 -12.660 13.015 1461 HB3 GLN 84 HB3 GLN 84 -9.737 -12.066 11.784 1462 HG2 GLN 84 HG2 GLN 84 -10.451 -14.329 11.265 1463 HG3 GLN 84 HG3 GLN 84 -9.258 -15.001 12.370 1464 HE21 GLN 84 HE21 GLN 84 -9.778 -12.986 14.466 1465 HE22 GLN 84 HE22 GLN 84 -11.305 -13.400 15.150 1466 H SER 85 H SER 85 -5.397 -12.545 10.998 1467 HA SER 85 HA SER 85 -4.629 -15.119 12.143 1468 HB2 SER 85 HB2 SER 85 -4.951 -15.520 9.657 1469 HB3 SER 85 HB3 SER 85 -3.698 -14.318 9.340 1470 HG SER 85 HG SER 85 -3.456 -16.831 10.635 1471 H ASP 86 H ASP 86 -2.127 -15.247 12.019 1472 HA ASP 86 HA ASP 86 -1.097 -13.126 13.597 1473 HB2 ASP 86 HB2 ASP 86 -0.481 -15.588 13.758 1474 HB3 ASP 86 HB3 ASP 86 0.444 -15.406 12.272 1475 HA PRO 87 HA PRO 87 0.252 -10.079 10.573 1476 HB2 PRO 87 HB2 PRO 87 2.706 -10.010 12.361 1477 HB3 PRO 87 HB3 PRO 87 1.771 -8.659 11.674 1478 HG2 PRO 87 HG2 PRO 87 1.398 -9.357 14.194 1479 HG3 PRO 87 HG3 PRO 87 0.006 -8.924 13.170 1480 HD2 PRO 87 HD2 PRO 87 0.894 -11.626 14.109 1481 HD3 PRO 87 HD3 PRO 87 -0.750 -11.026 13.794 1482 H THR 88 H THR 88 2.615 -12.612 11.506 1483 HA THR 88 HA THR 88 4.620 -12.103 9.601 1484 HB THR 88 HB THR 88 5.413 -14.440 10.021 1485 HG1 THR 88 HG1 THR 88 2.939 -14.607 11.432 1486 HG21 THR 88 HG21 THR 88 4.561 -12.993 12.558 1487 HG22 THR 88 HG22 THR 88 6.035 -12.672 11.638 1488 HG23 THR 88 HG23 THR 88 5.813 -14.229 12.439 1489 H MET 89 H MET 89 1.517 -13.312 8.952 1490 HA MET 89 HA MET 89 1.761 -14.924 6.737 1491 HB2 MET 89 HB2 MET 89 -0.416 -14.349 7.665 1492 HB3 MET 89 HB3 MET 89 -0.200 -12.651 7.251 1493 HG2 MET 89 HG2 MET 89 -1.748 -13.742 5.708 1494 HG3 MET 89 HG3 MET 89 -0.299 -13.211 4.858 1495 HE1 MET 89 HE1 MET 89 -0.905 -14.767 2.741 1496 HE2 MET 89 HE2 MET 89 -2.390 -15.213 3.584 1497 HE3 MET 89 HE3 MET 89 -1.349 -16.465 2.910 1498 H PHE 90 H PHE 90 2.143 -11.340 6.883 1499 HA PHE 90 HA PHE 90 2.342 -10.919 4.088 1500 HB2 PHE 90 HB2 PHE 90 2.928 -8.661 4.499 1501 HB3 PHE 90 HB3 PHE 90 1.947 -9.085 5.890 1502 HD1 PHE 90 HD1 PHE 90 5.358 -8.206 4.743 1503 HD2 PHE 90 HD2 PHE 90 2.960 -9.172 8.149 1504 HE1 PHE 90 HE1 PHE 90 7.164 -7.448 6.236 1505 HE2 PHE 90 HE2 PHE 90 4.769 -8.414 9.634 1506 HZ PHE 90 HZ PHE 90 6.871 -7.556 8.679 1507 H ASN 91 H ASN 91 4.794 -11.565 6.572 1508 HA ASN 91 HA ASN 91 7.127 -11.272 4.969 1509 HB2 ASN 91 HB2 ASN 91 7.055 -11.296 7.510 1510 HB3 ASN 91 HB3 ASN 91 6.755 -13.023 7.450 1511 HD21 ASN 91 HD21 ASN 91 8.935 -11.657 8.755 1512 HD22 ASN 91 HD22 ASN 91 10.393 -12.247 8.053 1513 H LYS 92 H LYS 92 4.934 -13.936 5.627 1514 HA LYS 92 HA LYS 92 6.383 -16.143 4.769 1515 HB2 LYS 92 HB2 LYS 92 4.266 -16.258 6.072 1516 HB3 LYS 92 HB3 LYS 92 3.354 -15.749 4.664 1517 HG2 LYS 92 HG2 LYS 92 5.006 -18.287 4.586 1518 HG3 LYS 92 HG3 LYS 92 3.408 -18.287 5.326 1519 HD2 LYS 92 HD2 LYS 92 2.392 -17.594 3.198 1520 HD3 LYS 92 HD3 LYS 92 3.983 -17.483 2.444 1521 HE2 LYS 92 HE2 LYS 92 2.887 -19.559 1.778 1522 HE3 LYS 92 HE3 LYS 92 4.285 -19.932 2.785 1523 HZ1 LYS 92 HZ1 LYS 92 1.461 -19.868 3.702 1524 HZ2 LYS 92 HZ2 LYS 92 2.798 -20.258 4.658 1525 HZ3 LYS 92 HZ3 LYS 92 2.357 -21.264 3.373 1526 H ILE 93 H ILE 93 3.958 -14.283 2.828 1527 HA ILE 93 HA ILE 93 4.685 -15.764 0.441 1528 HB ILE 93 HB ILE 93 3.064 -14.507 -0.811 1529 HG12 ILE 93 HG12 ILE 93 3.578 -12.256 0.436 1530 HG13 ILE 93 HG13 ILE 93 1.966 -12.542 -0.176 1531 HG21 ILE 93 HG21 ILE 93 2.171 -16.329 0.528 1532 HG22 ILE 93 HG22 ILE 93 0.991 -15.021 0.436 1533 HG23 ILE 93 HG23 ILE 93 1.938 -15.251 1.907 1534 HD11 ILE 93 HD11 ILE 93 2.823 -12.870 2.685 1535 HD12 ILE 93 HD12 ILE 93 1.187 -13.086 2.052 1536 HD13 ILE 93 HD13 ILE 93 1.949 -11.499 2.007 1537 H ALA 94 H ALA 94 5.644 -12.738 1.882 1538 HA ALA 94 HA ALA 94 6.484 -11.281 -0.373 1539 HB1 ALA 94 HB1 ALA 94 6.227 -10.277 1.852 1540 HB2 ALA 94 HB2 ALA 94 7.832 -9.953 1.196 1541 HB3 ALA 94 HB3 ALA 94 7.618 -11.190 2.439 1542 H VAL 95 H VAL 95 8.211 -13.698 1.584 1543 HA VAL 95 HA VAL 95 10.743 -13.407 0.305 1544 HB VAL 95 HB VAL 95 10.466 -14.452 2.574 1545 HG11 VAL 95 HG11 VAL 95 8.515 -15.852 2.197 1546 HG12 VAL 95 HG12 VAL 95 9.854 -16.828 2.798 1547 HG13 VAL 95 HG13 VAL 95 9.422 -16.877 1.085 1548 HG21 VAL 95 HG21 VAL 95 12.576 -14.736 1.356 1549 HG22 VAL 95 HG22 VAL 95 11.957 -16.187 0.570 1550 HG23 VAL 95 HG23 VAL 95 12.225 -16.177 2.315 1551 H PHE 96 H PHE 96 7.860 -15.317 -0.448 1552 HA PHE 96 HA PHE 96 9.123 -16.973 -2.455 1553 HB2 PHE 96 HB2 PHE 96 6.196 -16.508 -1.745 1554 HB3 PHE 96 HB3 PHE 96 6.714 -17.615 -3.014 1555 HD1 PHE 96 HD2 PHE 96 8.598 -19.365 -2.226 1556 HD2 PHE 96 HD1 PHE 96 5.785 -17.462 0.369 1557 HE1 PHE 96 HE2 PHE 96 8.880 -21.169 -0.586 1558 HE2 PHE 96 HE1 PHE 96 6.078 -19.274 2.012 1559 HZ PHE 96 HZ PHE 96 7.630 -21.128 1.535 1560 H PHE 97 H PHE 97 7.157 -14.044 -2.480 1561 HA PHE 97 HA PHE 97 6.204 -12.755 -4.050 1562 HB2 PHE 97 HB2 PHE 97 7.761 -11.533 -5.462 1563 HB3 PHE 97 HB3 PHE 97 8.451 -11.799 -3.876 1564 HD1 PHE 97 HD1 PHE 97 8.731 -12.641 -7.476 1565 HD2 PHE 97 HD2 PHE 97 10.478 -13.139 -3.610 1566 HE1 PHE 97 HE1 PHE 97 10.798 -13.486 -8.513 1567 HE2 PHE 97 HE2 PHE 97 12.538 -13.986 -4.652 1568 HZ PHE 97 HZ PHE 97 12.700 -14.165 -7.102 1569 H GLN 98 H GLN 98 5.745 -15.539 -4.701 1570 HA GLN 98 HA GLN 98 5.111 -15.402 -7.539 1571 HB2 GLN 98 HB2 GLN 98 7.445 -16.214 -7.588 1572 HB3 GLN 98 HB3 GLN 98 7.058 -17.482 -6.436 1573 HG2 GLN 98 HG2 GLN 98 7.262 -18.396 -8.685 1574 HG3 GLN 98 HG3 GLN 98 5.605 -18.567 -8.104 1575 HE21 GLN 98 HE21 GLN 98 3.967 -17.378 -9.117 1576 HE22 GLN 98 HE22 GLN 98 4.206 -16.575 -10.625 Start of MODEL 14 1 H1 GLY 1 H1 GLY 1 -0.205 3.887 -17.270 2 H2 GLY 1 H2 GLY 1 -1.243 3.810 -18.601 3 H3 GLY 1 H3 GLY 1 -1.235 5.179 -17.611 4 HA2 GLY 1 HA3 GLY 1 -0.069 5.653 -19.651 5 HA3 GLY 1 HA2 GLY 1 1.014 5.709 -18.266 6 H SER 2 H SER 2 2.934 5.139 -19.250 7 HA SER 2 HA SER 2 3.281 3.007 -21.063 8 HB2 SER 2 HB2 SER 2 4.909 4.881 -20.753 9 HB3 SER 2 HB3 SER 2 5.342 4.221 -19.174 10 HG SER 2 HG SER 2 6.424 3.611 -21.442 11 H MET 3 H MET 3 2.831 0.959 -20.595 12 HA MET 3 HA MET 3 2.494 -0.013 -17.927 13 HB2 MET 3 HB2 MET 3 2.397 -1.504 -20.581 14 HB3 MET 3 HB3 MET 3 1.845 -2.142 -19.037 15 HG2 MET 3 HG2 MET 3 0.127 -0.360 -18.936 16 HG3 MET 3 HG3 MET 3 0.671 0.232 -20.509 17 HE1 MET 3 HE1 MET 3 -1.981 0.027 -21.199 18 HE2 MET 3 HE2 MET 3 -2.412 -0.748 -19.672 19 HE3 MET 3 HE3 MET 3 -2.843 -1.510 -21.203 20 H GLN 4 H GLN 4 4.600 0.307 -17.074 21 HA GLN 4 HA GLN 4 6.763 -1.507 -17.987 22 HB2 GLN 4 HB2 GLN 4 6.887 1.053 -16.322 23 HB3 GLN 4 HB3 GLN 4 8.284 0.070 -16.744 24 HG2 GLN 4 HG2 GLN 4 6.518 1.593 -18.688 25 HG3 GLN 4 HG3 GLN 4 8.133 2.061 -18.157 26 HE21 GLN 4 HE21 GLN 4 6.300 -0.021 -20.239 27 HE22 GLN 4 HE22 GLN 4 7.636 -0.679 -21.115 28 H ASN 5 H ASN 5 4.766 -2.731 -16.571 29 HA ASN 5 HA ASN 5 5.420 -2.979 -13.766 30 HB2 ASN 5 HB2 ASN 5 3.724 -4.752 -15.577 31 HB3 ASN 5 HB3 ASN 5 3.893 -4.984 -13.837 32 HD21 ASN 5 HD21 ASN 5 2.535 -2.963 -16.335 33 HD22 ASN 5 HD22 ASN 5 1.474 -2.077 -15.302 34 H THR 6 H THR 6 7.695 -3.203 -14.113 35 HA THR 6 HA THR 6 8.724 -5.899 -14.477 36 HB THR 6 HB THR 6 10.510 -4.989 -16.135 37 HG1 THR 6 HG1 THR 6 8.927 -2.785 -15.839 38 HG21 THR 6 HG21 THR 6 9.155 -5.351 -18.158 39 HG22 THR 6 HG22 THR 6 7.672 -5.194 -17.215 40 HG23 THR 6 HG23 THR 6 8.757 -6.559 -16.931 41 H THR 7 H THR 7 10.158 -6.112 -12.825 42 HA THR 7 HA THR 7 10.823 -3.853 -11.198 43 HB THR 7 HB THR 7 11.739 -6.734 -10.850 44 HG1 THR 7 HG1 THR 7 9.277 -5.455 -10.449 45 HG21 THR 7 HG21 THR 7 11.799 -6.152 -8.445 46 HG22 THR 7 HG22 THR 7 11.333 -4.492 -8.825 47 HG23 THR 7 HG23 THR 7 12.895 -5.117 -9.364 48 H HIS 8 H HIS 8 12.076 -2.657 -12.689 49 HA HIS 8 HA HIS 8 14.840 -2.673 -12.230 50 HB2 HIS 8 HB2 HIS 8 15.811 -3.159 -14.430 51 HB3 HIS 8 HB3 HIS 8 14.865 -4.556 -13.922 52 HD1 HIS 8 HD1 HIS 8 15.133 -1.987 -16.589 53 HD2 HIS 8 HD2 HIS 8 12.430 -4.926 -15.423 54 HE1 HIS 8 HE1 HIS 8 13.526 -2.233 -18.501 55 HE2 HIS 8 HE2 HIS 8 11.970 -4.076 -17.812 56 H ASP 9 H ASP 9 12.210 -1.743 -14.416 57 HA ASP 9 HA ASP 9 13.362 0.850 -15.103 58 HB2 ASP 9 HB2 ASP 9 11.976 -0.629 -16.702 59 HB3 ASP 9 HB3 ASP 9 10.560 -0.142 -15.773 60 H ASN 10 H ASN 10 11.143 -0.518 -12.878 61 HA ASN 10 HA ASN 10 9.951 1.916 -11.952 62 HB2 ASN 10 HB2 ASN 10 8.995 0.496 -10.164 63 HB3 ASN 10 HB3 ASN 10 8.759 -0.239 -11.746 64 HD21 ASN 10 HD21 ASN 10 8.603 -1.652 -9.352 65 HD22 ASN 10 HD22 ASN 10 9.873 -2.813 -9.324 66 H VAL 11 H VAL 11 10.172 2.535 -9.619 67 HA VAL 11 HA VAL 11 12.940 2.386 -8.608 68 HB VAL 11 HB VAL 11 12.803 4.864 -8.010 69 HG11 VAL 11 HG11 VAL 11 12.850 4.239 -10.985 70 HG12 VAL 11 HG12 VAL 11 14.209 4.098 -9.868 71 HG13 VAL 11 HG13 VAL 11 13.521 5.685 -10.218 72 HG21 VAL 11 HG21 VAL 11 10.352 5.161 -8.271 73 HG22 VAL 11 HG22 VAL 11 10.504 4.918 -10.010 74 HG23 VAL 11 HG23 VAL 11 11.251 6.325 -9.249 75 H ILE 12 H ILE 12 13.118 2.603 -6.432 76 HA ILE 12 HA ILE 12 10.782 1.934 -4.848 77 HB ILE 12 HB ILE 12 13.695 2.156 -3.970 78 HG12 ILE 12 HG12 ILE 12 13.482 0.475 -5.777 79 HG13 ILE 12 HG13 ILE 12 13.914 -0.260 -4.242 80 HG21 ILE 12 HG21 ILE 12 12.121 2.204 -2.111 81 HG22 ILE 12 HG22 ILE 12 13.022 0.687 -2.120 82 HG23 ILE 12 HG23 ILE 12 11.355 0.725 -2.701 83 HD11 ILE 12 HD11 ILE 12 11.187 -0.254 -5.512 84 HD12 ILE 12 HD12 ILE 12 11.594 -0.986 -3.958 85 HD13 ILE 12 HD13 ILE 12 12.320 -1.601 -5.442 86 H LEU 13 H LEU 13 9.739 3.995 -4.854 87 HA LEU 13 HA LEU 13 11.054 6.266 -3.558 88 HB2 LEU 13 HB2 LEU 13 8.192 5.988 -4.570 89 HB3 LEU 13 HB3 LEU 13 8.963 7.478 -4.030 90 HG LEU 13 HG LEU 13 9.735 5.853 -6.487 91 HD11 LEU 13 HD11 LEU 13 8.966 7.786 -7.769 92 HD12 LEU 13 HD12 LEU 13 8.435 8.577 -6.281 93 HD13 LEU 13 HD13 LEU 13 7.666 7.077 -6.811 94 HD21 LEU 13 HD21 LEU 13 11.733 6.835 -5.494 95 HD22 LEU 13 HD22 LEU 13 10.965 8.426 -5.443 96 HD23 LEU 13 HD23 LEU 13 11.325 7.663 -6.996 97 H GLU 14 H GLU 14 11.415 5.516 -1.506 98 HA GLU 14 HA GLU 14 9.227 4.330 0.011 99 HB2 GLU 14 HB2 GLU 14 11.026 3.987 1.786 100 HB3 GLU 14 HB3 GLU 14 11.184 3.086 0.290 101 HG2 GLU 14 HG2 GLU 14 12.962 4.469 -0.481 102 HG3 GLU 14 HG3 GLU 14 12.690 5.648 0.802 103 H LEU 15 H LEU 15 7.870 5.719 0.769 104 HA LEU 15 HA LEU 15 8.671 8.195 2.125 105 HB2 LEU 15 HB2 LEU 15 5.988 7.035 1.279 106 HB3 LEU 15 HB3 LEU 15 6.101 8.420 2.346 107 HG LEU 15 HG LEU 15 5.632 9.147 0.095 108 HD11 LEU 15 HD11 LEU 15 6.925 10.643 1.457 109 HD12 LEU 15 HD12 LEU 15 7.359 10.804 -0.240 110 HD13 LEU 15 HD13 LEU 15 8.426 9.929 0.862 111 HD21 LEU 15 HD21 LEU 15 6.572 7.313 -1.211 112 HD22 LEU 15 HD22 LEU 15 8.206 7.855 -0.823 113 HD23 LEU 15 HD23 LEU 15 7.144 8.871 -1.804 114 H THR 16 H THR 16 9.275 7.872 4.205 115 HA THR 16 HA THR 16 7.932 5.910 5.910 116 HB THR 16 HB THR 16 10.037 7.981 6.689 117 HG1 THR 16 HG1 THR 16 10.942 6.494 5.248 118 HG21 THR 16 HG21 THR 16 9.072 5.497 8.165 119 HG22 THR 16 HG22 THR 16 8.662 7.163 8.598 120 HG23 THR 16 HG23 THR 16 10.338 6.602 8.710 121 H VAL 17 H VAL 17 5.855 6.616 6.179 122 HA VAL 17 HA VAL 17 5.406 9.374 7.162 123 HB VAL 17 HB VAL 17 3.273 9.389 6.233 124 HG11 VAL 17 HG11 VAL 17 4.938 9.533 4.459 125 HG12 VAL 17 HG12 VAL 17 3.483 8.745 3.849 126 HG13 VAL 17 HG13 VAL 17 4.912 7.775 4.250 127 HG21 VAL 17 HG21 VAL 17 2.026 7.420 5.339 128 HG22 VAL 17 HG22 VAL 17 2.364 7.295 7.065 129 HG23 VAL 17 HG23 VAL 17 3.329 6.373 5.916 130 H ARG 18 H ARG 18 4.268 9.623 9.117 131 HA ARG 18 HA ARG 18 3.833 7.148 10.693 132 HB2 ARG 18 HB2 ARG 18 3.741 8.597 12.685 133 HB3 ARG 18 HB3 ARG 18 5.251 8.772 11.805 134 HG2 ARG 18 HG2 ARG 18 4.363 10.907 10.835 135 HG3 ARG 18 HG3 ARG 18 2.943 10.739 11.873 136 HD2 ARG 18 HD2 ARG 18 5.833 11.064 12.761 137 HD3 ARG 18 HD3 ARG 18 4.536 12.248 12.918 138 HE ARG 18 HE ARG 18 3.951 9.785 14.294 139 HH11 ARG 18 HH11 ARG 18 5.660 12.863 14.612 140 HH12 ARG 18 HH12 ARG 18 5.622 12.834 16.342 141 HH21 ARG 18 HH21 ARG 18 3.949 9.761 16.566 142 HH22 ARG 18 HH22 ARG 18 4.653 11.076 17.454 143 H ASN 19 H ASN 19 1.836 6.468 11.230 144 HA ASN 19 HA ASN 19 -0.193 7.147 9.427 145 HB2 ASN 19 HB2 ASN 19 -0.016 5.159 11.683 146 HB3 ASN 19 HB3 ASN 19 -1.587 5.465 10.952 147 HD21 ASN 19 HD21 ASN 19 -0.150 2.978 10.902 148 HD22 ASN 19 HD22 ASN 19 0.146 2.603 9.244 149 H HIS 20 H HIS 20 -0.632 9.294 9.781 150 HA HIS 20 HA HIS 20 -2.569 9.957 11.899 151 HB2 HIS 20 HB2 HIS 20 -1.848 11.602 9.424 152 HB3 HIS 20 HB3 HIS 20 -2.662 12.173 10.872 153 HD1 HIS 20 HD1 HIS 20 0.172 13.080 9.471 154 HD2 HIS 20 HD2 HIS 20 -0.421 11.125 13.089 155 HE1 HIS 20 HE1 HIS 20 2.235 13.517 10.825 156 HE2 HIS 20 HE2 HIS 20 1.765 12.488 13.065 157 HA PRO 21 HA PRO 21 -6.343 8.603 9.868 158 HB2 PRO 21 HB2 PRO 21 -7.136 11.519 9.624 159 HB3 PRO 21 HB3 PRO 21 -8.102 10.133 10.187 160 HG2 PRO 21 HG2 PRO 21 -7.058 11.778 11.972 161 HG3 PRO 21 HG3 PRO 21 -6.999 10.024 12.257 162 HD2 PRO 21 HD2 PRO 21 -4.783 11.871 11.418 163 HD3 PRO 21 HD3 PRO 21 -4.723 10.425 12.456 164 H GLY 22 H GLY 22 -5.616 7.779 7.926 165 HA2 GLY 22 HA2 GLY 22 -5.856 7.439 5.679 166 HA3 GLY 22 HA3 GLY 22 -6.699 8.973 5.563 167 H VAL 23 H VAL 23 -3.337 8.158 6.505 168 HA VAL 23 HA VAL 23 -2.287 10.172 4.651 169 HB VAL 23 HB VAL 23 -0.073 9.681 5.663 170 HG11 VAL 23 HG11 VAL 23 -2.335 10.269 7.609 171 HG12 VAL 23 HG12 VAL 23 -1.495 11.432 6.578 172 HG13 VAL 23 HG13 VAL 23 -0.627 10.632 7.888 173 HG21 VAL 23 HG21 VAL 23 -0.402 7.291 6.216 174 HG22 VAL 23 HG22 VAL 23 -1.588 7.726 7.449 175 HG23 VAL 23 HG23 VAL 23 0.104 8.206 7.639 176 H MET 24 H MET 24 -2.487 6.698 4.815 177 HA MET 24 HA MET 24 -0.613 5.965 2.858 178 HB2 MET 24 HB2 MET 24 -1.964 3.870 2.622 179 HB3 MET 24 HB3 MET 24 -1.579 4.282 4.284 180 HG2 MET 24 HG2 MET 24 -4.253 4.863 3.000 181 HG3 MET 24 HG3 MET 24 -3.899 3.413 3.938 182 HE1 MET 24 HE1 MET 24 -2.046 4.591 6.296 183 HE2 MET 24 HE2 MET 24 -3.369 3.456 6.585 184 HE3 MET 24 HE3 MET 24 -3.262 4.950 7.520 185 H THR 25 H THR 25 -3.789 7.386 2.496 186 HA THR 25 HA THR 25 -4.288 6.893 -0.234 187 HB THR 25 HB THR 25 -5.791 8.867 -0.133 188 HG1 THR 25 HG1 THR 25 -5.756 9.769 2.224 189 HG21 THR 25 HG21 THR 25 -6.623 6.742 0.852 190 HG22 THR 25 HG22 THR 25 -7.252 8.140 1.729 191 HG23 THR 25 HG23 THR 25 -5.929 7.192 2.414 192 H HIS 26 H HIS 26 -2.101 9.138 1.348 193 HA HIS 26 HA HIS 26 -1.767 11.039 -0.735 194 HB2 HIS 26 HB2 HIS 26 0.192 10.297 1.494 195 HB3 HIS 26 HB3 HIS 26 0.289 11.742 0.490 196 HD1 HIS 26 HD1 HIS 26 0.178 12.097 3.487 197 HD2 HIS 26 HD2 HIS 26 -3.248 11.977 1.121 198 HE1 HIS 26 HE1 HIS 26 -1.614 13.255 4.810 199 HE2 HIS 26 HE2 HIS 26 -3.660 13.160 3.367 200 H VAL 27 H VAL 27 0.235 8.198 0.217 201 HA VAL 27 HA VAL 27 2.129 8.476 -1.871 202 HB VAL 27 HB VAL 27 2.882 6.198 -1.361 203 HG11 VAL 27 HG11 VAL 27 3.441 6.483 1.035 204 HG12 VAL 27 HG12 VAL 27 2.218 7.752 1.164 205 HG13 VAL 27 HG13 VAL 27 3.627 7.985 0.127 206 HG21 VAL 27 HG21 VAL 27 1.799 4.758 0.322 207 HG22 VAL 27 HG22 VAL 27 0.731 5.042 -1.055 208 HG23 VAL 27 HG23 VAL 27 0.467 5.909 0.459 209 H CYS 28 H CYS 28 -0.855 6.583 -1.596 210 HA CYS 28 HA CYS 28 -0.748 5.271 -4.084 211 HB2 CYS 28 HB2 CYS 28 -3.075 6.014 -2.268 212 HB3 CYS 28 HB3 CYS 28 -3.241 4.955 -3.671 213 HG CYS 28 HG CYS 28 -2.096 4.281 -0.628 214 H GLY 29 H GLY 29 -2.094 8.403 -3.141 215 HA2 GLY 29 HA2 GLY 29 -3.585 8.904 -5.511 216 HA3 GLY 29 HA3 GLY 29 -3.152 10.079 -4.277 217 H LEU 30 H LEU 30 -0.409 10.048 -4.358 218 HA LEU 30 HA LEU 30 -0.014 11.905 -6.458 219 HB2 LEU 30 HB2 LEU 30 1.674 10.847 -4.218 220 HB3 LEU 30 HB3 LEU 30 2.531 11.600 -5.549 221 HG LEU 30 HG LEU 30 2.182 13.227 -3.778 222 HD11 LEU 30 HD11 LEU 30 1.124 15.046 -5.022 223 HD12 LEU 30 HD12 LEU 30 0.394 13.892 -6.145 224 HD13 LEU 30 HD13 LEU 30 2.149 14.077 -6.076 225 HD21 LEU 30 HD21 LEU 30 -0.038 13.998 -3.057 226 HD22 LEU 30 HD22 LEU 30 0.202 12.294 -2.684 227 HD23 LEU 30 HD23 LEU 30 -0.807 12.758 -4.055 228 H PHE 31 H PHE 31 1.199 8.542 -6.000 229 HA PHE 31 HA PHE 31 2.819 8.817 -8.428 230 HB2 PHE 31 HB2 PHE 31 2.442 6.398 -6.631 231 HB3 PHE 31 HB3 PHE 31 3.638 6.559 -7.923 232 HD1 PHE 31 HD2 PHE 31 4.845 9.129 -7.680 233 HD2 PHE 31 HD1 PHE 31 3.488 6.587 -4.516 234 HE1 PHE 31 HE2 PHE 31 6.369 10.254 -6.113 235 HE2 PHE 31 HE1 PHE 31 5.012 7.725 -2.954 236 HZ PHE 31 HZ PHE 31 6.457 9.557 -3.751 237 H ALA 32 H ALA 32 -0.317 7.412 -7.628 238 HA ALA 32 HA ALA 32 -0.667 5.900 -10.026 239 HB1 ALA 32 HB1 ALA 32 -3.054 5.902 -9.460 240 HB2 ALA 32 HB2 ALA 32 -2.779 7.175 -8.261 241 HB3 ALA 32 HB3 ALA 32 -2.070 5.574 -8.030 242 H ARG 33 H ARG 33 -1.393 9.285 -9.188 243 HA ARG 33 HA ARG 33 -3.043 9.855 -11.442 244 HB2 ARG 33 HB2 ARG 33 -2.966 12.187 -10.715 245 HB3 ARG 33 HB3 ARG 33 -3.169 11.130 -9.320 246 HG2 ARG 33 HG2 ARG 33 -0.728 11.334 -8.856 247 HG3 ARG 33 HG3 ARG 33 -0.593 12.483 -10.187 248 HD2 ARG 33 HD2 ARG 33 -2.381 12.880 -7.763 249 HD3 ARG 33 HD3 ARG 33 -0.740 13.521 -7.902 250 HE ARG 33 HE ARG 33 -2.114 14.418 -10.143 251 HH11 ARG 33 HH11 ARG 33 -2.392 14.824 -6.663 252 HH12 ARG 33 HH12 ARG 33 -3.091 16.407 -6.769 253 HH21 ARG 33 HH21 ARG 33 -3.026 16.511 -10.284 254 HH22 ARG 33 HH22 ARG 33 -3.453 17.372 -8.837 255 H ARG 34 H ARG 34 0.364 9.578 -11.248 256 HA ARG 34 HA ARG 34 1.234 11.656 -12.953 257 HB2 ARG 34 HB2 ARG 34 2.817 10.471 -11.518 258 HB3 ARG 34 HB3 ARG 34 2.460 8.939 -12.301 259 HG2 ARG 34 HG2 ARG 34 4.641 9.757 -13.009 260 HG3 ARG 34 HG3 ARG 34 3.540 9.743 -14.384 261 HD2 ARG 34 HD2 ARG 34 4.171 12.241 -12.768 262 HD3 ARG 34 HD3 ARG 34 5.068 11.761 -14.206 263 HE ARG 34 HE ARG 34 2.259 12.682 -14.119 264 HH11 ARG 34 HH11 ARG 34 5.074 11.889 -16.094 265 HH12 ARG 34 HH12 ARG 34 4.391 12.545 -17.538 266 HH21 ARG 34 HH21 ARG 34 1.356 13.453 -16.052 267 HH22 ARG 34 HH22 ARG 34 2.291 13.425 -17.513 268 H ALA 35 H ALA 35 0.863 8.179 -13.669 269 HA ALA 35 HA ALA 35 -0.573 8.428 -16.076 270 HB1 ALA 35 HB1 ALA 35 1.501 9.441 -16.974 271 HB2 ALA 35 HB2 ALA 35 1.188 7.884 -17.745 272 HB3 ALA 35 HB3 ALA 35 2.426 8.019 -16.490 273 H PHE 36 H PHE 36 2.189 6.594 -14.814 274 HA PHE 36 HA PHE 36 0.898 4.025 -15.326 275 HB2 PHE 36 HB2 PHE 36 3.263 4.255 -15.932 276 HB3 PHE 36 HB3 PHE 36 3.667 4.798 -14.310 277 HD1 PHE 36 HD2 PHE 36 1.938 1.818 -15.872 278 HD2 PHE 36 HD1 PHE 36 4.808 3.215 -13.020 279 HE1 PHE 36 HE2 PHE 36 2.461 -0.496 -15.239 280 HE2 PHE 36 HE1 PHE 36 5.323 0.896 -12.401 281 HZ PHE 36 HZ PHE 36 4.154 -0.961 -13.511 282 H ASN 37 H ASN 37 0.044 2.757 -13.739 283 HA ASN 37 HA ASN 37 -0.444 3.753 -11.091 284 HB2 ASN 37 HB2 ASN 37 -0.860 0.943 -12.206 285 HB3 ASN 37 HB3 ASN 37 -1.488 1.532 -10.673 286 HD21 ASN 37 HD21 ASN 37 -1.937 1.525 -14.119 287 HD22 ASN 37 HD22 ASN 37 -3.435 2.383 -14.113 288 H VAL 38 H VAL 38 0.280 2.759 -9.124 289 HA VAL 38 HA VAL 38 3.048 2.230 -9.025 290 HB VAL 38 HB VAL 38 1.014 1.582 -6.844 291 HG11 VAL 38 HG11 VAL 38 2.916 1.921 -5.305 292 HG12 VAL 38 HG12 VAL 38 3.986 2.192 -6.685 293 HG13 VAL 38 HG13 VAL 38 3.226 0.614 -6.452 294 HG21 VAL 38 HG21 VAL 38 2.432 4.231 -7.350 295 HG22 VAL 38 HG22 VAL 38 1.429 3.853 -5.946 296 HG23 VAL 38 HG23 VAL 38 0.704 3.919 -7.553 297 H GLU 39 H GLU 39 4.025 0.450 -9.665 298 HA GLU 39 HA GLU 39 2.894 -1.984 -10.440 299 HB2 GLU 39 HB2 GLU 39 5.098 -1.109 -11.210 300 HB3 GLU 39 HB3 GLU 39 5.765 -1.374 -9.602 301 HG2 GLU 39 HG2 GLU 39 5.327 -3.834 -9.901 302 HG3 GLU 39 HG3 GLU 39 4.839 -3.500 -11.564 303 H GLY 40 H GLY 40 4.620 -1.082 -7.443 304 HA2 GLY 40 HA2 GLY 40 3.318 -3.289 -5.979 305 HA3 GLY 40 HA3 GLY 40 5.075 -3.320 -6.074 306 H ILE 41 H ILE 41 3.336 -3.036 -3.745 307 HA ILE 41 HA ILE 41 4.396 -0.516 -2.585 308 HB ILE 41 HB ILE 41 1.583 -1.643 -2.104 309 HG12 ILE 41 HG12 ILE 41 2.348 0.935 -3.533 310 HG13 ILE 41 HG13 ILE 41 1.748 -0.521 -4.316 311 HG21 ILE 41 HG21 ILE 41 1.146 0.329 -0.720 312 HG22 ILE 41 HG22 ILE 41 2.803 0.878 -0.973 313 HG23 ILE 41 HG23 ILE 41 2.498 -0.610 -0.078 314 HD11 ILE 41 HD11 ILE 41 -0.379 -0.267 -3.083 315 HD12 ILE 41 HD12 ILE 41 -0.013 1.092 -4.144 316 HD13 ILE 41 HD13 ILE 41 0.225 1.249 -2.404 317 H LEU 42 H LEU 42 5.133 -0.804 -0.424 318 HA LEU 42 HA LEU 42 4.155 -3.086 1.112 319 HB2 LEU 42 HB2 LEU 42 6.117 -4.077 0.084 320 HB3 LEU 42 HB3 LEU 42 7.126 -2.721 0.554 321 HG LEU 42 HG LEU 42 7.197 -3.419 2.857 322 HD11 LEU 42 HD11 LEU 42 4.993 -5.416 2.287 323 HD12 LEU 42 HD12 LEU 42 4.848 -3.930 3.226 324 HD13 LEU 42 HD13 LEU 42 5.864 -5.242 3.816 325 HD21 LEU 42 HD21 LEU 42 8.604 -4.763 1.359 326 HD22 LEU 42 HD22 LEU 42 7.306 -5.946 1.182 327 HD23 LEU 42 HD23 LEU 42 8.073 -5.698 2.756 328 H CYS 43 H CYS 43 3.295 -1.990 2.706 329 HA CYS 43 HA CYS 43 4.687 0.190 4.083 330 HB2 CYS 43 HB2 CYS 43 2.386 0.637 3.613 331 HB3 CYS 43 HB3 CYS 43 1.881 -0.930 4.218 332 HG CYS 43 HG CYS 43 2.017 1.905 5.766 333 H LEU 44 H LEU 44 6.179 -0.605 5.421 334 HA LEU 44 HA LEU 44 5.664 -2.946 7.133 335 HB2 LEU 44 HB2 LEU 44 7.775 -2.654 5.694 336 HB3 LEU 44 HB3 LEU 44 8.239 -1.377 6.796 337 HG LEU 44 HG LEU 44 8.197 -3.132 8.668 338 HD11 LEU 44 HD11 LEU 44 8.354 -5.485 8.032 339 HD12 LEU 44 HD12 LEU 44 8.074 -5.074 6.336 340 HD13 LEU 44 HD13 LEU 44 6.799 -4.814 7.535 341 HD21 LEU 44 HD21 LEU 44 10.409 -4.028 8.065 342 HD22 LEU 44 HD22 LEU 44 10.281 -2.314 7.686 343 HD23 LEU 44 HD23 LEU 44 10.172 -3.512 6.393 344 HA PRO 45 HA PRO 45 4.800 0.329 10.266 345 HB2 PRO 45 HB2 PRO 45 3.928 -1.417 12.244 346 HB3 PRO 45 HB3 PRO 45 2.892 -0.817 10.935 347 HG2 PRO 45 HG2 PRO 45 4.319 -3.450 11.138 348 HG3 PRO 45 HG3 PRO 45 2.667 -3.108 10.573 349 HD2 PRO 45 HD2 PRO 45 4.707 -3.545 8.839 350 HD3 PRO 45 HD3 PRO 45 3.385 -2.412 8.465 351 H ILE 46 H ILE 46 6.601 1.155 11.143 352 HA ILE 46 HA ILE 46 8.943 -0.298 11.754 353 HB ILE 46 HB ILE 46 8.207 2.539 12.614 354 HG12 ILE 46 HG12 ILE 46 8.091 2.322 10.160 355 HG13 ILE 46 HG13 ILE 46 9.492 3.287 10.606 356 HG21 ILE 46 HG21 ILE 46 10.649 2.921 12.809 357 HG22 ILE 46 HG22 ILE 46 10.945 1.217 12.449 358 HG23 ILE 46 HG23 ILE 46 10.094 1.671 13.929 359 HD11 ILE 46 HD11 ILE 46 9.499 0.407 9.715 360 HD12 ILE 46 HD12 ILE 46 10.926 1.308 10.235 361 HD13 ILE 46 HD13 ILE 46 10.038 1.813 8.800 362 H GLN 47 H GLN 47 9.551 -1.314 13.571 363 HA GLN 47 HA GLN 47 7.700 -1.810 15.683 364 HB2 GLN 47 HB2 GLN 47 9.409 -3.330 16.555 365 HB3 GLN 47 HB3 GLN 47 9.281 -3.494 14.809 366 HG2 GLN 47 HG2 GLN 47 11.293 -2.018 14.561 367 HG3 GLN 47 HG3 GLN 47 11.454 -2.011 16.313 368 HE21 GLN 47 HE21 GLN 47 11.747 -3.900 13.412 369 HE22 GLN 47 HE22 GLN 47 12.648 -5.204 14.112 370 H ASP 48 H ASP 48 10.206 0.519 15.317 371 HA ASP 48 HA ASP 48 10.923 0.751 18.112 372 HB2 ASP 48 HB2 ASP 48 11.664 2.524 15.736 373 HB3 ASP 48 HB3 ASP 48 12.430 2.559 17.323 374 H SER 49 H SER 49 8.995 2.605 15.786 375 HA SER 49 HA SER 49 7.805 4.229 17.943 376 HB2 SER 49 HB2 SER 49 9.123 5.431 15.459 377 HB3 SER 49 HB3 SER 49 8.191 6.335 16.654 378 HG SER 49 HG SER 49 9.957 5.094 18.066 379 H ASP 50 H ASP 50 5.932 5.591 17.023 380 HA ASP 50 HA ASP 50 4.240 3.923 15.420 381 HB2 ASP 50 HB2 ASP 50 2.514 5.669 15.708 382 HB3 ASP 50 HB3 ASP 50 3.261 5.255 17.240 383 H LYS 51 H LYS 51 5.552 3.738 13.543 384 HA LYS 51 HA LYS 51 5.223 5.919 11.591 385 HB2 LYS 51 HB2 LYS 51 7.831 4.431 12.145 386 HB3 LYS 51 HB3 LYS 51 7.556 5.446 10.732 387 HG2 LYS 51 HG2 LYS 51 7.328 7.424 12.163 388 HG3 LYS 51 HG3 LYS 51 7.510 6.417 13.609 389 HD2 LYS 51 HD2 LYS 51 9.801 5.780 12.861 390 HD3 LYS 51 HD3 LYS 51 9.622 6.816 11.440 391 HE2 LYS 51 HE2 LYS 51 9.440 8.793 12.892 392 HE3 LYS 51 HE3 LYS 51 9.551 7.767 14.324 393 HZ1 LYS 51 HZ1 LYS 51 11.780 7.134 13.671 394 HZ2 LYS 51 HZ2 LYS 51 11.661 8.810 13.794 395 HZ3 LYS 51 HZ3 LYS 51 11.679 8.076 12.271 396 H SER 52 H SER 52 5.701 5.091 9.403 397 HA SER 52 HA SER 52 5.006 2.298 8.898 398 HB2 SER 52 HB2 SER 52 2.821 3.458 9.280 399 HB3 SER 52 HB3 SER 52 3.245 4.671 8.071 400 HG SER 52 HG SER 52 2.566 1.972 7.742 401 H HIS 53 H HIS 53 6.603 1.846 7.460 402 HA HIS 53 HA HIS 53 7.627 3.998 5.699 403 HB2 HIS 53 HB2 HIS 53 9.144 2.727 7.340 404 HB3 HIS 53 HB3 HIS 53 8.920 1.300 6.343 405 HD1 HIS 53 HD1 HIS 53 11.420 3.511 6.968 406 HD2 HIS 53 HD2 HIS 53 9.641 2.360 3.402 407 HE1 HIS 53 HE1 HIS 53 13.135 3.928 5.195 408 HE2 HIS 53 HE2 HIS 53 12.130 2.956 3.122 409 H ILE 54 H ILE 54 6.447 3.956 3.851 410 HA ILE 54 HA ILE 54 5.676 1.407 2.615 411 HB ILE 54 HB ILE 54 4.785 4.198 1.736 412 HG12 ILE 54 HG12 ILE 54 2.509 3.414 2.839 413 HG13 ILE 54 HG13 ILE 54 3.522 2.338 3.790 414 HG21 ILE 54 HG21 ILE 54 3.668 1.435 1.152 415 HG22 ILE 54 HG22 ILE 54 4.592 2.440 0.032 416 HG23 ILE 54 HG23 ILE 54 2.994 2.962 0.572 417 HD11 ILE 54 HD11 ILE 54 3.680 5.339 3.715 418 HD12 ILE 54 HD12 ILE 54 4.719 4.277 4.670 419 HD13 ILE 54 HD13 ILE 54 2.988 4.346 4.999 420 H TRP 55 H TRP 55 7.081 0.606 1.104 421 HA TRP 55 HA TRP 55 8.749 2.344 -0.563 422 HB2 TRP 55 HB2 TRP 55 8.465 -0.705 -0.480 423 HB3 TRP 55 HB3 TRP 55 9.597 0.161 -1.514 424 HD1 TRP 55 HD1 TRP 55 11.810 1.142 -0.340 425 HE1 TRP 55 HE1 TRP 55 12.943 0.730 1.899 426 HE3 TRP 55 HE3 TRP 55 8.010 -1.242 1.997 427 HZ2 TRP 55 HZ2 TRP 55 12.311 -0.446 4.366 428 HZ3 TRP 55 HZ3 TRP 55 8.332 -1.974 4.300 429 HH2 TRP 55 HH2 TRP 55 10.444 -1.588 5.476 430 H LEU 56 H LEU 56 7.828 3.248 -2.360 431 HA LEU 56 HA LEU 56 5.548 1.915 -3.699 432 HB2 LEU 56 HB2 LEU 56 6.505 4.804 -3.837 433 HB3 LEU 56 HB3 LEU 56 5.232 4.154 -4.852 434 HG LEU 56 HG LEU 56 4.147 5.368 -3.125 435 HD11 LEU 56 HD11 LEU 56 2.786 3.720 -1.967 436 HD12 LEU 56 HD12 LEU 56 3.946 2.450 -2.365 437 HD13 LEU 56 HD13 LEU 56 3.053 3.270 -3.650 438 HD21 LEU 56 HD21 LEU 56 4.523 5.054 -0.716 439 HD22 LEU 56 HD22 LEU 56 5.975 5.605 -1.546 440 HD23 LEU 56 HD23 LEU 56 5.826 3.914 -1.066 441 H LEU 57 H LEU 57 6.219 0.657 -5.294 442 HA LEU 57 HA LEU 57 8.502 1.273 -6.991 443 HB2 LEU 57 HB2 LEU 57 6.649 -1.130 -6.795 444 HB3 LEU 57 HB3 LEU 57 7.819 -0.953 -8.092 445 HG LEU 57 HG LEU 57 9.658 -0.919 -6.378 446 HD11 LEU 57 HD11 LEU 57 9.248 -1.700 -4.106 447 HD12 LEU 57 HD12 LEU 57 7.503 -1.666 -4.396 448 HD13 LEU 57 HD13 LEU 57 8.439 -0.166 -4.424 449 HD21 LEU 57 HD21 LEU 57 9.622 -3.336 -5.947 450 HD22 LEU 57 HD22 LEU 57 9.139 -2.950 -7.598 451 HD23 LEU 57 HD23 LEU 57 7.914 -3.391 -6.405 452 H VAL 58 H VAL 58 8.047 2.810 -8.426 453 HA VAL 58 HA VAL 58 5.892 2.353 -10.427 454 HB VAL 58 HB VAL 58 5.123 4.110 -8.763 455 HG11 VAL 58 HG11 VAL 58 7.243 5.111 -8.162 456 HG12 VAL 58 HG12 VAL 58 6.121 6.346 -8.736 457 HG13 VAL 58 HG13 VAL 58 7.420 5.775 -9.790 458 HG21 VAL 58 HG21 VAL 58 5.520 5.169 -11.585 459 HG22 VAL 58 HG22 VAL 58 4.342 5.773 -10.415 460 HG23 VAL 58 HG23 VAL 58 4.196 4.131 -11.043 461 H ASN 59 H ASN 59 6.532 3.226 -12.577 462 HA ASN 59 HA ASN 59 9.378 3.155 -12.942 463 HB2 ASN 59 HB2 ASN 59 9.028 3.417 -15.311 464 HB3 ASN 59 HB3 ASN 59 7.874 2.252 -14.691 465 HD21 ASN 59 HD21 ASN 59 7.727 3.716 -17.152 466 HD22 ASN 59 HD22 ASN 59 6.272 4.647 -17.099 467 H ASP 60 H ASP 60 10.793 4.731 -13.194 468 HA ASP 60 HA ASP 60 10.320 7.278 -12.149 469 HB2 ASP 60 HB2 ASP 60 12.526 6.152 -12.085 470 HB3 ASP 60 HB3 ASP 60 12.665 6.316 -13.832 471 H ASP 61 H ASP 61 10.000 9.235 -13.076 472 HA ASP 61 HA ASP 61 9.901 9.584 -15.972 473 HB2 ASP 61 HB2 ASP 61 7.628 8.813 -15.370 474 HB3 ASP 61 HB3 ASP 61 7.530 10.007 -14.088 475 H GLN 62 H GLN 62 9.913 11.868 -16.532 476 HA GLN 62 HA GLN 62 11.687 13.401 -14.952 477 HB2 GLN 62 HB2 GLN 62 9.957 14.217 -17.324 478 HB3 GLN 62 HB3 GLN 62 11.228 15.229 -16.634 479 HG2 GLN 62 HG2 GLN 62 12.923 13.573 -17.218 480 HG3 GLN 62 HG3 GLN 62 11.681 12.472 -17.815 481 HE21 GLN 62 HE21 GLN 62 10.713 12.883 -19.812 482 HE22 GLN 62 HE22 GLN 62 11.366 14.010 -20.946 483 H ARG 63 H ARG 63 8.216 13.508 -15.354 484 HA ARG 63 HA ARG 63 7.809 15.932 -13.802 485 HB2 ARG 63 HB2 ARG 63 6.374 15.407 -15.753 486 HB3 ARG 63 HB3 ARG 63 5.811 13.936 -14.974 487 HG2 ARG 63 HG2 ARG 63 4.109 15.649 -14.792 488 HG3 ARG 63 HG3 ARG 63 4.757 15.317 -13.187 489 HD2 ARG 63 HD2 ARG 63 6.165 17.368 -13.361 490 HD3 ARG 63 HD3 ARG 63 5.462 17.694 -14.951 491 HE ARG 63 HE ARG 63 3.620 17.436 -12.687 492 HH11 ARG 63 HH11 ARG 63 5.324 19.648 -14.840 493 HH12 ARG 63 HH12 ARG 63 4.287 20.989 -14.473 494 HH21 ARG 63 HH21 ARG 63 2.266 19.196 -12.226 495 HH22 ARG 63 HH22 ARG 63 2.549 20.730 -12.986 496 H LEU 64 H LEU 64 7.852 12.474 -13.283 497 HA LEU 64 HA LEU 64 6.261 12.018 -11.077 498 HB2 LEU 64 HB2 LEU 64 7.583 10.333 -12.403 499 HB3 LEU 64 HB3 LEU 64 9.021 10.845 -11.545 500 HG LEU 64 HG LEU 64 7.765 10.106 -9.378 501 HD11 LEU 64 HD11 LEU 64 6.064 8.392 -9.635 502 HD12 LEU 64 HD12 LEU 64 6.095 8.578 -11.391 503 HD13 LEU 64 HD13 LEU 64 5.517 9.902 -10.368 504 HD21 LEU 64 HD21 LEU 64 9.687 8.902 -10.284 505 HD22 LEU 64 HD22 LEU 64 8.632 8.015 -11.389 506 HD23 LEU 64 HD23 LEU 64 8.481 7.782 -9.646 507 H GLU 65 H GLU 65 9.461 13.539 -11.147 508 HA GLU 65 HA GLU 65 10.158 13.450 -8.428 509 HB2 GLU 65 HB2 GLU 65 10.865 15.561 -10.499 510 HB3 GLU 65 HB3 GLU 65 11.692 15.334 -8.957 511 HG2 GLU 65 HG2 GLU 65 12.344 13.043 -9.700 512 HG3 GLU 65 HG3 GLU 65 11.602 13.368 -11.266 513 H GLN 66 H GLN 66 8.010 15.597 -10.151 514 HA GLN 66 HA GLN 66 7.809 17.625 -8.133 515 HB2 GLN 66 HB2 GLN 66 5.885 16.971 -10.414 516 HB3 GLN 66 HB3 GLN 66 5.882 18.451 -9.460 517 HG2 GLN 66 HG2 GLN 66 8.032 17.527 -11.387 518 HG3 GLN 66 HG3 GLN 66 6.926 18.878 -11.608 519 HE21 GLN 66 HE21 GLN 66 7.252 20.771 -10.346 520 HE22 GLN 66 HE22 GLN 66 8.791 21.138 -9.655 521 H MET 67 H MET 67 6.071 14.618 -8.831 522 HA MET 67 HA MET 67 4.014 14.921 -6.865 523 HB2 MET 67 HB2 MET 67 5.156 12.407 -8.164 524 HB3 MET 67 HB3 MET 67 3.777 12.395 -7.069 525 HG2 MET 67 HG2 MET 67 3.017 12.290 -9.362 526 HG3 MET 67 HG3 MET 67 2.530 13.830 -8.644 527 HE1 MET 67 HE1 MET 67 2.023 14.969 -10.902 528 HE2 MET 67 HE2 MET 67 2.372 13.460 -11.749 529 HE3 MET 67 HE3 MET 67 3.108 14.968 -12.289 530 H ILE 68 H ILE 68 7.228 13.454 -6.874 531 HA ILE 68 HA ILE 68 7.335 12.402 -4.260 532 HB ILE 68 HB ILE 68 9.583 13.511 -6.013 533 HG12 ILE 68 HG12 ILE 68 8.658 10.619 -5.684 534 HG13 ILE 68 HG13 ILE 68 8.237 11.654 -7.043 535 HG21 ILE 68 HG21 ILE 68 9.816 11.659 -3.614 536 HG22 ILE 68 HG22 ILE 68 10.352 13.340 -3.683 537 HG23 ILE 68 HG23 ILE 68 11.140 12.121 -4.686 538 HD11 ILE 68 HD11 ILE 68 11.009 10.718 -6.313 539 HD12 ILE 68 HD12 ILE 68 10.617 11.812 -7.643 540 HD13 ILE 68 HD13 ILE 68 10.011 10.156 -7.655 541 H SER 69 H SER 69 8.176 15.593 -5.570 542 HA SER 69 HA SER 69 9.134 16.770 -3.160 543 HB2 SER 69 HB2 SER 69 9.777 17.587 -5.416 544 HB3 SER 69 HB3 SER 69 8.118 18.100 -5.715 545 HG SER 69 HG SER 69 9.588 19.046 -3.492 546 H GLN 70 H GLN 70 5.965 16.603 -4.736 547 HA GLN 70 HA GLN 70 4.597 18.567 -3.226 548 HB2 GLN 70 HB2 GLN 70 3.877 17.445 -5.435 549 HB3 GLN 70 HB3 GLN 70 3.337 16.079 -4.475 550 HG2 GLN 70 HG2 GLN 70 2.267 18.908 -4.191 551 HG3 GLN 70 HG3 GLN 70 1.533 17.679 -5.203 552 HE21 GLN 70 HE21 GLN 70 1.889 15.512 -3.231 553 HE22 GLN 70 HE22 GLN 70 0.728 15.817 -1.991 554 H ILE 71 H ILE 71 4.766 15.018 -2.920 555 HA ILE 71 HA ILE 71 3.081 14.874 -0.643 556 HB ILE 71 HB ILE 71 3.376 12.992 -2.254 557 HG12 ILE 71 HG12 ILE 71 3.938 12.383 0.678 558 HG13 ILE 71 HG13 ILE 71 2.361 12.533 -0.088 559 HG21 ILE 71 HG21 ILE 71 5.816 13.141 -2.590 560 HG22 ILE 71 HG22 ILE 71 5.323 11.507 -2.148 561 HG23 ILE 71 HG23 ILE 71 6.081 12.555 -0.946 562 HD11 ILE 71 HD11 ILE 71 4.386 10.358 -0.542 563 HD12 ILE 71 HD12 ILE 71 2.854 10.517 -1.410 564 HD13 ILE 71 HD13 ILE 71 2.858 10.241 0.330 565 H ASP 72 H ASP 72 6.555 15.241 -1.058 566 HA ASP 72 HA ASP 72 7.478 14.584 1.498 567 HB2 ASP 72 HB2 ASP 72 9.032 14.897 -0.332 568 HB3 ASP 72 HB3 ASP 72 8.519 16.565 -0.571 569 H LYS 73 H LYS 73 5.831 17.464 0.336 570 HA LYS 73 HA LYS 73 6.525 19.189 2.517 571 HB2 LYS 73 HB2 LYS 73 4.180 19.445 0.595 572 HB3 LYS 73 HB3 LYS 73 4.833 20.719 1.611 573 HG2 LYS 73 HG2 LYS 73 6.110 19.460 -0.830 574 HG3 LYS 73 HG3 LYS 73 5.495 21.097 -0.668 575 HD2 LYS 73 HD2 LYS 73 7.725 21.587 -0.405 576 HD3 LYS 73 HD3 LYS 73 7.391 21.183 1.279 577 HE2 LYS 73 HE2 LYS 73 8.194 18.870 0.845 578 HE3 LYS 73 HE3 LYS 73 8.543 19.320 -0.822 579 HZ1 LYS 73 HZ1 LYS 73 10.197 20.837 -0.080 580 HZ2 LYS 73 HZ2 LYS 73 10.492 19.339 0.632 581 HZ3 LYS 73 HZ3 LYS 73 9.803 20.590 1.539 582 H LEU 74 H LEU 74 4.280 16.614 2.228 583 HA LEU 74 HA LEU 74 2.281 17.492 4.097 584 HB2 LEU 74 HB2 LEU 74 2.954 14.833 2.804 585 HB3 LEU 74 HB3 LEU 74 1.824 14.876 4.140 586 HG LEU 74 HG LEU 74 0.650 14.833 1.983 587 HD11 LEU 74 HD11 LEU 74 -0.892 16.701 2.348 588 HD12 LEU 74 HD12 LEU 74 0.274 17.474 3.427 589 HD13 LEU 74 HD13 LEU 74 -0.448 15.923 3.867 590 HD21 LEU 74 HD21 LEU 74 1.957 17.506 1.379 591 HD22 LEU 74 HD22 LEU 74 0.728 16.698 0.399 592 HD23 LEU 74 HD23 LEU 74 2.321 15.971 0.589 593 H GLU 75 H GLU 75 1.984 16.816 6.222 594 HA GLU 75 HA GLU 75 4.393 16.934 7.779 595 HB2 GLU 75 HB2 GLU 75 1.485 16.721 8.650 596 HB3 GLU 75 HB3 GLU 75 2.842 17.145 9.700 597 HG2 GLU 75 HG2 GLU 75 3.246 19.189 8.359 598 HG3 GLU 75 HG3 GLU 75 1.913 18.755 7.292 599 H ASP 76 H ASP 76 2.192 14.373 6.902 600 HA ASP 76 HA ASP 76 2.944 12.487 8.894 601 HB2 ASP 76 HB2 ASP 76 2.022 10.768 7.278 602 HB3 ASP 76 HB3 ASP 76 0.922 12.063 7.718 603 H VAL 77 H VAL 77 4.169 13.164 5.616 604 HA VAL 77 HA VAL 77 6.068 11.093 5.466 605 HB VAL 77 HB VAL 77 5.978 13.816 4.087 606 HG11 VAL 77 HG11 VAL 77 7.619 12.931 2.458 607 HG12 VAL 77 HG12 VAL 77 7.805 11.469 3.431 608 HG13 VAL 77 HG13 VAL 77 8.319 13.029 4.077 609 HG21 VAL 77 HG21 VAL 77 5.169 12.530 2.153 610 HG22 VAL 77 HG22 VAL 77 4.113 12.283 3.548 611 HG23 VAL 77 HG23 VAL 77 5.275 11.032 3.084 612 H VAL 78 H VAL 78 7.156 10.882 7.341 613 HA VAL 78 HA VAL 78 8.693 12.891 8.667 614 HB VAL 78 HB VAL 78 9.205 9.882 8.852 615 HG11 VAL 78 HG11 VAL 78 9.594 12.100 10.898 616 HG12 VAL 78 HG12 VAL 78 10.867 11.288 9.983 617 HG13 VAL 78 HG13 VAL 78 9.918 10.382 11.162 618 HG21 VAL 78 HG21 VAL 78 6.796 10.179 9.152 619 HG22 VAL 78 HG22 VAL 78 7.073 11.420 10.378 620 HG23 VAL 78 HG23 VAL 78 7.556 9.748 10.688 621 H LYS 79 H LYS 79 9.313 10.474 6.165 622 HA LYS 79 HA LYS 79 11.767 11.829 5.335 623 HB2 LYS 79 HB2 LYS 79 11.651 8.859 6.034 624 HB3 LYS 79 HB3 LYS 79 12.876 9.524 4.959 625 HG2 LYS 79 HG2 LYS 79 13.602 11.041 6.822 626 HG3 LYS 79 HG3 LYS 79 12.477 10.190 7.888 627 HD2 LYS 79 HD2 LYS 79 13.702 8.069 7.485 628 HD3 LYS 79 HD3 LYS 79 14.809 8.907 6.393 629 HE2 LYS 79 HE2 LYS 79 15.601 10.307 8.264 630 HE3 LYS 79 HE3 LYS 79 14.475 9.496 9.355 631 HZ1 LYS 79 HZ1 LYS 79 16.667 8.580 9.592 632 HZ2 LYS 79 HZ2 LYS 79 16.761 8.234 7.943 633 HZ3 LYS 79 HZ3 LYS 79 15.654 7.409 8.913 634 H VAL 80 H VAL 80 12.114 11.735 3.159 635 HA VAL 80 HA VAL 80 10.529 9.877 1.478 636 HB VAL 80 HB VAL 80 9.677 12.186 1.111 637 HG11 VAL 80 HG11 VAL 80 11.067 13.955 0.117 638 HG12 VAL 80 HG12 VAL 80 12.496 12.932 0.272 639 HG13 VAL 80 HG13 VAL 80 11.659 13.500 1.717 640 HG21 VAL 80 HG21 VAL 80 9.677 10.628 -0.791 641 HG22 VAL 80 HG22 VAL 80 11.288 11.177 -1.261 642 HG23 VAL 80 HG23 VAL 80 9.917 12.288 -1.341 643 H GLN 81 H GLN 81 11.833 8.584 0.230 644 HA GLN 81 HA GLN 81 14.578 9.477 -0.427 645 HB2 GLN 81 HB2 GLN 81 13.959 6.787 0.866 646 HB3 GLN 81 HB3 GLN 81 15.511 7.206 0.147 647 HG2 GLN 81 HG2 GLN 81 15.788 9.009 1.813 648 HG3 GLN 81 HG3 GLN 81 14.224 8.597 2.515 649 HE21 GLN 81 HE21 GLN 81 15.059 8.141 4.528 650 HE22 GLN 81 HE22 GLN 81 16.040 6.757 4.850 651 H ARG 82 H ARG 82 15.359 8.755 -2.321 652 HA ARG 82 HA ARG 82 13.487 7.359 -4.140 653 HB2 ARG 82 HB2 ARG 82 15.548 9.532 -4.732 654 HB3 ARG 82 HB3 ARG 82 14.560 8.716 -5.943 655 HG2 ARG 82 HG2 ARG 82 12.540 9.706 -5.098 656 HG3 ARG 82 HG3 ARG 82 13.366 10.322 -3.663 657 HD2 ARG 82 HD2 ARG 82 12.923 12.087 -5.342 658 HD3 ARG 82 HD3 ARG 82 14.648 11.881 -5.014 659 HE ARG 82 HE ARG 82 13.990 10.298 -7.234 660 HH11 ARG 82 HH11 ARG 82 14.127 13.730 -6.439 661 HH12 ARG 82 HH12 ARG 82 14.475 14.202 -8.071 662 HH21 ARG 82 HH21 ARG 82 14.506 10.930 -9.339 663 HH22 ARG 82 HH22 ARG 82 14.691 12.618 -9.714 664 H ASN 83 H ASN 83 14.232 5.333 -4.158 665 HA ASN 83 HA ASN 83 17.126 4.761 -4.469 666 HB2 ASN 83 HB2 ASN 83 14.979 3.116 -3.045 667 HB3 ASN 83 HB3 ASN 83 16.616 2.541 -3.361 668 HD21 ASN 83 HD21 ASN 83 15.308 2.895 -0.809 669 HD22 ASN 83 HD22 ASN 83 16.284 4.001 0.085 670 H GLN 84 H GLN 84 17.667 2.908 -5.758 671 HA GLN 84 HA GLN 84 15.971 2.575 -8.118 672 HB2 GLN 84 HB2 GLN 84 18.746 1.461 -7.473 673 HB3 GLN 84 HB3 GLN 84 17.936 1.349 -9.037 674 HG2 GLN 84 HG2 GLN 84 17.963 3.793 -9.247 675 HG3 GLN 84 HG3 GLN 84 18.730 3.935 -7.668 676 HE21 GLN 84 HE21 GLN 84 19.683 4.879 -10.256 677 HE22 GLN 84 HE22 GLN 84 21.224 4.131 -10.505 678 H SER 85 H SER 85 15.104 0.610 -8.792 679 HA SER 85 HA SER 85 14.347 -1.140 -6.603 680 HB2 SER 85 HB2 SER 85 12.591 -0.260 -8.036 681 HB3 SER 85 HB3 SER 85 13.330 -0.974 -9.457 682 HG SER 85 HG SER 85 12.017 -2.550 -8.988 683 H ASP 86 H ASP 86 14.446 -3.354 -6.577 684 HA ASP 86 HA ASP 86 16.247 -4.761 -8.420 685 HB2 ASP 86 HB2 ASP 86 17.561 -3.811 -6.420 686 HB3 ASP 86 HB3 ASP 86 16.607 -4.855 -5.380 687 HA PRO 87 HA PRO 87 13.042 -7.946 -8.159 688 HB2 PRO 87 HB2 PRO 87 15.458 -9.780 -8.108 689 HB3 PRO 87 HB3 PRO 87 13.962 -9.907 -9.065 690 HG2 PRO 87 HG2 PRO 87 16.149 -8.986 -10.230 691 HG3 PRO 87 HG3 PRO 87 14.586 -8.194 -10.539 692 HD2 PRO 87 HD2 PRO 87 16.860 -7.266 -8.808 693 HD3 PRO 87 HD3 PRO 87 15.744 -6.314 -9.820 694 H THR 88 H THR 88 15.794 -8.147 -5.893 695 HA THR 88 HA THR 88 14.425 -10.023 -4.128 696 HB THR 88 HB THR 88 16.452 -10.003 -2.767 697 HG1 THR 88 HG1 THR 88 17.313 -7.887 -4.460 698 HG21 THR 88 HG21 THR 88 16.512 -11.408 -4.818 699 HG22 THR 88 HG22 THR 88 18.117 -10.793 -4.412 700 HG23 THR 88 HG23 THR 88 17.191 -10.053 -5.721 701 H MET 89 H MET 89 14.015 -6.773 -4.519 702 HA MET 89 HA MET 89 14.499 -5.483 -2.145 703 HB2 MET 89 HB2 MET 89 13.790 -4.328 -4.203 704 HB3 MET 89 HB3 MET 89 12.172 -5.004 -4.055 705 HG2 MET 89 HG2 MET 89 11.923 -2.813 -3.277 706 HG3 MET 89 HG3 MET 89 12.082 -3.725 -1.782 707 HE1 MET 89 HE1 MET 89 15.439 -2.508 -0.314 708 HE2 MET 89 HE2 MET 89 14.983 -4.091 -0.940 709 HE3 MET 89 HE3 MET 89 13.840 -3.166 0.034 710 H PHE 90 H PHE 90 11.185 -6.672 -3.038 711 HA PHE 90 HA PHE 90 9.877 -6.146 -0.673 712 HB2 PHE 90 HB2 PHE 90 9.385 -8.372 -2.690 713 HB3 PHE 90 HB3 PHE 90 8.315 -8.118 -1.324 714 HD1 PHE 90 HD1 PHE 90 7.452 -5.584 -1.061 715 HD2 PHE 90 HD2 PHE 90 8.770 -7.363 -4.731 716 HE1 PHE 90 HE1 PHE 90 6.107 -3.966 -2.335 717 HE2 PHE 90 HE2 PHE 90 7.424 -5.732 -5.989 718 HZ PHE 90 HZ PHE 90 6.095 -4.040 -4.792 719 H ASN 91 H ASN 91 11.652 -9.072 -1.539 720 HA ASN 91 HA ASN 91 10.992 -10.664 0.697 721 HB2 ASN 91 HB2 ASN 91 11.874 -11.540 -1.479 722 HB3 ASN 91 HB3 ASN 91 13.435 -10.813 -1.119 723 HD21 ASN 91 HD21 ASN 91 11.253 -13.410 -0.383 724 HD22 ASN 91 HD22 ASN 91 12.356 -14.345 0.567 725 H LYS 92 H LYS 92 13.742 -8.560 -0.069 726 HA LYS 92 HA LYS 92 15.460 -9.122 2.024 727 HB2 LYS 92 HB2 LYS 92 16.145 -7.839 0.068 728 HB3 LYS 92 HB3 LYS 92 15.070 -6.514 0.507 729 HG2 LYS 92 HG2 LYS 92 16.405 -6.081 2.527 730 HG3 LYS 92 HG3 LYS 92 17.468 -7.434 2.124 731 HD2 LYS 92 HD2 LYS 92 18.220 -6.283 0.097 732 HD3 LYS 92 HD3 LYS 92 17.084 -4.958 0.397 733 HE2 LYS 92 HE2 LYS 92 19.403 -4.386 1.073 734 HE3 LYS 92 HE3 LYS 92 18.285 -4.345 2.437 735 HZ1 LYS 92 HZ1 LYS 92 20.405 -5.425 2.977 736 HZ2 LYS 92 HZ2 LYS 92 20.110 -6.605 1.803 737 HZ3 LYS 92 HZ3 LYS 92 19.102 -6.490 3.147 738 H ILE 93 H ILE 93 13.126 -6.336 1.951 739 HA ILE 93 HA ILE 93 13.813 -5.666 4.677 740 HB ILE 93 HB ILE 93 12.203 -3.864 4.621 741 HG12 ILE 93 HG12 ILE 93 10.505 -5.199 3.086 742 HG13 ILE 93 HG13 ILE 93 10.572 -3.453 3.008 743 HG21 ILE 93 HG21 ILE 93 13.174 -2.529 2.766 744 HG22 ILE 93 HG22 ILE 93 13.860 -4.004 2.080 745 HG23 ILE 93 HG23 ILE 93 14.397 -3.435 3.662 746 HD11 ILE 93 HD11 ILE 93 11.891 -3.588 0.966 747 HD12 ILE 93 HD12 ILE 93 10.341 -4.415 0.831 748 HD13 ILE 93 HD13 ILE 93 11.816 -5.349 1.050 749 H ALA 94 H ALA 94 11.338 -7.621 3.187 750 HA ALA 94 HA ALA 94 9.601 -7.895 5.429 751 HB1 ALA 94 HB1 ALA 94 10.228 -9.863 3.204 752 HB2 ALA 94 HB2 ALA 94 8.987 -8.608 3.170 753 HB3 ALA 94 HB3 ALA 94 8.842 -9.952 4.303 754 H VAL 95 H VAL 95 12.628 -9.509 4.532 755 HA VAL 95 HA VAL 95 12.623 -11.356 6.768 756 HB VAL 95 HB VAL 95 14.843 -10.587 4.812 757 HG11 VAL 95 HG11 VAL 95 15.873 -11.432 6.883 758 HG12 VAL 95 HG12 VAL 95 16.059 -12.609 5.580 759 HG13 VAL 95 HG13 VAL 95 14.840 -12.864 6.832 760 HG21 VAL 95 HG21 VAL 95 12.937 -11.741 3.754 761 HG22 VAL 95 HG22 VAL 95 13.085 -13.064 4.910 762 HG23 VAL 95 HG23 VAL 95 14.377 -12.762 3.743 763 H PHE 96 H PHE 96 13.724 -8.105 6.163 764 HA PHE 96 HA PHE 96 15.505 -7.964 8.444 765 HB2 PHE 96 HB2 PHE 96 15.889 -6.692 6.321 766 HB3 PHE 96 HB3 PHE 96 14.435 -5.754 6.643 767 HD1 PHE 96 HD1 PHE 96 17.195 -6.784 8.977 768 HD2 PHE 96 HD2 PHE 96 15.224 -3.536 6.993 769 HE1 PHE 96 HE1 PHE 96 18.578 -5.180 10.217 770 HE2 PHE 96 HE2 PHE 96 16.620 -1.941 8.248 771 HZ PHE 96 HZ PHE 96 18.294 -2.763 9.860 772 H PHE 97 H PHE 97 12.200 -7.159 7.667 773 HA PHE 97 HA PHE 97 10.610 -5.830 8.598 774 HB2 PHE 97 HB2 PHE 97 9.790 -6.974 10.813 775 HB3 PHE 97 HB3 PHE 97 9.767 -7.860 9.303 776 HD1 PHE 97 HD2 PHE 97 11.829 -7.368 12.390 777 HD2 PHE 97 HD1 PHE 97 10.840 -9.967 9.143 778 HE1 PHE 97 HE2 PHE 97 13.156 -9.162 13.424 779 HE2 PHE 97 HE1 PHE 97 12.168 -11.753 10.187 780 HZ PHE 97 HZ PHE 97 13.325 -11.356 12.321 781 H GLN 98 H GLN 98 12.222 -4.030 8.720 782 HA GLN 98 HA GLN 98 13.179 -3.062 11.199 783 HB2 GLN 98 HB2 GLN 98 14.045 -2.253 9.031 784 HB3 GLN 98 HB3 GLN 98 12.484 -1.530 8.658 785 HG2 GLN 98 HG2 GLN 98 14.137 0.164 9.376 786 HG3 GLN 98 HG3 GLN 98 12.754 0.094 10.465 787 HE21 GLN 98 HE21 GLN 98 13.051 -0.680 12.592 788 HE22 GLN 98 HE22 GLN 98 14.625 -0.850 13.285 789 H1 GLY 1 H1 GLY 1 -7.063 8.400 17.759 790 H2 GLY 1 H2 GLY 1 -7.987 9.581 16.986 791 H3 GLY 1 H3 GLY 1 -7.831 8.048 16.297 792 HA2 GLY 1 HA3 GLY 1 -9.200 8.682 18.845 793 HA3 GLY 1 HA2 GLY 1 -9.991 8.291 17.331 794 H SER 2 H SER 2 -7.518 6.296 17.079 795 HA SER 2 HA SER 2 -8.171 4.233 19.012 796 HB2 SER 2 HB2 SER 2 -9.989 3.937 17.311 797 HB3 SER 2 HB3 SER 2 -8.774 3.777 16.041 798 HG SER 2 HG SER 2 -9.765 1.839 17.380 799 H MET 3 H MET 3 -6.068 3.958 19.574 800 HA MET 3 HA MET 3 -4.075 3.253 17.478 801 HB2 MET 3 HB2 MET 3 -3.593 4.478 20.238 802 HB3 MET 3 HB3 MET 3 -2.327 3.984 19.121 803 HG2 MET 3 HG2 MET 3 -3.078 5.677 17.507 804 HG3 MET 3 HG3 MET 3 -4.362 6.165 18.618 805 HE1 MET 3 HE1 MET 3 -1.906 9.212 18.882 806 HE2 MET 3 HE2 MET 3 -3.586 8.727 18.644 807 HE3 MET 3 HE3 MET 3 -2.360 8.312 17.439 808 H GLN 4 H GLN 4 -6.144 1.694 19.206 809 HA GLN 4 HA GLN 4 -4.476 -0.184 20.681 810 HB2 GLN 4 HB2 GLN 4 -7.477 -0.044 20.150 811 HB3 GLN 4 HB3 GLN 4 -6.725 -1.367 21.035 812 HG2 GLN 4 HG2 GLN 4 -6.654 1.550 21.855 813 HG3 GLN 4 HG3 GLN 4 -7.740 0.332 22.519 814 HE21 GLN 4 HE21 GLN 4 -4.465 1.516 22.459 815 HE22 GLN 4 HE22 GLN 4 -3.885 0.571 23.784 816 H ASN 5 H ASN 5 -3.305 -1.511 19.426 817 HA ASN 5 HA ASN 5 -4.570 -3.363 17.602 818 HB2 ASN 5 HB2 ASN 5 -3.197 -2.859 15.651 819 HB3 ASN 5 HB3 ASN 5 -4.125 -1.437 16.097 820 HD21 ASN 5 HD21 ASN 5 -1.496 -1.913 14.636 821 HD22 ASN 5 HD22 ASN 5 -0.420 -0.770 15.358 822 H THR 6 H THR 6 -3.315 -5.126 17.127 823 HA THR 6 HA THR 6 -0.513 -5.359 17.873 824 HB THR 6 HB THR 6 -1.030 -7.601 19.071 825 HG1 THR 6 HG1 THR 6 -3.606 -6.401 19.350 826 HG21 THR 6 HG21 THR 6 -1.440 -6.607 21.286 827 HG22 THR 6 HG22 THR 6 -1.917 -5.086 20.527 828 HG23 THR 6 HG23 THR 6 -0.252 -5.660 20.387 829 H THR 7 H THR 7 0.390 -7.395 16.889 830 HA THR 7 HA THR 7 -0.864 -7.957 14.345 831 HB THR 7 HB THR 7 1.692 -9.202 15.451 832 HG1 THR 7 HG1 THR 7 1.208 -6.728 14.106 833 HG21 THR 7 HG21 THR 7 2.298 -9.430 13.048 834 HG22 THR 7 HG22 THR 7 0.720 -8.786 12.588 835 HG23 THR 7 HG23 THR 7 0.830 -10.339 13.424 836 H HIS 8 H HIS 8 -2.750 -8.793 15.467 837 HA HIS 8 HA HIS 8 -3.280 -11.444 14.969 838 HB2 HIS 8 HB2 HIS 8 -3.695 -12.475 17.175 839 HB3 HIS 8 HB3 HIS 8 -2.001 -12.014 17.054 840 HD1 HIS 8 HD1 HIS 8 -5.212 -11.026 18.794 841 HD2 HIS 8 HD2 HIS 8 -1.137 -10.247 19.018 842 HE1 HIS 8 HE1 HIS 8 -4.886 -9.760 20.933 843 HE2 HIS 8 HE2 HIS 8 -2.414 -9.340 21.064 844 H ASP 9 H ASP 9 -3.978 -8.581 16.866 845 HA ASP 9 HA ASP 9 -6.853 -8.823 16.909 846 HB2 ASP 9 HB2 ASP 9 -5.483 -7.577 18.637 847 HB3 ASP 9 HB3 ASP 9 -5.117 -6.365 17.414 848 H ASN 10 H ASN 10 -4.424 -7.407 14.827 849 HA ASN 10 HA ASN 10 -6.290 -6.213 12.994 850 HB2 ASN 10 HB2 ASN 10 -4.345 -5.876 11.528 851 HB3 ASN 10 HB3 ASN 10 -3.972 -5.354 13.167 852 HD21 ASN 10 HD21 ASN 10 -2.046 -5.960 11.227 853 HD22 ASN 10 HD22 ASN 10 -1.134 -7.304 11.790 854 H VAL 11 H VAL 11 -6.354 -6.978 10.686 855 HA VAL 11 HA VAL 11 -6.443 -9.913 10.420 856 HB VAL 11 HB VAL 11 -8.647 -9.681 9.156 857 HG11 VAL 11 HG11 VAL 11 -8.749 -8.992 12.115 858 HG12 VAL 11 HG12 VAL 11 -8.584 -10.609 11.427 859 HG13 VAL 11 HG13 VAL 11 -10.068 -9.690 11.167 860 HG21 VAL 11 HG21 VAL 11 -8.566 -7.229 8.756 861 HG22 VAL 11 HG22 VAL 11 -8.773 -6.939 10.483 862 HG23 VAL 11 HG23 VAL 11 -10.067 -7.707 9.558 863 H ILE 12 H ILE 12 -6.162 -10.651 8.357 864 HA ILE 12 HA ILE 12 -4.767 -8.879 6.524 865 HB ILE 12 HB ILE 12 -5.250 -11.878 6.305 866 HG12 ILE 12 HG12 ILE 12 -4.025 -11.356 8.394 867 HG13 ILE 12 HG13 ILE 12 -3.035 -12.254 7.256 868 HG21 ILE 12 HG21 ILE 12 -4.613 -10.852 4.189 869 HG22 ILE 12 HG22 ILE 12 -3.307 -11.869 4.804 870 HG23 ILE 12 HG23 ILE 12 -3.204 -10.113 4.958 871 HD11 ILE 12 HD11 ILE 12 -2.887 -9.302 7.811 872 HD12 ILE 12 HD12 ILE 12 -1.892 -10.176 6.643 873 HD13 ILE 12 HD13 ILE 12 -1.764 -10.540 8.362 874 H LEU 13 H LEU 13 -6.564 -7.658 5.744 875 HA LEU 13 HA LEU 13 -8.653 -9.026 4.217 876 HB2 LEU 13 HB2 LEU 13 -8.152 -6.042 4.577 877 HB3 LEU 13 HB3 LEU 13 -9.580 -6.779 3.852 878 HG LEU 13 HG LEU 13 -8.725 -7.029 6.763 879 HD11 LEU 13 HD11 LEU 13 -10.746 -5.756 7.269 880 HD12 LEU 13 HD12 LEU 13 -11.070 -5.558 5.544 881 HD13 LEU 13 HD13 LEU 13 -9.629 -4.836 6.265 882 HD21 LEU 13 HD21 LEU 13 -9.767 -9.109 6.035 883 HD22 LEU 13 HD22 LEU 13 -11.153 -8.226 5.387 884 HD23 LEU 13 HD23 LEU 13 -10.841 -8.234 7.125 885 H GLU 14 H GLU 14 -7.518 -9.994 2.586 886 HA GLU 14 HA GLU 14 -5.669 -8.416 0.978 887 HB2 GLU 14 HB2 GLU 14 -5.229 -10.645 -0.181 888 HB3 GLU 14 HB3 GLU 14 -4.729 -10.488 1.494 889 HG2 GLU 14 HG2 GLU 14 -6.512 -11.861 2.267 890 HG3 GLU 14 HG3 GLU 14 -7.320 -11.816 0.700 891 H LEU 15 H LEU 15 -6.580 -7.181 -0.425 892 HA LEU 15 HA LEU 15 -8.776 -8.057 -2.168 893 HB2 LEU 15 HB2 LEU 15 -7.421 -5.375 -1.688 894 HB3 LEU 15 HB3 LEU 15 -8.522 -5.630 -3.027 895 HG LEU 15 HG LEU 15 -9.662 -4.509 -1.221 896 HD11 LEU 15 HD11 LEU 15 -10.993 -5.963 -2.593 897 HD12 LEU 15 HD12 LEU 15 -11.612 -5.910 -0.946 898 HD13 LEU 15 HD13 LEU 15 -10.692 -7.314 -1.498 899 HD21 LEU 15 HD21 LEU 15 -8.356 -5.245 0.704 900 HD22 LEU 15 HD22 LEU 15 -9.055 -6.861 0.577 901 HD23 LEU 15 HD23 LEU 15 -10.082 -5.480 0.980 902 H THR 16 H THR 16 -8.077 -9.220 -3.887 903 HA THR 16 HA THR 16 -5.580 -8.569 -5.266 904 HB THR 16 HB THR 16 -7.723 -10.597 -6.065 905 HG1 THR 16 HG1 THR 16 -6.787 -11.270 -4.139 906 HG21 THR 16 HG21 THR 16 -4.845 -10.298 -7.017 907 HG22 THR 16 HG22 THR 16 -6.278 -9.853 -7.953 908 HG23 THR 16 HG23 THR 16 -5.985 -11.546 -7.527 909 H VAL 17 H VAL 17 -5.853 -6.582 -6.181 910 HA VAL 17 HA VAL 17 -8.191 -6.132 -7.944 911 HB VAL 17 HB VAL 17 -8.066 -3.839 -7.571 912 HG11 VAL 17 HG11 VAL 17 -8.895 -4.954 -5.566 913 HG12 VAL 17 HG12 VAL 17 -8.041 -3.475 -5.120 914 HG13 VAL 17 HG13 VAL 17 -7.256 -5.052 -4.905 915 HG21 VAL 17 HG21 VAL 17 -6.181 -2.610 -6.491 916 HG22 VAL 17 HG22 VAL 17 -5.715 -3.403 -7.997 917 HG23 VAL 17 HG23 VAL 17 -5.260 -4.120 -6.453 918 H ARG 18 H ARG 18 -7.782 -5.548 -10.099 919 HA ARG 18 HA ARG 18 -4.977 -5.803 -11.014 920 HB2 ARG 18 HB2 ARG 18 -5.894 -6.081 -13.284 921 HB3 ARG 18 HB3 ARG 18 -6.524 -7.278 -12.165 922 HG2 ARG 18 HG2 ARG 18 -8.637 -5.941 -12.022 923 HG3 ARG 18 HG3 ARG 18 -7.990 -4.867 -13.267 924 HD2 ARG 18 HD2 ARG 18 -8.584 -7.836 -13.548 925 HD3 ARG 18 HD3 ARG 18 -9.473 -6.504 -14.292 926 HE ARG 18 HE ARG 18 -6.697 -6.536 -15.069 927 HH11 ARG 18 HH11 ARG 18 -9.825 -7.989 -15.793 928 HH12 ARG 18 HH12 ARG 18 -9.391 -8.412 -17.415 929 HH21 ARG 18 HH21 ARG 18 -6.126 -7.157 -17.190 930 HH22 ARG 18 HH22 ARG 18 -7.295 -7.942 -18.210 931 H ASN 19 H ASN 19 -3.859 -4.093 -11.752 932 HA ASN 19 HA ASN 19 -4.597 -1.599 -10.745 933 HB2 ASN 19 HB2 ASN 19 -2.195 -2.565 -12.285 934 HB3 ASN 19 HB3 ASN 19 -2.409 -0.834 -12.054 935 HD21 ASN 19 HD21 ASN 19 -0.278 -2.472 -10.978 936 HD22 ASN 19 HD22 ASN 19 -0.370 -2.323 -9.262 937 H HIS 20 H HIS 20 -6.471 -1.017 -11.726 938 HA HIS 20 HA HIS 20 -6.293 0.308 -14.358 939 HB2 HIS 20 HB2 HIS 20 -8.567 0.431 -12.321 940 HB3 HIS 20 HB3 HIS 20 -8.644 0.877 -14.020 941 HD1 HIS 20 HD1 HIS 20 -10.252 -1.392 -12.251 942 HD2 HIS 20 HD2 HIS 20 -7.486 -1.967 -15.294 943 HE1 HIS 20 HE1 HIS 20 -10.733 -3.671 -13.172 944 HE2 HIS 20 HE2 HIS 20 -9.169 -3.905 -15.129 945 HA PRO 21 HA PRO 21 -4.865 4.337 -12.973 946 HB2 PRO 21 HB2 PRO 21 -7.591 5.438 -13.714 947 HB3 PRO 21 HB3 PRO 21 -5.975 6.089 -14.082 948 HG2 PRO 21 HG2 PRO 21 -7.286 4.775 -15.965 949 HG3 PRO 21 HG3 PRO 21 -5.545 4.479 -15.737 950 HD2 PRO 21 HD2 PRO 21 -7.869 2.743 -14.956 951 HD3 PRO 21 HD3 PRO 21 -6.244 2.277 -15.512 952 H GLY 22 H GLY 22 -4.644 4.076 -10.767 953 HA2 GLY 22 HA2 GLY 22 -4.808 4.839 -8.624 954 HA3 GLY 22 HA3 GLY 22 -6.154 5.849 -9.121 955 H VAL 23 H VAL 23 -5.736 2.296 -9.025 956 HA VAL 23 HA VAL 23 -8.265 1.984 -7.582 957 HB VAL 23 HB VAL 23 -7.924 -0.458 -7.887 958 HG11 VAL 23 HG11 VAL 23 -7.662 1.254 -10.385 959 HG12 VAL 23 HG12 VAL 23 -9.155 0.840 -9.537 960 HG13 VAL 23 HG13 VAL 23 -8.226 -0.420 -10.348 961 HG21 VAL 23 HG21 VAL 23 -5.449 -0.528 -7.844 962 HG22 VAL 23 HG22 VAL 23 -5.387 0.327 -9.388 963 HG23 VAL 23 HG23 VAL 23 -6.081 -1.299 -9.304 964 H MET 24 H MET 24 -4.864 1.793 -6.871 965 HA MET 24 HA MET 24 -4.916 0.431 -4.419 966 HB2 MET 24 HB2 MET 24 -2.741 1.562 -3.945 967 HB3 MET 24 HB3 MET 24 -2.811 0.804 -5.526 968 HG2 MET 24 HG2 MET 24 -3.222 3.764 -5.076 969 HG3 MET 24 HG3 MET 24 -1.673 3.033 -5.487 970 HE1 MET 24 HE1 MET 24 -2.574 0.755 -7.582 971 HE2 MET 24 HE2 MET 24 -1.192 1.822 -7.853 972 HE3 MET 24 HE3 MET 24 -2.424 1.631 -9.102 973 H THR 25 H THR 25 -5.843 3.717 -5.172 974 HA THR 25 HA THR 25 -5.908 4.841 -2.584 975 HB THR 25 HB THR 25 -7.540 6.456 -3.539 976 HG1 THR 25 HG1 THR 25 -7.852 5.921 -5.973 977 HG21 THR 25 HG21 THR 25 -5.130 6.793 -4.052 978 HG22 THR 25 HG22 THR 25 -6.151 7.319 -5.391 979 HG23 THR 25 HG23 THR 25 -5.294 5.780 -5.490 980 H HIS 26 H HIS 26 -8.076 2.578 -4.177 981 HA HIS 26 HA HIS 26 -10.425 2.997 -2.641 982 HB2 HIS 26 HB2 HIS 26 -9.521 0.456 -4.081 983 HB3 HIS 26 HB3 HIS 26 -11.153 0.770 -3.499 984 HD1 HIS 26 HD1 HIS 26 -10.761 0.124 -6.421 985 HD2 HIS 26 HD2 HIS 26 -10.672 4.024 -4.962 986 HE1 HIS 26 HE1 HIS 26 -11.282 1.601 -8.374 987 HE2 HIS 26 HE2 HIS 26 -11.288 3.931 -7.459 988 H VAL 27 H VAL 27 -7.802 0.557 -2.323 989 HA VAL 27 HA VAL 27 -8.861 -0.693 -0.002 990 HB VAL 27 HB VAL 27 -6.691 -1.800 0.267 991 HG11 VAL 27 HG11 VAL 27 -6.516 -2.933 -1.922 992 HG12 VAL 27 HG12 VAL 27 -7.495 -1.659 -2.660 993 HG13 VAL 27 HG13 VAL 27 -8.196 -2.712 -1.428 994 HG21 VAL 27 HG21 VAL 27 -4.750 -1.343 -1.178 995 HG22 VAL 27 HG22 VAL 27 -5.163 0.069 -0.201 996 HG23 VAL 27 HG23 VAL 27 -5.604 0.019 -1.909 997 H CYS 28 H CYS 28 -6.607 1.972 -0.473 998 HA CYS 28 HA CYS 28 -5.878 2.334 2.246 999 HB2 CYS 28 HB2 CYS 28 -5.723 4.147 -0.191 1000 HB3 CYS 28 HB3 CYS 28 -5.013 4.563 1.371 1001 HG CYS 28 HG CYS 28 -3.858 2.579 -1.020 1002 H GLY 29 H GLY 29 -8.461 3.630 0.231 1003 HA2 GLY 29 HA2 GLY 29 -9.213 5.789 1.951 1004 HA3 GLY 29 HA3 GLY 29 -10.134 5.153 0.596 1005 H LEU 30 H LEU 30 -10.559 2.544 1.340 1006 HA LEU 30 HA LEU 30 -12.905 2.931 2.875 1007 HB2 LEU 30 HB2 LEU 30 -11.637 0.600 1.477 1008 HB3 LEU 30 HB3 LEU 30 -12.822 0.214 2.710 1009 HG LEU 30 HG LEU 30 -13.896 0.233 0.532 1010 HD11 LEU 30 HD11 LEU 30 -15.749 1.775 0.939 1011 HD12 LEU 30 HD12 LEU 30 -14.788 2.657 2.132 1012 HD13 LEU 30 HD13 LEU 30 -15.251 0.979 2.430 1013 HD21 LEU 30 HD21 LEU 30 -14.082 2.237 -0.878 1014 HD22 LEU 30 HD22 LEU 30 -12.404 1.729 -0.701 1015 HD23 LEU 30 HD23 LEU 30 -13.001 3.117 0.209 1016 H PHE 31 H PHE 31 -9.809 1.334 3.684 1017 HA PHE 31 HA PHE 31 -10.895 0.413 6.231 1018 HB2 PHE 31 HB2 PHE 31 -8.097 0.080 5.093 1019 HB3 PHE 31 HB3 PHE 31 -8.736 -0.725 6.531 1020 HD1 PHE 31 HD2 PHE 31 -11.351 -1.688 5.882 1021 HD2 PHE 31 HD1 PHE 31 -7.936 -1.469 3.310 1022 HE1 PHE 31 HE2 PHE 31 -12.300 -3.454 4.457 1023 HE2 PHE 31 HE1 PHE 31 -8.899 -3.232 1.888 1024 HZ PHE 31 HZ PHE 31 -11.079 -4.229 2.461 1025 H ALA 32 H ALA 32 -8.864 3.058 5.140 1026 HA ALA 32 HA ALA 32 -7.882 3.879 7.692 1027 HB1 ALA 32 HB1 ALA 32 -7.326 5.997 6.583 1028 HB2 ALA 32 HB2 ALA 32 -8.317 5.540 5.190 1029 HB3 ALA 32 HB3 ALA 32 -6.860 4.621 5.579 1030 H ARG 33 H ARG 33 -10.800 4.706 5.823 1031 HA ARG 33 HA ARG 33 -11.586 6.949 7.399 1032 HB2 ARG 33 HB2 ARG 33 -13.665 6.925 6.115 1033 HB3 ARG 33 HB3 ARG 33 -12.297 6.633 5.045 1034 HG2 ARG 33 HG2 ARG 33 -12.796 4.194 5.126 1035 HG3 ARG 33 HG3 ARG 33 -14.229 4.540 6.095 1036 HD2 ARG 33 HD2 ARG 33 -13.743 5.642 3.307 1037 HD3 ARG 33 HD3 ARG 33 -14.661 4.171 3.646 1038 HE ARG 33 HE ARG 33 -15.829 6.170 5.174 1039 HH11 ARG 33 HH11 ARG 33 -15.326 5.552 1.744 1040 HH12 ARG 33 HH12 ARG 33 -16.745 6.403 1.252 1041 HH21 ARG 33 HH21 ARG 33 -17.723 7.278 4.510 1042 HH22 ARG 33 HH22 ARG 33 -18.114 7.387 2.824 1043 H ARG 34 H ARG 34 -11.836 3.603 8.072 1044 HA ARG 34 HA ARG 34 -14.365 3.428 9.310 1045 HB2 ARG 34 HB2 ARG 34 -13.161 1.413 8.642 1046 HB3 ARG 34 HB3 ARG 34 -11.819 1.797 9.707 1047 HG2 ARG 34 HG2 ARG 34 -13.141 -0.020 10.641 1048 HG3 ARG 34 HG3 ARG 34 -13.266 1.398 11.682 1049 HD2 ARG 34 HD2 ARG 34 -15.376 0.633 9.630 1050 HD3 ARG 34 HD3 ARG 34 -15.414 0.094 11.307 1051 HE ARG 34 HE ARG 34 -15.785 2.867 10.351 1052 HH11 ARG 34 HH11 ARG 34 -16.007 0.573 13.029 1053 HH12 ARG 34 HH12 ARG 34 -16.885 1.670 14.041 1054 HH21 ARG 34 HH21 ARG 34 -16.882 4.286 11.711 1055 HH22 ARG 34 HH22 ARG 34 -17.375 3.769 13.289 1056 H ALA 35 H ALA 35 -11.138 3.611 10.832 1057 HA ALA 35 HA ALA 35 -11.696 5.656 12.683 1058 HB1 ALA 35 HB1 ALA 35 -13.224 4.013 13.734 1059 HB2 ALA 35 HB2 ALA 35 -11.861 4.360 14.800 1060 HB3 ALA 35 HB3 ALA 35 -11.904 2.853 13.875 1061 H PHE 36 H PHE 36 -10.108 2.493 12.619 1062 HA PHE 36 HA PHE 36 -7.549 3.601 13.500 1063 HB2 PHE 36 HB2 PHE 36 -8.306 1.518 14.552 1064 HB3 PHE 36 HB3 PHE 36 -8.530 0.758 12.980 1065 HD1 PHE 36 HD2 PHE 36 -5.742 2.523 14.818 1066 HD2 PHE 36 HD1 PHE 36 -6.904 -0.836 12.430 1067 HE1 PHE 36 HE2 PHE 36 -3.444 1.649 14.907 1068 HE2 PHE 36 HE1 PHE 36 -4.608 -1.701 12.532 1069 HZ PHE 36 HZ PHE 36 -2.881 -0.460 13.767 1070 H ASN 37 H ASN 37 -5.815 3.852 12.156 1071 HA ASN 37 HA ASN 37 -6.094 3.736 9.294 1072 HB2 ASN 37 HB2 ASN 37 -3.587 4.156 10.981 1073 HB3 ASN 37 HB3 ASN 37 -3.699 4.413 9.248 1074 HD21 ASN 37 HD21 ASN 37 -4.424 5.744 12.378 1075 HD22 ASN 37 HD22 ASN 37 -4.996 7.270 11.809 1076 H VAL 38 H VAL 38 -4.786 2.423 7.877 1077 HA VAL 38 HA VAL 38 -4.727 -0.312 8.565 1078 HB VAL 38 HB VAL 38 -3.258 0.989 6.227 1079 HG11 VAL 38 HG11 VAL 38 -3.545 -1.213 5.140 1080 HG12 VAL 38 HG12 VAL 38 -4.301 -1.838 6.608 1081 HG13 VAL 38 HG13 VAL 38 -2.609 -1.336 6.633 1082 HG21 VAL 38 HG21 VAL 38 -6.146 0.027 6.330 1083 HG22 VAL 38 HG22 VAL 38 -5.298 0.576 4.881 1084 HG23 VAL 38 HG23 VAL 38 -5.615 1.707 6.199 1085 H GLU 39 H GLU 39 -3.326 -1.286 9.857 1086 HA GLU 39 HA GLU 39 -0.997 -0.235 10.986 1087 HB2 GLU 39 HB2 GLU 39 -2.379 -2.063 11.979 1088 HB3 GLU 39 HB3 GLU 39 -1.845 -3.159 10.709 1089 HG2 GLU 39 HG2 GLU 39 0.499 -2.921 11.572 1090 HG3 GLU 39 HG3 GLU 39 -0.127 -1.936 12.893 1091 H GLY 40 H GLY 40 -1.413 -2.566 8.318 1092 HA2 GLY 40 HA2 GLY 40 1.247 -1.934 7.247 1093 HA3 GLY 40 HA3 GLY 40 0.972 -3.599 7.754 1094 H ILE 41 H ILE 41 1.515 -2.531 5.094 1095 HA ILE 41 HA ILE 41 -0.810 -3.601 3.589 1096 HB ILE 41 HB ILE 41 0.839 -1.138 2.789 1097 HG12 ILE 41 HG12 ILE 41 -2.091 -1.236 3.615 1098 HG13 ILE 41 HG13 ILE 41 -0.779 -0.603 4.601 1099 HG21 ILE 41 HG21 ILE 41 -0.657 -0.889 0.870 1100 HG22 ILE 41 HG22 ILE 41 -1.516 -2.357 1.343 1101 HG23 ILE 41 HG23 ILE 41 0.170 -2.451 0.831 1102 HD11 ILE 41 HD11 ILE 41 -0.382 1.140 2.890 1103 HD12 ILE 41 HD12 ILE 41 -1.991 1.207 3.606 1104 HD13 ILE 41 HD13 ILE 41 -1.777 0.535 1.990 1105 H LEU 42 H LEU 42 -0.145 -4.887 1.793 1106 HA LEU 42 HA LEU 42 2.556 -4.606 0.756 1107 HB2 LEU 42 HB2 LEU 42 2.929 -6.316 2.440 1108 HB3 LEU 42 HB3 LEU 42 1.571 -7.266 1.863 1109 HG LEU 42 HG LEU 42 2.767 -8.017 -0.085 1110 HD11 LEU 42 HD11 LEU 42 4.916 -5.959 0.482 1111 HD12 LEU 42 HD12 LEU 42 3.737 -5.914 -0.831 1112 HD13 LEU 42 HD13 LEU 42 4.961 -7.180 -0.796 1113 HD21 LEU 42 HD21 LEU 42 3.466 -9.109 2.000 1114 HD22 LEU 42 HD22 LEU 42 4.775 -7.938 2.188 1115 HD23 LEU 42 HD23 LEU 42 4.780 -9.064 0.826 1116 H CYS 43 H CYS 43 2.016 -4.097 -1.229 1117 HA CYS 43 HA CYS 43 0.012 -5.575 -2.772 1118 HB2 CYS 43 HB2 CYS 43 -0.145 -3.200 -2.983 1119 HB3 CYS 43 HB3 CYS 43 1.582 -3.032 -3.241 1120 HG CYS 43 HG CYS 43 -0.790 -3.273 -5.423 1121 H LEU 44 H LEU 44 0.843 -7.452 -3.450 1122 HA LEU 44 HA LEU 44 3.564 -7.650 -4.563 1123 HB2 LEU 44 HB2 LEU 44 2.601 -9.287 -2.823 1124 HB3 LEU 44 HB3 LEU 44 1.554 -9.878 -4.095 1125 HG LEU 44 HG LEU 44 3.690 -10.482 -5.400 1126 HD11 LEU 44 HD11 LEU 44 5.764 -10.728 -4.121 1127 HD12 LEU 44 HD12 LEU 44 5.006 -9.980 -2.711 1128 HD13 LEU 44 HD13 LEU 44 5.260 -9.037 -4.187 1129 HD21 LEU 44 HD21 LEU 44 4.046 -12.571 -4.137 1130 HD22 LEU 44 HD22 LEU 44 2.333 -12.177 -4.263 1131 HD23 LEU 44 HD23 LEU 44 3.195 -11.881 -2.750 1132 HA PRO 45 HA PRO 45 1.305 -7.310 -8.571 1133 HB2 PRO 45 HB2 PRO 45 3.587 -7.188 -10.149 1134 HB3 PRO 45 HB3 PRO 45 2.872 -5.781 -9.342 1135 HG2 PRO 45 HG2 PRO 45 5.211 -7.447 -8.480 1136 HG3 PRO 45 HG3 PRO 45 5.008 -5.682 -8.428 1137 HD2 PRO 45 HD2 PRO 45 4.693 -7.229 -6.218 1138 HD3 PRO 45 HD3 PRO 45 3.738 -5.746 -6.474 1139 H ILE 46 H ILE 46 0.422 -9.178 -9.192 1140 HA ILE 46 HA ILE 46 1.548 -11.743 -8.827 1141 HB ILE 46 HB ILE 46 -0.824 -10.961 -10.586 1142 HG12 ILE 46 HG12 ILE 46 -1.184 -10.202 -8.272 1143 HG13 ILE 46 HG13 ILE 46 -2.243 -11.560 -8.621 1144 HG21 ILE 46 HG21 ILE 46 -1.577 -13.310 -10.293 1145 HG22 ILE 46 HG22 ILE 46 -0.077 -13.680 -9.434 1146 HG23 ILE 46 HG23 ILE 46 -0.029 -13.213 -11.137 1147 HD11 ILE 46 HD11 ILE 46 0.291 -11.620 -6.992 1148 HD12 ILE 46 HD12 ILE 46 -0.685 -13.036 -7.392 1149 HD13 ILE 46 HD13 ILE 46 -1.366 -11.747 -6.405 1150 H GLN 47 H GLN 47 2.847 -12.917 -10.113 1151 HA GLN 47 HA GLN 47 4.120 -11.741 -12.386 1152 HB2 GLN 47 HB2 GLN 47 5.510 -13.752 -12.404 1153 HB3 GLN 47 HB3 GLN 47 5.289 -13.183 -10.755 1154 HG2 GLN 47 HG2 GLN 47 3.518 -14.923 -10.427 1155 HG3 GLN 47 HG3 GLN 47 3.878 -15.544 -12.038 1156 HE21 GLN 47 HE21 GLN 47 5.016 -15.228 -8.768 1157 HE22 GLN 47 HE22 GLN 47 6.292 -16.391 -8.889 1158 H ASP 48 H ASP 48 1.377 -13.793 -12.076 1159 HA ASP 48 HA ASP 48 1.696 -15.198 -14.590 1160 HB2 ASP 48 HB2 ASP 48 -0.690 -15.098 -12.690 1161 HB3 ASP 48 HB3 ASP 48 -0.469 -16.243 -14.011 1162 H SER 49 H SER 49 -0.293 -12.528 -13.371 1163 HA SER 49 HA SER 49 -1.137 -11.806 -16.097 1164 HB2 SER 49 HB2 SER 49 -3.111 -12.325 -13.818 1165 HB3 SER 49 HB3 SER 49 -3.531 -11.646 -15.390 1166 HG SER 49 HG SER 49 -2.324 -13.809 -16.028 1167 H ASP 50 H ASP 50 -2.374 -9.629 -16.025 1168 HA ASP 50 HA ASP 50 -0.845 -7.763 -14.467 1169 HB2 ASP 50 HB2 ASP 50 -2.170 -5.997 -15.590 1170 HB3 ASP 50 HB3 ASP 50 -1.535 -7.152 -16.746 1171 H LYS 51 H LYS 51 -1.327 -8.541 -12.365 1172 HA LYS 51 HA LYS 51 -3.813 -7.488 -11.191 1173 HB2 LYS 51 HB2 LYS 51 -2.691 -10.292 -10.724 1174 HB3 LYS 51 HB3 LYS 51 -3.947 -9.557 -9.730 1175 HG2 LYS 51 HG2 LYS 51 -5.473 -9.505 -11.647 1176 HG3 LYS 51 HG3 LYS 51 -4.203 -10.150 -12.697 1177 HD2 LYS 51 HD2 LYS 51 -4.145 -12.228 -11.320 1178 HD3 LYS 51 HD3 LYS 51 -5.443 -11.586 -10.310 1179 HE2 LYS 51 HE2 LYS 51 -6.955 -11.564 -12.256 1180 HE3 LYS 51 HE3 LYS 51 -5.653 -12.163 -13.287 1181 HZ1 LYS 51 HZ1 LYS 51 -5.590 -14.188 -11.985 1182 HZ2 LYS 51 HZ2 LYS 51 -7.143 -13.935 -12.591 1183 HZ3 LYS 51 HZ3 LYS 51 -6.807 -13.617 -10.967 1184 H SER 52 H SER 52 -3.609 -7.441 -8.819 1185 HA SER 52 HA SER 52 -0.935 -6.930 -7.759 1186 HB2 SER 52 HB2 SER 52 -1.595 -4.818 -8.932 1187 HB3 SER 52 HB3 SER 52 -3.110 -4.781 -8.028 1188 HG SER 52 HG SER 52 -0.491 -4.301 -7.166 1189 H HIS 53 H HIS 53 -1.111 -8.140 -5.926 1190 HA HIS 53 HA HIS 53 -3.755 -8.428 -4.618 1191 HB2 HIS 53 HB2 HIS 53 -2.409 -10.451 -5.468 1192 HB3 HIS 53 HB3 HIS 53 -1.239 -10.120 -4.202 1193 HD1 HIS 53 HD1 HIS 53 -3.647 -12.456 -4.812 1194 HD2 HIS 53 HD2 HIS 53 -3.052 -9.931 -1.572 1195 HE1 HIS 53 HE1 HIS 53 -4.726 -13.597 -2.859 1196 HE2 HIS 53 HE2 HIS 53 -4.133 -12.165 -0.897 1197 H ILE 54 H ILE 54 -3.940 -6.800 -3.158 1198 HA ILE 54 HA ILE 54 -1.662 -6.001 -1.492 1199 HB ILE 54 HB ILE 54 -4.394 -4.634 -1.625 1200 HG12 ILE 54 HG12 ILE 54 -3.006 -2.822 -2.969 1201 HG13 ILE 54 HG13 ILE 54 -1.924 -4.158 -3.339 1202 HG21 ILE 54 HG21 ILE 54 -1.700 -3.687 -0.594 1203 HG22 ILE 54 HG22 ILE 54 -3.080 -4.173 0.396 1204 HG23 ILE 54 HG23 ILE 54 -3.185 -2.732 -0.616 1205 HD11 ILE 54 HD11 ILE 54 -4.843 -3.979 -4.037 1206 HD12 ILE 54 HD12 ILE 54 -3.777 -5.337 -4.406 1207 HD13 ILE 54 HD13 ILE 54 -3.476 -3.758 -5.131 1208 H TRP 55 H TRP 55 -1.481 -7.014 0.470 1209 HA TRP 55 HA TRP 55 -3.814 -8.020 1.936 1210 HB2 TRP 55 HB2 TRP 55 -0.827 -8.072 2.609 1211 HB3 TRP 55 HB3 TRP 55 -2.082 -8.802 3.605 1212 HD1 TRP 55 HD1 TRP 55 -3.119 -11.127 2.745 1213 HE1 TRP 55 HE1 TRP 55 -2.394 -12.843 1.020 1214 HE3 TRP 55 HE3 TRP 55 0.349 -8.347 0.328 1215 HZ2 TRP 55 HZ2 TRP 55 -0.586 -13.017 -1.117 1216 HZ3 TRP 55 HZ3 TRP 55 1.533 -9.342 -1.557 1217 HH2 TRP 55 HH2 TRP 55 1.084 -11.637 -2.277 1218 H LEU 56 H LEU 56 -4.957 -6.557 3.154 1219 HA LEU 56 HA LEU 56 -3.611 -4.156 4.247 1220 HB2 LEU 56 HB2 LEU 56 -6.570 -4.743 3.821 1221 HB3 LEU 56 HB3 LEU 56 -5.973 -3.318 4.652 1222 HG LEU 56 HG LEU 56 -6.547 -2.611 2.460 1223 HD11 LEU 56 HD11 LEU 56 -4.469 -1.784 1.509 1224 HD12 LEU 56 HD12 LEU 56 -3.542 -2.924 2.488 1225 HD13 LEU 56 HD13 LEU 56 -4.476 -1.642 3.267 1226 HD21 LEU 56 HD21 LEU 56 -5.744 -3.645 0.378 1227 HD22 LEU 56 HD22 LEU 56 -6.710 -4.760 1.341 1228 HD23 LEU 56 HD23 LEU 56 -4.952 -4.918 1.313 1229 H LEU 57 H LEU 57 -2.893 -4.492 6.238 1230 HA LEU 57 HA LEU 57 -4.260 -6.179 8.180 1231 HB2 LEU 57 HB2 LEU 57 -1.608 -4.695 8.217 1232 HB3 LEU 57 HB3 LEU 57 -2.271 -5.458 9.652 1233 HG LEU 57 HG LEU 57 -2.206 -7.672 8.454 1234 HD11 LEU 57 HD11 LEU 57 -0.858 -7.958 6.445 1235 HD12 LEU 57 HD12 LEU 57 -0.662 -6.204 6.309 1236 HD13 LEU 57 HD13 LEU 57 -2.264 -6.936 6.144 1237 HD21 LEU 57 HD21 LEU 57 0.215 -8.001 8.695 1238 HD22 LEU 57 HD22 LEU 57 -0.458 -7.062 10.027 1239 HD23 LEU 57 HD23 LEU 57 0.450 -6.249 8.748 1240 H VAL 58 H VAL 58 -5.995 -5.200 9.025 1241 HA VAL 58 HA VAL 58 -5.662 -2.654 10.509 1242 HB VAL 58 HB VAL 58 -6.829 -2.182 8.305 1243 HG11 VAL 58 HG11 VAL 58 -8.003 -4.273 7.960 1244 HG12 VAL 58 HG12 VAL 58 -9.132 -2.916 7.911 1245 HG13 VAL 58 HG13 VAL 58 -9.047 -3.944 9.347 1246 HG21 VAL 58 HG21 VAL 58 -8.560 -1.716 10.759 1247 HG22 VAL 58 HG22 VAL 58 -8.672 -0.826 9.236 1248 HG23 VAL 58 HG23 VAL 58 -7.217 -0.696 10.227 1249 H ASN 59 H ASN 59 -7.097 -2.605 12.432 1250 HA ASN 59 HA ASN 59 -7.595 -5.244 13.441 1251 HB2 ASN 59 HB2 ASN 59 -8.353 -4.269 15.498 1252 HB3 ASN 59 HB3 ASN 59 -6.900 -3.436 14.984 1253 HD21 ASN 59 HD21 ASN 59 -8.883 -2.535 16.841 1254 HD22 ASN 59 HD22 ASN 59 -9.536 -1.063 16.219 1255 H ASP 60 H ASP 60 -9.390 -6.386 13.565 1256 HA ASP 60 HA ASP 60 -11.523 -5.968 11.818 1257 HB2 ASP 60 HB2 ASP 60 -10.757 -8.198 12.639 1258 HB3 ASP 60 HB3 ASP 60 -11.392 -7.824 14.228 1259 H ASP 61 H ASP 61 -13.541 -5.166 12.065 1260 HA ASP 61 HA ASP 61 -14.554 -4.264 14.659 1261 HB2 ASP 61 HB2 ASP 61 -13.265 -2.355 13.773 1262 HB3 ASP 61 HB3 ASP 61 -14.081 -2.473 12.223 1263 H GLN 62 H GLN 62 -16.877 -3.943 14.588 1264 HA GLN 62 HA GLN 62 -18.254 -5.906 13.091 1265 HB2 GLN 62 HB2 GLN 62 -19.334 -3.547 14.699 1266 HB3 GLN 62 HB3 GLN 62 -20.330 -4.865 14.084 1267 HG2 GLN 62 HG2 GLN 62 -19.147 -6.475 15.488 1268 HG3 GLN 62 HG3 GLN 62 -18.034 -5.224 16.035 1269 HE21 GLN 62 HE21 GLN 62 -18.736 -3.711 17.555 1270 HE22 GLN 62 HE22 GLN 62 -20.192 -3.911 18.467 1271 H ARG 63 H ARG 63 -17.896 -2.457 12.664 1272 HA ARG 63 HA ARG 63 -19.776 -2.217 10.463 1273 HB2 ARG 63 HB2 ARG 63 -19.491 -0.388 12.113 1274 HB3 ARG 63 HB3 ARG 63 -17.804 -0.209 11.649 1275 HG2 ARG 63 HG2 ARG 63 -19.108 1.557 10.630 1276 HG3 ARG 63 HG3 ARG 63 -18.528 0.473 9.366 1277 HD2 ARG 63 HD2 ARG 63 -20.770 -0.613 9.298 1278 HD3 ARG 63 HD3 ARG 63 -21.338 0.513 10.541 1279 HE ARG 63 HE ARG 63 -20.250 1.636 8.062 1280 HH11 ARG 63 HH11 ARG 63 -23.154 0.858 9.905 1281 HH12 ARG 63 HH12 ARG 63 -24.170 1.914 8.972 1282 HH21 ARG 63 HH21 ARG 63 -21.575 3.020 6.852 1283 HH22 ARG 63 HH22 ARG 63 -23.265 3.147 7.232 1284 H LEU 64 H LEU 64 -16.347 -2.763 10.910 1285 HA LEU 64 HA LEU 64 -15.125 -1.851 8.605 1286 HB2 LEU 64 HB2 LEU 64 -14.039 -2.947 10.597 1287 HB3 LEU 64 HB3 LEU 64 -14.570 -4.499 9.983 1288 HG LEU 64 HG LEU 64 -13.142 -3.943 7.869 1289 HD11 LEU 64 HD11 LEU 64 -11.276 -2.423 8.180 1290 HD12 LEU 64 HD12 LEU 64 -11.869 -1.968 9.780 1291 HD13 LEU 64 HD13 LEU 64 -12.801 -1.547 8.334 1292 HD21 LEU 64 HD21 LEU 64 -12.519 -5.672 9.479 1293 HD22 LEU 64 HD22 LEU 64 -11.753 -4.460 10.512 1294 HD23 LEU 64 HD23 LEU 64 -11.097 -4.798 8.907 1295 H GLU 65 H GLU 65 -17.129 -4.754 8.988 1296 HA GLU 65 HA GLU 65 -16.537 -6.160 6.635 1297 HB2 GLU 65 HB2 GLU 65 -19.179 -6.040 8.138 1298 HB3 GLU 65 HB3 GLU 65 -18.740 -7.266 6.949 1299 HG2 GLU 65 HG2 GLU 65 -16.865 -7.963 8.436 1300 HG3 GLU 65 HG3 GLU 65 -17.417 -6.800 9.636 1301 H GLN 66 H GLN 66 -18.612 -3.411 7.168 1302 HA GLN 66 HA GLN 66 -20.053 -3.535 4.690 1303 HB2 GLN 66 HB2 GLN 66 -19.640 -1.185 6.595 1304 HB3 GLN 66 HB3 GLN 66 -20.831 -1.260 5.301 1305 HG2 GLN 66 HG2 GLN 66 -20.762 -2.955 7.811 1306 HG3 GLN 66 HG3 GLN 66 -21.914 -1.679 7.426 1307 HE21 GLN 66 HE21 GLN 66 -23.497 -2.082 5.818 1308 HE22 GLN 66 HE22 GLN 66 -23.952 -3.689 5.384 1309 H MET 67 H MET 67 -17.042 -2.014 5.763 1310 HA MET 67 HA MET 67 -16.537 -0.511 3.378 1311 HB2 MET 67 HB2 MET 67 -14.642 -1.519 5.541 1312 HB3 MET 67 HB3 MET 67 -14.126 -0.495 4.204 1313 HG2 MET 67 HG2 MET 67 -14.455 0.843 6.192 1314 HG3 MET 67 HG3 MET 67 -15.668 1.271 4.981 1315 HE1 MET 67 HE1 MET 67 -17.221 2.492 6.673 1316 HE2 MET 67 HE2 MET 67 -16.028 2.222 7.948 1317 HE3 MET 67 HE3 MET 67 -17.723 1.818 8.222 1318 H ILE 68 H ILE 68 -15.666 -3.739 4.507 1319 HA ILE 68 HA ILE 68 -14.076 -4.638 2.359 1320 HB ILE 68 HB ILE 68 -15.915 -6.216 4.223 1321 HG12 ILE 68 HG12 ILE 68 -12.914 -5.705 4.463 1322 HG13 ILE 68 HG13 ILE 68 -14.154 -4.846 5.370 1323 HG21 ILE 68 HG21 ILE 68 -13.627 -7.270 2.520 1324 HG22 ILE 68 HG22 ILE 68 -15.343 -7.588 2.262 1325 HG23 ILE 68 HG23 ILE 68 -14.540 -8.206 3.706 1326 HD11 ILE 68 HD11 ILE 68 -13.542 -7.790 5.546 1327 HD12 ILE 68 HD12 ILE 68 -14.835 -6.959 6.416 1328 HD13 ILE 68 HD13 ILE 68 -13.152 -6.545 6.732 1329 H SER 69 H SER 69 -17.578 -4.751 2.933 1330 HA SER 69 HA SER 69 -18.297 -6.207 0.594 1331 HB2 SER 69 HB2 SER 69 -19.722 -6.125 2.639 1332 HB3 SER 69 HB3 SER 69 -20.040 -4.415 2.352 1333 HG SER 69 HG SER 69 -20.616 -6.444 0.454 1334 H GLN 70 H GLN 70 -18.010 -2.765 1.378 1335 HA GLN 70 HA GLN 70 -19.308 -1.678 -0.885 1336 HB2 GLN 70 HB2 GLN 70 -18.651 -0.490 1.304 1337 HB3 GLN 70 HB3 GLN 70 -17.019 -0.381 0.669 1338 HG2 GLN 70 HG2 GLN 70 -19.457 0.861 -0.651 1339 HG3 GLN 70 HG3 GLN 70 -18.405 1.708 0.467 1340 HE21 GLN 70 HE21 GLN 70 -15.916 0.619 -0.649 1341 HE22 GLN 70 HE22 GLN 70 -15.693 1.425 -2.157 1342 H ILE 71 H ILE 71 -15.855 -2.247 -0.169 1343 HA ILE 71 HA ILE 71 -14.894 -1.268 -2.643 1344 HB ILE 71 HB ILE 71 -13.523 -1.323 -0.562 1345 HG12 ILE 71 HG12 ILE 71 -12.349 -2.693 -3.018 1346 HG13 ILE 71 HG13 ILE 71 -12.408 -0.964 -2.698 1347 HG21 ILE 71 HG21 ILE 71 -14.141 -3.564 0.268 1348 HG22 ILE 71 HG22 ILE 71 -12.391 -3.369 0.175 1349 HG23 ILE 71 HG23 ILE 71 -13.241 -4.307 -1.058 1350 HD11 ILE 71 HD11 ILE 71 -10.768 -3.011 -1.230 1351 HD12 ILE 71 HD12 ILE 71 -10.866 -1.295 -0.815 1352 HD13 ILE 71 HD13 ILE 71 -10.198 -1.790 -2.369 1353 H ASP 72 H ASP 72 -15.929 -4.447 -1.572 1354 HA ASP 72 HA ASP 72 -14.851 -6.051 -3.598 1355 HB2 ASP 72 HB2 ASP 72 -15.815 -7.051 -1.603 1356 HB3 ASP 72 HB3 ASP 72 -17.397 -6.356 -1.949 1357 H LYS 73 H LYS 73 -17.608 -3.861 -3.629 1358 HA LYS 73 HA LYS 73 -18.872 -4.935 -5.971 1359 HB2 LYS 73 HB2 LYS 73 -19.197 -2.154 -4.782 1360 HB3 LYS 73 HB3 LYS 73 -20.284 -2.933 -5.921 1361 HG2 LYS 73 HG2 LYS 73 -19.832 -3.660 -3.014 1362 HG3 LYS 73 HG3 LYS 73 -21.269 -2.940 -3.723 1363 HD2 LYS 73 HD2 LYS 73 -22.052 -5.099 -3.637 1364 HD3 LYS 73 HD3 LYS 73 -21.194 -5.257 -5.168 1365 HE2 LYS 73 HE2 LYS 73 -19.235 -6.174 -3.938 1366 HE3 LYS 73 HE3 LYS 73 -20.129 -6.025 -2.430 1367 HZ1 LYS 73 HZ1 LYS 73 -21.705 -7.636 -3.201 1368 HZ2 LYS 73 HZ2 LYS 73 -20.149 -8.280 -3.345 1369 HZ3 LYS 73 HZ3 LYS 73 -20.967 -7.729 -4.714 1370 H LEU 74 H LEU 74 -16.085 -3.024 -5.548 1371 HA LEU 74 HA LEU 74 -16.162 -1.498 -7.983 1372 HB2 LEU 74 HB2 LEU 74 -14.032 -2.092 -5.915 1373 HB3 LEU 74 HB3 LEU 74 -13.571 -1.360 -7.435 1374 HG LEU 74 HG LEU 74 -13.810 0.335 -5.679 1375 HD11 LEU 74 HD11 LEU 74 -15.264 1.920 -6.855 1376 HD12 LEU 74 HD12 LEU 74 -15.955 0.602 -7.806 1377 HD13 LEU 74 HD13 LEU 74 -14.247 1.017 -7.976 1378 HD21 LEU 74 HD21 LEU 74 -16.734 -0.464 -5.500 1379 HD22 LEU 74 HD22 LEU 74 -15.971 0.895 -4.665 1380 HD23 LEU 74 HD23 LEU 74 -15.499 -0.757 -4.275 1381 H GLU 75 H GLU 75 -14.944 -1.835 -9.855 1382 HA GLU 75 HA GLU 75 -15.102 -4.547 -10.808 1383 HB2 GLU 75 HB2 GLU 75 -14.225 -2.009 -12.238 1384 HB3 GLU 75 HB3 GLU 75 -14.602 -3.546 -13.021 1385 HG2 GLU 75 HG2 GLU 75 -16.938 -3.380 -12.246 1386 HG3 GLU 75 HG3 GLU 75 -16.565 -1.867 -11.422 1387 H ASP 76 H ASP 76 -12.520 -2.504 -9.732 1388 HA ASP 76 HA ASP 76 -10.358 -3.907 -10.967 1389 HB2 ASP 76 HB2 ASP 76 -8.943 -2.776 -9.185 1390 HB3 ASP 76 HB3 ASP 76 -9.880 -1.709 -10.214 1391 H VAL 77 H VAL 77 -11.968 -4.153 -7.805 1392 HA VAL 77 HA VAL 77 -10.335 -6.142 -6.672 1393 HB VAL 77 HB VAL 77 -13.253 -5.422 -6.128 1394 HG11 VAL 77 HG11 VAL 77 -13.050 -6.657 -3.987 1395 HG12 VAL 77 HG12 VAL 77 -11.453 -7.238 -4.470 1396 HG13 VAL 77 HG13 VAL 77 -12.884 -7.743 -5.370 1397 HG21 VAL 77 HG21 VAL 77 -12.339 -4.258 -4.165 1398 HG22 VAL 77 HG22 VAL 77 -11.602 -3.643 -5.649 1399 HG23 VAL 77 HG23 VAL 77 -10.703 -4.759 -4.611 1400 H VAL 78 H VAL 78 -9.889 -7.706 -8.139 1401 HA VAL 78 HA VAL 78 -11.784 -9.334 -9.521 1402 HB VAL 78 HB VAL 78 -8.948 -10.196 -8.786 1403 HG11 VAL 78 HG11 VAL 78 -10.684 -10.862 -11.196 1404 HG12 VAL 78 HG12 VAL 78 -10.323 -11.932 -9.837 1405 HG13 VAL 78 HG13 VAL 78 -9.031 -11.426 -10.926 1406 HG21 VAL 78 HG21 VAL 78 -8.745 -7.933 -9.694 1407 HG22 VAL 78 HG22 VAL 78 -9.704 -8.382 -11.110 1408 HG23 VAL 78 HG23 VAL 78 -8.116 -9.113 -10.845 1409 H LYS 79 H LYS 79 -10.090 -9.528 -6.406 1410 HA LYS 79 HA LYS 79 -12.023 -11.493 -5.416 1411 HB2 LYS 79 HB2 LYS 79 -9.005 -11.907 -5.288 1412 HB3 LYS 79 HB3 LYS 79 -10.118 -12.721 -4.192 1413 HG2 LYS 79 HG2 LYS 79 -11.253 -13.733 -6.185 1414 HG3 LYS 79 HG3 LYS 79 -9.997 -13.025 -7.206 1415 HD2 LYS 79 HD2 LYS 79 -8.273 -14.334 -5.986 1416 HD3 LYS 79 HD3 LYS 79 -9.525 -15.025 -4.947 1417 HE2 LYS 79 HE2 LYS 79 -10.560 -16.099 -6.917 1418 HE3 LYS 79 HE3 LYS 79 -9.318 -15.396 -7.956 1419 HZ1 LYS 79 HZ1 LYS 79 -8.773 -17.655 -7.443 1420 HZ2 LYS 79 HZ2 LYS 79 -8.886 -17.369 -5.788 1421 HZ3 LYS 79 HZ3 LYS 79 -7.654 -16.644 -6.684 1422 H VAL 80 H VAL 80 -12.496 -11.272 -3.283 1423 HA VAL 80 HA VAL 80 -10.854 -9.492 -1.577 1424 HB VAL 80 HB VAL 80 -13.018 -8.362 -2.069 1425 HG11 VAL 80 HG11 VAL 80 -15.177 -9.270 -1.308 1426 HG12 VAL 80 HG12 VAL 80 -14.386 -10.776 -0.838 1427 HG13 VAL 80 HG13 VAL 80 -14.441 -10.303 -2.539 1428 HG21 VAL 80 HG21 VAL 80 -11.972 -7.995 0.123 1429 HG22 VAL 80 HG22 VAL 80 -12.862 -9.360 0.799 1430 HG23 VAL 80 HG23 VAL 80 -13.730 -7.922 0.255 1431 H GLN 81 H GLN 81 -10.119 -10.553 0.248 1432 HA GLN 81 HA GLN 81 -11.584 -12.928 1.238 1433 HB2 GLN 81 HB2 GLN 81 -8.601 -12.954 0.608 1434 HB3 GLN 81 HB3 GLN 81 -9.430 -14.209 1.522 1435 HG2 GLN 81 HG2 GLN 81 -10.802 -14.749 -0.455 1436 HG3 GLN 81 HG3 GLN 81 -10.005 -13.463 -1.362 1437 HE21 GLN 81 HE21 GLN 81 -9.181 -14.794 -2.933 1438 HE22 GLN 81 HE22 GLN 81 -7.923 -15.936 -2.643 1439 H ARG 82 H ARG 82 -11.533 -13.205 3.393 1440 HA ARG 82 HA ARG 82 -10.271 -11.095 5.041 1441 HB2 ARG 82 HB2 ARG 82 -12.833 -12.685 5.489 1442 HB3 ARG 82 HB3 ARG 82 -12.170 -11.503 6.616 1443 HG2 ARG 82 HG2 ARG 82 -12.566 -9.689 5.082 1444 HG3 ARG 82 HG3 ARG 82 -12.974 -10.804 3.774 1445 HD2 ARG 82 HD2 ARG 82 -14.966 -9.721 4.786 1446 HD3 ARG 82 HD3 ARG 82 -15.000 -11.483 4.912 1447 HE ARG 82 HE ARG 82 -13.865 -10.458 7.267 1448 HH11 ARG 82 HH11 ARG 82 -17.004 -10.467 5.666 1449 HH12 ARG 82 HH12 ARG 82 -17.881 -10.348 7.151 1450 HH21 ARG 82 HH21 ARG 82 -15.037 -10.366 9.198 1451 HH22 ARG 82 HH22 ARG 82 -16.771 -10.291 9.154 1452 H ASN 83 H ASN 83 -8.458 -12.012 5.725 1453 HA ASN 83 HA ASN 83 -8.423 -14.763 6.818 1454 HB2 ASN 83 HB2 ASN 83 -6.209 -13.175 5.433 1455 HB3 ASN 83 HB3 ASN 83 -5.949 -14.721 6.242 1456 HD21 ASN 83 HD21 ASN 83 -5.463 -14.162 3.491 1457 HD22 ASN 83 HD22 ASN 83 -6.497 -15.188 2.566 1458 H GLN 84 H GLN 84 -7.017 -15.138 8.640 1459 HA GLN 84 HA GLN 84 -7.021 -12.937 10.578 1460 HB2 GLN 84 HB2 GLN 84 -6.242 -15.882 10.892 1461 HB3 GLN 84 HB3 GLN 84 -6.381 -14.713 12.207 1462 HG2 GLN 84 HG2 GLN 84 -8.778 -14.456 11.755 1463 HG3 GLN 84 HG3 GLN 84 -8.662 -15.589 10.410 1464 HE21 GLN 84 HE21 GLN 84 -10.285 -15.717 12.863 1465 HE22 GLN 84 HE22 GLN 84 -9.877 -17.222 13.605 1466 H SER 85 H SER 85 -5.150 -12.081 11.542 1467 HA SER 85 HA SER 85 -2.832 -12.115 9.792 1468 HB2 SER 85 HB2 SER 85 -3.685 -9.956 10.497 1469 HB3 SER 85 HB3 SER 85 -3.481 -10.375 12.187 1470 HG SER 85 HG SER 85 -1.636 -9.402 11.890 1471 H ASP 86 H ASP 86 -0.706 -12.425 10.412 1472 HA ASP 86 HA ASP 86 -0.108 -13.828 12.914 1473 HB2 ASP 86 HB2 ASP 86 -0.776 -15.513 11.090 1474 HB3 ASP 86 HB3 ASP 86 0.633 -14.990 10.177 1475 HA PRO 87 HA PRO 87 3.564 -11.176 12.793 1476 HB2 PRO 87 HB2 PRO 87 4.920 -13.695 13.800 1477 HB3 PRO 87 HB3 PRO 87 5.061 -12.020 14.389 1478 HG2 PRO 87 HG2 PRO 87 3.534 -13.713 15.719 1479 HG3 PRO 87 HG3 PRO 87 2.959 -12.054 15.427 1480 HD2 PRO 87 HD2 PRO 87 2.134 -14.604 14.070 1481 HD3 PRO 87 HD3 PRO 87 1.151 -13.186 14.512 1482 H THR 88 H THR 88 3.816 -14.437 11.353 1483 HA THR 88 HA THR 88 6.264 -13.761 9.909 1484 HB THR 88 HB THR 88 6.239 -16.069 9.078 1485 HG1 THR 88 HG1 THR 88 3.652 -16.198 10.266 1486 HG21 THR 88 HG21 THR 88 7.114 -15.729 11.383 1487 HG22 THR 88 HG22 THR 88 6.351 -17.313 11.212 1488 HG23 THR 88 HG23 THR 88 5.493 -16.008 12.030 1489 H MET 89 H MET 89 3.131 -12.932 9.303 1490 HA MET 89 HA MET 89 2.361 -13.911 6.848 1491 HB2 MET 89 HB2 MET 89 0.882 -12.573 8.290 1492 HB3 MET 89 HB3 MET 89 1.830 -11.127 7.969 1493 HG2 MET 89 HG2 MET 89 -0.036 -10.873 6.585 1494 HG3 MET 89 HG3 MET 89 1.167 -11.511 5.473 1495 HE1 MET 89 HE1 MET 89 -0.213 -14.997 4.533 1496 HE2 MET 89 HE2 MET 89 1.231 -14.555 5.442 1497 HE3 MET 89 HE3 MET 89 0.766 -13.625 4.018 1498 H PHE 90 H PHE 90 3.845 -10.618 7.242 1499 HA PHE 90 HA PHE 90 4.096 -9.937 4.581 1500 HB2 PHE 90 HB2 PHE 90 5.841 -9.151 6.944 1501 HB3 PHE 90 HB3 PHE 90 6.092 -8.464 5.348 1502 HD1 PHE 90 HD1 PHE 90 3.875 -7.452 4.224 1503 HD2 PHE 90 HD2 PHE 90 4.501 -7.923 8.438 1504 HE1 PHE 90 HE1 PHE 90 2.257 -5.654 4.670 1505 HE2 PHE 90 HE2 PHE 90 2.874 -6.128 8.866 1506 HZ PHE 90 HZ PHE 90 1.757 -4.997 6.986 1507 H ASN 91 H ASN 91 6.392 -11.723 6.571 1508 HA ASN 91 HA ASN 91 8.551 -11.820 4.752 1509 HB2 ASN 91 HB2 ASN 91 8.732 -12.191 7.227 1510 HB3 ASN 91 HB3 ASN 91 7.873 -13.714 7.039 1511 HD21 ASN 91 HD21 ASN 91 10.873 -12.045 6.558 1512 HD22 ASN 91 HD22 ASN 91 11.823 -13.433 6.158 1513 H LYS 92 H LYS 92 5.869 -14.018 5.483 1514 HA LYS 92 HA LYS 92 6.660 -16.298 4.120 1515 HB2 LYS 92 HB2 LYS 92 4.858 -16.320 5.758 1516 HB3 LYS 92 HB3 LYS 92 3.860 -15.277 4.746 1517 HG2 LYS 92 HG2 LYS 92 3.710 -17.056 3.050 1518 HG3 LYS 92 HG3 LYS 92 4.736 -18.098 4.039 1519 HD2 LYS 92 HD2 LYS 92 3.029 -18.164 5.797 1520 HD3 LYS 92 HD3 LYS 92 2.018 -17.030 4.892 1521 HE2 LYS 92 HE2 LYS 92 1.261 -19.392 4.671 1522 HE3 LYS 92 HE3 LYS 92 1.686 -18.669 3.118 1523 HZ1 LYS 92 HZ1 LYS 92 2.545 -20.929 3.353 1524 HZ2 LYS 92 HZ2 LYS 92 3.440 -20.473 4.709 1525 HZ3 LYS 92 HZ3 LYS 92 3.807 -19.819 3.198 1526 H ILE 93 H ILE 93 4.382 -13.765 2.873 1527 HA ILE 93 HA ILE 93 4.229 -15.086 0.310 1528 HB ILE 93 HB ILE 93 2.757 -13.329 -0.470 1529 HG12 ILE 93 HG12 ILE 93 3.983 -11.446 0.944 1530 HG13 ILE 93 HG13 ILE 93 2.282 -11.296 0.561 1531 HG21 ILE 93 HG21 ILE 93 0.893 -13.628 1.139 1532 HG22 ILE 93 HG22 ILE 93 2.033 -14.258 2.331 1533 HG23 ILE 93 HG23 ILE 93 1.756 -15.135 0.824 1534 HD11 ILE 93 HD11 ILE 93 1.708 -12.042 2.811 1535 HD12 ILE 93 HD12 ILE 93 2.736 -10.612 2.810 1536 HD13 ILE 93 HD13 ILE 93 3.426 -12.186 3.187 1537 H ALA 94 H ALA 94 6.174 -12.549 1.665 1538 HA ALA 94 HA ALA 94 7.236 -11.461 -0.745 1539 HB1 ALA 94 HB1 ALA 94 8.496 -11.686 2.012 1540 HB2 ALA 94 HB2 ALA 94 7.492 -10.356 1.425 1541 HB3 ALA 94 HB3 ALA 94 9.069 -10.649 0.695 1542 H VAL 95 H VAL 95 8.088 -14.278 1.221 1543 HA VAL 95 HA VAL 95 10.378 -15.061 -0.366 1544 HB VAL 95 HB VAL 95 8.793 -16.595 1.749 1545 HG11 VAL 95 HG11 VAL 95 9.928 -18.209 0.285 1546 HG12 VAL 95 HG12 VAL 95 10.714 -18.164 1.865 1547 HG13 VAL 95 HG13 VAL 95 11.456 -17.346 0.486 1548 HG21 VAL 95 HG21 VAL 95 9.947 -14.608 2.637 1549 HG22 VAL 95 HG22 VAL 95 11.470 -15.168 1.951 1550 HG23 VAL 95 HG23 VAL 95 10.697 -16.086 3.248 1551 H PHE 96 H PHE 96 6.941 -15.633 -0.444 1552 HA PHE 96 HA PHE 96 7.057 -17.946 -2.173 1553 HB2 PHE 96 HB2 PHE 96 5.268 -17.584 -0.460 1554 HB3 PHE 96 HB3 PHE 96 4.692 -16.198 -1.378 1555 HD1 PHE 96 HD1 PHE 96 5.770 -19.568 -2.643 1556 HD2 PHE 96 HD2 PHE 96 2.496 -16.869 -2.031 1557 HE1 PHE 96 HE1 PHE 96 4.281 -21.086 -3.870 1558 HE2 PHE 96 HE2 PHE 96 1.018 -18.404 -3.269 1559 HZ PHE 96 HZ PHE 96 1.914 -20.504 -4.193 1560 H PHE 97 H PHE 97 6.510 -14.482 -2.493 1561 HA PHE 97 HA PHE 97 5.884 -13.105 -4.195 1562 HB2 PHE 97 HB2 PHE 97 7.802 -12.943 -5.914 1563 HB3 PHE 97 HB3 PHE 97 8.197 -12.746 -4.219 1564 HD1 PHE 97 HD2 PHE 97 8.140 -15.405 -6.893 1565 HD2 PHE 97 HD1 PHE 97 10.018 -13.936 -3.336 1566 HE1 PHE 97 HE2 PHE 97 9.868 -17.144 -7.086 1567 HE2 PHE 97 HE1 PHE 97 11.746 -15.679 -3.545 1568 HZ PHE 97 HZ PHE 97 11.667 -17.283 -5.411 1569 H GLN 98 H GLN 98 4.105 -15.013 -4.559 1570 HA GLN 98 HA GLN 98 4.120 -16.003 -7.303 1571 HB2 GLN 98 HB2 GLN 98 3.203 -17.382 -5.432 1572 HB3 GLN 98 HB3 GLN 98 1.943 -16.183 -5.177 1573 HG2 GLN 98 HG2 GLN 98 1.036 -18.084 -6.401 1574 HG3 GLN 98 HG3 GLN 98 1.042 -16.663 -7.446 1575 HE21 GLN 98 HE21 GLN 98 2.464 -16.602 -9.216 1576 HE22 GLN 98 HE22 GLN 98 3.269 -18.021 -9.794 Start of MODEL 15 1 H1 GLY 1 H1 GLY 1 0.049 0.393 -24.091 2 H2 GLY 1 H2 GLY 1 0.685 -0.902 -23.216 3 H3 GLY 1 H3 GLY 1 0.393 -1.071 -24.869 4 HA2 GLY 1 HA3 GLY 1 2.739 -0.785 -24.504 5 HA3 GLY 1 HA2 GLY 1 2.067 0.589 -25.371 6 H SER 2 H SER 2 2.419 -0.457 -21.964 7 HA SER 2 HA SER 2 3.038 2.255 -21.071 8 HB2 SER 2 HB2 SER 2 3.160 1.121 -18.796 9 HB3 SER 2 HB3 SER 2 1.613 0.914 -19.619 10 HG SER 2 HG SER 2 2.027 -1.117 -19.114 11 H MET 3 H MET 3 4.987 2.254 -19.364 12 HA MET 3 HA MET 3 7.412 2.040 -20.744 13 HB2 MET 3 HB2 MET 3 6.790 2.253 -17.782 14 HB3 MET 3 HB3 MET 3 8.444 2.230 -18.376 15 HG2 MET 3 HG2 MET 3 6.383 4.299 -19.166 16 HG3 MET 3 HG3 MET 3 7.586 4.502 -17.887 17 HE1 MET 3 HE1 MET 3 8.925 6.547 -18.749 18 HE2 MET 3 HE2 MET 3 7.590 6.751 -19.886 19 HE3 MET 3 HE3 MET 3 9.256 6.834 -20.457 20 H GLN 4 H GLN 4 8.769 0.385 -21.139 21 HA GLN 4 HA GLN 4 8.108 -2.308 -20.401 22 HB2 GLN 4 HB2 GLN 4 9.117 -1.823 -22.606 23 HB3 GLN 4 HB3 GLN 4 10.582 -1.228 -21.830 24 HG2 GLN 4 HG2 GLN 4 10.930 -3.528 -20.865 25 HG3 GLN 4 HG3 GLN 4 9.540 -4.084 -21.788 26 HE21 GLN 4 HE21 GLN 4 10.256 -2.471 -24.175 27 HE22 GLN 4 HE22 GLN 4 11.606 -3.281 -24.879 28 H ASN 5 H ASN 5 8.356 -2.741 -18.256 29 HA ASN 5 HA ASN 5 10.979 -2.284 -16.978 30 HB2 ASN 5 HB2 ASN 5 9.012 -1.519 -15.669 31 HB3 ASN 5 HB3 ASN 5 8.355 -3.156 -15.695 32 HD21 ASN 5 HD21 ASN 5 8.445 -3.487 -13.483 33 HD22 ASN 5 HD22 ASN 5 9.916 -3.589 -12.586 34 H THR 6 H THR 6 12.350 -3.927 -17.325 35 HA THR 6 HA THR 6 11.521 -6.708 -17.236 36 HB THR 6 HB THR 6 13.988 -7.182 -17.317 37 HG1 THR 6 HG1 THR 6 15.451 -5.519 -17.365 38 HG21 THR 6 HG21 THR 6 13.043 -5.168 -19.400 39 HG22 THR 6 HG22 THR 6 12.777 -6.913 -19.449 40 HG23 THR 6 HG23 THR 6 14.413 -6.269 -19.587 41 H THR 7 H THR 7 13.724 -4.683 -15.244 42 HA THR 7 HA THR 7 12.545 -5.311 -12.736 43 HB THR 7 HB THR 7 13.535 -7.538 -13.107 44 HG1 THR 7 HG1 THR 7 13.960 -6.085 -10.998 45 HG21 THR 7 HG21 THR 7 15.955 -7.916 -13.326 46 HG22 THR 7 HG22 THR 7 16.245 -6.175 -13.345 47 HG23 THR 7 HG23 THR 7 15.362 -6.936 -14.670 48 H HIS 8 H HIS 8 13.581 -3.001 -14.304 49 HA HIS 8 HA HIS 8 15.435 -1.808 -12.349 50 HB2 HIS 8 HB2 HIS 8 17.130 -1.176 -13.947 51 HB3 HIS 8 HB3 HIS 8 16.851 -2.899 -14.176 52 HD1 HIS 8 HD1 HIS 8 15.597 -3.605 -16.391 53 HD2 HIS 8 HD2 HIS 8 16.588 0.427 -16.201 54 HE1 HIS 8 HE1 HIS 8 15.237 -2.703 -18.710 55 HE2 HIS 8 HE2 HIS 8 16.044 -0.333 -18.605 56 H ASP 9 H ASP 9 13.010 -1.468 -14.790 57 HA ASP 9 HA ASP 9 13.270 1.382 -15.208 58 HB2 ASP 9 HB2 ASP 9 12.471 -0.010 -17.023 59 HB3 ASP 9 HB3 ASP 9 11.177 -0.655 -16.027 60 H ASN 10 H ASN 10 11.341 -0.726 -13.144 61 HA ASN 10 HA ASN 10 9.900 1.451 -11.891 62 HB2 ASN 10 HB2 ASN 10 9.192 -0.233 -10.224 63 HB3 ASN 10 HB3 ASN 10 8.931 -0.826 -11.859 64 HD21 ASN 10 HD21 ASN 10 9.097 -2.418 -9.490 65 HD22 ASN 10 HD22 ASN 10 10.444 -3.481 -9.689 66 H VAL 11 H VAL 11 10.245 1.924 -9.522 67 HA VAL 11 HA VAL 11 13.049 1.816 -8.628 68 HB VAL 11 HB VAL 11 13.033 4.233 -7.987 69 HG11 VAL 11 HG11 VAL 11 13.415 5.206 -10.221 70 HG12 VAL 11 HG12 VAL 11 12.620 3.817 -10.967 71 HG13 VAL 11 HG13 VAL 11 14.131 3.597 -10.082 72 HG21 VAL 11 HG21 VAL 11 11.354 5.800 -8.884 73 HG22 VAL 11 HG22 VAL 11 10.589 4.591 -7.852 74 HG23 VAL 11 HG23 VAL 11 10.463 4.455 -9.602 75 H ILE 12 H ILE 12 13.286 2.084 -6.359 76 HA ILE 12 HA ILE 12 10.894 1.353 -4.807 77 HB ILE 12 HB ILE 12 13.812 1.320 -3.930 78 HG12 ILE 12 HG12 ILE 12 13.344 -0.311 -5.804 79 HG13 ILE 12 HG13 ILE 12 13.954 -1.033 -4.327 80 HG21 ILE 12 HG21 ILE 12 11.368 0.064 -2.686 81 HG22 ILE 12 HG22 ILE 12 12.264 1.455 -2.065 82 HG23 ILE 12 HG23 ILE 12 13.024 -0.136 -2.113 83 HD11 ILE 12 HD11 ILE 12 11.084 -1.045 -5.249 84 HD12 ILE 12 HD12 ILE 12 11.699 -1.800 -3.775 85 HD13 ILE 12 HD13 ILE 12 12.224 -2.385 -5.353 86 H LEU 13 H LEU 13 9.917 3.394 -4.501 87 HA LEU 13 HA LEU 13 11.456 5.591 -3.303 88 HB2 LEU 13 HB2 LEU 13 8.513 5.479 -4.093 89 HB3 LEU 13 HB3 LEU 13 9.394 6.916 -3.578 90 HG LEU 13 HG LEU 13 9.874 5.340 -6.137 91 HD11 LEU 13 HD11 LEU 13 9.124 7.383 -7.271 92 HD12 LEU 13 HD12 LEU 13 8.727 8.106 -5.709 93 HD13 LEU 13 HD13 LEU 13 7.867 6.669 -6.269 94 HD21 LEU 13 HD21 LEU 13 11.500 7.106 -6.723 95 HD22 LEU 13 HD22 LEU 13 12.000 6.176 -5.316 96 HD23 LEU 13 HD23 LEU 13 11.329 7.794 -5.105 97 H GLU 14 H GLU 14 11.891 5.005 -1.159 98 HA GLU 14 HA GLU 14 9.679 3.970 0.449 99 HB2 GLU 14 HB2 GLU 14 11.271 3.715 2.301 100 HB3 GLU 14 HB3 GLU 14 11.754 2.857 0.856 101 HG2 GLU 14 HG2 GLU 14 13.507 4.424 0.398 102 HG3 GLU 14 HG3 GLU 14 12.935 5.516 1.658 103 H LEU 15 H LEU 15 8.263 5.413 0.961 104 HA LEU 15 HA LEU 15 9.043 7.997 2.129 105 HB2 LEU 15 HB2 LEU 15 6.248 6.894 1.623 106 HB3 LEU 15 HB3 LEU 15 6.670 8.540 2.084 107 HG LEU 15 HG LEU 15 7.191 7.193 -0.596 108 HD11 LEU 15 HD11 LEU 15 5.736 8.967 -1.465 109 HD12 LEU 15 HD12 LEU 15 5.500 9.579 0.177 110 HD13 LEU 15 HD13 LEU 15 4.911 7.973 -0.264 111 HD21 LEU 15 HD21 LEU 15 8.203 9.318 -1.337 112 HD22 LEU 15 HD22 LEU 15 9.144 8.556 -0.059 113 HD23 LEU 15 HD23 LEU 15 8.113 9.940 0.315 114 H THR 16 H THR 16 9.532 7.874 4.207 115 HA THR 16 HA THR 16 8.404 5.823 5.968 116 HB THR 16 HB THR 16 10.372 8.066 6.600 117 HG1 THR 16 HG1 THR 16 11.188 6.448 5.168 118 HG21 THR 16 HG21 THR 16 9.576 5.654 8.282 119 HG22 THR 16 HG22 THR 16 9.123 7.330 8.617 120 HG23 THR 16 HG23 THR 16 10.820 6.832 8.696 121 H VAL 17 H VAL 17 6.318 6.334 6.362 122 HA VAL 17 HA VAL 17 5.663 9.099 7.128 123 HB VAL 17 HB VAL 17 3.484 8.815 6.358 124 HG11 VAL 17 HG11 VAL 17 5.220 7.290 4.385 125 HG12 VAL 17 HG12 VAL 17 5.041 9.047 4.497 126 HG13 VAL 17 HG13 VAL 17 3.668 8.055 4.003 127 HG21 VAL 17 HG21 VAL 17 2.827 6.707 7.352 128 HG22 VAL 17 HG22 VAL 17 3.880 5.808 6.266 129 HG23 VAL 17 HG23 VAL 17 2.459 6.636 5.626 130 H ARG 18 H ARG 18 4.913 9.494 9.108 131 HA ARG 18 HA ARG 18 4.365 7.303 10.976 132 HB2 ARG 18 HB2 ARG 18 4.010 9.166 12.639 133 HB3 ARG 18 HB3 ARG 18 5.617 9.092 11.937 134 HG2 ARG 18 HG2 ARG 18 4.966 10.965 10.400 135 HG3 ARG 18 HG3 ARG 18 3.435 11.086 11.276 136 HD2 ARG 18 HD2 ARG 18 6.222 11.489 12.418 137 HD3 ARG 18 HD3 ARG 18 5.012 12.741 12.134 138 HE ARG 18 HE ARG 18 4.689 10.545 14.119 139 HH11 ARG 18 HH11 ARG 18 4.312 13.942 13.281 140 HH12 ARG 18 HH12 ARG 18 3.564 14.347 14.792 141 HH21 ARG 18 HH21 ARG 18 3.720 11.078 16.068 142 HH22 ARG 18 HH22 ARG 18 3.228 12.715 16.379 143 H ASN 19 H ASN 19 2.298 6.933 11.881 144 HA ASN 19 HA ASN 19 0.372 6.954 9.761 145 HB2 ASN 19 HB2 ASN 19 0.241 5.723 12.538 146 HB3 ASN 19 HB3 ASN 19 -0.982 5.489 11.294 147 HD21 ASN 19 HD21 ASN 19 -0.687 3.281 11.051 148 HD22 ASN 19 HD22 ASN 19 0.756 2.567 10.426 149 H HIS 20 H HIS 20 0.066 9.226 9.689 150 HA HIS 20 HA HIS 20 -1.742 10.595 11.478 151 HB2 HIS 20 HB2 HIS 20 -0.821 11.163 8.617 152 HB3 HIS 20 HB3 HIS 20 -1.843 12.254 9.528 153 HD1 HIS 20 HD1 HIS 20 -0.634 13.150 11.869 154 HD2 HIS 20 HD2 HIS 20 1.803 11.685 8.845 155 HE1 HIS 20 HE1 HIS 20 1.664 14.037 12.355 156 HE2 HIS 20 HE2 HIS 20 3.062 13.296 10.402 157 HA PRO 21 HA PRO 21 -5.817 9.313 9.904 158 HB2 PRO 21 HB2 PRO 21 -6.209 12.190 9.019 159 HB3 PRO 21 HB3 PRO 21 -7.302 11.132 9.938 160 HG2 PRO 21 HG2 PRO 21 -5.935 12.997 11.214 161 HG3 PRO 21 HG3 PRO 21 -6.099 11.376 11.933 162 HD2 PRO 21 HD2 PRO 21 -3.724 12.595 10.545 163 HD3 PRO 21 HD3 PRO 21 -3.775 11.508 11.954 164 H GLY 22 H GLY 22 -5.250 8.005 8.179 165 HA2 GLY 22 HA2 GLY 22 -5.415 7.226 6.047 166 HA3 GLY 22 HA3 GLY 22 -6.249 8.711 5.643 167 H VAL 23 H VAL 23 -2.873 7.764 6.469 168 HA VAL 23 HA VAL 23 -1.717 9.717 4.713 169 HB VAL 23 HB VAL 23 -0.234 7.266 5.745 170 HG11 VAL 23 HG11 VAL 23 1.719 8.789 5.623 171 HG12 VAL 23 HG12 VAL 23 0.684 10.065 4.989 172 HG13 VAL 23 HG13 VAL 23 0.945 8.587 4.053 173 HG21 VAL 23 HG21 VAL 23 0.402 8.546 7.738 174 HG22 VAL 23 HG22 VAL 23 -1.346 8.316 7.671 175 HG23 VAL 23 HG23 VAL 23 -0.647 9.877 7.238 176 H MET 24 H MET 24 -2.389 6.267 4.476 177 HA MET 24 HA MET 24 -1.027 5.688 2.102 178 HB2 MET 24 HB2 MET 24 -2.501 3.693 1.939 179 HB3 MET 24 HB3 MET 24 -1.798 3.896 3.534 180 HG2 MET 24 HG2 MET 24 -4.628 4.688 2.823 181 HG3 MET 24 HG3 MET 24 -4.178 3.146 3.543 182 HE1 MET 24 HE1 MET 24 -6.423 4.995 4.804 183 HE2 MET 24 HE2 MET 24 -5.989 4.941 6.513 184 HE3 MET 24 HE3 MET 24 -5.896 3.476 5.536 185 H THR 25 H THR 25 -4.115 7.262 2.626 186 HA THR 25 HA THR 25 -5.049 7.215 -0.065 187 HB THR 25 HB THR 25 -5.779 9.356 1.975 188 HG1 THR 25 HG1 THR 25 -7.276 7.842 2.833 189 HG21 THR 25 HG21 THR 25 -8.020 9.178 0.937 190 HG22 THR 25 HG22 THR 25 -7.430 7.920 -0.151 191 HG23 THR 25 HG23 THR 25 -6.804 9.568 -0.284 192 H HIS 26 H HIS 26 -2.829 9.271 1.704 193 HA HIS 26 HA HIS 26 -2.753 11.466 -0.151 194 HB2 HIS 26 HB2 HIS 26 -0.730 10.699 2.011 195 HB3 HIS 26 HB3 HIS 26 -0.802 12.247 1.174 196 HD1 HIS 26 HD1 HIS 26 -0.908 12.421 4.126 197 HD2 HIS 26 HD2 HIS 26 -4.361 11.862 1.887 198 HE1 HIS 26 HE1 HIS 26 -2.789 13.202 5.581 199 HE2 HIS 26 HE2 HIS 26 -4.827 13.064 4.118 200 H VAL 27 H VAL 27 -0.609 8.681 0.542 201 HA VAL 27 HA VAL 27 1.374 9.341 -1.375 202 HB VAL 27 HB VAL 27 2.368 7.165 -0.987 203 HG11 VAL 27 HG11 VAL 27 1.223 8.240 1.621 204 HG12 VAL 27 HG12 VAL 27 2.674 8.818 0.799 205 HG13 VAL 27 HG13 VAL 27 2.638 7.189 1.472 206 HG21 VAL 27 HG21 VAL 27 1.312 5.387 0.370 207 HG22 VAL 27 HG22 VAL 27 0.400 5.705 -1.106 208 HG23 VAL 27 HG23 VAL 27 -0.184 6.322 0.440 209 H CYS 28 H CYS 28 -1.557 7.332 -1.549 210 HA CYS 28 HA CYS 28 -1.076 6.250 -4.143 211 HB2 CYS 28 HB2 CYS 28 -3.409 5.548 -4.050 212 HB3 CYS 28 HB3 CYS 28 -2.652 5.266 -2.487 213 HG CYS 28 HG CYS 28 -4.455 8.093 -3.024 214 H GLY 29 H GLY 29 -2.609 9.204 -2.913 215 HA2 GLY 29 HA2 GLY 29 -3.846 10.206 -5.200 216 HA3 GLY 29 HA3 GLY 29 -3.136 11.185 -3.926 217 H LEU 30 H LEU 30 -0.477 10.869 -4.107 218 HA LEU 30 HA LEU 30 0.197 12.521 -6.323 219 HB2 LEU 30 HB2 LEU 30 1.867 11.127 -4.222 220 HB3 LEU 30 HB3 LEU 30 2.642 11.984 -5.541 221 HG LEU 30 HG LEU 30 2.615 13.452 -3.647 222 HD11 LEU 30 HD11 LEU 30 0.456 14.419 -5.547 223 HD12 LEU 30 HD12 LEU 30 2.198 14.540 -5.804 224 HD13 LEU 30 HD13 LEU 30 1.448 15.415 -4.476 225 HD21 LEU 30 HD21 LEU 30 0.593 14.174 -2.461 226 HD22 LEU 30 HD22 LEU 30 0.844 12.437 -2.310 227 HD23 LEU 30 HD23 LEU 30 -0.385 13.054 -3.418 228 H PHE 31 H PHE 31 0.592 9.075 -5.760 229 HA PHE 31 HA PHE 31 2.222 8.615 -8.115 230 HB2 PHE 31 HB2 PHE 31 0.980 6.796 -6.031 231 HB3 PHE 31 HB3 PHE 31 1.802 6.147 -7.453 232 HD1 PHE 31 HD1 PHE 31 2.494 8.887 -4.932 233 HD2 PHE 31 HD2 PHE 31 4.008 5.482 -7.035 234 HE1 PHE 31 HE1 PHE 31 4.670 9.183 -3.832 235 HE2 PHE 31 HE2 PHE 31 6.180 5.787 -5.922 236 HZ PHE 31 HZ PHE 31 6.516 7.633 -4.328 237 H ALA 32 H ALA 32 -1.205 8.610 -7.483 238 HA ALA 32 HA ALA 32 -1.966 7.246 -9.913 239 HB1 ALA 32 HB1 ALA 32 -3.458 7.304 -7.963 240 HB2 ALA 32 HB2 ALA 32 -4.245 8.009 -9.375 241 HB3 ALA 32 HB3 ALA 32 -3.602 9.056 -8.102 242 H ARG 33 H ARG 33 -0.978 10.531 -9.171 243 HA ARG 33 HA ARG 33 -2.511 11.661 -11.448 244 HB2 ARG 33 HB2 ARG 33 -2.308 13.826 -10.372 245 HB3 ARG 33 HB3 ARG 33 -2.914 12.659 -9.200 246 HG2 ARG 33 HG2 ARG 33 -0.628 12.466 -8.248 247 HG3 ARG 33 HG3 ARG 33 -0.065 13.691 -9.383 248 HD2 ARG 33 HD2 ARG 33 -2.160 14.087 -7.222 249 HD3 ARG 33 HD3 ARG 33 -0.483 14.638 -7.158 250 HE ARG 33 HE ARG 33 -1.802 15.661 -9.454 251 HH11 ARG 33 HH11 ARG 33 -1.561 16.167 -5.989 252 HH12 ARG 33 HH12 ARG 33 -1.996 17.844 -6.078 253 HH21 ARG 33 HH21 ARG 33 -2.405 17.842 -9.571 254 HH22 ARG 33 HH22 ARG 33 -2.476 18.796 -8.121 255 H ARG 34 H ARG 34 0.644 10.747 -10.601 256 HA ARG 34 HA ARG 34 2.176 12.677 -12.005 257 HB2 ARG 34 HB2 ARG 34 3.948 10.856 -12.047 258 HB3 ARG 34 HB3 ARG 34 3.370 11.306 -10.462 259 HG2 ARG 34 HG2 ARG 34 2.524 9.237 -10.023 260 HG3 ARG 34 HG3 ARG 34 1.932 9.004 -11.659 261 HD2 ARG 34 HD2 ARG 34 4.823 8.708 -10.811 262 HD3 ARG 34 HD3 ARG 34 3.681 7.377 -11.012 263 HE ARG 34 HE ARG 34 4.307 9.168 -13.272 264 HH11 ARG 34 HH11 ARG 34 4.335 5.951 -11.890 265 HH12 ARG 34 HH12 ARG 34 4.793 5.185 -13.372 266 HH21 ARG 34 HH21 ARG 34 4.941 8.155 -15.213 267 HH22 ARG 34 HH22 ARG 34 5.138 6.431 -15.255 268 H ALA 35 H ALA 35 0.965 9.448 -12.984 269 HA ALA 35 HA ALA 35 0.293 10.013 -15.612 270 HB1 ALA 35 HB1 ALA 35 3.070 8.766 -15.435 271 HB2 ALA 35 HB2 ALA 35 2.702 10.383 -16.033 272 HB3 ALA 35 HB3 ALA 35 2.119 8.970 -16.912 273 H PHE 36 H PHE 36 2.107 7.426 -13.947 274 HA PHE 36 HA PHE 36 0.136 5.412 -14.884 275 HB2 PHE 36 HB2 PHE 36 2.367 5.271 -15.995 276 HB3 PHE 36 HB3 PHE 36 3.142 5.137 -14.422 277 HD1 PHE 36 HD2 PHE 36 0.496 3.407 -16.477 278 HD2 PHE 36 HD1 PHE 36 3.711 2.975 -13.679 279 HE1 PHE 36 HE2 PHE 36 0.297 0.957 -16.613 280 HE2 PHE 36 HE1 PHE 36 3.501 0.527 -13.824 281 HZ PHE 36 HZ PHE 36 1.798 -0.483 -15.290 282 H ASN 37 H ASN 37 -0.214 3.605 -13.488 283 HA ASN 37 HA ASN 37 -0.615 4.240 -10.737 284 HB2 ASN 37 HB2 ASN 37 -0.890 1.562 -12.185 285 HB3 ASN 37 HB3 ASN 37 -1.537 1.920 -10.586 286 HD21 ASN 37 HD21 ASN 37 -2.862 1.111 -13.120 287 HD22 ASN 37 HD22 ASN 37 -4.083 2.298 -13.392 288 H VAL 38 H VAL 38 -0.012 2.509 -9.021 289 HA VAL 38 HA VAL 38 2.880 2.133 -8.960 290 HB VAL 38 HB VAL 38 0.807 1.365 -6.843 291 HG11 VAL 38 HG11 VAL 38 2.927 0.160 -6.565 292 HG12 VAL 38 HG12 VAL 38 2.728 1.350 -5.275 293 HG13 VAL 38 HG13 VAL 38 3.823 1.682 -6.620 294 HG21 VAL 38 HG21 VAL 38 2.476 3.898 -7.028 295 HG22 VAL 38 HG22 VAL 38 1.434 3.448 -5.674 296 HG23 VAL 38 HG23 VAL 38 0.729 3.787 -7.257 297 H GLU 39 H GLU 39 3.898 0.208 -9.175 298 HA GLU 39 HA GLU 39 2.571 -2.156 -10.171 299 HB2 GLU 39 HB2 GLU 39 4.794 -1.462 -10.995 300 HB3 GLU 39 HB3 GLU 39 5.465 -1.603 -9.373 301 HG2 GLU 39 HG2 GLU 39 4.869 -4.088 -9.487 302 HG3 GLU 39 HG3 GLU 39 4.533 -3.838 -11.199 303 H GLY 40 H GLY 40 4.503 -1.387 -7.235 304 HA2 GLY 40 HA2 GLY 40 3.136 -3.528 -5.709 305 HA3 GLY 40 HA3 GLY 40 4.888 -3.598 -5.863 306 H ILE 41 H ILE 41 3.290 -3.307 -3.435 307 HA ILE 41 HA ILE 41 4.379 -0.751 -2.384 308 HB ILE 41 HB ILE 41 1.603 -1.854 -1.680 309 HG12 ILE 41 HG12 ILE 41 2.287 0.625 -3.325 310 HG13 ILE 41 HG13 ILE 41 1.626 -0.870 -3.969 311 HG21 ILE 41 HG21 ILE 41 1.294 0.236 -0.390 312 HG22 ILE 41 HG22 ILE 41 2.940 0.731 -0.791 313 HG23 ILE 41 HG23 ILE 41 2.669 -0.691 0.217 314 HD11 ILE 41 HD11 ILE 41 0.229 1.004 -2.059 315 HD12 ILE 41 HD12 ILE 41 -0.429 -0.510 -2.687 316 HD13 ILE 41 HD13 ILE 41 -0.081 0.823 -3.786 317 H LEU 42 H LEU 42 5.339 -0.952 -0.373 318 HA LEU 42 HA LEU 42 4.687 -3.293 1.310 319 HB2 LEU 42 HB2 LEU 42 6.748 -3.898 0.120 320 HB3 LEU 42 HB3 LEU 42 7.507 -2.388 0.600 321 HG LEU 42 HG LEU 42 7.436 -3.133 2.995 322 HD11 LEU 42 HD11 LEU 42 5.530 -4.635 2.925 323 HD12 LEU 42 HD12 LEU 42 6.951 -5.460 3.563 324 HD13 LEU 42 HD13 LEU 42 6.425 -5.766 1.904 325 HD21 LEU 42 HD21 LEU 42 9.234 -4.788 2.833 326 HD22 LEU 42 HD22 LEU 42 9.453 -3.473 1.682 327 HD23 LEU 42 HD23 LEU 42 8.859 -5.040 1.125 328 H CYS 43 H CYS 43 3.518 -1.944 2.715 329 HA CYS 43 HA CYS 43 4.925 0.176 4.176 330 HB2 CYS 43 HB2 CYS 43 2.556 0.550 3.631 331 HB3 CYS 43 HB3 CYS 43 2.096 -0.916 4.493 332 HG CYS 43 HG CYS 43 2.443 0.032 6.992 333 H LEU 44 H LEU 44 6.375 -0.598 5.565 334 HA LEU 44 HA LEU 44 5.841 -2.992 7.219 335 HB2 LEU 44 HB2 LEU 44 7.903 -2.860 5.747 336 HB3 LEU 44 HB3 LEU 44 8.447 -1.512 6.722 337 HG LEU 44 HG LEU 44 8.393 -3.179 8.728 338 HD11 LEU 44 HD11 LEU 44 7.074 -4.943 7.636 339 HD12 LEU 44 HD12 LEU 44 8.645 -5.543 8.164 340 HD13 LEU 44 HD13 LEU 44 8.369 -5.186 6.454 341 HD21 LEU 44 HD21 LEU 44 10.416 -3.585 6.500 342 HD22 LEU 44 HD22 LEU 44 10.643 -4.018 8.197 343 HD23 LEU 44 HD23 LEU 44 10.470 -2.326 7.736 344 HA PRO 45 HA PRO 45 5.116 0.332 10.325 345 HB2 PRO 45 HB2 PRO 45 4.061 -1.317 12.278 346 HB3 PRO 45 HB3 PRO 45 3.117 -0.698 10.907 347 HG2 PRO 45 HG2 PRO 45 4.414 -3.388 11.232 348 HG3 PRO 45 HG3 PRO 45 2.800 -2.988 10.601 349 HD2 PRO 45 HD2 PRO 45 4.878 -3.550 8.951 350 HD3 PRO 45 HD3 PRO 45 3.618 -2.375 8.504 351 H ILE 46 H ILE 46 6.727 1.094 11.484 352 HA ILE 46 HA ILE 46 8.966 -0.509 12.355 353 HB ILE 46 HB ILE 46 8.398 2.476 12.619 354 HG12 ILE 46 HG12 ILE 46 8.582 1.819 10.269 355 HG13 ILE 46 HG13 ILE 46 10.023 2.716 10.724 356 HG21 ILE 46 HG21 ILE 46 10.805 2.763 13.096 357 HG22 ILE 46 HG22 ILE 46 11.009 1.010 13.129 358 HG23 ILE 46 HG23 ILE 46 10.000 1.804 14.340 359 HD11 ILE 46 HD11 ILE 46 9.801 -0.272 10.373 360 HD12 ILE 46 HD12 ILE 46 11.254 0.578 10.906 361 HD13 ILE 46 HD13 ILE 46 10.598 0.873 9.296 362 H GLN 47 H GLN 47 9.384 -1.191 14.383 363 HA GLN 47 HA GLN 47 7.308 -1.299 16.332 364 HB2 GLN 47 HB2 GLN 47 8.651 -3.245 16.207 365 HB3 GLN 47 HB3 GLN 47 10.152 -2.331 16.165 366 HG2 GLN 47 HG2 GLN 47 10.000 -1.836 18.529 367 HG3 GLN 47 HG3 GLN 47 8.399 -2.544 18.629 368 HE21 GLN 47 HE21 GLN 47 10.897 -3.196 20.080 369 HE22 GLN 47 HE22 GLN 47 11.168 -4.880 19.800 370 H ASP 48 H ASP 48 10.531 0.207 16.343 371 HA ASP 48 HA ASP 48 10.460 0.955 19.091 372 HB2 ASP 48 HB2 ASP 48 12.641 2.081 18.572 373 HB3 ASP 48 HB3 ASP 48 12.548 0.404 18.028 374 H SER 49 H SER 49 9.196 2.546 16.342 375 HA SER 49 HA SER 49 8.646 4.978 17.857 376 HB2 SER 49 HB2 SER 49 9.561 6.414 15.930 377 HB3 SER 49 HB3 SER 49 10.778 5.617 16.929 378 HG SER 49 HG SER 49 10.887 3.969 15.324 379 H ASP 50 H ASP 50 6.958 6.251 16.943 380 HA ASP 50 HA ASP 50 4.996 4.748 15.490 381 HB2 ASP 50 HB2 ASP 50 3.552 6.766 15.723 382 HB3 ASP 50 HB3 ASP 50 4.239 6.259 17.255 383 H LYS 51 H LYS 51 6.115 4.297 13.573 384 HA LYS 51 HA LYS 51 5.489 6.046 11.400 385 HB2 LYS 51 HB2 LYS 51 7.782 6.318 10.484 386 HB3 LYS 51 HB3 LYS 51 7.620 7.109 12.047 387 HG2 LYS 51 HG2 LYS 51 8.725 5.078 13.096 388 HG3 LYS 51 HG3 LYS 51 9.027 4.486 11.461 389 HD2 LYS 51 HD2 LYS 51 11.033 5.588 12.339 390 HD3 LYS 51 HD3 LYS 51 10.390 6.509 10.980 391 HE2 LYS 51 HE2 LYS 51 9.443 8.167 12.481 392 HE3 LYS 51 HE3 LYS 51 9.852 7.191 13.893 393 HZ1 LYS 51 HZ1 LYS 51 11.427 8.976 13.612 394 HZ2 LYS 51 HZ2 LYS 51 11.797 8.471 12.042 395 HZ3 LYS 51 HZ3 LYS 51 12.201 7.495 13.358 396 H SER 52 H SER 52 6.419 5.042 9.330 397 HA SER 52 HA SER 52 6.786 2.170 9.285 398 HB2 SER 52 HB2 SER 52 4.321 3.483 8.008 399 HB3 SER 52 HB3 SER 52 4.797 1.800 7.823 400 HG SER 52 HG SER 52 3.671 3.109 10.023 401 H HIS 53 H HIS 53 8.102 1.742 7.479 402 HA HIS 53 HA HIS 53 8.493 3.937 5.509 403 HB2 HIS 53 HB2 HIS 53 9.980 1.300 5.869 404 HB3 HIS 53 HB3 HIS 53 10.297 2.423 4.555 405 HD1 HIS 53 HD1 HIS 53 12.513 3.380 5.023 406 HD2 HIS 53 HD2 HIS 53 10.213 3.137 8.477 407 HE1 HIS 53 HE1 HIS 53 13.923 4.377 6.841 408 HE2 HIS 53 HE2 HIS 53 12.581 4.043 8.938 409 H ILE 54 H ILE 54 7.532 3.851 3.536 410 HA ILE 54 HA ILE 54 6.188 1.347 2.692 411 HB ILE 54 HB ILE 54 5.363 4.213 1.964 412 HG12 ILE 54 HG12 ILE 54 3.178 3.574 3.158 413 HG13 ILE 54 HG13 ILE 54 4.015 2.164 3.785 414 HG21 ILE 54 HG21 ILE 54 3.441 3.154 0.812 415 HG22 ILE 54 HG22 ILE 54 4.087 1.558 1.196 416 HG23 ILE 54 HG23 ILE 54 4.974 2.631 0.112 417 HD11 ILE 54 HD11 ILE 54 3.846 3.952 5.408 418 HD12 ILE 54 HD12 ILE 54 4.745 5.026 4.335 419 HD13 ILE 54 HD13 ILE 54 5.525 3.598 5.016 420 H TRP 55 H TRP 55 7.613 0.403 1.305 421 HA TRP 55 HA TRP 55 9.211 1.974 -0.566 422 HB2 TRP 55 HB2 TRP 55 9.022 -1.048 -0.099 423 HB3 TRP 55 HB3 TRP 55 10.121 -0.287 -1.243 424 HD1 TRP 55 HD1 TRP 55 12.346 0.862 -0.221 425 HE1 TRP 55 HE1 TRP 55 13.464 0.804 2.082 426 HE3 TRP 55 HE3 TRP 55 8.535 -1.154 2.410 427 HZ2 TRP 55 HZ2 TRP 55 12.807 -0.046 4.699 428 HZ3 TRP 55 HZ3 TRP 55 8.849 -1.573 4.775 429 HH2 TRP 55 HH2 TRP 55 10.932 -1.037 5.929 430 H LEU 56 H LEU 56 7.973 2.816 -2.104 431 HA LEU 56 HA LEU 56 5.791 1.361 -3.399 432 HB2 LEU 56 HB2 LEU 56 6.710 4.262 -3.479 433 HB3 LEU 56 HB3 LEU 56 5.423 3.653 -4.513 434 HG LEU 56 HG LEU 56 5.313 3.506 -1.471 435 HD11 LEU 56 HD11 LEU 56 3.793 5.419 -1.504 436 HD12 LEU 56 HD12 LEU 56 4.039 5.609 -3.244 437 HD13 LEU 56 HD13 LEU 56 5.382 5.864 -2.127 438 HD21 LEU 56 HD21 LEU 56 3.902 1.872 -2.615 439 HD22 LEU 56 HD22 LEU 56 3.156 3.151 -3.577 440 HD23 LEU 56 HD23 LEU 56 2.916 3.102 -1.829 441 H LEU 57 H LEU 57 6.288 0.160 -5.072 442 HA LEU 57 HA LEU 57 8.570 0.608 -6.823 443 HB2 LEU 57 HB2 LEU 57 6.494 -1.611 -6.622 444 HB3 LEU 57 HB3 LEU 57 7.635 -1.525 -7.953 445 HG LEU 57 HG LEU 57 9.522 -1.785 -6.353 446 HD11 LEU 57 HD11 LEU 57 9.100 -2.490 -4.026 447 HD12 LEU 57 HD12 LEU 57 7.386 -2.106 -4.234 448 HD13 LEU 57 HD13 LEU 57 8.603 -0.827 -4.341 449 HD21 LEU 57 HD21 LEU 57 9.158 -4.155 -5.870 450 HD22 LEU 57 HD22 LEU 57 8.586 -3.737 -7.483 451 HD23 LEU 57 HD23 LEU 57 7.428 -3.966 -6.169 452 H VAL 58 H VAL 58 8.231 2.155 -8.275 453 HA VAL 58 HA VAL 58 5.942 2.001 -10.123 454 HB VAL 58 HB VAL 58 5.414 3.640 -8.190 455 HG11 VAL 58 HG11 VAL 58 7.507 5.391 -9.509 456 HG12 VAL 58 HG12 VAL 58 7.615 4.662 -7.907 457 HG13 VAL 58 HG13 VAL 58 6.389 5.887 -8.232 458 HG21 VAL 58 HG21 VAL 58 5.375 4.751 -11.011 459 HG22 VAL 58 HG22 VAL 58 4.398 5.341 -9.663 460 HG23 VAL 58 HG23 VAL 58 4.153 3.706 -10.281 461 H ASN 59 H ASN 59 6.506 2.948 -12.215 462 HA ASN 59 HA ASN 59 9.371 3.225 -12.643 463 HB2 ASN 59 HB2 ASN 59 8.708 3.599 -15.088 464 HB3 ASN 59 HB3 ASN 59 8.312 2.040 -14.387 465 HD21 ASN 59 HD21 ASN 59 6.752 1.583 -15.877 466 HD22 ASN 59 HD22 ASN 59 5.229 2.398 -15.938 467 H ASP 60 H ASP 60 10.482 5.042 -12.574 468 HA ASP 60 HA ASP 60 9.614 7.449 -11.650 469 HB2 ASP 60 HB2 ASP 60 11.983 6.785 -11.593 470 HB3 ASP 60 HB3 ASP 60 12.087 6.950 -13.342 471 H ASP 61 H ASP 61 9.268 9.502 -12.531 472 HA ASP 61 HA ASP 61 8.513 9.677 -15.363 473 HB2 ASP 61 HB2 ASP 61 6.544 8.885 -13.946 474 HB3 ASP 61 HB3 ASP 61 6.624 10.401 -13.067 475 H GLN 62 H GLN 62 8.287 11.909 -16.053 476 HA GLN 62 HA GLN 62 10.199 13.696 -14.985 477 HB2 GLN 62 HB2 GLN 62 7.884 14.248 -16.895 478 HB3 GLN 62 HB3 GLN 62 9.242 15.341 -16.613 479 HG2 GLN 62 HG2 GLN 62 10.798 13.712 -17.545 480 HG3 GLN 62 HG3 GLN 62 9.504 12.528 -17.723 481 HE21 GLN 62 HE21 GLN 62 7.959 12.825 -19.365 482 HE22 GLN 62 HE22 GLN 62 8.246 13.874 -20.708 483 H ARG 63 H ARG 63 6.712 13.413 -14.552 484 HA ARG 63 HA ARG 63 6.425 15.835 -12.964 485 HB2 ARG 63 HB2 ARG 63 4.457 13.568 -13.538 486 HB3 ARG 63 HB3 ARG 63 4.059 15.034 -12.648 487 HG2 ARG 63 HG2 ARG 63 4.957 14.936 -15.543 488 HG3 ARG 63 HG3 ARG 63 3.289 15.103 -14.995 489 HD2 ARG 63 HD2 ARG 63 3.901 17.253 -13.889 490 HD3 ARG 63 HD3 ARG 63 5.544 17.089 -14.523 491 HE ARG 63 HE ARG 63 3.992 16.907 -16.745 492 HH11 ARG 63 HH11 ARG 63 4.234 19.344 -14.209 493 HH12 ARG 63 HH12 ARG 63 3.759 20.645 -15.255 494 HH21 ARG 63 HH21 ARG 63 3.329 18.606 -18.082 495 HH22 ARG 63 HH22 ARG 63 3.246 20.222 -17.456 496 H LEU 64 H LEU 64 7.008 12.428 -12.412 497 HA LEU 64 HA LEU 64 5.918 11.954 -9.915 498 HB2 LEU 64 HB2 LEU 64 6.921 10.199 -11.311 499 HB3 LEU 64 HB3 LEU 64 8.519 10.877 -11.049 500 HG LEU 64 HG LEU 64 8.186 10.345 -8.542 501 HD11 LEU 64 HD11 LEU 64 5.954 8.584 -9.561 502 HD12 LEU 64 HD12 LEU 64 5.743 10.041 -8.581 503 HD13 LEU 64 HD13 LEU 64 6.591 8.646 -7.916 504 HD21 LEU 64 HD21 LEU 64 9.660 9.030 -9.974 505 HD22 LEU 64 HD22 LEU 64 8.299 8.014 -10.460 506 HD23 LEU 64 HD23 LEU 64 8.847 8.016 -8.783 507 H GLU 65 H GLU 65 9.043 13.456 -10.695 508 HA GLU 65 HA GLU 65 10.118 13.526 -8.083 509 HB2 GLU 65 HB2 GLU 65 10.690 15.288 -10.496 510 HB3 GLU 65 HB3 GLU 65 11.685 15.225 -9.040 511 HG2 GLU 65 HG2 GLU 65 12.138 12.837 -9.456 512 HG3 GLU 65 HG3 GLU 65 11.152 12.904 -10.916 513 H GLN 66 H GLN 66 8.059 15.803 -9.832 514 HA GLN 66 HA GLN 66 8.091 17.872 -7.836 515 HB2 GLN 66 HB2 GLN 66 6.124 17.333 -10.104 516 HB3 GLN 66 HB3 GLN 66 6.011 18.723 -9.033 517 HG2 GLN 66 HG2 GLN 66 7.057 19.535 -10.980 518 HG3 GLN 66 HG3 GLN 66 8.353 19.361 -9.804 519 HE21 GLN 66 HE21 GLN 66 9.911 17.707 -10.121 520 HE22 GLN 66 HE22 GLN 66 10.107 16.937 -11.654 521 H MET 67 H MET 67 6.100 15.024 -8.473 522 HA MET 67 HA MET 67 4.071 15.479 -6.525 523 HB2 MET 67 HB2 MET 67 5.077 12.802 -7.607 524 HB3 MET 67 HB3 MET 67 3.540 13.079 -6.792 525 HG2 MET 67 HG2 MET 67 4.370 14.173 -9.484 526 HG3 MET 67 HG3 MET 67 3.207 12.879 -9.190 527 HE1 MET 67 HE1 MET 67 1.650 14.347 -10.904 528 HE2 MET 67 HE2 MET 67 2.816 15.674 -10.944 529 HE3 MET 67 HE3 MET 67 1.128 15.993 -10.548 530 H ILE 68 H ILE 68 7.197 13.925 -6.493 531 HA ILE 68 HA ILE 68 7.190 12.755 -3.911 532 HB ILE 68 HB ILE 68 9.321 13.428 -5.970 533 HG12 ILE 68 HG12 ILE 68 8.441 10.751 -4.802 534 HG13 ILE 68 HG13 ILE 68 7.828 11.442 -6.300 535 HG21 ILE 68 HG21 ILE 68 9.971 12.242 -3.262 536 HG22 ILE 68 HG22 ILE 68 10.495 13.813 -3.863 537 HG23 ILE 68 HG23 ILE 68 11.082 12.336 -4.627 538 HD11 ILE 68 HD11 ILE 68 10.645 10.539 -5.748 539 HD12 ILE 68 HD12 ILE 68 10.125 11.366 -7.218 540 HD13 ILE 68 HD13 ILE 68 9.457 9.787 -6.811 541 H SER 69 H SER 69 8.409 15.838 -5.209 542 HA SER 69 HA SER 69 9.512 16.881 -2.829 543 HB2 SER 69 HB2 SER 69 9.992 17.790 -5.132 544 HB3 SER 69 HB3 SER 69 8.365 18.464 -5.173 545 HG SER 69 HG SER 69 10.222 19.069 -3.128 546 H GLN 70 H GLN 70 6.318 17.155 -4.338 547 HA GLN 70 HA GLN 70 5.188 19.124 -2.683 548 HB2 GLN 70 HB2 GLN 70 4.388 18.377 -4.972 549 HB3 GLN 70 HB3 GLN 70 3.721 16.933 -4.234 550 HG2 GLN 70 HG2 GLN 70 2.845 19.700 -3.360 551 HG3 GLN 70 HG3 GLN 70 2.141 18.926 -4.772 552 HE21 GLN 70 HE21 GLN 70 2.321 18.907 -1.295 553 HE22 GLN 70 HE22 GLN 70 1.039 17.784 -1.031 554 H ILE 71 H ILE 71 4.908 15.549 -2.579 555 HA ILE 71 HA ILE 71 3.227 15.523 -0.276 556 HB ILE 71 HB ILE 71 3.287 13.663 -1.949 557 HG12 ILE 71 HG12 ILE 71 3.762 12.892 0.966 558 HG13 ILE 71 HG13 ILE 71 2.217 13.282 0.220 559 HG21 ILE 71 HG21 ILE 71 5.719 13.522 -2.278 560 HG22 ILE 71 HG22 ILE 71 5.032 11.949 -1.870 561 HG23 ILE 71 HG23 ILE 71 5.906 12.872 -0.647 562 HD11 ILE 71 HD11 ILE 71 3.927 10.870 -0.331 563 HD12 ILE 71 HD12 ILE 71 2.425 11.263 -1.175 564 HD13 ILE 71 HD13 ILE 71 2.403 10.924 0.555 565 H ASP 72 H ASP 72 6.713 15.512 -0.730 566 HA ASP 72 HA ASP 72 7.518 14.652 1.831 567 HB2 ASP 72 HB2 ASP 72 9.141 14.681 0.061 568 HB3 ASP 72 HB3 ASP 72 8.876 16.392 -0.260 569 H LYS 73 H LYS 73 6.348 17.720 0.661 570 HA LYS 73 HA LYS 73 7.190 19.380 2.822 571 HB2 LYS 73 HB2 LYS 73 4.807 19.832 0.977 572 HB3 LYS 73 HB3 LYS 73 5.690 21.051 1.892 573 HG2 LYS 73 HG2 LYS 73 7.710 20.608 0.485 574 HG3 LYS 73 HG3 LYS 73 6.779 19.424 -0.421 575 HD2 LYS 73 HD2 LYS 73 6.845 21.482 -1.695 576 HD3 LYS 73 HD3 LYS 73 5.195 21.234 -1.113 577 HE2 LYS 73 HE2 LYS 73 5.649 22.830 0.747 578 HE3 LYS 73 HE3 LYS 73 7.269 23.091 0.098 579 HZ1 LYS 73 HZ1 LYS 73 6.265 23.938 -1.931 580 HZ2 LYS 73 HZ2 LYS 73 5.771 24.836 -0.590 581 HZ3 LYS 73 HZ3 LYS 73 4.724 23.710 -1.287 582 H LEU 74 H LEU 74 4.713 17.010 2.575 583 HA LEU 74 HA LEU 74 2.977 18.033 4.664 584 HB2 LEU 74 HB2 LEU 74 3.100 15.375 3.181 585 HB3 LEU 74 HB3 LEU 74 2.033 15.605 4.551 586 HG LEU 74 HG LEU 74 0.804 15.846 2.445 587 HD11 LEU 74 HD11 LEU 74 1.028 18.506 3.878 588 HD12 LEU 74 HD12 LEU 74 0.024 17.137 4.366 589 HD13 LEU 74 HD13 LEU 74 -0.310 17.974 2.852 590 HD21 LEU 74 HD21 LEU 74 2.621 18.189 1.813 591 HD22 LEU 74 HD22 LEU 74 1.233 17.652 0.859 592 HD23 LEU 74 HD23 LEU 74 2.650 16.615 1.020 593 H GLU 75 H GLU 75 2.714 17.095 6.699 594 HA GLU 75 HA GLU 75 5.094 16.404 8.117 595 HB2 GLU 75 HB2 GLU 75 2.193 16.374 9.031 596 HB3 GLU 75 HB3 GLU 75 3.600 16.294 10.092 597 HG2 GLU 75 HG2 GLU 75 4.272 18.555 9.427 598 HG3 GLU 75 HG3 GLU 75 2.934 18.637 8.279 599 H ASP 76 H ASP 76 2.876 14.559 6.356 600 HA ASP 76 HA ASP 76 2.905 12.069 7.668 601 HB2 ASP 76 HB2 ASP 76 2.810 12.656 4.667 602 HB3 ASP 76 HB3 ASP 76 2.369 11.129 5.425 603 H VAL 77 H VAL 77 4.952 13.350 5.062 604 HA VAL 77 HA VAL 77 6.671 11.047 5.009 605 HB VAL 77 HB VAL 77 6.719 13.708 3.516 606 HG11 VAL 77 HG11 VAL 77 8.565 11.322 3.078 607 HG12 VAL 77 HG12 VAL 77 9.050 12.900 3.702 608 HG13 VAL 77 HG13 VAL 77 8.464 12.751 2.045 609 HG21 VAL 77 HG21 VAL 77 6.025 12.338 1.591 610 HG22 VAL 77 HG22 VAL 77 4.880 12.165 2.924 611 HG23 VAL 77 HG23 VAL 77 6.051 10.883 2.594 612 H VAL 78 H VAL 78 7.745 10.834 6.852 613 HA VAL 78 HA VAL 78 9.434 12.804 8.106 614 HB VAL 78 HB VAL 78 9.534 9.775 8.504 615 HG11 VAL 78 HG11 VAL 78 10.341 10.310 10.768 616 HG12 VAL 78 HG12 VAL 78 10.262 12.034 10.404 617 HG13 VAL 78 HG13 VAL 78 11.401 11.001 9.536 618 HG21 VAL 78 HG21 VAL 78 7.884 10.027 10.328 619 HG22 VAL 78 HG22 VAL 78 7.199 10.458 8.761 620 HG23 VAL 78 HG23 VAL 78 7.663 11.727 9.898 621 H LYS 79 H LYS 79 9.845 10.110 5.811 622 HA LYS 79 HA LYS 79 12.467 11.217 4.993 623 HB2 LYS 79 HB2 LYS 79 11.886 8.269 5.466 624 HB3 LYS 79 HB3 LYS 79 13.217 8.809 4.464 625 HG2 LYS 79 HG2 LYS 79 14.289 9.860 6.371 626 HG3 LYS 79 HG3 LYS 79 12.922 9.449 7.413 627 HD2 LYS 79 HD2 LYS 79 13.457 7.155 7.449 628 HD3 LYS 79 HD3 LYS 79 14.350 7.227 5.929 629 HE2 LYS 79 HE2 LYS 79 15.318 8.446 8.534 630 HE3 LYS 79 HE3 LYS 79 15.803 6.863 7.925 631 HZ1 LYS 79 HZ1 LYS 79 16.688 7.958 5.945 632 HZ2 LYS 79 HZ2 LYS 79 17.435 8.518 7.353 633 HZ3 LYS 79 HZ3 LYS 79 16.273 9.469 6.578 634 H VAL 80 H VAL 80 12.919 11.024 2.829 635 HA VAL 80 HA VAL 80 11.152 9.504 1.057 636 HB VAL 80 HB VAL 80 10.188 11.740 0.932 637 HG11 VAL 80 HG11 VAL 80 11.438 13.753 0.260 638 HG12 VAL 80 HG12 VAL 80 12.944 12.832 0.277 639 HG13 VAL 80 HG13 VAL 80 12.054 13.091 1.778 640 HG21 VAL 80 HG21 VAL 80 11.883 11.219 -1.536 641 HG22 VAL 80 HG22 VAL 80 10.420 12.207 -1.474 642 HG23 VAL 80 HG23 VAL 80 10.326 10.473 -1.170 643 H GLN 81 H GLN 81 12.622 8.057 0.346 644 HA GLN 81 HA GLN 81 15.280 8.988 -0.608 645 HB2 GLN 81 HB2 GLN 81 14.694 6.343 0.792 646 HB3 GLN 81 HB3 GLN 81 16.265 6.888 0.217 647 HG2 GLN 81 HG2 GLN 81 16.238 8.721 1.880 648 HG3 GLN 81 HG3 GLN 81 14.652 8.196 2.436 649 HE21 GLN 81 HE21 GLN 81 17.280 5.975 1.617 650 HE22 GLN 81 HE22 GLN 81 17.535 5.420 3.228 651 H ARG 82 H ARG 82 15.436 8.706 -2.737 652 HA ARG 82 HA ARG 82 13.703 6.828 -4.150 653 HB2 ARG 82 HB2 ARG 82 15.702 8.809 -5.346 654 HB3 ARG 82 HB3 ARG 82 14.433 7.934 -6.200 655 HG2 ARG 82 HG2 ARG 82 12.815 9.212 -4.563 656 HG3 ARG 82 HG3 ARG 82 14.190 10.296 -4.336 657 HD2 ARG 82 HD2 ARG 82 12.790 9.650 -6.952 658 HD3 ARG 82 HD3 ARG 82 12.689 11.164 -6.057 659 HE ARG 82 HE ARG 82 15.297 11.095 -6.542 660 HH11 ARG 82 HH11 ARG 82 12.655 10.324 -8.750 661 HH12 ARG 82 HH12 ARG 82 13.517 10.822 -10.166 662 HH21 ARG 82 HH21 ARG 82 16.413 11.797 -8.437 663 HH22 ARG 82 HH22 ARG 82 15.648 11.658 -9.992 664 H ASN 83 H ASN 83 14.494 4.846 -3.817 665 HA ASN 83 HA ASN 83 17.311 4.142 -4.314 666 HB2 ASN 83 HB2 ASN 83 15.013 2.400 -3.297 667 HB3 ASN 83 HB3 ASN 83 16.709 1.936 -3.360 668 HD21 ASN 83 HD21 ASN 83 14.759 2.147 -1.120 669 HD22 ASN 83 HD22 ASN 83 15.530 3.144 0.059 670 H GLN 84 H GLN 84 17.822 2.504 -5.886 671 HA GLN 84 HA GLN 84 16.001 2.317 -8.177 672 HB2 GLN 84 HB2 GLN 84 18.840 1.259 -7.777 673 HB3 GLN 84 HB3 GLN 84 17.924 1.133 -9.279 674 HG2 GLN 84 HG2 GLN 84 17.816 3.631 -9.370 675 HG3 GLN 84 HG3 GLN 84 18.838 3.692 -7.933 676 HE21 GLN 84 HE21 GLN 84 20.490 4.808 -9.019 677 HE22 GLN 84 HE22 GLN 84 21.499 4.048 -10.200 678 H SER 85 H SER 85 15.178 0.298 -8.986 679 HA SER 85 HA SER 85 14.410 -1.348 -6.727 680 HB2 SER 85 HB2 SER 85 12.662 -0.383 -8.162 681 HB3 SER 85 HB3 SER 85 13.244 -1.333 -9.518 682 HG SER 85 HG SER 85 11.423 -2.202 -8.246 683 H ASP 86 H ASP 86 14.478 -3.412 -6.516 684 HA ASP 86 HA ASP 86 15.542 -5.289 -8.453 685 HB2 ASP 86 HB2 ASP 86 17.552 -4.400 -7.166 686 HB3 ASP 86 HB3 ASP 86 16.801 -4.954 -5.674 687 HA PRO 87 HA PRO 87 12.026 -7.358 -6.591 688 HB2 PRO 87 HB2 PRO 87 12.621 -10.038 -7.031 689 HB3 PRO 87 HB3 PRO 87 12.032 -8.931 -8.289 690 HG2 PRO 87 HG2 PRO 87 14.862 -9.753 -7.695 691 HG3 PRO 87 HG3 PRO 87 14.034 -9.634 -9.265 692 HD2 PRO 87 HD2 PRO 87 15.688 -7.683 -8.441 693 HD3 PRO 87 HD3 PRO 87 14.193 -7.290 -9.324 694 H THR 88 H THR 88 15.261 -8.317 -5.504 695 HA THR 88 HA THR 88 14.159 -9.576 -3.089 696 HB THR 88 HB THR 88 16.390 -10.381 -2.609 697 HG1 THR 88 HG1 THR 88 17.418 -9.174 -4.958 698 HG21 THR 88 HG21 THR 88 15.802 -10.732 -5.576 699 HG22 THR 88 HG22 THR 88 15.101 -11.695 -4.272 700 HG23 THR 88 HG23 THR 88 16.833 -11.781 -4.600 701 H MET 89 H MET 89 15.015 -6.461 -3.998 702 HA MET 89 HA MET 89 16.316 -5.460 -1.676 703 HB2 MET 89 HB2 MET 89 16.187 -4.250 -3.884 704 HB3 MET 89 HB3 MET 89 14.477 -3.953 -3.603 705 HG2 MET 89 HG2 MET 89 16.691 -2.910 -1.811 706 HG3 MET 89 HG3 MET 89 15.975 -1.996 -3.135 707 HE1 MET 89 HE1 MET 89 15.600 -0.043 -1.192 708 HE2 MET 89 HE2 MET 89 16.193 -1.135 0.061 709 HE3 MET 89 HE3 MET 89 14.633 -0.334 0.254 710 H PHE 90 H PHE 90 12.863 -5.175 -2.667 711 HA PHE 90 HA PHE 90 11.992 -4.210 -0.168 712 HB2 PHE 90 HB2 PHE 90 9.703 -4.467 -0.965 713 HB3 PHE 90 HB3 PHE 90 10.713 -3.743 -2.201 714 HD1 PHE 90 HD1 PHE 90 8.843 -6.781 -1.232 715 HD2 PHE 90 HD2 PHE 90 11.088 -4.872 -4.338 716 HE1 PHE 90 HE1 PHE 90 8.012 -8.439 -2.857 717 HE2 PHE 90 HE2 PHE 90 10.256 -6.538 -5.952 718 HZ PHE 90 HZ PHE 90 8.721 -8.317 -5.213 719 H ASN 91 H ASN 91 12.433 -7.431 -1.409 720 HA ASN 91 HA ASN 91 11.029 -8.905 0.571 721 HB2 ASN 91 HB2 ASN 91 11.763 -9.837 -1.622 722 HB3 ASN 91 HB3 ASN 91 13.443 -9.696 -1.119 723 HD21 ASN 91 HD21 ASN 91 13.760 -11.913 -1.431 724 HD22 ASN 91 HD22 ASN 91 13.143 -13.094 -0.334 725 H LYS 92 H LYS 92 14.268 -7.512 0.414 726 HA LYS 92 HA LYS 92 15.550 -8.910 2.489 727 HB2 LYS 92 HB2 LYS 92 16.731 -7.585 0.773 728 HB3 LYS 92 HB3 LYS 92 16.091 -6.098 1.461 729 HG2 LYS 92 HG2 LYS 92 17.364 -6.534 3.551 730 HG3 LYS 92 HG3 LYS 92 18.020 -8.009 2.832 731 HD2 LYS 92 HD2 LYS 92 18.453 -5.169 1.816 732 HD3 LYS 92 HD3 LYS 92 19.640 -6.160 2.668 733 HE2 LYS 92 HE2 LYS 92 19.649 -7.769 0.794 734 HE3 LYS 92 HE3 LYS 92 18.435 -6.806 -0.051 735 HZ1 LYS 92 HZ1 LYS 92 20.020 -4.974 -0.131 736 HZ2 LYS 92 HZ2 LYS 92 20.630 -6.351 -0.899 737 HZ3 LYS 92 HZ3 LYS 92 21.183 -5.924 0.639 738 H ILE 93 H ILE 93 13.885 -5.712 2.565 739 HA ILE 93 HA ILE 93 14.241 -5.524 5.468 740 HB ILE 93 HB ILE 93 12.635 -3.578 5.375 741 HG12 ILE 93 HG12 ILE 93 11.686 -4.567 3.018 742 HG13 ILE 93 HG13 ILE 93 11.567 -2.879 3.464 743 HG21 ILE 93 HG21 ILE 93 15.025 -3.186 5.353 744 HG22 ILE 93 HG22 ILE 93 14.240 -2.043 4.262 745 HG23 ILE 93 HG23 ILE 93 15.098 -3.438 3.607 746 HD11 ILE 93 HD11 ILE 93 12.240 -3.156 1.185 747 HD12 ILE 93 HD12 ILE 93 13.668 -4.065 1.678 748 HD13 ILE 93 HD13 ILE 93 13.506 -2.357 2.110 749 H ALA 94 H ALA 94 11.728 -6.780 3.351 750 HA ALA 94 HA ALA 94 9.556 -6.842 5.156 751 HB1 ALA 94 HB1 ALA 94 8.586 -8.539 3.654 752 HB2 ALA 94 HB2 ALA 94 10.156 -8.749 2.869 753 HB3 ALA 94 HB3 ALA 94 9.302 -7.209 2.737 754 H VAL 95 H VAL 95 12.207 -9.155 4.611 755 HA VAL 95 HA VAL 95 11.203 -11.115 6.485 756 HB VAL 95 HB VAL 95 13.257 -12.363 6.106 757 HG11 VAL 95 HG11 VAL 95 13.130 -12.700 3.667 758 HG12 VAL 95 HG12 VAL 95 12.217 -11.197 3.504 759 HG13 VAL 95 HG13 VAL 95 11.531 -12.556 4.398 760 HG21 VAL 95 HG21 VAL 95 14.904 -10.537 6.124 761 HG22 VAL 95 HG22 VAL 95 14.317 -9.966 4.560 762 HG23 VAL 95 HG23 VAL 95 15.104 -11.543 4.686 763 H PHE 96 H PHE 96 13.117 -8.262 6.728 764 HA PHE 96 HA PHE 96 14.507 -9.048 9.168 765 HB2 PHE 96 HB2 PHE 96 15.534 -7.603 7.320 766 HB3 PHE 96 HB3 PHE 96 14.476 -6.298 7.837 767 HD1 PHE 96 HD2 PHE 96 17.172 -8.602 9.068 768 HD2 PHE 96 HD1 PHE 96 15.189 -4.852 9.606 769 HE1 PHE 96 HE2 PHE 96 18.848 -7.948 10.748 770 HE2 PHE 96 HE1 PHE 96 16.868 -4.205 11.281 771 HZ PHE 96 HZ PHE 96 18.697 -5.751 11.860 772 H PHE 97 H PHE 97 11.654 -7.320 8.185 773 HA PHE 97 HA PHE 97 9.887 -6.384 9.235 774 HB2 PHE 97 HB2 PHE 97 10.819 -7.959 11.672 775 HB3 PHE 97 HB3 PHE 97 9.222 -7.254 11.454 776 HD1 PHE 97 HD2 PHE 97 7.812 -8.095 9.440 777 HD2 PHE 97 HD1 PHE 97 11.226 -10.167 10.969 778 HE1 PHE 97 HE2 PHE 97 7.038 -10.176 8.388 779 HE2 PHE 97 HE1 PHE 97 10.445 -12.235 9.911 780 HZ PHE 97 HZ PHE 97 8.351 -12.244 8.628 781 H GLN 98 H GLN 98 12.295 -4.879 9.199 782 HA GLN 98 HA GLN 98 11.713 -2.826 11.107 783 HB2 GLN 98 HB2 GLN 98 13.046 -4.369 12.550 784 HB3 GLN 98 HB3 GLN 98 14.361 -4.327 11.389 785 HG2 GLN 98 HG2 GLN 98 14.884 -2.912 13.300 786 HG3 GLN 98 HG3 GLN 98 14.700 -1.917 11.856 787 HE21 GLN 98 HE21 GLN 98 12.884 -0.551 11.694 788 HE22 GLN 98 HE22 GLN 98 11.925 -0.148 13.071 789 H1 GLY 1 H1 GLY 1 -5.478 5.616 24.061 790 H2 GLY 1 H2 GLY 1 -4.835 4.898 22.677 791 H3 GLY 1 H3 GLY 1 -6.143 4.183 23.462 792 HA2 GLY 1 HA3 GLY 1 -7.540 6.086 22.910 793 HA3 GLY 1 HA2 GLY 1 -6.166 6.808 22.083 794 H SER 2 H SER 2 -6.807 3.364 21.981 795 HA SER 2 HA SER 2 -8.175 3.257 19.470 796 HB2 SER 2 HB2 SER 2 -6.266 2.304 18.128 797 HB3 SER 2 HB3 SER 2 -5.955 3.975 18.600 798 HG SER 2 HG SER 2 -4.761 1.603 19.513 799 H MET 3 H MET 3 -7.683 0.769 18.585 800 HA MET 3 HA MET 3 -8.206 -1.121 20.674 801 HB2 MET 3 HB2 MET 3 -7.282 -1.584 17.798 802 HB3 MET 3 HB3 MET 3 -7.848 -2.848 18.888 803 HG2 MET 3 HG2 MET 3 -9.502 -0.530 17.859 804 HG3 MET 3 HG3 MET 3 -9.578 -2.201 17.291 805 HE1 MET 3 HE1 MET 3 -12.186 -2.295 17.671 806 HE2 MET 3 HE2 MET 3 -12.177 -0.615 18.214 807 HE3 MET 3 HE3 MET 3 -12.976 -1.852 19.183 808 H GLN 4 H GLN 4 -6.777 -2.744 21.474 809 HA GLN 4 HA GLN 4 -4.114 -1.864 22.018 810 HB2 GLN 4 HB2 GLN 4 -5.460 -3.223 23.618 811 HB3 GLN 4 HB3 GLN 4 -5.384 -4.590 22.513 812 HG2 GLN 4 HG2 GLN 4 -2.896 -4.604 22.776 813 HG3 GLN 4 HG3 GLN 4 -3.046 -3.319 23.973 814 HE21 GLN 4 HE21 GLN 4 -5.487 -4.450 25.181 815 HE22 GLN 4 HE22 GLN 4 -4.965 -5.827 26.085 816 H ASN 5 H ASN 5 -2.853 -1.708 20.260 817 HA ASN 5 HA ASN 5 -2.874 -3.302 17.948 818 HB2 ASN 5 HB2 ASN 5 -2.002 -1.017 17.917 819 HB3 ASN 5 HB3 ASN 5 -0.708 -1.448 19.029 820 HD21 ASN 5 HD21 ASN 5 -1.891 -1.808 15.753 821 HD22 ASN 5 HD22 ASN 5 -0.402 -2.332 15.054 822 H THR 6 H THR 6 -2.655 -5.417 18.266 823 HA THR 6 HA THR 6 -0.008 -6.510 18.978 824 HB THR 6 HB THR 6 -1.243 -8.522 19.993 825 HG1 THR 6 HG1 THR 6 -3.433 -6.681 19.987 826 HG21 THR 6 HG21 THR 6 -1.595 -5.882 21.474 827 HG22 THR 6 HG22 THR 6 -0.141 -6.884 21.486 828 HG23 THR 6 HG23 THR 6 -1.632 -7.488 22.211 829 H THR 7 H THR 7 0.404 -8.582 17.851 830 HA THR 7 HA THR 7 -0.761 -8.522 15.191 831 HB THR 7 HB THR 7 1.643 -8.713 15.299 832 HG1 THR 7 HG1 THR 7 0.797 -9.713 13.534 833 HG21 THR 7 HG21 THR 7 1.909 -9.925 17.457 834 HG22 THR 7 HG22 THR 7 2.840 -10.681 16.162 835 HG23 THR 7 HG23 THR 7 1.317 -11.401 16.691 836 H HIS 8 H HIS 8 -2.814 -9.033 16.092 837 HA HIS 8 HA HIS 8 -3.887 -11.414 15.256 838 HB2 HIS 8 HB2 HIS 8 -4.717 -12.497 17.355 839 HB3 HIS 8 HB3 HIS 8 -2.967 -12.568 17.230 840 HD1 HIS 8 HD1 HIS 8 -1.686 -11.804 19.226 841 HD2 HIS 8 HD2 HIS 8 -5.627 -10.472 19.324 842 HE1 HIS 8 HE1 HIS 8 -2.007 -10.785 21.497 843 HE2 HIS 8 HE2 HIS 8 -4.334 -9.850 21.471 844 H ASP 9 H ASP 9 -4.046 -8.594 17.321 845 HA ASP 9 HA ASP 9 -6.812 -8.005 17.215 846 HB2 ASP 9 HB2 ASP 9 -5.389 -6.736 18.709 847 HB3 ASP 9 HB3 ASP 9 -4.321 -6.252 17.400 848 H ASN 10 H ASN 10 -4.116 -7.263 15.071 849 HA ASN 10 HA ASN 10 -5.730 -6.077 12.993 850 HB2 ASN 10 HB2 ASN 10 -3.614 -6.027 11.706 851 HB3 ASN 10 HB3 ASN 10 -3.380 -5.375 13.322 852 HD21 ASN 10 HD21 ASN 10 -1.306 -6.336 11.609 853 HD22 ASN 10 HD22 ASN 10 -0.580 -7.686 12.402 854 H VAL 11 H VAL 11 -5.708 -7.025 10.752 855 HA VAL 11 HA VAL 11 -5.863 -9.972 10.636 856 HB VAL 11 HB VAL 11 -8.036 -9.876 9.386 857 HG11 VAL 11 HG11 VAL 11 -9.545 -9.533 11.308 858 HG12 VAL 11 HG12 VAL 11 -8.249 -8.719 12.189 859 HG13 VAL 11 HG13 VAL 11 -8.095 -10.427 11.774 860 HG21 VAL 11 HG21 VAL 11 -9.452 -7.856 9.424 861 HG22 VAL 11 HG22 VAL 11 -7.929 -7.538 8.593 862 HG23 VAL 11 HG23 VAL 11 -8.168 -6.959 10.239 863 H ILE 12 H ILE 12 -5.616 -10.795 8.500 864 HA ILE 12 HA ILE 12 -4.178 -8.992 6.673 865 HB ILE 12 HB ILE 12 -4.423 -12.026 6.551 866 HG12 ILE 12 HG12 ILE 12 -3.208 -11.235 8.617 867 HG13 ILE 12 HG13 ILE 12 -2.279 -12.287 7.567 868 HG21 ILE 12 HG21 ILE 12 -2.539 -10.147 5.130 869 HG22 ILE 12 HG22 ILE 12 -3.879 -11.037 4.403 870 HG23 ILE 12 HG23 ILE 12 -2.487 -11.909 5.044 871 HD11 ILE 12 HD11 ILE 12 -2.008 -9.290 7.752 872 HD12 ILE 12 HD12 ILE 12 -1.049 -10.354 6.719 873 HD13 ILE 12 HD13 ILE 12 -0.932 -10.486 8.472 874 H LEU 13 H LEU 13 -5.907 -7.934 5.618 875 HA LEU 13 HA LEU 13 -7.992 -9.512 4.280 876 HB2 LEU 13 HB2 LEU 13 -7.585 -6.492 4.357 877 HB3 LEU 13 HB3 LEU 13 -8.991 -7.331 3.706 878 HG LEU 13 HG LEU 13 -8.137 -7.260 6.627 879 HD11 LEU 13 HD11 LEU 13 -10.235 -6.034 6.982 880 HD12 LEU 13 HD12 LEU 13 -10.512 -6.002 5.238 881 HD13 LEU 13 HD13 LEU 13 -9.119 -5.169 5.931 882 HD21 LEU 13 HD21 LEU 13 -10.226 -8.488 7.094 883 HD22 LEU 13 HD22 LEU 13 -9.095 -9.436 6.137 884 HD23 LEU 13 HD23 LEU 13 -10.495 -8.690 5.360 885 H GLU 14 H GLU 14 -7.021 -10.564 2.537 886 HA GLU 14 HA GLU 14 -5.297 -8.990 0.771 887 HB2 GLU 14 HB2 GLU 14 -4.894 -11.052 -0.504 888 HB3 GLU 14 HB3 GLU 14 -4.480 -11.197 1.190 889 HG2 GLU 14 HG2 GLU 14 -6.400 -12.570 1.634 890 HG3 GLU 14 HG3 GLU 14 -7.039 -12.291 0.013 891 H LEU 15 H LEU 15 -6.350 -7.626 -0.414 892 HA LEU 15 HA LEU 15 -8.690 -8.446 -1.994 893 HB2 LEU 15 HB2 LEU 15 -7.293 -5.739 -1.910 894 HB3 LEU 15 HB3 LEU 15 -8.841 -6.109 -2.664 895 HG LEU 15 HG LEU 15 -8.229 -6.012 0.316 896 HD11 LEU 15 HD11 LEU 15 -9.890 -4.206 0.330 897 HD12 LEU 15 HD12 LEU 15 -10.070 -4.358 -1.422 898 HD13 LEU 15 HD13 LEU 15 -8.530 -3.840 -0.731 899 HD21 LEU 15 HD21 LEU 15 -10.604 -6.565 0.701 900 HD22 LEU 15 HD22 LEU 15 -9.737 -7.890 -0.070 901 HD23 LEU 15 HD23 LEU 15 -10.815 -6.870 -1.028 902 H THR 16 H THR 16 -8.193 -9.481 -3.806 903 HA THR 16 HA THR 16 -5.625 -9.100 -5.163 904 HB THR 16 HB THR 16 -7.963 -10.917 -5.889 905 HG1 THR 16 HG1 THR 16 -6.868 -11.469 -3.923 906 HG21 THR 16 HG21 THR 16 -5.130 -10.863 -7.005 907 HG22 THR 16 HG22 THR 16 -6.584 -10.352 -7.873 908 HG23 THR 16 HG23 THR 16 -6.373 -12.048 -7.409 909 H VAL 17 H VAL 17 -5.683 -7.129 -6.144 910 HA VAL 17 HA VAL 17 -8.048 -6.449 -7.757 911 HB VAL 17 HB VAL 17 -7.597 -4.182 -7.488 912 HG11 VAL 17 HG11 VAL 17 -6.869 -5.456 -4.826 913 HG12 VAL 17 HG12 VAL 17 -8.500 -5.142 -5.436 914 HG13 VAL 17 HG13 VAL 17 -7.436 -3.790 -5.042 915 HG21 VAL 17 HG21 VAL 17 -5.241 -4.029 -8.018 916 HG22 VAL 17 HG22 VAL 17 -4.797 -4.830 -6.517 917 HG23 VAL 17 HG23 VAL 17 -5.504 -3.215 -6.473 918 H ARG 18 H ARG 18 -7.860 -6.255 -9.891 919 HA ARG 18 HA ARG 18 -5.246 -6.449 -11.198 920 HB2 ARG 18 HB2 ARG 18 -6.597 -6.364 -13.323 921 HB3 ARG 18 HB3 ARG 18 -6.951 -7.725 -12.273 922 HG2 ARG 18 HG2 ARG 18 -8.990 -6.499 -11.475 923 HG3 ARG 18 HG3 ARG 18 -8.652 -5.253 -12.684 924 HD2 ARG 18 HD2 ARG 18 -9.233 -8.187 -13.210 925 HD3 ARG 18 HD3 ARG 18 -10.301 -6.826 -13.551 926 HE ARG 18 HE ARG 18 -7.689 -7.252 -14.917 927 HH11 ARG 18 HH11 ARG 18 -11.094 -6.367 -15.080 928 HH12 ARG 18 HH12 ARG 18 -11.046 -6.017 -16.778 929 HH21 ARG 18 HH21 ARG 18 -7.627 -6.800 -17.119 930 HH22 ARG 18 HH22 ARG 18 -9.063 -6.268 -17.945 931 H ASN 19 H ASN 19 -4.342 -4.759 -12.426 932 HA ASN 19 HA ASN 19 -4.546 -2.317 -10.946 933 HB2 ASN 19 HB2 ASN 19 -2.704 -3.084 -13.242 934 HB3 ASN 19 HB3 ASN 19 -2.573 -1.587 -12.326 935 HD21 ASN 19 HD21 ASN 19 -0.546 -2.010 -11.435 936 HD22 ASN 19 HD22 ASN 19 -0.243 -3.276 -10.300 937 H HIS 20 H HIS 20 -6.670 -1.774 -11.517 938 HA HIS 20 HA HIS 20 -7.302 -0.412 -13.992 939 HB2 HIS 20 HB2 HIS 20 -8.637 -0.445 -11.239 940 HB3 HIS 20 HB3 HIS 20 -9.317 0.379 -12.626 941 HD1 HIS 20 HD1 HIS 20 -9.781 -1.374 -14.756 942 HD2 HIS 20 HD2 HIS 20 -9.545 -2.963 -10.941 943 HE1 HIS 20 HE1 HIS 20 -10.969 -3.577 -14.876 944 HE2 HIS 20 HE2 HIS 20 -10.925 -4.456 -12.518 945 HA PRO 21 HA PRO 21 -5.752 3.793 -13.167 946 HB2 PRO 21 HB2 PRO 21 -8.654 4.692 -13.174 947 HB3 PRO 21 HB3 PRO 21 -7.255 5.388 -14.027 948 HG2 PRO 21 HG2 PRO 21 -8.983 3.910 -15.374 949 HG3 PRO 21 HG3 PRO 21 -7.238 3.708 -15.660 950 HD2 PRO 21 HD2 PRO 21 -9.109 1.942 -14.101 951 HD3 PRO 21 HD3 PRO 21 -7.750 1.493 -15.158 952 H GLY 22 H GLY 22 -4.971 3.597 -11.064 953 HA2 GLY 22 HA2 GLY 22 -4.695 4.287 -8.908 954 HA3 GLY 22 HA3 GLY 22 -6.089 5.322 -9.130 955 H VAL 23 H VAL 23 -5.541 1.768 -8.853 956 HA VAL 23 HA VAL 23 -7.994 1.336 -7.430 957 HB VAL 23 HB VAL 23 -5.656 -0.617 -7.414 958 HG11 VAL 23 HG11 VAL 23 -7.466 -2.298 -7.223 959 HG12 VAL 23 HG12 VAL 23 -8.667 -1.010 -7.214 960 HG13 VAL 23 HG13 VAL 23 -7.504 -1.147 -5.889 961 HG21 VAL 23 HG21 VAL 23 -6.548 -1.634 -9.458 962 HG22 VAL 23 HG22 VAL 23 -6.056 0.035 -9.752 963 HG23 VAL 23 HG23 VAL 23 -7.768 -0.362 -9.580 964 H MET 24 H MET 24 -4.619 1.695 -6.473 965 HA MET 24 HA MET 24 -4.826 0.980 -3.773 966 HB2 MET 24 HB2 MET 24 -2.705 2.236 -3.449 967 HB3 MET 24 HB3 MET 24 -2.651 1.146 -4.824 968 HG2 MET 24 HG2 MET 24 -3.108 4.127 -5.043 969 HG3 MET 24 HG3 MET 24 -1.539 3.346 -5.208 970 HE1 MET 24 HE1 MET 24 -2.655 5.338 -7.402 971 HE2 MET 24 HE2 MET 24 -2.291 4.453 -8.884 972 HE3 MET 24 HE3 MET 24 -1.120 4.479 -7.568 973 H THR 25 H THR 25 -5.697 3.946 -5.419 974 HA THR 25 HA THR 25 -6.121 5.570 -3.113 975 HB THR 25 HB THR 25 -7.560 5.946 -5.770 976 HG1 THR 25 HG1 THR 25 -5.658 6.995 -6.503 977 HG21 THR 25 HG21 THR 25 -7.269 8.350 -5.269 978 HG22 THR 25 HG22 THR 25 -6.405 7.951 -3.780 979 HG23 THR 25 HG23 THR 25 -8.119 7.549 -3.943 980 H HIS 26 H HIS 26 -8.041 3.161 -4.779 981 HA HIS 26 HA HIS 26 -10.586 3.810 -3.598 982 HB2 HIS 26 HB2 HIS 26 -9.702 1.205 -4.932 983 HB3 HIS 26 HB3 HIS 26 -11.362 1.661 -4.561 984 HD1 HIS 26 HD1 HIS 26 -10.818 0.962 -7.405 985 HD2 HIS 26 HD2 HIS 26 -10.293 4.824 -5.972 986 HE1 HIS 26 HE1 HIS 26 -10.964 2.452 -9.413 987 HE2 HIS 26 HE2 HIS 26 -10.820 4.786 -8.490 988 H VAL 27 H VAL 27 -8.095 1.299 -3.012 989 HA VAL 27 HA VAL 27 -9.496 -0.015 -0.924 990 HB VAL 27 HB VAL 27 -7.493 -1.302 -0.484 991 HG11 VAL 27 HG11 VAL 27 -7.748 -0.803 -3.475 992 HG12 VAL 27 HG12 VAL 27 -8.729 -1.909 -2.511 993 HG13 VAL 27 HG13 VAL 27 -7.008 -2.225 -2.726 994 HG21 VAL 27 HG21 VAL 27 -5.301 -0.843 -1.539 995 HG22 VAL 27 HG22 VAL 27 -5.787 0.459 -0.454 996 HG23 VAL 27 HG23 VAL 27 -5.934 0.668 -2.199 997 H CYS 28 H CYS 28 -7.155 2.650 -0.928 998 HA CYS 28 HA CYS 28 -6.745 2.756 1.894 999 HB2 CYS 28 HB2 CYS 28 -5.703 4.918 1.439 1000 HB3 CYS 28 HB3 CYS 28 -5.194 3.744 0.231 1001 HG CYS 28 HG CYS 28 -7.753 5.888 -0.415 1002 H GLY 29 H GLY 29 -9.118 4.104 -0.323 1003 HA2 GLY 29 HA2 GLY 29 -10.333 6.078 1.242 1004 HA3 GLY 29 HA3 GLY 29 -11.116 5.160 -0.033 1005 H LEU 30 H LEU 30 -11.283 2.638 0.868 1006 HA LEU 30 HA LEU 30 -13.505 2.765 2.634 1007 HB2 LEU 30 HB2 LEU 30 -11.950 0.475 1.421 1008 HB3 LEU 30 HB3 LEU 30 -13.203 0.155 2.605 1009 HG LEU 30 HG LEU 30 -14.171 -0.167 0.439 1010 HD11 LEU 30 HD11 LEU 30 -15.183 2.500 1.459 1011 HD12 LEU 30 HD12 LEU 30 -15.637 0.913 2.080 1012 HD13 LEU 30 HD13 LEU 30 -16.055 1.358 0.430 1013 HD21 LEU 30 HD21 LEU 30 -14.270 1.528 -1.332 1014 HD22 LEU 30 HD22 LEU 30 -12.608 1.079 -0.963 1015 HD23 LEU 30 HD23 LEU 30 -13.256 2.612 -0.371 1016 H PHE 31 H PHE 31 -10.148 1.940 3.128 1017 HA PHE 31 HA PHE 31 -10.486 0.944 5.825 1018 HB2 PHE 31 HB2 PHE 31 -8.078 1.384 4.034 1019 HB3 PHE 31 HB3 PHE 31 -7.897 0.917 5.726 1020 HD1 PHE 31 HD1 PHE 31 -10.080 -0.158 2.825 1021 HD2 PHE 31 HD2 PHE 31 -7.526 -1.378 6.036 1022 HE1 PHE 31 HE1 PHE 31 -10.468 -2.512 2.234 1023 HE2 PHE 31 HE2 PHE 31 -7.919 -3.728 5.430 1024 HZ PHE 31 HZ PHE 31 -9.388 -4.298 3.537 1025 H ALA 32 H ALA 32 -9.767 4.046 4.397 1026 HA ALA 32 HA ALA 32 -8.882 5.317 6.832 1027 HB1 ALA 32 HB1 ALA 32 -8.264 6.208 4.622 1028 HB2 ALA 32 HB2 ALA 32 -9.136 7.417 5.568 1029 HB3 ALA 32 HB3 ALA 32 -9.960 6.547 4.267 1030 H ARG 33 H ARG 33 -12.030 4.488 5.506 1031 HA ARG 33 HA ARG 33 -13.372 6.687 6.972 1032 HB2 ARG 33 HB2 ARG 33 -15.248 6.422 5.458 1033 HB3 ARG 33 HB3 ARG 33 -13.764 6.565 4.518 1034 HG2 ARG 33 HG2 ARG 33 -13.739 4.095 4.227 1035 HG3 ARG 33 HG3 ARG 33 -15.267 3.992 5.101 1036 HD2 ARG 33 HD2 ARG 33 -14.810 5.450 2.475 1037 HD3 ARG 33 HD3 ARG 33 -15.600 3.882 2.669 1038 HE ARG 33 HE ARG 33 -16.879 5.884 4.241 1039 HH11 ARG 33 HH11 ARG 33 -16.667 4.699 0.934 1040 HH12 ARG 33 HH12 ARG 33 -18.231 5.294 0.495 1041 HH21 ARG 33 HH21 ARG 33 -18.913 6.670 3.647 1042 HH22 ARG 33 HH22 ARG 33 -19.507 6.413 2.035 1043 H ARG 34 H ARG 34 -12.830 3.334 7.165 1044 HA ARG 34 HA ARG 34 -15.239 2.446 8.351 1045 HB2 ARG 34 HB2 ARG 34 -13.791 0.596 9.320 1046 HB3 ARG 34 HB3 ARG 34 -13.772 0.736 7.581 1047 HG2 ARG 34 HG2 ARG 34 -11.550 1.220 7.497 1048 HG3 ARG 34 HG3 ARG 34 -11.589 2.216 8.942 1049 HD2 ARG 34 HD2 ARG 34 -11.598 -0.814 8.927 1050 HD3 ARG 34 HD3 ARG 34 -10.177 0.199 9.192 1051 HE ARG 34 HE ARG 34 -12.518 0.399 10.978 1052 HH11 ARG 34 HH11 ARG 34 -9.121 -0.305 10.539 1053 HH12 ARG 34 HH12 ARG 34 -8.792 -0.407 12.235 1054 HH21 ARG 34 HH21 ARG 34 -12.095 0.227 13.218 1055 HH22 ARG 34 HH22 ARG 34 -10.479 -0.108 13.758 1056 H ALA 35 H ALA 35 -12.163 3.560 9.823 1057 HA ALA 35 HA ALA 35 -13.200 4.953 11.985 1058 HB1 ALA 35 HB1 ALA 35 -12.406 2.120 12.781 1059 HB2 ALA 35 HB2 ALA 35 -14.041 2.778 12.813 1060 HB3 ALA 35 HB3 ALA 35 -12.812 3.435 13.890 1061 H PHE 36 H PHE 36 -10.625 2.528 11.515 1062 HA PHE 36 HA PHE 36 -8.588 4.473 12.460 1063 HB2 PHE 36 HB2 PHE 36 -9.070 2.638 14.077 1064 HB3 PHE 36 HB3 PHE 36 -8.717 1.445 12.835 1065 HD1 PHE 36 HD2 PHE 36 -7.075 4.359 14.582 1066 HD2 PHE 36 HD1 PHE 36 -6.561 0.485 12.826 1067 HE1 PHE 36 HE2 PHE 36 -4.721 4.332 15.304 1068 HE2 PHE 36 HE1 PHE 36 -4.208 0.472 13.554 1069 HZ PHE 36 HZ PHE 36 -3.289 2.393 14.793 1070 H ASN 37 H ASN 37 -6.473 4.221 11.556 1071 HA ASN 37 HA ASN 37 -6.399 3.932 8.720 1072 HB2 ASN 37 HB2 ASN 37 -4.104 4.298 10.705 1073 HB3 ASN 37 HB3 ASN 37 -3.993 4.544 8.963 1074 HD21 ASN 37 HD21 ASN 37 -3.556 6.391 11.251 1075 HD22 ASN 37 HD22 ASN 37 -4.563 7.753 10.924 1076 H VAL 38 H VAL 38 -4.467 2.711 7.694 1077 HA VAL 38 HA VAL 38 -4.551 -0.112 8.428 1078 HB VAL 38 HB VAL 38 -3.001 1.218 6.147 1079 HG11 VAL 38 HG11 VAL 38 -2.140 -1.017 6.708 1080 HG12 VAL 38 HG12 VAL 38 -2.961 -1.051 5.145 1081 HG13 VAL 38 HG13 VAL 38 -3.765 -1.695 6.581 1082 HG21 VAL 38 HG21 VAL 38 -5.750 -0.077 6.069 1083 HG22 VAL 38 HG22 VAL 38 -4.845 0.506 4.667 1084 HG23 VAL 38 HG23 VAL 38 -5.410 1.647 5.890 1085 H GLU 39 H GLU 39 -2.902 -1.223 9.358 1086 HA GLU 39 HA GLU 39 -0.659 0.105 10.604 1087 HB2 GLU 39 HB2 GLU 39 -1.874 -1.726 11.734 1088 HB3 GLU 39 HB3 GLU 39 -1.493 -2.826 10.414 1089 HG2 GLU 39 HG2 GLU 39 0.979 -2.461 11.029 1090 HG3 GLU 39 HG3 GLU 39 0.387 -1.695 12.502 1091 H GLY 40 H GLY 40 -1.026 -2.470 8.127 1092 HA2 GLY 40 HA2 GLY 40 1.589 -1.800 6.927 1093 HA3 GLY 40 HA3 GLY 40 1.333 -3.439 7.518 1094 H ILE 41 H ILE 41 1.855 -2.567 4.783 1095 HA ILE 41 HA ILE 41 -0.547 -3.627 3.398 1096 HB ILE 41 HB ILE 41 1.129 -1.271 2.368 1097 HG12 ILE 41 HG12 ILE 41 -1.736 -1.227 3.422 1098 HG13 ILE 41 HG13 ILE 41 -0.337 -0.569 4.256 1099 HG21 ILE 41 HG21 ILE 41 -0.533 -1.113 0.542 1100 HG22 ILE 41 HG22 ILE 41 -1.371 -2.530 1.178 1101 HG23 ILE 41 HG23 ILE 41 0.268 -2.687 0.544 1102 HD11 ILE 41 HD11 ILE 41 -1.475 0.434 1.646 1103 HD12 ILE 41 HD12 ILE 41 -0.055 1.084 2.469 1104 HD13 ILE 41 HD13 ILE 41 -1.639 1.186 3.232 1105 H LEU 42 H LEU 42 -0.051 -5.071 1.748 1106 HA LEU 42 HA LEU 42 2.688 -5.170 0.672 1107 HB2 LEU 42 HB2 LEU 42 2.653 -6.876 2.440 1108 HB3 LEU 42 HB3 LEU 42 1.187 -7.582 1.776 1109 HG LEU 42 HG LEU 42 2.459 -8.247 -0.282 1110 HD11 LEU 42 HD11 LEU 42 4.197 -6.552 -0.281 1111 HD12 LEU 42 HD12 LEU 42 4.901 -8.169 -0.321 1112 HD13 LEU 42 HD13 LEU 42 4.906 -7.241 1.184 1113 HD21 LEU 42 HD21 LEU 42 3.717 -10.087 0.735 1114 HD22 LEU 42 HD22 LEU 42 2.157 -9.850 1.521 1115 HD23 LEU 42 HD23 LEU 42 3.634 -9.283 2.308 1116 H CYS 43 H CYS 43 1.903 -4.295 -1.270 1117 HA CYS 43 HA CYS 43 -0.036 -5.817 -2.859 1118 HB2 CYS 43 HB2 CYS 43 -0.122 -3.361 -3.007 1119 HB3 CYS 43 HB3 CYS 43 1.555 -3.308 -3.540 1120 HG CYS 43 HG CYS 43 1.150 -4.234 -6.041 1121 H LEU 44 H LEU 44 0.781 -7.658 -3.613 1122 HA LEU 44 HA LEU 44 3.545 -7.833 -4.657 1123 HB2 LEU 44 HB2 LEU 44 2.744 -9.382 -2.815 1124 HB3 LEU 44 HB3 LEU 44 1.584 -10.042 -3.949 1125 HG LEU 44 HG LEU 44 3.635 -10.721 -5.392 1126 HD11 LEU 44 HD11 LEU 44 5.305 -9.309 -4.261 1127 HD12 LEU 44 HD12 LEU 44 5.748 -11.015 -4.206 1128 HD13 LEU 44 HD13 LEU 44 5.077 -10.234 -2.769 1129 HD21 LEU 44 HD21 LEU 44 3.214 -12.034 -2.690 1130 HD22 LEU 44 HD22 LEU 44 3.971 -12.781 -4.099 1131 HD23 LEU 44 HD23 LEU 44 2.270 -12.330 -4.152 1132 HA PRO 45 HA PRO 45 1.164 -7.671 -8.601 1133 HB2 PRO 45 HB2 PRO 45 3.357 -7.346 -10.257 1134 HB3 PRO 45 HB3 PRO 45 2.606 -6.012 -9.357 1135 HG2 PRO 45 HG2 PRO 45 5.057 -7.602 -8.657 1136 HG3 PRO 45 HG3 PRO 45 4.790 -5.846 -8.558 1137 HD2 PRO 45 HD2 PRO 45 4.627 -7.440 -6.369 1138 HD3 PRO 45 HD3 PRO 45 3.598 -5.998 -6.559 1139 H ILE 46 H ILE 46 0.428 -9.475 -9.482 1140 HA ILE 46 HA ILE 46 1.814 -12.007 -9.325 1141 HB ILE 46 HB ILE 46 -0.899 -11.266 -10.509 1142 HG12 ILE 46 HG12 ILE 46 -0.836 -10.857 -8.091 1143 HG13 ILE 46 HG13 ILE 46 -1.838 -12.266 -8.414 1144 HG21 ILE 46 HG21 ILE 46 -1.440 -13.681 -10.436 1145 HG22 ILE 46 HG22 ILE 46 0.222 -14.040 -9.958 1146 HG23 ILE 46 HG23 ILE 46 -0.110 -13.336 -11.543 1147 HD11 ILE 46 HD11 ILE 46 0.986 -12.270 -7.350 1148 HD12 ILE 46 HD12 ILE 46 0.045 -13.717 -7.727 1149 HD13 ILE 46 HD13 ILE 46 -0.492 -12.619 -6.453 1150 H GLN 47 H GLN 47 2.884 -13.012 -10.931 1151 HA GLN 47 HA GLN 47 3.740 -11.593 -13.236 1152 HB2 GLN 47 HB2 GLN 47 5.336 -13.046 -12.272 1153 HB3 GLN 47 HB3 GLN 47 4.198 -14.380 -12.150 1154 HG2 GLN 47 HG2 GLN 47 4.327 -14.808 -14.522 1155 HG3 GLN 47 HG3 GLN 47 5.285 -13.361 -14.790 1156 HE21 GLN 47 HE21 GLN 47 5.902 -16.170 -15.413 1157 HE22 GLN 47 HE22 GLN 47 7.393 -16.509 -14.610 1158 H ASP 48 H ASP 48 1.736 -14.513 -12.892 1159 HA ASP 48 HA ASP 48 1.664 -15.098 -15.687 1160 HB2 ASP 48 HB2 ASP 48 0.148 -16.967 -15.002 1161 HB3 ASP 48 HB3 ASP 48 1.642 -16.876 -14.069 1162 H SER 49 H SER 49 -0.273 -13.002 -13.819 1163 HA SER 49 HA SER 49 -2.200 -12.662 -15.986 1164 HB2 SER 49 HB2 SER 49 -4.134 -12.857 -14.302 1165 HB3 SER 49 HB3 SER 49 -3.357 -14.373 -14.764 1166 HG SER 49 HG SER 49 -2.112 -14.209 -12.834 1167 H ASP 50 H ASP 50 -3.310 -10.654 -15.908 1168 HA ASP 50 HA ASP 50 -1.901 -8.527 -14.618 1169 HB2 ASP 50 HB2 ASP 50 -3.538 -7.006 -15.698 1170 HB3 ASP 50 HB3 ASP 50 -2.838 -8.138 -16.842 1171 H LYS 51 H LYS 51 -2.072 -9.100 -12.436 1172 HA LYS 51 HA LYS 51 -4.141 -7.752 -11.004 1173 HB2 LYS 51 HB2 LYS 51 -4.982 -9.671 -9.671 1174 HB3 LYS 51 HB3 LYS 51 -5.365 -9.860 -11.377 1175 HG2 LYS 51 HG2 LYS 51 -3.366 -11.408 -11.575 1176 HG3 LYS 51 HG3 LYS 51 -3.199 -11.307 -9.822 1177 HD2 LYS 51 HD2 LYS 51 -4.390 -13.356 -10.432 1178 HD3 LYS 51 HD3 LYS 51 -5.470 -12.276 -9.549 1179 HE2 LYS 51 HE2 LYS 51 -6.584 -11.624 -11.609 1180 HE3 LYS 51 HE3 LYS 51 -5.408 -12.518 -12.577 1181 HZ1 LYS 51 HZ1 LYS 51 -7.454 -13.758 -12.347 1182 HZ2 LYS 51 HZ2 LYS 51 -7.346 -13.711 -10.663 1183 HZ3 LYS 51 HZ3 LYS 51 -6.200 -14.571 -11.562 1184 H SER 52 H SER 52 -3.798 -8.173 -8.582 1185 HA SER 52 HA SER 52 -1.114 -8.812 -7.695 1186 HB2 SER 52 HB2 SER 52 -2.245 -5.970 -7.433 1187 HB3 SER 52 HB3 SER 52 -0.750 -6.550 -6.710 1188 HG SER 52 HG SER 52 -1.333 -5.949 -9.381 1189 H HIS 53 H HIS 53 -1.376 -9.675 -5.603 1190 HA HIS 53 HA HIS 53 -3.954 -9.251 -4.220 1191 HB2 HIS 53 HB2 HIS 53 -1.577 -11.028 -3.512 1192 HB3 HIS 53 HB3 HIS 53 -3.009 -10.872 -2.507 1193 HD1 HIS 53 HD1 HIS 53 -4.197 -13.032 -2.677 1194 HD2 HIS 53 HD2 HIS 53 -2.751 -11.792 -6.377 1195 HE1 HIS 53 HE1 HIS 53 -4.940 -14.786 -4.314 1196 HE2 HIS 53 HE2 HIS 53 -3.917 -14.086 -6.502 1197 H ILE 54 H ILE 54 -4.148 -7.798 -2.577 1198 HA ILE 54 HA ILE 54 -1.707 -6.531 -1.469 1199 HB ILE 54 HB ILE 54 -4.486 -5.251 -1.730 1200 HG12 ILE 54 HG12 ILE 54 -3.240 -3.549 -3.197 1201 HG13 ILE 54 HG13 ILE 54 -1.885 -4.665 -3.218 1202 HG21 ILE 54 HG21 ILE 54 -3.414 -3.205 -0.833 1203 HG22 ILE 54 HG22 ILE 54 -1.901 -4.087 -0.618 1204 HG23 ILE 54 HG23 ILE 54 -3.325 -4.534 0.325 1205 HD11 ILE 54 HD11 ILE 54 -3.211 -4.760 -5.241 1206 HD12 ILE 54 HD12 ILE 54 -4.631 -5.219 -4.302 1207 HD13 ILE 54 HD13 ILE 54 -3.237 -6.297 -4.383 1208 H TRP 55 H TRP 55 -1.345 -7.600 0.422 1209 HA TRP 55 HA TRP 55 -3.540 -8.475 2.140 1210 HB2 TRP 55 HB2 TRP 55 -0.502 -8.710 2.451 1211 HB3 TRP 55 HB3 TRP 55 -1.670 -9.379 3.584 1212 HD1 TRP 55 HD1 TRP 55 -2.892 -11.681 2.861 1213 HE1 TRP 55 HE1 TRP 55 -2.487 -13.380 0.990 1214 HE3 TRP 55 HE3 TRP 55 0.238 -8.927 0.009 1215 HZ2 TRP 55 HZ2 TRP 55 -0.976 -13.537 -1.390 1216 HZ3 TRP 55 HZ3 TRP 55 1.124 -9.908 -2.022 1217 HH2 TRP 55 HH2 TRP 55 0.543 -12.167 -2.737 1218 H LEU 56 H LEU 56 -4.500 -6.774 3.050 1219 HA LEU 56 HA LEU 56 -3.036 -4.485 4.128 1220 HB2 LEU 56 HB2 LEU 56 -5.989 -5.053 3.669 1221 HB3 LEU 56 HB3 LEU 56 -5.428 -3.601 4.488 1222 HG LEU 56 HG LEU 56 -4.585 -4.336 1.654 1223 HD11 LEU 56 HD11 LEU 56 -6.177 -2.680 0.825 1224 HD12 LEU 56 HD12 LEU 56 -6.792 -2.423 2.463 1225 HD13 LEU 56 HD13 LEU 56 -7.008 -3.986 1.672 1226 HD21 LEU 56 HD21 LEU 56 -3.039 -2.841 2.814 1227 HD22 LEU 56 HD22 LEU 56 -4.361 -1.736 3.201 1228 HD23 LEU 56 HD23 LEU 56 -3.880 -1.989 1.521 1229 H LEU 57 H LEU 57 -2.345 -4.621 6.132 1230 HA LEU 57 HA LEU 57 -3.547 -6.294 8.189 1231 HB2 LEU 57 HB2 LEU 57 -1.036 -4.573 8.089 1232 HB3 LEU 57 HB3 LEU 57 -1.604 -5.295 9.584 1233 HG LEU 57 HG LEU 57 -1.298 -7.563 8.608 1234 HD11 LEU 57 HD11 LEU 57 -0.023 -7.866 6.518 1235 HD12 LEU 57 HD12 LEU 57 -0.158 -6.132 6.196 1236 HD13 LEU 57 HD13 LEU 57 -1.610 -7.142 6.255 1237 HD21 LEU 57 HD21 LEU 57 1.147 -7.583 8.690 1238 HD22 LEU 57 HD22 LEU 57 0.475 -6.555 9.952 1239 HD23 LEU 57 HD23 LEU 57 1.183 -5.827 8.506 1240 H VAL 58 H VAL 58 -5.310 -5.422 9.089 1241 HA VAL 58 HA VAL 58 -5.198 -2.742 10.296 1242 HB VAL 58 HB VAL 58 -6.249 -2.595 7.935 1243 HG11 VAL 58 HG11 VAL 58 -8.573 -4.066 9.206 1244 HG12 VAL 58 HG12 VAL 58 -7.528 -4.679 7.924 1245 HG13 VAL 58 HG13 VAL 58 -8.575 -3.293 7.615 1246 HG21 VAL 58 HG21 VAL 58 -7.945 -1.685 10.277 1247 HG22 VAL 58 HG22 VAL 58 -8.048 -1.054 8.630 1248 HG23 VAL 58 HG23 VAL 58 -6.576 -0.818 9.574 1249 H ASN 59 H ASN 59 -6.653 -2.613 12.145 1250 HA ASN 59 HA ASN 59 -7.508 -5.197 13.158 1251 HB2 ASN 59 HB2 ASN 59 -8.347 -3.841 15.165 1252 HB3 ASN 59 HB3 ASN 59 -6.618 -3.843 14.863 1253 HD21 ASN 59 HD21 ASN 59 -6.248 -2.003 16.004 1254 HD22 ASN 59 HD22 ASN 59 -6.778 -0.435 15.493 1255 H ASP 60 H ASP 60 -9.418 -6.098 12.878 1256 HA ASP 60 HA ASP 60 -11.385 -5.289 11.183 1257 HB2 ASP 60 HB2 ASP 60 -11.145 -7.627 11.857 1258 HB3 ASP 60 HB3 ASP 60 -11.650 -7.236 13.498 1259 H ASP 61 H ASP 61 -13.500 -4.528 11.395 1260 HA ASP 61 HA ASP 61 -14.193 -3.012 13.808 1261 HB2 ASP 61 HB2 ASP 61 -12.778 -1.586 12.233 1262 HB3 ASP 61 HB3 ASP 61 -14.045 -1.750 11.029 1263 H GLN 62 H GLN 62 -16.442 -2.406 13.823 1264 HA GLN 62 HA GLN 62 -18.239 -4.328 12.815 1265 HB2 GLN 62 HB2 GLN 62 -18.795 -1.536 13.908 1266 HB3 GLN 62 HB3 GLN 62 -20.015 -2.793 13.691 1267 HG2 GLN 62 HG2 GLN 62 -18.907 -4.207 15.346 1268 HG3 GLN 62 HG3 GLN 62 -17.590 -3.047 15.499 1269 HE21 GLN 62 HE21 GLN 62 -17.958 -1.104 16.615 1270 HE22 GLN 62 HE22 GLN 62 -19.297 -0.904 17.692 1271 H ARG 63 H ARG 63 -17.292 -1.148 11.641 1272 HA ARG 63 HA ARG 63 -19.210 -1.054 9.457 1273 HB2 ARG 63 HB2 ARG 63 -16.837 0.752 10.119 1274 HB3 ARG 63 HB3 ARG 63 -17.979 1.046 8.812 1275 HG2 ARG 63 HG2 ARG 63 -18.682 0.955 11.762 1276 HG3 ARG 63 HG3 ARG 63 -18.445 2.421 10.809 1277 HD2 ARG 63 HD2 ARG 63 -20.354 1.737 9.352 1278 HD3 ARG 63 HD3 ARG 63 -20.619 0.337 10.401 1279 HE ARG 63 HE ARG 63 -20.687 2.444 12.122 1280 HH11 ARG 63 HH11 ARG 63 -22.463 1.720 9.162 1281 HH12 ARG 63 HH12 ARG 63 -23.868 2.608 9.660 1282 HH21 ARG 63 HH21 ARG 63 -22.525 3.606 12.740 1283 HH22 ARG 63 HH22 ARG 63 -23.904 3.677 11.685 1284 H LEU 64 H LEU 64 -15.911 -2.105 9.967 1285 HA LEU 64 HA LEU 64 -14.709 -1.780 7.495 1286 HB2 LEU 64 HB2 LEU 64 -13.498 -2.533 9.499 1287 HB3 LEU 64 HB3 LEU 64 -14.348 -4.068 9.459 1288 HG LEU 64 HG LEU 64 -13.214 -4.484 7.174 1289 HD11 LEU 64 HD11 LEU 64 -11.389 -2.243 8.051 1290 HD12 LEU 64 HD12 LEU 64 -12.533 -2.163 6.704 1291 HD13 LEU 64 HD13 LEU 64 -11.182 -3.295 6.648 1292 HD21 LEU 64 HD21 LEU 64 -12.511 -5.634 9.210 1293 HD22 LEU 64 HD22 LEU 64 -11.424 -4.296 9.602 1294 HD23 LEU 64 HD23 LEU 64 -11.138 -5.278 8.163 1295 H GLU 65 H GLU 65 -16.852 -4.408 8.572 1296 HA GLU 65 HA GLU 65 -16.504 -6.153 6.374 1297 HB2 GLU 65 HB2 GLU 65 -18.855 -5.859 8.289 1298 HB3 GLU 65 HB3 GLU 65 -18.605 -7.227 7.197 1299 HG2 GLU 65 HG2 GLU 65 -16.506 -7.774 8.344 1300 HG3 GLU 65 HG3 GLU 65 -16.721 -6.396 9.422 1301 H GLN 66 H GLN 66 -18.725 -3.464 6.901 1302 HA GLN 66 HA GLN 66 -20.260 -3.842 4.495 1303 HB2 GLN 66 HB2 GLN 66 -19.958 -1.385 6.282 1304 HB3 GLN 66 HB3 GLN 66 -21.021 -1.443 4.882 1305 HG2 GLN 66 HG2 GLN 66 -22.410 -1.818 6.754 1306 HG3 GLN 66 HG3 GLN 66 -22.211 -3.393 5.991 1307 HE21 GLN 66 HE21 GLN 66 -20.942 -4.979 7.064 1308 HE22 GLN 66 HE22 GLN 66 -20.561 -4.840 8.743 1309 H MET 67 H MET 67 -17.360 -2.034 5.386 1310 HA MET 67 HA MET 67 -17.008 -0.580 2.965 1311 HB2 MET 67 HB2 MET 67 -14.852 -1.518 4.920 1312 HB3 MET 67 HB3 MET 67 -14.679 -0.238 3.721 1313 HG2 MET 67 HG2 MET 67 -16.488 -0.191 6.143 1314 HG3 MET 67 HG3 MET 67 -14.978 0.699 5.948 1315 HE1 MET 67 HE1 MET 67 -16.536 2.823 6.787 1316 HE2 MET 67 HE2 MET 67 -18.000 1.838 6.734 1317 HE3 MET 67 HE3 MET 67 -17.942 3.379 5.879 1318 H ILE 68 H ILE 68 -16.017 -3.735 4.089 1319 HA ILE 68 HA ILE 68 -14.324 -4.553 1.968 1320 HB ILE 68 HB ILE 68 -15.779 -5.968 4.231 1321 HG12 ILE 68 HG12 ILE 68 -12.800 -5.706 3.624 1322 HG13 ILE 68 HG13 ILE 68 -13.700 -4.644 4.699 1323 HG21 ILE 68 HG21 ILE 68 -14.129 -7.432 2.158 1324 HG22 ILE 68 HG22 ILE 68 -15.860 -7.618 2.430 1325 HG23 ILE 68 HG23 ILE 68 -14.712 -8.123 3.671 1326 HD11 ILE 68 HD11 ILE 68 -13.171 -7.581 5.092 1327 HD12 ILE 68 HD12 ILE 68 -14.212 -6.600 6.128 1328 HD13 ILE 68 HD13 ILE 68 -12.494 -6.228 5.999 1329 H SER 69 H SER 69 -17.781 -5.060 2.680 1330 HA SER 69 HA SER 69 -18.421 -6.668 0.443 1331 HB2 SER 69 HB2 SER 69 -19.889 -6.387 2.487 1332 HB3 SER 69 HB3 SER 69 -20.303 -4.771 1.918 1333 HG SER 69 HG SER 69 -20.691 -7.114 0.367 1334 H GLN 70 H GLN 70 -18.504 -3.174 1.022 1335 HA GLN 70 HA GLN 70 -19.829 -2.353 -1.315 1336 HB2 GLN 70 HB2 GLN 70 -19.496 -1.032 0.829 1337 HB3 GLN 70 HB3 GLN 70 -17.836 -0.731 0.345 1338 HG2 GLN 70 HG2 GLN 70 -20.163 0.115 -1.403 1339 HG3 GLN 70 HG3 GLN 70 -19.637 1.108 -0.053 1340 HE21 GLN 70 HE21 GLN 70 -18.838 -0.035 -3.245 1341 HE22 GLN 70 HE22 GLN 70 -17.491 1.017 -3.507 1342 H ILE 71 H ILE 71 -16.325 -2.470 -0.547 1343 HA ILE 71 HA ILE 71 -15.505 -1.480 -3.090 1344 HB ILE 71 HB ILE 71 -14.109 -1.269 -1.026 1345 HG12 ILE 71 HG12 ILE 71 -12.785 -2.583 -3.443 1346 HG13 ILE 71 HG13 ILE 71 -13.079 -0.865 -3.210 1347 HG21 ILE 71 HG21 ILE 71 -14.440 -3.524 -0.104 1348 HG22 ILE 71 HG22 ILE 71 -12.726 -3.131 -0.238 1349 HG23 ILE 71 HG23 ILE 71 -13.479 -4.210 -1.416 1350 HD11 ILE 71 HD11 ILE 71 -11.164 -2.590 -1.661 1351 HD12 ILE 71 HD12 ILE 71 -11.489 -0.884 -1.331 1352 HD13 ILE 71 HD13 ILE 71 -10.769 -1.366 -2.867 1353 H ASP 72 H ASP 72 -16.143 -4.693 -1.838 1354 HA ASP 72 HA ASP 72 -14.890 -6.244 -3.819 1355 HB2 ASP 72 HB2 ASP 72 -15.585 -7.314 -1.789 1356 HB3 ASP 72 HB3 ASP 72 -17.254 -6.790 -1.990 1357 H LYS 73 H LYS 73 -17.895 -4.475 -3.817 1358 HA LYS 73 HA LYS 73 -19.136 -5.709 -6.081 1359 HB2 LYS 73 HB2 LYS 73 -19.621 -2.893 -5.028 1360 HB3 LYS 73 HB3 LYS 73 -20.721 -3.879 -5.991 1361 HG2 LYS 73 HG2 LYS 73 -20.930 -5.470 -4.071 1362 HG3 LYS 73 HG3 LYS 73 -19.857 -4.433 -3.140 1363 HD2 LYS 73 HD2 LYS 73 -22.145 -3.966 -2.488 1364 HD3 LYS 73 HD3 LYS 73 -21.502 -2.566 -3.350 1365 HE2 LYS 73 HE2 LYS 73 -22.663 -3.350 -5.413 1366 HE3 LYS 73 HE3 LYS 73 -23.332 -4.700 -4.491 1367 HZ1 LYS 73 HZ1 LYS 73 -24.441 -3.101 -3.057 1368 HZ2 LYS 73 HZ2 LYS 73 -24.922 -2.925 -4.662 1369 HZ3 LYS 73 HZ3 LYS 73 -23.834 -1.826 -3.979 1370 H LEU 74 H LEU 74 -16.506 -3.528 -5.804 1371 HA LEU 74 HA LEU 74 -16.748 -2.296 -8.427 1372 HB2 LEU 74 HB2 LEU 74 -14.560 -2.273 -6.309 1373 HB3 LEU 74 HB3 LEU 74 -14.288 -1.601 -7.902 1374 HG LEU 74 HG LEU 74 -14.793 0.174 -6.310 1375 HD11 LEU 74 HD11 LEU 74 -17.075 -0.176 -8.268 1376 HD12 LEU 74 HD12 LEU 74 -15.489 0.514 -8.622 1377 HD13 LEU 74 HD13 LEU 74 -16.573 1.336 -7.501 1378 HD21 LEU 74 HD21 LEU 74 -17.478 -1.154 -5.852 1379 HD22 LEU 74 HD22 LEU 74 -16.939 0.383 -5.164 1380 HD23 LEU 74 HD23 LEU 74 -16.134 -1.121 -4.714 1381 H GLU 75 H GLU 75 -15.367 -2.701 -10.174 1382 HA GLU 75 HA GLU 75 -14.764 -5.439 -10.732 1383 HB2 GLU 75 HB2 GLU 75 -14.014 -2.930 -12.285 1384 HB3 GLU 75 HB3 GLU 75 -13.945 -4.577 -12.909 1385 HG2 GLU 75 HG2 GLU 75 -16.371 -4.784 -12.753 1386 HG3 GLU 75 HG3 GLU 75 -16.488 -3.197 -11.992 1387 H ASP 76 H ASP 76 -13.012 -3.030 -9.127 1388 HA ASP 76 HA ASP 76 -10.334 -3.668 -9.702 1389 HB2 ASP 76 HB2 ASP 76 -11.527 -2.714 -7.057 1390 HB3 ASP 76 HB3 ASP 76 -9.831 -2.621 -7.517 1391 H VAL 77 H VAL 77 -12.481 -4.785 -7.103 1392 HA VAL 77 HA VAL 77 -10.567 -6.648 -6.043 1393 HB VAL 77 HB VAL 77 -13.474 -6.026 -5.336 1394 HG11 VAL 77 HG11 VAL 77 -11.583 -7.915 -3.866 1395 HG12 VAL 77 HG12 VAL 77 -13.034 -8.392 -4.749 1396 HG13 VAL 77 HG13 VAL 77 -13.174 -7.398 -3.297 1397 HG21 VAL 77 HG21 VAL 77 -12.484 -4.979 -3.338 1398 HG22 VAL 77 HG22 VAL 77 -11.825 -4.259 -4.808 1399 HG23 VAL 77 HG23 VAL 77 -10.862 -5.419 -3.886 1400 H VAL 78 H VAL 78 -10.114 -8.209 -7.417 1401 HA VAL 78 HA VAL 78 -12.003 -9.930 -8.737 1402 HB VAL 78 HB VAL 78 -9.031 -10.467 -8.302 1403 HG11 VAL 78 HG11 VAL 78 -9.188 -11.801 -10.365 1404 HG12 VAL 78 HG12 VAL 78 -10.911 -11.436 -10.487 1405 HG13 VAL 78 HG13 VAL 78 -10.306 -12.400 -9.135 1406 HG21 VAL 78 HG21 VAL 78 -8.584 -9.368 -10.470 1407 HG22 VAL 78 HG22 VAL 78 -9.237 -8.233 -9.288 1408 HG23 VAL 78 HG23 VAL 78 -10.277 -8.865 -10.569 1409 H LYS 79 H LYS 79 -10.026 -10.012 -5.789 1410 HA LYS 79 HA LYS 79 -11.707 -12.191 -4.706 1411 HB2 LYS 79 HB2 LYS 79 -8.670 -12.058 -4.532 1412 HB3 LYS 79 HB3 LYS 79 -9.626 -12.996 -3.402 1413 HG2 LYS 79 HG2 LYS 79 -10.397 -14.451 -5.181 1414 HG3 LYS 79 HG3 LYS 79 -9.558 -13.474 -6.393 1415 HD2 LYS 79 HD2 LYS 79 -7.423 -14.204 -5.712 1416 HD3 LYS 79 HD3 LYS 79 -7.968 -14.650 -4.095 1417 HE2 LYS 79 HE2 LYS 79 -8.719 -16.158 -6.622 1418 HE3 LYS 79 HE3 LYS 79 -7.401 -16.610 -5.539 1419 HZ1 LYS 79 HZ1 LYS 79 -9.019 -16.838 -3.744 1420 HZ2 LYS 79 HZ2 LYS 79 -9.382 -17.860 -5.036 1421 HZ3 LYS 79 HZ3 LYS 79 -10.277 -16.452 -4.809 1422 H VAL 80 H VAL 80 -12.076 -12.052 -2.519 1423 HA VAL 80 HA VAL 80 -10.726 -10.026 -0.893 1424 HB VAL 80 HB VAL 80 -12.750 -8.846 -1.568 1425 HG11 VAL 80 HG11 VAL 80 -15.035 -9.656 -1.159 1426 HG12 VAL 80 HG12 VAL 80 -14.395 -11.199 -0.585 1427 HG13 VAL 80 HG13 VAL 80 -14.167 -10.722 -2.268 1428 HG21 VAL 80 HG21 VAL 80 -13.073 -9.868 1.275 1429 HG22 VAL 80 HG22 VAL 80 -13.772 -8.383 0.621 1430 HG23 VAL 80 HG23 VAL 80 -12.023 -8.546 0.760 1431 H GLN 81 H GLN 81 -9.745 -11.355 0.530 1432 HA GLN 81 HA GLN 81 -11.274 -13.575 1.785 1433 HB2 GLN 81 HB2 GLN 81 -8.323 -13.624 1.021 1434 HB3 GLN 81 HB3 GLN 81 -9.212 -14.927 1.799 1435 HG2 GLN 81 HG2 GLN 81 -10.603 -15.188 -0.229 1436 HG3 GLN 81 HG3 GLN 81 -9.735 -13.863 -0.999 1437 HE21 GLN 81 HE21 GLN 81 -8.166 -16.356 0.963 1438 HE22 GLN 81 HE22 GLN 81 -7.317 -17.090 -0.346 1439 H ARG 82 H ARG 82 -11.515 -13.196 3.899 1440 HA ARG 82 HA ARG 82 -9.769 -11.310 5.294 1441 HB2 ARG 82 HB2 ARG 82 -12.263 -12.721 6.376 1442 HB3 ARG 82 HB3 ARG 82 -11.413 -11.361 7.109 1443 HG2 ARG 82 HG2 ARG 82 -12.012 -10.130 4.854 1444 HG3 ARG 82 HG3 ARG 82 -13.234 -11.396 4.704 1445 HD2 ARG 82 HD2 ARG 82 -12.942 -9.407 6.981 1446 HD3 ARG 82 HD3 ARG 82 -14.186 -9.392 5.733 1447 HE ARG 82 HE ARG 82 -14.659 -11.763 6.832 1448 HH11 ARG 82 HH11 ARG 82 -14.012 -8.701 8.456 1449 HH12 ARG 82 HH12 ARG 82 -14.968 -9.089 9.847 1450 HH21 ARG 82 HH21 ARG 82 -15.948 -12.246 8.667 1451 HH22 ARG 82 HH22 ARG 82 -16.065 -11.100 9.965 1452 H ASN 83 H ASN 83 -7.901 -12.352 5.691 1453 HA ASN 83 HA ASN 83 -7.798 -14.980 7.023 1454 HB2 ASN 83 HB2 ASN 83 -5.509 -13.232 6.006 1455 HB3 ASN 83 HB3 ASN 83 -5.375 -14.896 6.562 1456 HD21 ASN 83 HD21 ASN 83 -4.722 -13.596 3.974 1457 HD22 ASN 83 HD22 ASN 83 -5.552 -14.518 2.779 1458 H GLN 84 H GLN 84 -6.667 -15.207 9.063 1459 HA GLN 84 HA GLN 84 -6.710 -12.847 10.806 1460 HB2 GLN 84 HB2 GLN 84 -6.077 -15.773 11.407 1461 HB3 GLN 84 HB3 GLN 84 -6.148 -14.494 12.620 1462 HG2 GLN 84 HG2 GLN 84 -8.548 -14.123 12.030 1463 HG3 GLN 84 HG3 GLN 84 -8.447 -15.478 10.904 1464 HE21 GLN 84 HE21 GLN 84 -10.027 -16.670 12.003 1465 HE22 GLN 84 HE22 GLN 84 -9.741 -17.395 13.545 1466 H SER 85 H SER 85 -4.819 -12.047 11.902 1467 HA SER 85 HA SER 85 -2.615 -12.087 10.019 1468 HB2 SER 85 HB2 SER 85 -3.565 -9.930 10.676 1469 HB3 SER 85 HB3 SER 85 -3.072 -10.204 12.336 1470 HG SER 85 HG SER 85 -1.651 -8.901 10.896 1471 H ASP 86 H ASP 86 -0.598 -12.448 10.354 1472 HA ASP 86 HA ASP 86 0.589 -13.096 12.919 1473 HB2 ASP 86 HB2 ASP 86 -0.304 -15.286 11.993 1474 HB3 ASP 86 HB3 ASP 86 0.655 -15.037 10.542 1475 HA PRO 87 HA PRO 87 3.565 -10.463 10.893 1476 HB2 PRO 87 HB2 PRO 87 5.928 -11.149 12.165 1477 HB3 PRO 87 HB3 PRO 87 4.656 -10.163 12.914 1478 HG2 PRO 87 HG2 PRO 87 5.165 -13.111 13.215 1479 HG3 PRO 87 HG3 PRO 87 4.809 -11.900 14.469 1480 HD2 PRO 87 HD2 PRO 87 2.882 -13.532 13.553 1481 HD3 PRO 87 HD3 PRO 87 2.526 -11.834 13.949 1482 H THR 88 H THR 88 4.228 -13.943 10.910 1483 HA THR 88 HA THR 88 6.149 -13.668 8.699 1484 HB THR 88 HB THR 88 6.672 -16.014 8.997 1485 HG1 THR 88 HG1 THR 88 4.818 -16.234 11.127 1486 HG21 THR 88 HG21 THR 88 6.433 -14.684 11.731 1487 HG22 THR 88 HG22 THR 88 7.770 -14.465 10.599 1488 HG23 THR 88 HG23 THR 88 7.487 -16.043 11.337 1489 H MET 89 H MET 89 2.816 -13.926 8.985 1490 HA MET 89 HA MET 89 2.153 -15.709 6.873 1491 HB2 MET 89 HB2 MET 89 0.499 -14.892 8.582 1492 HB3 MET 89 HB3 MET 89 0.549 -13.294 7.849 1493 HG2 MET 89 HG2 MET 89 -0.376 -15.794 6.395 1494 HG3 MET 89 HG3 MET 89 -1.455 -14.670 7.218 1495 HE1 MET 89 HE1 MET 89 -2.802 -14.616 4.777 1496 HE2 MET 89 HE2 MET 89 -1.558 -15.627 4.036 1497 HE3 MET 89 HE3 MET 89 -2.017 -14.099 3.284 1498 H PHE 90 H PHE 90 2.268 -12.095 6.899 1499 HA PHE 90 HA PHE 90 2.009 -11.877 4.093 1500 HB2 PHE 90 HB2 PHE 90 2.470 -9.492 4.325 1501 HB3 PHE 90 HB3 PHE 90 1.327 -10.032 5.540 1502 HD1 PHE 90 HD1 PHE 90 4.769 -8.814 4.966 1503 HD2 PHE 90 HD2 PHE 90 1.876 -9.921 7.921 1504 HE1 PHE 90 HE1 PHE 90 6.142 -7.747 6.713 1505 HE2 PHE 90 HE2 PHE 90 3.259 -8.856 9.661 1506 HZ PHE 90 HZ PHE 90 5.388 -7.771 9.058 1507 H ASN 91 H ASN 91 4.778 -12.279 6.163 1508 HA ASN 91 HA ASN 91 6.843 -11.607 4.332 1509 HB2 ASN 91 HB2 ASN 91 7.160 -11.839 6.790 1510 HB3 ASN 91 HB3 ASN 91 6.869 -13.570 6.666 1511 HD21 ASN 91 HD21 ASN 91 8.894 -14.016 7.559 1512 HD22 ASN 91 HD22 ASN 91 10.363 -13.805 6.678 1513 H LYS 92 H LYS 92 4.943 -14.520 4.877 1514 HA LYS 92 HA LYS 92 6.542 -16.455 3.629 1515 HB2 LYS 92 HB2 LYS 92 4.671 -16.946 5.166 1516 HB3 LYS 92 HB3 LYS 92 3.519 -16.402 3.952 1517 HG2 LYS 92 HG2 LYS 92 4.209 -18.259 2.470 1518 HG3 LYS 92 HG3 LYS 92 5.365 -18.804 3.691 1519 HD2 LYS 92 HD2 LYS 92 2.338 -18.683 4.006 1520 HD3 LYS 92 HD3 LYS 92 3.297 -20.145 3.772 1521 HE2 LYS 92 HE2 LYS 92 4.407 -19.769 5.950 1522 HE3 LYS 92 HE3 LYS 92 3.468 -18.289 6.180 1523 HZ1 LYS 92 HZ1 LYS 92 1.442 -19.624 6.145 1524 HZ2 LYS 92 HZ2 LYS 92 2.486 -20.139 7.372 1525 HZ3 LYS 92 HZ3 LYS 92 2.359 -21.037 5.949 1526 H ILE 93 H ILE 93 3.858 -14.520 2.244 1527 HA ILE 93 HA ILE 93 4.210 -15.676 -0.399 1528 HB ILE 93 HB ILE 93 2.567 -13.908 -1.168 1529 HG12 ILE 93 HG12 ILE 93 3.178 -12.472 1.076 1530 HG13 ILE 93 HG13 ILE 93 1.672 -12.293 0.201 1531 HG21 ILE 93 HG21 ILE 93 1.791 -16.148 -0.664 1532 HG22 ILE 93 HG22 ILE 93 0.591 -14.977 -0.115 1533 HG23 ILE 93 HG23 ILE 93 1.655 -15.764 1.054 1534 HD11 ILE 93 HD11 ILE 93 1.320 -12.362 2.568 1535 HD12 ILE 93 HD12 ILE 93 2.068 -13.954 2.675 1536 HD13 ILE 93 HD13 ILE 93 0.547 -13.741 1.796 1537 H ALA 94 H ALA 94 5.360 -12.844 1.323 1538 HA ALA 94 HA ALA 94 6.165 -11.231 -0.852 1539 HB1 ALA 94 HB1 ALA 94 7.616 -10.076 0.775 1540 HB2 ALA 94 HB2 ALA 94 7.379 -11.394 1.929 1541 HB3 ALA 94 HB3 ALA 94 6.014 -10.383 1.453 1542 H VAL 95 H VAL 95 7.857 -13.831 0.905 1543 HA VAL 95 HA VAL 95 10.309 -13.575 -0.597 1544 HB VAL 95 HB VAL 95 11.094 -15.568 0.562 1545 HG11 VAL 95 HG11 VAL 95 10.887 -14.846 2.916 1546 HG12 VAL 95 HG12 VAL 95 9.556 -13.773 2.472 1547 HG13 VAL 95 HG13 VAL 95 11.176 -13.483 1.833 1548 HG21 VAL 95 HG21 VAL 95 9.081 -16.969 0.458 1549 HG22 VAL 95 HG22 VAL 95 8.272 -15.929 1.632 1550 HG23 VAL 95 HG23 VAL 95 9.684 -16.872 2.114 1551 H PHE 96 H PHE 96 7.305 -15.210 -1.096 1552 HA PHE 96 HA PHE 96 8.367 -17.257 -2.883 1553 HB2 PHE 96 HB2 PHE 96 6.431 -17.626 -1.245 1554 HB3 PHE 96 HB3 PHE 96 5.436 -16.625 -2.295 1555 HD1 PHE 96 HD2 PHE 96 7.464 -19.768 -2.216 1556 HD2 PHE 96 HD1 PHE 96 4.345 -17.622 -4.199 1557 HE1 PHE 96 HE2 PHE 96 6.939 -21.759 -3.558 1558 HE2 PHE 96 HE1 PHE 96 3.825 -19.617 -5.538 1559 HZ PHE 96 HZ PHE 96 5.124 -21.687 -5.225 1560 H PHE 97 H PHE 97 6.922 -14.103 -3.038 1561 HA PHE 97 HA PHE 97 6.482 -12.600 -4.647 1562 HB2 PHE 97 HB2 PHE 97 8.281 -14.338 -6.381 1563 HB3 PHE 97 HB3 PHE 97 7.764 -12.706 -6.788 1564 HD1 PHE 97 HD2 PHE 97 8.506 -10.772 -5.296 1565 HD2 PHE 97 HD1 PHE 97 10.183 -14.692 -4.960 1566 HE1 PHE 97 HE2 PHE 97 10.438 -9.859 -4.080 1567 HE2 PHE 97 HE1 PHE 97 12.105 -13.764 -3.741 1568 HZ PHE 97 HZ PHE 97 12.237 -11.345 -3.305 1569 H GLN 98 H GLN 98 4.769 -15.016 -4.370 1570 HA GLN 98 HA GLN 98 2.981 -14.404 -6.578 1571 HB2 GLN 98 HB2 GLN 98 4.153 -17.166 -6.151 1572 HB3 GLN 98 HB3 GLN 98 2.493 -17.038 -6.709 1573 HG2 GLN 98 HG2 GLN 98 4.939 -15.938 -8.128 1574 HG3 GLN 98 HG3 GLN 98 4.029 -17.380 -8.583 1575 HE21 GLN 98 HE21 GLN 98 1.838 -17.089 -9.308 1576 HE22 GLN 98 HE22 GLN 98 1.340 -15.608 -10.040 Start of MODEL 16 1 H1 GLY 1 H1 GLY 1 7.881 7.882 -18.380 2 H2 GLY 1 H2 GLY 1 6.725 8.159 -19.572 3 H3 GLY 1 H3 GLY 1 7.638 9.446 -18.975 4 HA2 GLY 1 HA3 GLY 1 8.450 8.836 -21.120 5 HA3 GLY 1 HA2 GLY 1 9.646 8.458 -19.884 6 H SER 2 H SER 2 10.254 7.123 -21.925 7 HA SER 2 HA SER 2 8.861 4.673 -22.436 8 HB2 SER 2 HB2 SER 2 11.720 5.513 -23.101 9 HB3 SER 2 HB3 SER 2 10.919 4.072 -23.733 10 HG SER 2 HG SER 2 10.336 6.787 -24.221 11 H MET 3 H MET 3 8.635 3.244 -20.857 12 HA MET 3 HA MET 3 10.720 2.871 -18.801 13 HB2 MET 3 HB2 MET 3 8.988 1.856 -17.415 14 HB3 MET 3 HB3 MET 3 8.392 3.393 -18.030 15 HG2 MET 3 HG2 MET 3 7.661 0.681 -19.161 16 HG3 MET 3 HG3 MET 3 6.672 1.614 -18.032 17 HE1 MET 3 HE1 MET 3 4.758 1.848 -21.507 18 HE2 MET 3 HE2 MET 3 4.663 1.266 -19.844 19 HE3 MET 3 HE3 MET 3 5.746 0.482 -20.993 20 H GLN 4 H GLN 4 11.372 0.805 -18.180 21 HA GLN 4 HA GLN 4 11.419 -1.270 -20.281 22 HB2 GLN 4 HB2 GLN 4 12.983 -1.117 -17.645 23 HB3 GLN 4 HB3 GLN 4 13.327 -2.159 -19.023 24 HG2 GLN 4 HG2 GLN 4 13.965 -0.228 -20.377 25 HG3 GLN 4 HG3 GLN 4 13.504 0.867 -19.073 26 HE21 GLN 4 HE21 GLN 4 15.571 1.773 -18.950 27 HE22 GLN 4 HE22 GLN 4 16.923 0.917 -18.299 28 H ASN 5 H ASN 5 11.822 -3.511 -18.582 29 HA ASN 5 HA ASN 5 9.992 -3.724 -16.427 30 HB2 ASN 5 HB2 ASN 5 8.438 -5.448 -17.432 31 HB3 ASN 5 HB3 ASN 5 8.216 -3.822 -18.065 32 HD21 ASN 5 HD21 ASN 5 8.965 -3.376 -20.214 33 HD22 ASN 5 HD22 ASN 5 9.153 -4.645 -21.370 34 H THR 6 H THR 6 11.838 -4.477 -15.411 35 HA THR 6 HA THR 6 12.272 -7.362 -15.659 36 HB THR 6 HB THR 6 14.829 -6.888 -15.184 37 HG1 THR 6 HG1 THR 6 14.966 -4.759 -16.797 38 HG21 THR 6 HG21 THR 6 13.730 -6.461 -17.981 39 HG22 THR 6 HG22 THR 6 14.100 -8.022 -17.244 40 HG23 THR 6 HG23 THR 6 15.399 -6.876 -17.589 41 H THR 7 H THR 7 13.898 -4.759 -13.829 42 HA THR 7 HA THR 7 12.341 -5.049 -11.438 43 HB THR 7 HB THR 7 14.644 -5.454 -10.068 44 HG1 THR 7 HG1 THR 7 15.120 -7.285 -12.148 45 HG21 THR 7 HG21 THR 7 12.616 -6.846 -9.771 46 HG22 THR 7 HG22 THR 7 14.089 -7.818 -9.748 47 HG23 THR 7 HG23 THR 7 13.072 -7.800 -11.187 48 H HIS 8 H HIS 8 15.624 -4.055 -12.525 49 HA HIS 8 HA HIS 8 15.901 -1.832 -10.822 50 HB2 HIS 8 HB2 HIS 8 17.892 -1.299 -12.028 51 HB3 HIS 8 HB3 HIS 8 17.744 -3.049 -12.130 52 HD1 HIS 8 HD1 HIS 8 18.437 -0.215 -14.168 53 HD2 HIS 8 HD2 HIS 8 16.378 -3.772 -14.781 54 HE1 HIS 8 HE1 HIS 8 18.269 -0.482 -16.653 55 HE2 HIS 8 HE2 HIS 8 16.897 -2.553 -16.994 56 H ASP 9 H ASP 9 14.011 -2.091 -13.641 57 HA ASP 9 HA ASP 9 13.805 0.497 -14.659 58 HB2 ASP 9 HB2 ASP 9 12.783 -1.361 -15.815 59 HB3 ASP 9 HB3 ASP 9 11.800 -1.776 -14.415 60 H ASN 10 H ASN 10 11.820 -1.052 -12.101 61 HA ASN 10 HA ASN 10 10.473 1.431 -11.501 62 HB2 ASN 10 HB2 ASN 10 9.219 0.192 -9.796 63 HB3 ASN 10 HB3 ASN 10 9.214 -0.690 -11.315 64 HD21 ASN 10 HD21 ASN 10 10.407 -0.655 -8.019 65 HD22 ASN 10 HD22 ASN 10 10.915 -2.307 -7.989 66 H VAL 11 H VAL 11 10.432 2.346 -9.357 67 HA VAL 11 HA VAL 11 13.044 2.290 -7.992 68 HB VAL 11 HB VAL 11 12.661 4.701 -7.362 69 HG11 VAL 11 HG11 VAL 11 12.779 4.204 -10.364 70 HG12 VAL 11 HG12 VAL 11 14.141 4.145 -9.244 71 HG13 VAL 11 HG13 VAL 11 13.315 5.675 -9.541 72 HG21 VAL 11 HG21 VAL 11 10.396 4.672 -9.407 73 HG22 VAL 11 HG22 VAL 11 11.001 6.086 -8.540 74 HG23 VAL 11 HG23 VAL 11 10.185 4.792 -7.661 75 H ILE 12 H ILE 12 13.001 2.207 -5.820 76 HA ILE 12 HA ILE 12 10.482 1.328 -4.561 77 HB ILE 12 HB ILE 12 13.302 1.059 -3.408 78 HG12 ILE 12 HG12 ILE 12 13.283 0.018 -5.670 79 HG13 ILE 12 HG13 ILE 12 13.559 -1.143 -4.383 80 HG21 ILE 12 HG21 ILE 12 12.377 -0.857 -2.182 81 HG22 ILE 12 HG22 ILE 12 10.801 -0.583 -2.928 82 HG23 ILE 12 HG23 ILE 12 11.480 0.625 -1.833 83 HD11 ILE 12 HD11 ILE 12 12.127 -2.052 -6.088 84 HD12 ILE 12 HD12 ILE 12 10.987 -0.724 -5.893 85 HD13 ILE 12 HD13 ILE 12 11.225 -1.884 -4.583 86 H LEU 13 H LEU 13 9.594 3.357 -4.104 87 HA LEU 13 HA LEU 13 11.244 5.477 -2.963 88 HB2 LEU 13 HB2 LEU 13 8.299 5.399 -3.743 89 HB3 LEU 13 HB3 LEU 13 9.154 6.835 -3.194 90 HG LEU 13 HG LEU 13 9.848 5.279 -5.715 91 HD11 LEU 13 HD11 LEU 13 7.668 6.360 -5.942 92 HD12 LEU 13 HD12 LEU 13 8.875 7.133 -6.966 93 HD13 LEU 13 HD13 LEU 13 8.369 7.909 -5.462 94 HD21 LEU 13 HD21 LEU 13 11.283 7.197 -6.265 95 HD22 LEU 13 HD22 LEU 13 11.792 6.426 -4.766 96 HD23 LEU 13 HD23 LEU 13 10.897 7.947 -4.713 97 H GLU 14 H GLU 14 11.674 5.237 -0.891 98 HA GLU 14 HA GLU 14 9.832 3.988 0.974 99 HB2 GLU 14 HB2 GLU 14 12.298 3.496 0.958 100 HB3 GLU 14 HB3 GLU 14 12.614 5.162 1.430 101 HG2 GLU 14 HG2 GLU 14 11.389 4.776 3.550 102 HG3 GLU 14 HG3 GLU 14 11.111 3.100 3.077 103 H LEU 15 H LEU 15 8.161 5.492 1.000 104 HA LEU 15 HA LEU 15 8.556 8.145 2.136 105 HB2 LEU 15 HB2 LEU 15 6.014 6.622 1.422 106 HB3 LEU 15 HB3 LEU 15 6.021 8.203 2.176 107 HG LEU 15 HG LEU 15 5.574 8.569 -0.109 108 HD11 LEU 15 HD11 LEU 15 8.481 9.264 0.278 109 HD12 LEU 15 HD12 LEU 15 7.097 10.192 0.862 110 HD13 LEU 15 HD13 LEU 15 7.363 10.011 -0.869 111 HD21 LEU 15 HD21 LEU 15 6.293 6.425 -1.053 112 HD22 LEU 15 HD22 LEU 15 7.982 6.907 -0.889 113 HD23 LEU 15 HD23 LEU 15 6.918 7.777 -1.998 114 H THR 16 H THR 16 9.195 8.035 4.190 115 HA THR 16 HA THR 16 8.004 6.193 6.117 116 HB THR 16 HB THR 16 9.961 8.503 6.516 117 HG1 THR 16 HG1 THR 16 10.963 6.830 5.413 118 HG21 THR 16 HG21 THR 16 10.356 7.578 8.766 119 HG22 THR 16 HG22 THR 16 9.116 6.354 8.491 120 HG23 THR 16 HG23 THR 16 8.663 8.058 8.578 121 H VAL 17 H VAL 17 5.902 6.709 6.348 122 HA VAL 17 HA VAL 17 5.074 9.503 6.789 123 HB VAL 17 HB VAL 17 2.882 8.890 6.142 124 HG11 VAL 17 HG11 VAL 17 4.786 7.437 4.260 125 HG12 VAL 17 HG12 VAL 17 4.415 9.166 4.238 126 HG13 VAL 17 HG13 VAL 17 3.156 7.994 3.846 127 HG21 VAL 17 HG21 VAL 17 3.709 5.968 6.235 128 HG22 VAL 17 HG22 VAL 17 2.158 6.553 5.627 129 HG23 VAL 17 HG23 VAL 17 2.582 6.780 7.323 130 H ARG 18 H ARG 18 4.002 10.079 8.665 131 HA ARG 18 HA ARG 18 4.033 8.173 10.892 132 HB2 ARG 18 HB2 ARG 18 3.174 10.157 12.237 133 HB3 ARG 18 HB3 ARG 18 4.793 10.303 11.570 134 HG2 ARG 18 HG2 ARG 18 3.815 11.720 9.717 135 HG3 ARG 18 HG3 ARG 18 2.272 11.673 10.582 136 HD2 ARG 18 HD2 ARG 18 4.895 12.800 11.626 137 HD3 ARG 18 HD3 ARG 18 3.486 13.736 11.128 138 HE ARG 18 HE ARG 18 2.331 12.402 13.021 139 HH11 ARG 18 HH11 ARG 18 5.668 13.539 13.176 140 HH12 ARG 18 HH12 ARG 18 5.671 13.643 14.906 141 HH21 ARG 18 HH21 ARG 18 2.363 12.525 15.294 142 HH22 ARG 18 HH22 ARG 18 3.797 13.067 16.107 143 H ASN 19 H ASN 19 2.437 6.828 11.067 144 HA ASN 19 HA ASN 19 0.349 6.798 9.174 145 HB2 ASN 19 HB2 ASN 19 1.496 4.742 9.885 146 HB3 ASN 19 HB3 ASN 19 0.895 4.941 11.526 147 HD21 ASN 19 HD21 ASN 19 -0.076 2.866 11.433 148 HD22 ASN 19 HD22 ASN 19 -1.513 2.567 10.522 149 H HIS 20 H HIS 20 -0.844 8.620 9.616 150 HA HIS 20 HA HIS 20 -2.982 8.204 11.627 151 HB2 HIS 20 HB2 HIS 20 -3.630 10.575 11.219 152 HB3 HIS 20 HB3 HIS 20 -1.986 10.454 11.817 153 HD1 HIS 20 HD1 HIS 20 -0.157 11.462 10.397 154 HD2 HIS 20 HD2 HIS 20 -3.835 11.409 8.456 155 HE1 HIS 20 HE1 HIS 20 0.119 12.944 8.388 156 HE2 HIS 20 HE2 HIS 20 -2.035 12.702 7.120 157 HA PRO 21 HA PRO 21 -5.609 6.650 8.427 158 HB2 PRO 21 HB2 PRO 21 -7.882 8.299 9.502 159 HB3 PRO 21 HB3 PRO 21 -7.756 6.536 9.328 160 HG2 PRO 21 HG2 PRO 21 -7.608 7.671 11.733 161 HG3 PRO 21 HG3 PRO 21 -6.582 6.276 11.326 162 HD2 PRO 21 HD2 PRO 21 -5.843 9.198 11.429 163 HD3 PRO 21 HD3 PRO 21 -4.925 7.781 11.991 164 H GLY 22 H GLY 22 -4.875 7.514 6.535 165 HA2 GLY 22 HA2 GLY 22 -6.166 9.034 4.788 166 HA3 GLY 22 HA3 GLY 22 -5.429 10.294 5.778 167 H VAL 23 H VAL 23 -2.954 8.769 6.318 168 HA VAL 23 HA VAL 23 -1.294 9.945 4.458 169 HB VAL 23 HB VAL 23 0.562 8.485 5.255 170 HG11 VAL 23 HG11 VAL 23 -1.212 9.470 7.501 171 HG12 VAL 23 HG12 VAL 23 -0.059 10.436 6.580 172 HG13 VAL 23 HG13 VAL 23 0.519 9.128 7.616 173 HG21 VAL 23 HG21 VAL 23 0.214 6.765 6.957 174 HG22 VAL 23 HG22 VAL 23 -0.640 6.343 5.468 175 HG23 VAL 23 HG23 VAL 23 -1.540 6.976 6.849 176 H MET 24 H MET 24 -2.692 6.753 4.297 177 HA MET 24 HA MET 24 -1.184 5.639 2.169 178 HB2 MET 24 HB2 MET 24 -4.047 4.980 2.954 179 HB3 MET 24 HB3 MET 24 -2.922 3.930 2.106 180 HG2 MET 24 HG2 MET 24 -1.617 3.609 4.085 181 HG3 MET 24 HG3 MET 24 -2.502 4.879 4.941 182 HE1 MET 24 HE1 MET 24 -5.553 4.309 3.994 183 HE2 MET 24 HE2 MET 24 -5.084 4.684 5.654 184 HE3 MET 24 HE3 MET 24 -6.076 3.268 5.320 185 H THR 25 H THR 25 -4.395 7.200 2.302 186 HA THR 25 HA THR 25 -5.058 7.074 -0.425 187 HB THR 25 HB THR 25 -6.025 9.235 1.512 188 HG1 THR 25 HG1 THR 25 -7.708 7.473 1.866 189 HG21 THR 25 HG21 THR 25 -8.159 9.022 0.272 190 HG22 THR 25 HG22 THR 25 -7.439 7.802 -0.781 191 HG23 THR 25 HG23 THR 25 -6.849 9.466 -0.827 192 H HIS 26 H HIS 26 -3.099 9.340 1.376 193 HA HIS 26 HA HIS 26 -2.977 11.453 -0.549 194 HB2 HIS 26 HB2 HIS 26 -1.244 10.791 1.871 195 HB3 HIS 26 HB3 HIS 26 -0.969 12.209 0.861 196 HD1 HIS 26 HD1 HIS 26 -1.603 14.006 2.546 197 HD2 HIS 26 HD2 HIS 26 -4.538 11.094 2.186 198 HE1 HIS 26 HE1 HIS 26 -3.581 14.871 3.826 199 HE2 HIS 26 HE2 HIS 26 -5.331 13.096 3.593 200 H VAL 27 H VAL 27 -0.666 8.802 0.331 201 HA VAL 27 HA VAL 27 1.256 9.492 -1.641 202 HB VAL 27 HB VAL 27 2.380 7.365 -1.208 203 HG11 VAL 27 HG11 VAL 27 1.272 8.497 1.389 204 HG12 VAL 27 HG12 VAL 27 2.655 9.118 0.491 205 HG13 VAL 27 HG13 VAL 27 2.737 7.519 1.230 206 HG21 VAL 27 HG21 VAL 27 -0.058 6.478 0.372 207 HG22 VAL 27 HG22 VAL 27 1.473 5.605 0.261 208 HG23 VAL 27 HG23 VAL 27 0.473 5.815 -1.175 209 H CYS 28 H CYS 28 -1.380 7.153 -1.631 210 HA CYS 28 HA CYS 28 -1.000 5.990 -4.149 211 HB2 CYS 28 HB2 CYS 28 -3.525 6.332 -2.479 212 HB3 CYS 28 HB3 CYS 28 -3.378 5.248 -3.865 213 HG CYS 28 HG CYS 28 -2.673 4.671 -0.740 214 H GLY 29 H GLY 29 -2.585 8.945 -3.128 215 HA2 GLY 29 HA2 GLY 29 -4.080 9.571 -5.432 216 HA3 GLY 29 HA3 GLY 29 -3.489 10.716 -4.232 217 H LEU 30 H LEU 30 -0.813 10.686 -4.408 218 HA LEU 30 HA LEU 30 -0.317 12.375 -6.603 219 HB2 LEU 30 HB2 LEU 30 1.462 11.119 -4.529 220 HB3 LEU 30 HB3 LEU 30 2.224 11.875 -5.914 221 HG LEU 30 HG LEU 30 2.186 13.468 -4.107 222 HD11 LEU 30 HD11 LEU 30 0.121 14.301 -6.171 223 HD12 LEU 30 HD12 LEU 30 1.873 14.401 -6.352 224 HD13 LEU 30 HD13 LEU 30 1.060 15.380 -5.135 225 HD21 LEU 30 HD21 LEU 30 0.145 14.312 -3.042 226 HD22 LEU 30 HD22 LEU 30 0.346 12.586 -2.754 227 HD23 LEU 30 HD23 LEU 30 -0.828 13.148 -3.947 228 H PHE 31 H PHE 31 0.581 8.963 -6.147 229 HA PHE 31 HA PHE 31 2.097 8.876 -8.629 230 HB2 PHE 31 HB2 PHE 31 1.339 6.657 -6.692 231 HB3 PHE 31 HB3 PHE 31 2.448 6.476 -8.053 232 HD1 PHE 31 HD2 PHE 31 4.492 8.140 -8.123 233 HD2 PHE 31 HD1 PHE 31 2.241 7.320 -4.580 234 HE1 PHE 31 HE2 PHE 31 6.342 8.991 -6.740 235 HE2 PHE 31 HE1 PHE 31 4.094 8.186 -3.205 236 HZ PHE 31 HZ PHE 31 6.147 9.018 -4.284 237 H ALA 32 H ALA 32 -1.182 7.952 -7.685 238 HA ALA 32 HA ALA 32 -1.838 6.437 -10.027 239 HB1 ALA 32 HB1 ALA 32 -4.186 6.703 -9.335 240 HB2 ALA 32 HB2 ALA 32 -3.713 7.926 -8.149 241 HB3 ALA 32 HB3 ALA 32 -3.171 6.258 -7.962 242 H ARG 33 H ARG 33 -2.080 9.885 -9.180 243 HA ARG 33 HA ARG 33 -3.580 10.570 -11.571 244 HB2 ARG 33 HB2 ARG 33 -3.643 12.821 -10.716 245 HB3 ARG 33 HB3 ARG 33 -3.937 11.722 -9.372 246 HG2 ARG 33 HG2 ARG 33 -1.523 11.987 -8.710 247 HG3 ARG 33 HG3 ARG 33 -1.355 13.194 -9.984 248 HD2 ARG 33 HD2 ARG 33 -3.263 13.406 -7.627 249 HD3 ARG 33 HD3 ARG 33 -1.705 14.231 -7.762 250 HE ARG 33 HE ARG 33 -2.909 15.077 -9.983 251 HH11 ARG 33 HH11 ARG 33 -4.201 14.940 -6.703 252 HH12 ARG 33 HH12 ARG 33 -5.249 16.302 -6.945 253 HH21 ARG 33 HH21 ARG 33 -4.248 16.857 -10.269 254 HH22 ARG 33 HH22 ARG 33 -5.279 17.400 -8.981 255 H ARG 34 H ARG 34 -0.278 10.017 -11.022 256 HA ARG 34 HA ARG 34 0.832 11.954 -12.787 257 HB2 ARG 34 HB2 ARG 34 2.365 10.885 -11.282 258 HB3 ARG 34 HB3 ARG 34 1.841 9.276 -11.752 259 HG2 ARG 34 HG2 ARG 34 4.063 9.674 -12.633 260 HG3 ARG 34 HG3 ARG 34 2.937 9.589 -13.983 261 HD2 ARG 34 HD2 ARG 34 3.976 12.184 -12.789 262 HD3 ARG 34 HD3 ARG 34 4.697 11.381 -14.184 263 HE ARG 34 HE ARG 34 2.077 12.728 -14.079 264 HH11 ARG 34 HH11 ARG 34 4.585 11.229 -16.073 265 HH12 ARG 34 HH12 ARG 34 3.873 11.781 -17.564 266 HH21 ARG 34 HH21 ARG 34 1.170 13.406 -16.046 267 HH22 ARG 34 HH22 ARG 34 1.960 13.003 -17.541 268 H ALA 35 H ALA 35 0.546 8.447 -13.346 269 HA ALA 35 HA ALA 35 -0.677 8.416 -15.844 270 HB1 ALA 35 HB1 ALA 35 1.260 8.230 -17.405 271 HB2 ALA 35 HB2 ALA 35 2.358 8.647 -16.083 272 HB3 ALA 35 HB3 ALA 35 1.183 9.830 -16.659 273 H PHE 36 H PHE 36 2.288 7.245 -14.333 274 HA PHE 36 HA PHE 36 2.021 4.563 -15.295 275 HB2 PHE 36 HB2 PHE 36 3.975 5.914 -13.386 276 HB3 PHE 36 HB3 PHE 36 4.062 4.196 -13.758 277 HD1 PHE 36 HD2 PHE 36 4.347 3.480 -16.191 278 HD2 PHE 36 HD1 PHE 36 4.938 7.516 -14.896 279 HE1 PHE 36 HE2 PHE 36 5.613 3.957 -18.241 280 HE2 PHE 36 HE1 PHE 36 6.192 7.979 -16.962 281 HZ PHE 36 HZ PHE 36 6.530 6.205 -18.626 282 H ASN 37 H ASN 37 1.316 2.809 -14.293 283 HA ASN 37 HA ASN 37 -0.274 2.948 -11.900 284 HB2 ASN 37 HB2 ASN 37 0.679 0.430 -13.342 285 HB3 ASN 37 HB3 ASN 37 -0.691 0.570 -12.247 286 HD21 ASN 37 HD21 ASN 37 -2.152 -0.230 -13.745 287 HD22 ASN 37 HD22 ASN 37 -2.637 0.642 -15.155 288 H VAL 38 H VAL 38 0.409 2.510 -9.856 289 HA VAL 38 HA VAL 38 3.126 1.779 -9.260 290 HB VAL 38 HB VAL 38 0.681 1.836 -7.433 291 HG11 VAL 38 HG11 VAL 38 3.634 1.664 -6.751 292 HG12 VAL 38 HG12 VAL 38 2.443 0.378 -6.553 293 HG13 VAL 38 HG13 VAL 38 2.323 1.846 -5.580 294 HG21 VAL 38 HG21 VAL 38 2.861 3.914 -7.834 295 HG22 VAL 38 HG22 VAL 38 1.544 4.011 -6.659 296 HG23 VAL 38 HG23 VAL 38 1.190 4.049 -8.389 297 H GLU 39 H GLU 39 3.840 -0.241 -9.521 298 HA GLU 39 HA GLU 39 1.936 -2.327 -10.162 299 HB2 GLU 39 HB2 GLU 39 4.124 -1.795 -11.441 300 HB3 GLU 39 HB3 GLU 39 4.965 -2.612 -10.130 301 HG2 GLU 39 HG2 GLU 39 4.626 -4.110 -12.038 302 HG3 GLU 39 HG3 GLU 39 3.746 -4.685 -10.621 303 H GLY 40 H GLY 40 4.170 -1.492 -7.557 304 HA2 GLY 40 HA2 GLY 40 3.073 -3.703 -5.912 305 HA3 GLY 40 HA3 GLY 40 4.820 -3.550 -6.083 306 H ILE 41 H ILE 41 3.121 -3.318 -3.699 307 HA ILE 41 HA ILE 41 4.186 -0.750 -2.689 308 HB ILE 41 HB ILE 41 1.396 -1.808 -1.947 309 HG12 ILE 41 HG12 ILE 41 2.058 0.658 -3.627 310 HG13 ILE 41 HG13 ILE 41 1.415 -0.853 -4.257 311 HG21 ILE 41 HG21 ILE 41 1.122 0.309 -0.683 312 HG22 ILE 41 HG22 ILE 41 2.770 0.782 -1.105 313 HG23 ILE 41 HG23 ILE 41 2.493 -0.625 -0.077 314 HD11 ILE 41 HD11 ILE 41 -0.003 0.987 -2.334 315 HD12 ILE 41 HD12 ILE 41 -0.642 -0.520 -2.997 316 HD13 ILE 41 HD13 ILE 41 -0.304 0.841 -4.065 317 H LEU 42 H LEU 42 4.869 -0.901 -0.558 318 HA LEU 42 HA LEU 42 4.371 -3.293 1.039 319 HB2 LEU 42 HB2 LEU 42 6.421 -3.852 -0.212 320 HB3 LEU 42 HB3 LEU 42 7.169 -2.339 0.268 321 HG LEU 42 HG LEU 42 7.358 -3.095 2.579 322 HD11 LEU 42 HD11 LEU 42 5.932 -5.631 1.748 323 HD12 LEU 42 HD12 LEU 42 5.286 -4.370 2.799 324 HD13 LEU 42 HD13 LEU 42 6.671 -5.326 3.320 325 HD21 LEU 42 HD21 LEU 42 8.901 -5.001 2.276 326 HD22 LEU 42 HD22 LEU 42 9.164 -3.735 1.080 327 HD23 LEU 42 HD23 LEU 42 8.310 -5.212 0.626 328 H CYS 43 H CYS 43 4.468 -2.787 3.242 329 HA CYS 43 HA CYS 43 5.366 -0.175 4.149 330 HB2 CYS 43 HB2 CYS 43 3.134 0.416 3.405 331 HB3 CYS 43 HB3 CYS 43 2.433 -0.982 4.212 332 HG CYS 43 HG CYS 43 4.012 1.419 6.030 333 H LEU 44 H LEU 44 6.706 -1.021 5.637 334 HA LEU 44 HA LEU 44 5.615 -2.852 7.677 335 HB2 LEU 44 HB2 LEU 44 8.368 -2.381 6.651 336 HB3 LEU 44 HB3 LEU 44 8.267 -2.565 8.393 337 HG LEU 44 HG LEU 44 7.234 -4.777 8.154 338 HD11 LEU 44 HD11 LEU 44 7.007 -5.890 5.975 339 HD12 LEU 44 HD12 LEU 44 7.442 -4.382 5.162 340 HD13 LEU 44 HD13 LEU 44 5.961 -4.479 6.118 341 HD21 LEU 44 HD21 LEU 44 9.755 -4.537 6.490 342 HD22 LEU 44 HD22 LEU 44 9.151 -6.012 7.248 343 HD23 LEU 44 HD23 LEU 44 9.673 -4.660 8.248 344 HA PRO 45 HA PRO 45 5.086 0.868 10.231 345 HB2 PRO 45 HB2 PRO 45 4.069 -0.457 12.433 346 HB3 PRO 45 HB3 PRO 45 3.094 -0.080 10.997 347 HG2 PRO 45 HG2 PRO 45 4.472 -2.658 11.699 348 HG3 PRO 45 HG3 PRO 45 2.813 -2.397 11.110 349 HD2 PRO 45 HD2 PRO 45 4.763 -3.172 9.433 350 HD3 PRO 45 HD3 PRO 45 3.508 -2.019 8.909 351 H ILE 46 H ILE 46 6.705 1.801 11.383 352 HA ILE 46 HA ILE 46 8.785 0.272 12.666 353 HB ILE 46 HB ILE 46 8.193 3.256 12.954 354 HG12 ILE 46 HG12 ILE 46 8.587 2.747 10.588 355 HG13 ILE 46 HG13 ILE 46 9.984 3.591 11.234 356 HG21 ILE 46 HG21 ILE 46 10.561 3.441 13.663 357 HG22 ILE 46 HG22 ILE 46 10.719 1.685 13.591 358 HG23 ILE 46 HG23 ILE 46 9.623 2.426 14.762 359 HD11 ILE 46 HD11 ILE 46 9.797 0.625 10.685 360 HD12 ILE 46 HD12 ILE 46 11.207 1.456 11.348 361 HD13 ILE 46 HD13 ILE 46 10.648 1.828 9.716 362 H GLN 47 H GLN 47 8.032 -0.957 14.280 363 HA GLN 47 HA GLN 47 5.879 -0.495 15.991 364 HB2 GLN 47 HB2 GLN 47 6.826 -2.371 17.362 365 HB3 GLN 47 HB3 GLN 47 6.735 -2.720 15.647 366 HG2 GLN 47 HG2 GLN 47 9.151 -2.228 15.414 367 HG3 GLN 47 HG3 GLN 47 9.243 -1.936 17.150 368 HE21 GLN 47 HE21 GLN 47 10.623 -3.926 15.472 369 HE22 GLN 47 HE22 GLN 47 10.261 -5.462 16.180 370 H ASP 48 H ASP 48 9.042 0.832 16.156 371 HA ASP 48 HA ASP 48 9.231 1.146 18.990 372 HB2 ASP 48 HB2 ASP 48 11.220 0.924 17.549 373 HB3 ASP 48 HB3 ASP 48 10.839 2.447 16.751 374 H SER 49 H SER 49 8.192 3.245 16.312 375 HA SER 49 HA SER 49 7.132 5.254 18.176 376 HB2 SER 49 HB2 SER 49 9.120 6.008 15.987 377 HB3 SER 49 HB3 SER 49 8.289 7.137 17.062 378 HG SER 49 HG SER 49 9.426 5.527 18.699 379 H ASP 50 H ASP 50 5.983 7.062 16.889 380 HA ASP 50 HA ASP 50 4.013 5.847 15.197 381 HB2 ASP 50 HB2 ASP 50 4.404 8.768 15.998 382 HB3 ASP 50 HB3 ASP 50 3.007 8.163 15.108 383 H LYS 51 H LYS 51 5.457 5.138 13.510 384 HA LYS 51 HA LYS 51 5.143 6.738 11.186 385 HB2 LYS 51 HB2 LYS 51 7.581 6.707 10.468 386 HB3 LYS 51 HB3 LYS 51 7.184 7.846 11.748 387 HG2 LYS 51 HG2 LYS 51 8.199 6.429 13.425 388 HG3 LYS 51 HG3 LYS 51 8.449 5.139 12.246 389 HD2 LYS 51 HD2 LYS 51 10.088 6.449 11.041 390 HD3 LYS 51 HD3 LYS 51 9.722 7.890 11.997 391 HE2 LYS 51 HE2 LYS 51 10.916 5.335 13.123 392 HE3 LYS 51 HE3 LYS 51 11.846 6.759 12.660 393 HZ1 LYS 51 HZ1 LYS 51 10.676 8.045 14.318 394 HZ2 LYS 51 HZ2 LYS 51 11.388 6.691 15.038 395 HZ3 LYS 51 HZ3 LYS 51 9.729 6.712 14.735 396 H SER 52 H SER 52 5.945 5.545 9.225 397 HA SER 52 HA SER 52 6.289 2.681 9.418 398 HB2 SER 52 HB2 SER 52 3.804 2.962 9.744 399 HB3 SER 52 HB3 SER 52 3.718 3.826 8.207 400 HG SER 52 HG SER 52 3.293 1.414 8.306 401 H HIS 53 H HIS 53 7.378 2.014 7.572 402 HA HIS 53 HA HIS 53 7.996 4.078 5.557 403 HB2 HIS 53 HB2 HIS 53 9.318 1.404 6.200 404 HB3 HIS 53 HB3 HIS 53 9.810 2.431 4.856 405 HD1 HIS 53 HD1 HIS 53 12.157 2.833 5.800 406 HD2 HIS 53 HD2 HIS 53 9.137 4.010 8.390 407 HE1 HIS 53 HE1 HIS 53 13.292 4.163 7.595 408 HE2 HIS 53 HE2 HIS 53 11.418 5.017 9.017 409 H ILE 54 H ILE 54 6.691 4.068 3.850 410 HA ILE 54 HA ILE 54 5.568 1.601 2.719 411 HB ILE 54 HB ILE 54 4.983 4.556 2.119 412 HG12 ILE 54 HG12 ILE 54 2.631 3.944 2.829 413 HG13 ILE 54 HG13 ILE 54 3.210 2.340 3.257 414 HG21 ILE 54 HG21 ILE 54 3.275 3.793 0.477 415 HG22 ILE 54 HG22 ILE 54 3.825 2.129 0.690 416 HG23 ILE 54 HG23 ILE 54 4.907 3.329 -0.018 417 HD11 ILE 54 HD11 ILE 54 4.109 4.911 4.546 418 HD12 ILE 54 HD12 ILE 54 4.578 3.276 5.018 419 HD13 ILE 54 HD13 ILE 54 2.903 3.797 5.193 420 H TRP 55 H TRP 55 7.077 0.609 1.454 421 HA TRP 55 HA TRP 55 8.796 2.066 -0.389 422 HB2 TRP 55 HB2 TRP 55 8.337 -0.909 0.143 423 HB3 TRP 55 HB3 TRP 55 9.488 -0.296 -1.045 424 HD1 TRP 55 HD1 TRP 55 11.649 1.053 -0.076 425 HE1 TRP 55 HE1 TRP 55 12.835 0.934 2.186 426 HE3 TRP 55 HE3 TRP 55 8.003 -1.257 2.647 427 HZ2 TRP 55 HZ2 TRP 55 12.320 0.018 4.783 428 HZ3 TRP 55 HZ3 TRP 55 8.422 -1.709 5.027 429 HH2 TRP 55 HH2 TRP 55 10.541 -1.087 6.078 430 H LEU 56 H LEU 56 7.886 2.873 -2.098 431 HA LEU 56 HA LEU 56 5.395 1.796 -3.241 432 HB2 LEU 56 HB2 LEU 56 5.674 4.174 -2.235 433 HB3 LEU 56 HB3 LEU 56 6.678 4.546 -3.618 434 HG LEU 56 HG LEU 56 4.380 5.442 -3.822 435 HD11 LEU 56 HD11 LEU 56 4.909 3.331 -5.929 436 HD12 LEU 56 HD12 LEU 56 5.620 4.944 -5.881 437 HD13 LEU 56 HD13 LEU 56 3.882 4.759 -6.096 438 HD21 LEU 56 HD21 LEU 56 3.436 2.554 -3.837 439 HD22 LEU 56 HD22 LEU 56 2.436 3.974 -4.154 440 HD23 LEU 56 HD23 LEU 56 3.149 3.741 -2.561 441 H LEU 57 H LEU 57 5.824 0.462 -4.942 442 HA LEU 57 HA LEU 57 8.255 0.746 -6.565 443 HB2 LEU 57 HB2 LEU 57 6.200 -1.461 -6.260 444 HB3 LEU 57 HB3 LEU 57 7.330 -1.464 -7.599 445 HG LEU 57 HG LEU 57 9.218 -1.680 -6.093 446 HD11 LEU 57 HD11 LEU 57 7.264 -1.564 -3.784 447 HD12 LEU 57 HD12 LEU 57 8.516 -0.380 -4.185 448 HD13 LEU 57 HD13 LEU 57 8.974 -2.000 -3.667 449 HD21 LEU 57 HD21 LEU 57 8.770 -3.924 -5.198 450 HD22 LEU 57 HD22 LEU 57 8.139 -3.723 -6.832 451 HD23 LEU 57 HD23 LEU 57 7.038 -3.679 -5.452 452 H VAL 58 H VAL 58 7.874 2.393 -7.918 453 HA VAL 58 HA VAL 58 5.978 1.882 -10.136 454 HB VAL 58 HB VAL 58 5.013 3.683 -8.602 455 HG11 VAL 58 HG11 VAL 58 7.372 5.356 -9.481 456 HG12 VAL 58 HG12 VAL 58 7.046 4.768 -7.849 457 HG13 VAL 58 HG13 VAL 58 5.960 5.944 -8.589 458 HG21 VAL 58 HG21 VAL 58 4.310 3.559 -10.951 459 HG22 VAL 58 HG22 VAL 58 5.663 4.587 -11.430 460 HG23 VAL 58 HG23 VAL 58 4.372 5.241 -10.417 461 H ASN 59 H ASN 59 6.878 2.530 -12.175 462 HA ASN 59 HA ASN 59 9.764 2.900 -12.149 463 HB2 ASN 59 HB2 ASN 59 9.413 2.937 -14.752 464 HB3 ASN 59 HB3 ASN 59 9.240 1.435 -13.858 465 HD21 ASN 59 HD21 ASN 59 8.058 0.627 -15.602 466 HD22 ASN 59 HD22 ASN 59 6.393 1.040 -15.824 467 H ASP 60 H ASP 60 10.865 4.658 -12.594 468 HA ASP 60 HA ASP 60 9.838 7.150 -11.873 469 HB2 ASP 60 HB2 ASP 60 12.133 6.553 -11.363 470 HB3 ASP 60 HB3 ASP 60 12.512 6.330 -13.068 471 H ASP 61 H ASP 61 9.517 9.022 -12.935 472 HA ASP 61 HA ASP 61 9.736 9.252 -15.843 473 HB2 ASP 61 HB2 ASP 61 7.425 8.548 -15.548 474 HB3 ASP 61 HB3 ASP 61 7.192 9.657 -14.205 475 H GLN 62 H GLN 62 9.763 11.485 -16.495 476 HA GLN 62 HA GLN 62 11.364 13.186 -14.957 477 HB2 GLN 62 HB2 GLN 62 9.541 13.944 -17.287 478 HB3 GLN 62 HB3 GLN 62 10.915 14.883 -16.711 479 HG2 GLN 62 HG2 GLN 62 12.452 13.095 -17.388 480 HG3 GLN 62 HG3 GLN 62 11.094 12.092 -17.890 481 HE21 GLN 62 HE21 GLN 62 9.614 14.274 -19.156 482 HE22 GLN 62 HE22 GLN 62 10.471 14.648 -20.612 483 H ARG 63 H ARG 63 7.846 13.199 -15.440 484 HA ARG 63 HA ARG 63 7.428 15.540 -13.755 485 HB2 ARG 63 HB2 ARG 63 5.985 15.170 -15.767 486 HB3 ARG 63 HB3 ARG 63 5.326 13.713 -15.026 487 HG2 ARG 63 HG2 ARG 63 4.353 15.037 -13.202 488 HG3 ARG 63 HG3 ARG 63 5.108 16.503 -13.822 489 HD2 ARG 63 HD2 ARG 63 3.017 14.898 -15.325 490 HD3 ARG 63 HD3 ARG 63 2.657 16.302 -14.320 491 HE ARG 63 HE ARG 63 4.125 16.301 -16.873 492 HH11 ARG 63 HH11 ARG 63 2.600 18.163 -14.289 493 HH12 ARG 63 HH12 ARG 63 2.637 19.649 -15.188 494 HH21 ARG 63 HH21 ARG 63 4.154 18.233 -18.023 495 HH22 ARG 63 HH22 ARG 63 3.522 19.686 -17.315 496 H LEU 64 H LEU 64 7.341 12.038 -13.426 497 HA LEU 64 HA LEU 64 5.782 11.682 -11.140 498 HB2 LEU 64 HB2 LEU 64 6.888 9.849 -12.493 499 HB3 LEU 64 HB3 LEU 64 8.404 10.245 -11.708 500 HG LEU 64 HG LEU 64 6.923 9.788 -9.479 501 HD11 LEU 64 HD11 LEU 64 5.385 7.937 -9.750 502 HD12 LEU 64 HD12 LEU 64 5.613 7.958 -11.501 503 HD13 LEU 64 HD13 LEU 64 4.839 9.327 -10.689 504 HD21 LEU 64 HD21 LEU 64 7.823 7.549 -9.363 505 HD22 LEU 64 HD22 LEU 64 9.022 8.643 -10.050 506 HD23 LEU 64 HD23 LEU 64 8.129 7.540 -11.102 507 H GLU 65 H GLU 65 9.151 12.702 -11.443 508 HA GLU 65 HA GLU 65 9.917 12.780 -8.734 509 HB2 GLU 65 HB2 GLU 65 10.944 14.490 -11.038 510 HB3 GLU 65 HB3 GLU 65 11.771 14.209 -9.507 511 HG2 GLU 65 HG2 GLU 65 11.908 11.788 -10.049 512 HG3 GLU 65 HG3 GLU 65 11.140 12.109 -11.600 513 H GLN 66 H GLN 66 8.222 15.112 -10.728 514 HA GLN 66 HA GLN 66 8.270 17.331 -8.927 515 HB2 GLN 66 HB2 GLN 66 7.765 17.507 -11.376 516 HB3 GLN 66 HB3 GLN 66 6.244 16.666 -11.116 517 HG2 GLN 66 HG2 GLN 66 5.535 18.547 -9.616 518 HG3 GLN 66 HG3 GLN 66 7.017 19.397 -10.046 519 HE21 GLN 66 HE21 GLN 66 6.894 18.497 -12.892 520 HE22 GLN 66 HE22 GLN 66 5.632 19.435 -13.604 521 H MET 67 H MET 67 6.112 14.573 -9.401 522 HA MET 67 HA MET 67 4.088 15.349 -7.519 523 HB2 MET 67 HB2 MET 67 4.700 12.489 -8.376 524 HB3 MET 67 HB3 MET 67 3.161 13.149 -7.828 525 HG2 MET 67 HG2 MET 67 4.551 13.709 -10.454 526 HG3 MET 67 HG3 MET 67 3.065 12.791 -10.211 527 HE1 MET 67 HE1 MET 67 1.326 14.428 -8.247 528 HE2 MET 67 HE2 MET 67 0.690 13.886 -9.798 529 HE3 MET 67 HE3 MET 67 0.482 15.563 -9.299 530 H ILE 68 H ILE 68 7.081 13.524 -7.363 531 HA ILE 68 HA ILE 68 6.945 12.598 -4.672 532 HB ILE 68 HB ILE 68 9.340 13.071 -6.517 533 HG12 ILE 68 HG12 ILE 68 7.968 10.436 -5.781 534 HG13 ILE 68 HG13 ILE 68 7.687 11.318 -7.273 535 HG21 ILE 68 HG21 ILE 68 10.666 11.632 -4.996 536 HG22 ILE 68 HG22 ILE 68 9.304 11.574 -3.874 537 HG23 ILE 68 HG23 ILE 68 10.118 13.106 -4.192 538 HD11 ILE 68 HD11 ILE 68 9.179 9.484 -7.672 539 HD12 ILE 68 HD12 ILE 68 10.280 10.041 -6.414 540 HD13 ILE 68 HD13 ILE 68 10.058 10.998 -7.883 541 H SER 69 H SER 69 8.158 15.551 -6.217 542 HA SER 69 HA SER 69 9.322 16.769 -3.916 543 HB2 SER 69 HB2 SER 69 8.250 18.050 -6.467 544 HB3 SER 69 HB3 SER 69 9.263 18.861 -5.269 545 HG SER 69 HG SER 69 10.148 16.449 -6.405 546 H GLN 70 H GLN 70 6.077 16.778 -5.330 547 HA GLN 70 HA GLN 70 4.962 18.856 -3.723 548 HB2 GLN 70 HB2 GLN 70 4.097 17.959 -5.995 549 HB3 GLN 70 HB3 GLN 70 3.409 16.613 -5.105 550 HG2 GLN 70 HG2 GLN 70 2.691 19.518 -4.599 551 HG3 GLN 70 HG3 GLN 70 1.806 18.473 -5.695 552 HE21 GLN 70 HE21 GLN 70 1.926 16.122 -3.929 553 HE22 GLN 70 HE22 GLN 70 0.830 16.454 -2.643 554 H ILE 71 H ILE 71 4.831 15.283 -3.595 555 HA ILE 71 HA ILE 71 3.067 15.036 -1.417 556 HB ILE 71 HB ILE 71 3.560 13.222 -3.098 557 HG12 ILE 71 HG12 ILE 71 3.734 12.491 -0.147 558 HG13 ILE 71 HG13 ILE 71 2.282 12.598 -1.136 559 HG21 ILE 71 HG21 ILE 71 5.474 11.743 -2.838 560 HG22 ILE 71 HG22 ILE 71 6.057 12.690 -1.466 561 HG23 ILE 71 HG23 ILE 71 6.025 13.400 -3.076 562 HD11 ILE 71 HD11 ILE 71 2.828 10.311 -0.752 563 HD12 ILE 71 HD12 ILE 71 4.468 10.538 -1.348 564 HD13 ILE 71 HD13 ILE 71 3.096 10.666 -2.457 565 H ASP 72 H ASP 72 6.554 15.332 -1.577 566 HA ASP 72 HA ASP 72 7.345 14.611 0.991 567 HB2 ASP 72 HB2 ASP 72 8.998 14.962 -0.715 568 HB3 ASP 72 HB3 ASP 72 8.453 16.609 -1.015 569 H LYS 73 H LYS 73 5.817 17.567 -0.146 570 HA LYS 73 HA LYS 73 6.496 19.153 2.182 571 HB2 LYS 73 HB2 LYS 73 4.504 19.877 0.003 572 HB3 LYS 73 HB3 LYS 73 5.355 20.970 1.092 573 HG2 LYS 73 HG2 LYS 73 6.521 19.374 -1.202 574 HG3 LYS 73 HG3 LYS 73 6.350 21.127 -1.101 575 HD2 LYS 73 HD2 LYS 73 8.045 21.203 0.689 576 HD3 LYS 73 HD3 LYS 73 8.163 19.441 0.678 577 HE2 LYS 73 HE2 LYS 73 8.937 19.586 -1.716 578 HE3 LYS 73 HE3 LYS 73 8.984 21.340 -1.541 579 HZ1 LYS 73 HZ1 LYS 73 10.632 21.107 0.193 580 HZ2 LYS 73 HZ2 LYS 73 11.154 20.277 -1.186 581 HZ3 LYS 73 HZ3 LYS 73 10.523 19.421 0.125 582 H LEU 74 H LEU 74 4.113 16.844 1.582 583 HA LEU 74 HA LEU 74 2.053 17.941 3.325 584 HB2 LEU 74 HB2 LEU 74 2.378 15.243 1.953 585 HB3 LEU 74 HB3 LEU 74 1.119 15.524 3.138 586 HG LEU 74 HG LEU 74 0.125 15.735 0.956 587 HD11 LEU 74 HD11 LEU 74 -0.703 17.323 2.633 588 HD12 LEU 74 HD12 LEU 74 -0.810 17.994 1.007 589 HD13 LEU 74 HD13 LEU 74 0.476 18.525 2.095 590 HD21 LEU 74 HD21 LEU 74 2.231 17.808 0.265 591 HD22 LEU 74 HD22 LEU 74 0.877 17.316 -0.759 592 HD23 LEU 74 HD23 LEU 74 2.146 16.162 -0.364 593 H GLU 75 H GLU 75 1.621 17.276 5.414 594 HA GLU 75 HA GLU 75 3.865 16.690 7.074 595 HB2 GLU 75 HB2 GLU 75 0.915 16.755 7.841 596 HB3 GLU 75 HB3 GLU 75 2.280 16.860 8.953 597 HG2 GLU 75 HG2 GLU 75 2.943 19.007 7.950 598 HG3 GLU 75 HG3 GLU 75 1.589 18.912 6.824 599 H ASP 76 H ASP 76 1.637 14.664 5.481 600 HA ASP 76 HA ASP 76 1.618 12.303 7.011 601 HB2 ASP 76 HB2 ASP 76 1.806 12.445 3.951 602 HB3 ASP 76 HB3 ASP 76 1.121 11.139 4.914 603 H VAL 77 H VAL 77 3.825 13.379 4.451 604 HA VAL 77 HA VAL 77 5.661 11.178 4.783 605 HB VAL 77 HB VAL 77 5.705 13.654 2.987 606 HG11 VAL 77 HG11 VAL 77 7.655 11.317 2.938 607 HG12 VAL 77 HG12 VAL 77 8.034 12.974 3.413 608 HG13 VAL 77 HG13 VAL 77 7.573 12.623 1.748 609 HG21 VAL 77 HG21 VAL 77 5.186 12.073 1.179 610 HG22 VAL 77 HG22 VAL 77 3.959 11.993 2.443 611 HG23 VAL 77 HG23 VAL 77 5.186 10.729 2.326 612 H VAL 78 H VAL 78 6.736 11.243 6.653 613 HA VAL 78 HA VAL 78 7.993 13.549 7.832 614 HB VAL 78 HB VAL 78 8.699 10.622 8.386 615 HG11 VAL 78 HG11 VAL 78 10.236 12.255 9.399 616 HG12 VAL 78 HG12 VAL 78 9.303 11.412 10.635 617 HG13 VAL 78 HG13 VAL 78 8.877 13.067 10.189 618 HG21 VAL 78 HG21 VAL 78 6.422 12.202 9.636 619 HG22 VAL 78 HG22 VAL 78 6.981 10.611 10.167 620 HG23 VAL 78 HG23 VAL 78 6.272 10.805 8.563 621 H LYS 79 H LYS 79 9.031 10.788 5.852 622 HA LYS 79 HA LYS 79 11.454 12.224 4.978 623 HB2 LYS 79 HB2 LYS 79 11.377 9.277 5.788 624 HB3 LYS 79 HB3 LYS 79 12.725 10.054 4.972 625 HG2 LYS 79 HG2 LYS 79 13.135 11.462 6.929 626 HG3 LYS 79 HG3 LYS 79 11.731 10.760 7.737 627 HD2 LYS 79 HD2 LYS 79 12.794 8.554 7.783 628 HD3 LYS 79 HD3 LYS 79 14.158 9.150 6.835 629 HE2 LYS 79 HE2 LYS 79 13.440 10.068 9.637 630 HE3 LYS 79 HE3 LYS 79 14.701 8.904 9.234 631 HZ1 LYS 79 HZ1 LYS 79 15.664 11.046 9.579 632 HZ2 LYS 79 HZ2 LYS 79 14.621 11.761 8.460 633 HZ3 LYS 79 HZ3 LYS 79 15.789 10.662 7.935 634 H VAL 80 H VAL 80 11.841 11.991 2.830 635 HA VAL 80 HA VAL 80 10.409 9.882 1.302 636 HB VAL 80 HB VAL 80 9.622 12.125 0.599 637 HG11 VAL 80 HG11 VAL 80 12.498 12.767 -0.120 638 HG12 VAL 80 HG12 VAL 80 11.555 13.508 1.171 639 HG13 VAL 80 HG13 VAL 80 11.093 13.763 -0.512 640 HG21 VAL 80 HG21 VAL 80 9.729 10.325 -1.073 641 HG22 VAL 80 HG22 VAL 80 11.363 10.814 -1.524 642 HG23 VAL 80 HG23 VAL 80 10.002 11.898 -1.826 643 H GLN 81 H GLN 81 11.718 8.452 0.268 644 HA GLN 81 HA GLN 81 14.574 9.078 -0.157 645 HB2 GLN 81 HB2 GLN 81 14.344 8.034 2.110 646 HB3 GLN 81 HB3 GLN 81 13.611 6.615 1.368 647 HG2 GLN 81 HG2 GLN 81 15.693 6.117 0.185 648 HG3 GLN 81 HG3 GLN 81 16.433 7.591 0.812 649 HE21 GLN 81 HE21 GLN 81 15.302 4.379 1.653 650 HE22 GLN 81 HE22 GLN 81 16.137 4.264 3.160 651 H ARG 82 H ARG 82 15.514 7.925 -1.831 652 HA ARG 82 HA ARG 82 13.674 6.362 -3.560 653 HB2 ARG 82 HB2 ARG 82 16.070 8.077 -4.391 654 HB3 ARG 82 HB3 ARG 82 15.045 7.136 -5.473 655 HG2 ARG 82 HG2 ARG 82 13.092 8.559 -4.716 656 HG3 ARG 82 HG3 ARG 82 14.254 9.584 -3.869 657 HD2 ARG 82 HD2 ARG 82 13.665 10.507 -6.079 658 HD3 ARG 82 HD3 ARG 82 15.380 10.087 -5.998 659 HE ARG 82 HE ARG 82 14.400 7.860 -7.070 660 HH11 ARG 82 HH11 ARG 82 13.693 11.188 -7.970 661 HH12 ARG 82 HH12 ARG 82 13.368 10.791 -9.628 662 HH21 ARG 82 HH21 ARG 82 13.997 7.368 -9.248 663 HH22 ARG 82 HH22 ARG 82 13.540 8.636 -10.342 664 H ASN 83 H ASN 83 14.148 4.354 -2.808 665 HA ASN 83 HA ASN 83 16.901 3.371 -2.589 666 HB2 ASN 83 HB2 ASN 83 14.297 1.808 -2.179 667 HB3 ASN 83 HB3 ASN 83 15.915 1.307 -1.701 668 HD21 ASN 83 HD21 ASN 83 15.414 1.082 0.457 669 HD22 ASN 83 HD22 ASN 83 15.006 2.405 1.491 670 H GLN 84 H GLN 84 17.644 1.544 -3.831 671 HA GLN 84 HA GLN 84 16.709 1.583 -6.609 672 HB2 GLN 84 HB2 GLN 84 19.090 0.074 -5.436 673 HB3 GLN 84 HB3 GLN 84 18.785 0.413 -7.141 674 HG2 GLN 84 HG2 GLN 84 19.055 2.838 -6.676 675 HG3 GLN 84 HG3 GLN 84 19.417 2.459 -4.994 676 HE21 GLN 84 HE21 GLN 84 20.619 2.438 -8.262 677 HE22 GLN 84 HE22 GLN 84 22.260 2.050 -7.870 678 H SER 85 H SER 85 16.064 -0.290 -7.738 679 HA SER 85 HA SER 85 14.352 -1.932 -6.137 680 HB2 SER 85 HB2 SER 85 13.598 -0.970 -8.282 681 HB3 SER 85 HB3 SER 85 14.748 -1.984 -9.126 682 HG SER 85 HG SER 85 12.683 -2.921 -9.125 683 H ASP 86 H ASP 86 15.739 -3.108 -4.923 684 HA ASP 86 HA ASP 86 17.356 -5.228 -6.063 685 HB2 ASP 86 HB2 ASP 86 18.134 -4.040 -4.058 686 HB3 ASP 86 HB3 ASP 86 16.640 -4.420 -3.211 687 HA PRO 87 HA PRO 87 13.765 -7.995 -6.372 688 HB2 PRO 87 HB2 PRO 87 15.151 -10.409 -6.493 689 HB3 PRO 87 HB3 PRO 87 14.974 -9.302 -7.869 690 HG2 PRO 87 HG2 PRO 87 17.280 -9.544 -5.944 691 HG3 PRO 87 HG3 PRO 87 17.309 -9.456 -7.724 692 HD2 PRO 87 HD2 PRO 87 17.825 -7.277 -6.283 693 HD3 PRO 87 HD3 PRO 87 16.817 -7.153 -7.746 694 H THR 88 H THR 88 16.310 -8.560 -4.013 695 HA THR 88 HA THR 88 14.632 -10.185 -2.250 696 HB THR 88 HB THR 88 16.786 -10.471 -0.953 697 HG1 THR 88 HG1 THR 88 17.802 -8.517 -1.743 698 HG21 THR 88 HG21 THR 88 16.139 -12.156 -2.638 699 HG22 THR 88 HG22 THR 88 17.893 -11.953 -2.599 700 HG23 THR 88 HG23 THR 88 16.947 -11.219 -3.897 701 H MET 89 H MET 89 14.923 -6.962 -2.716 702 HA MET 89 HA MET 89 15.426 -5.694 -0.332 703 HB2 MET 89 HB2 MET 89 14.936 -4.489 -2.434 704 HB3 MET 89 HB3 MET 89 13.252 -4.994 -2.365 705 HG2 MET 89 HG2 MET 89 13.556 -2.644 -1.671 706 HG3 MET 89 HG3 MET 89 12.904 -3.629 -0.356 707 HE1 MET 89 HE1 MET 89 13.551 -1.795 1.476 708 HE2 MET 89 HE2 MET 89 14.159 -0.740 0.199 709 HE3 MET 89 HE3 MET 89 15.158 -1.083 1.612 710 H PHE 90 H PHE 90 12.388 -7.253 -1.328 711 HA PHE 90 HA PHE 90 10.673 -6.459 0.728 712 HB2 PHE 90 HB2 PHE 90 10.664 -9.168 -0.689 713 HB3 PHE 90 HB3 PHE 90 9.305 -8.457 0.171 714 HD1 PHE 90 HD1 PHE 90 8.042 -6.561 -0.823 715 HD2 PHE 90 HD2 PHE 90 11.253 -8.436 -2.951 716 HE1 PHE 90 HE1 PHE 90 7.263 -5.534 -2.923 717 HE2 PHE 90 HE2 PHE 90 10.462 -7.402 -5.042 718 HZ PHE 90 HZ PHE 90 8.471 -5.958 -5.027 719 H ASN 91 H ASN 91 12.742 -9.337 0.507 720 HA ASN 91 HA ASN 91 12.066 -10.371 3.092 721 HB2 ASN 91 HB2 ASN 91 12.881 -11.785 1.150 722 HB3 ASN 91 HB3 ASN 91 14.489 -11.099 1.376 723 HD21 ASN 91 HD21 ASN 91 15.568 -12.921 2.048 724 HD22 ASN 91 HD22 ASN 91 15.179 -13.834 3.463 725 H LYS 92 H LYS 92 14.572 -8.277 1.782 726 HA LYS 92 HA LYS 92 16.592 -8.322 3.670 727 HB2 LYS 92 HB2 LYS 92 16.575 -6.992 1.513 728 HB3 LYS 92 HB3 LYS 92 15.564 -5.789 2.304 729 HG2 LYS 92 HG2 LYS 92 17.473 -5.534 4.016 730 HG3 LYS 92 HG3 LYS 92 18.458 -6.488 2.907 731 HD2 LYS 92 HD2 LYS 92 17.198 -3.770 2.386 732 HD3 LYS 92 HD3 LYS 92 18.916 -4.142 2.525 733 HE2 LYS 92 HE2 LYS 92 17.051 -5.027 0.294 734 HE3 LYS 92 HE3 LYS 92 18.315 -3.806 0.186 735 HZ1 LYS 92 HZ1 LYS 92 19.007 -5.916 -0.764 736 HZ2 LYS 92 HZ2 LYS 92 18.761 -6.692 0.716 737 HZ3 LYS 92 HZ3 LYS 92 19.962 -5.516 0.570 738 H ILE 93 H ILE 93 13.823 -6.038 3.669 739 HA ILE 93 HA ILE 93 14.511 -5.160 6.367 740 HB ILE 93 HB ILE 93 12.844 -3.483 6.256 741 HG12 ILE 93 HG12 ILE 93 10.998 -4.906 5.226 742 HG13 ILE 93 HG13 ILE 93 11.082 -3.255 4.652 743 HG21 ILE 93 HG21 ILE 93 14.146 -3.697 3.514 744 HG22 ILE 93 HG22 ILE 93 14.861 -2.989 4.964 745 HG23 ILE 93 HG23 ILE 93 13.457 -2.228 4.214 746 HD11 ILE 93 HD11 ILE 93 12.113 -5.657 3.176 747 HD12 ILE 93 HD12 ILE 93 12.093 -3.989 2.593 748 HD13 ILE 93 HD13 ILE 93 10.582 -4.838 2.895 749 H ALA 94 H ALA 94 12.204 -7.400 4.930 750 HA ALA 94 HA ALA 94 10.346 -7.672 7.016 751 HB1 ALA 94 HB1 ALA 94 9.874 -9.904 6.098 752 HB2 ALA 94 HB2 ALA 94 11.375 -9.852 5.168 753 HB3 ALA 94 HB3 ALA 94 10.072 -8.721 4.802 754 H VAL 95 H VAL 95 13.419 -9.455 6.543 755 HA VAL 95 HA VAL 95 13.242 -10.915 9.025 756 HB VAL 95 HB VAL 95 15.540 -11.693 8.561 757 HG11 VAL 95 HG11 VAL 95 13.795 -11.771 6.075 758 HG12 VAL 95 HG12 VAL 95 13.665 -12.845 7.471 759 HG13 VAL 95 HG13 VAL 95 15.110 -12.887 6.460 760 HG21 VAL 95 HG21 VAL 95 15.525 -9.794 6.181 761 HG22 VAL 95 HG22 VAL 95 16.771 -10.993 6.536 762 HG23 VAL 95 HG23 VAL 95 16.518 -9.635 7.632 763 H PHE 96 H PHE 96 14.384 -7.789 8.135 764 HA PHE 96 HA PHE 96 16.120 -7.339 10.394 765 HB2 PHE 96 HB2 PHE 96 16.463 -6.104 8.294 766 HB3 PHE 96 HB3 PHE 96 14.860 -5.390 8.410 767 HD1 PHE 96 HD1 PHE 96 18.132 -5.585 10.236 768 HD2 PHE 96 HD2 PHE 96 14.627 -3.255 9.464 769 HE1 PHE 96 HE1 PHE 96 19.089 -3.714 11.508 770 HE2 PHE 96 HE2 PHE 96 15.598 -1.385 10.741 771 HZ PHE 96 HZ PHE 96 17.826 -1.617 11.765 772 H PHE 97 H PHE 97 12.730 -6.857 9.650 773 HA PHE 97 HA PHE 97 12.044 -5.149 11.829 774 HB2 PHE 97 HB2 PHE 97 10.642 -5.331 9.792 775 HB3 PHE 97 HB3 PHE 97 10.286 -7.014 10.167 776 HD1 PHE 97 HD1 PHE 97 10.081 -3.636 11.841 777 HD2 PHE 97 HD2 PHE 97 8.192 -7.422 11.183 778 HE1 PHE 97 HE1 PHE 97 8.152 -2.918 13.187 779 HE2 PHE 97 HE2 PHE 97 6.266 -6.686 12.529 780 HZ PHE 97 HZ PHE 97 6.248 -4.438 13.533 781 H GLN 98 H GLN 98 12.036 -8.651 11.341 782 HA GLN 98 HA GLN 98 10.843 -9.343 13.837 783 HB2 GLN 98 HB2 GLN 98 10.830 -10.850 11.845 784 HB3 GLN 98 HB3 GLN 98 12.578 -11.028 11.969 785 HG2 GLN 98 HG2 GLN 98 12.296 -12.087 14.199 786 HG3 GLN 98 HG3 GLN 98 10.548 -11.922 14.036 787 HE21 GLN 98 HE21 GLN 98 10.227 -14.151 14.198 788 HE22 GLN 98 HE22 GLN 98 10.654 -15.245 12.931 789 H1 GLY 1 H1 GLY 1 -12.338 0.788 18.247 790 H2 GLY 1 H2 GLY 1 -13.433 1.141 19.483 791 H3 GLY 1 H3 GLY 1 -13.911 1.275 17.869 792 HA2 GLY 1 HA3 GLY 1 -14.822 -0.717 18.826 793 HA3 GLY 1 HA2 GLY 1 -13.666 -1.090 17.553 794 H SER 2 H SER 2 -13.734 -3.195 18.696 795 HA SER 2 HA SER 2 -12.200 -3.360 21.204 796 HB2 SER 2 HB2 SER 2 -13.674 -5.556 19.669 797 HB3 SER 2 HB3 SER 2 -13.013 -5.671 21.305 798 HG SER 2 HG SER 2 -14.506 -3.765 21.672 799 H MET 3 H MET 3 -10.077 -2.999 20.513 800 HA MET 3 HA MET 3 -8.897 -4.996 18.651 801 HB2 MET 3 HB2 MET 3 -7.203 -3.347 18.009 802 HB3 MET 3 HB3 MET 3 -8.813 -2.711 17.701 803 HG2 MET 3 HG2 MET 3 -7.101 -1.977 20.090 804 HG3 MET 3 HG3 MET 3 -7.248 -1.020 18.613 805 HE1 MET 3 HE1 MET 3 -9.309 1.263 20.990 806 HE2 MET 3 HE2 MET 3 -8.031 1.180 19.778 807 HE3 MET 3 HE3 MET 3 -7.799 0.429 21.357 808 H GLN 4 H GLN 4 -6.565 -5.325 19.014 809 HA GLN 4 HA GLN 4 -5.767 -5.531 21.856 810 HB2 GLN 4 HB2 GLN 4 -5.557 -7.771 19.771 811 HB3 GLN 4 HB3 GLN 4 -5.105 -7.883 21.469 812 HG2 GLN 4 HG2 GLN 4 -7.433 -7.757 22.159 813 HG3 GLN 4 HG3 GLN 4 -7.945 -7.408 20.506 814 HE21 GLN 4 HE21 GLN 4 -9.326 -9.180 20.369 815 HE22 GLN 4 HE22 GLN 4 -8.763 -10.811 20.330 816 H ASN 5 H ASN 5 -3.282 -6.925 21.173 817 HA ASN 5 HA ASN 5 -1.887 -5.563 19.077 818 HB2 ASN 5 HB2 ASN 5 -0.292 -4.265 20.550 819 HB3 ASN 5 HB3 ASN 5 -1.929 -3.628 20.527 820 HD21 ASN 5 HD21 ASN 5 -3.246 -3.913 22.419 821 HD22 ASN 5 HD22 ASN 5 -2.533 -4.215 23.965 822 H THR 6 H THR 6 -1.601 -7.984 18.782 823 HA THR 6 HA THR 6 1.118 -8.587 19.783 824 HB THR 6 HB THR 6 0.585 -11.070 19.778 825 HG1 THR 6 HG1 THR 6 -1.973 -11.098 20.285 826 HG21 THR 6 HG21 THR 6 -0.971 -9.456 21.837 827 HG22 THR 6 HG22 THR 6 0.740 -9.879 21.939 828 HG23 THR 6 HG23 THR 6 -0.488 -11.146 22.001 829 H THR 7 H THR 7 -1.164 -10.211 17.549 830 HA THR 7 HA THR 7 0.273 -9.517 15.137 831 HB THR 7 HB THR 7 0.545 -12.059 14.521 832 HG1 THR 7 HG1 THR 7 1.093 -12.711 17.136 833 HG21 THR 7 HG21 THR 7 2.483 -10.900 16.556 834 HG22 THR 7 HG22 THR 7 2.526 -10.618 14.813 835 HG23 THR 7 HG23 THR 7 2.817 -12.237 15.454 836 H HIS 8 H HIS 8 -1.758 -12.165 16.410 837 HA HIS 8 HA HIS 8 -3.361 -12.487 14.113 838 HB2 HIS 8 HB2 HIS 8 -4.658 -14.075 15.435 839 HB3 HIS 8 HB3 HIS 8 -2.954 -14.248 15.847 840 HD1 HIS 8 HD1 HIS 8 -6.252 -13.417 17.294 841 HD2 HIS 8 HD2 HIS 8 -2.269 -13.237 18.477 842 HE1 HIS 8 HE1 HIS 8 -6.297 -13.042 19.774 843 HE2 HIS 8 HE2 HIS 8 -3.890 -12.752 20.430 844 H ASP 9 H ASP 9 -3.577 -10.117 16.524 845 HA ASP 9 HA ASP 9 -6.260 -9.385 16.695 846 HB2 ASP 9 HB2 ASP 9 -4.649 -8.309 18.126 847 HB3 ASP 9 HB3 ASP 9 -3.688 -7.761 16.757 848 H ASN 10 H ASN 10 -3.793 -8.242 14.338 849 HA ASN 10 HA ASN 10 -5.790 -6.841 12.786 850 HB2 ASN 10 HB2 ASN 10 -3.983 -6.207 11.256 851 HB3 ASN 10 HB3 ASN 10 -3.506 -5.904 12.918 852 HD21 ASN 10 HD21 ASN 10 -2.940 -7.891 10.089 853 HD22 ASN 10 HD22 ASN 10 -1.437 -8.554 10.625 854 H VAL 11 H VAL 11 -6.170 -7.284 10.535 855 HA VAL 11 HA VAL 11 -6.231 -10.157 9.886 856 HB VAL 11 HB VAL 11 -8.333 -9.704 8.565 857 HG11 VAL 11 HG11 VAL 11 -8.552 -9.072 11.534 858 HG12 VAL 11 HG12 VAL 11 -8.471 -10.680 10.815 859 HG13 VAL 11 HG13 VAL 11 -9.868 -9.649 10.503 860 HG21 VAL 11 HG21 VAL 11 -8.385 -6.995 9.971 861 HG22 VAL 11 HG22 VAL 11 -9.647 -7.653 8.925 862 HG23 VAL 11 HG23 VAL 11 -8.069 -7.239 8.254 863 H ILE 12 H ILE 12 -5.608 -10.721 7.874 864 HA ILE 12 HA ILE 12 -4.075 -8.720 6.350 865 HB ILE 12 HB ILE 12 -3.996 -11.753 5.985 866 HG12 ILE 12 HG12 ILE 12 -3.522 -11.235 8.376 867 HG13 ILE 12 HG13 ILE 12 -2.151 -11.947 7.545 868 HG21 ILE 12 HG21 ILE 12 -1.726 -11.366 5.134 869 HG22 ILE 12 HG22 ILE 12 -1.913 -9.633 5.402 870 HG23 ILE 12 HG23 ILE 12 -2.922 -10.453 4.209 871 HD11 ILE 12 HD11 ILE 12 -1.451 -10.207 9.054 872 HD12 ILE 12 HD12 ILE 12 -2.498 -9.038 8.253 873 HD13 ILE 12 HD13 ILE 12 -1.116 -9.723 7.393 874 H LEU 13 H LEU 13 -5.756 -7.775 5.178 875 HA LEU 13 HA LEU 13 -7.797 -9.436 3.919 876 HB2 LEU 13 HB2 LEU 13 -7.409 -6.414 3.986 877 HB3 LEU 13 HB3 LEU 13 -8.800 -7.234 3.290 878 HG LEU 13 HG LEU 13 -8.007 -7.381 6.224 879 HD11 LEU 13 HD11 LEU 13 -8.735 -5.124 5.640 880 HD12 LEU 13 HD12 LEU 13 -9.913 -5.928 6.673 881 HD13 LEU 13 HD13 LEU 13 -10.225 -5.767 4.941 882 HD21 LEU 13 HD21 LEU 13 -10.211 -8.412 6.567 883 HD22 LEU 13 HD22 LEU 13 -9.211 -9.383 5.491 884 HD23 LEU 13 HD23 LEU 13 -10.508 -8.388 4.825 885 H GLU 14 H GLU 14 -7.152 -10.428 2.146 886 HA GLU 14 HA GLU 14 -5.216 -9.282 0.308 887 HB2 GLU 14 HB2 GLU 14 -5.152 -11.691 1.015 888 HB3 GLU 14 HB3 GLU 14 -6.697 -11.951 0.215 889 HG2 GLU 14 HG2 GLU 14 -5.635 -11.353 -1.960 890 HG3 GLU 14 HG3 GLU 14 -4.088 -11.173 -1.128 891 H LEU 15 H LEU 15 -6.380 -7.535 -0.505 892 HA LEU 15 HA LEU 15 -8.730 -7.950 -2.177 893 HB2 LEU 15 HB2 LEU 15 -7.011 -5.478 -1.691 894 HB3 LEU 15 HB3 LEU 15 -8.350 -5.521 -2.821 895 HG LEU 15 HG LEU 15 -9.161 -4.449 -0.884 896 HD11 LEU 15 HD11 LEU 15 -10.222 -7.265 -0.761 897 HD12 LEU 15 HD12 LEU 15 -10.745 -6.000 -1.875 898 HD13 LEU 15 HD13 LEU 15 -11.018 -5.813 -0.146 899 HD21 LEU 15 HD21 LEU 15 -7.449 -5.104 0.741 900 HD22 LEU 15 HD22 LEU 15 -8.152 -6.719 0.847 901 HD23 LEU 15 HD23 LEU 15 -9.069 -5.316 1.405 902 H THR 16 H THR 16 -8.255 -9.117 -3.927 903 HA THR 16 HA THR 16 -5.843 -8.672 -5.510 904 HB THR 16 HB THR 16 -8.291 -10.416 -6.055 905 HG1 THR 16 HG1 THR 16 -7.090 -11.231 -4.330 906 HG21 THR 16 HG21 THR 16 -6.943 -11.486 -7.821 907 HG22 THR 16 HG22 THR 16 -5.629 -10.347 -7.521 908 HG23 THR 16 HG23 THR 16 -7.167 -9.764 -8.164 909 H VAL 17 H VAL 17 -5.934 -6.664 -6.361 910 HA VAL 17 HA VAL 17 -8.376 -5.703 -7.703 911 HB VAL 17 HB VAL 17 -7.574 -3.492 -7.444 912 HG11 VAL 17 HG11 VAL 17 -6.928 -4.967 -4.859 913 HG12 VAL 17 HG12 VAL 17 -8.531 -4.430 -5.382 914 HG13 VAL 17 HG13 VAL 17 -7.291 -3.237 -4.995 915 HG21 VAL 17 HG21 VAL 17 -4.888 -4.607 -6.561 916 HG22 VAL 17 HG22 VAL 17 -5.332 -2.900 -6.510 917 HG23 VAL 17 HG23 VAL 17 -5.228 -3.735 -8.059 918 H ARG 18 H ARG 18 -8.315 -5.116 -9.871 919 HA ARG 18 HA ARG 18 -5.970 -5.938 -11.427 920 HB2 ARG 18 HB2 ARG 18 -7.409 -5.286 -13.420 921 HB3 ARG 18 HB3 ARG 18 -7.970 -6.642 -12.456 922 HG2 ARG 18 HG2 ARG 18 -9.611 -5.069 -11.346 923 HG3 ARG 18 HG3 ARG 18 -9.110 -3.828 -12.504 924 HD2 ARG 18 HD2 ARG 18 -10.357 -6.520 -13.170 925 HD3 ARG 18 HD3 ARG 18 -11.151 -4.947 -13.290 926 HE ARG 18 HE ARG 18 -9.208 -4.476 -14.952 927 HH11 ARG 18 HH11 ARG 18 -10.900 -7.555 -14.664 928 HH12 ARG 18 HH12 ARG 18 -10.609 -7.998 -16.318 929 HH21 ARG 18 HH21 ARG 18 -8.803 -5.085 -17.089 930 HH22 ARG 18 HH22 ARG 18 -9.414 -6.592 -17.693 931 H ASN 19 H ASN 19 -4.376 -4.595 -11.573 932 HA ASN 19 HA ASN 19 -4.442 -2.087 -10.317 933 HB2 ASN 19 HB2 ASN 19 -2.497 -3.579 -10.180 934 HB3 ASN 19 HB3 ASN 19 -2.213 -3.418 -11.907 935 HD21 ASN 19 HD21 ASN 19 -0.082 -2.674 -11.489 936 HD22 ASN 19 HD22 ASN 19 0.227 -1.083 -10.890 937 H HIS 20 H HIS 20 -5.885 -0.868 -11.465 938 HA HIS 20 HA HIS 20 -4.680 0.598 -13.743 939 HB2 HIS 20 HB2 HIS 20 -6.936 1.573 -14.138 940 HB3 HIS 20 HB3 HIS 20 -6.957 -0.175 -14.287 941 HD1 HIS 20 HD1 HIS 20 -8.541 -1.448 -12.782 942 HD2 HIS 20 HD2 HIS 20 -8.329 2.588 -11.825 943 HE1 HIS 20 HE1 HIS 20 -10.482 -1.010 -11.252 944 HE2 HIS 20 HE2 HIS 20 -10.192 1.375 -10.520 945 HA PRO 21 HA PRO 21 -3.495 3.813 -10.947 946 HB2 PRO 21 HB2 PRO 21 -4.439 5.881 -12.912 947 HB3 PRO 21 HB3 PRO 21 -2.809 5.610 -12.259 948 HG2 PRO 21 HG2 PRO 21 -3.388 4.958 -14.781 949 HG3 PRO 21 HG3 PRO 21 -2.310 3.935 -13.800 950 HD2 PRO 21 HD2 PRO 21 -5.215 3.504 -14.484 951 HD3 PRO 21 HD3 PRO 21 -3.881 2.329 -14.430 952 H GLY 22 H GLY 22 -4.887 3.709 -9.241 953 HA2 GLY 22 HA2 GLY 22 -6.546 5.564 -8.316 954 HA3 GLY 22 HA3 GLY 22 -7.638 4.709 -9.408 955 H VAL 23 H VAL 23 -6.466 2.048 -8.934 956 HA VAL 23 HA VAL 23 -8.291 1.071 -7.116 957 HB VAL 23 HB VAL 23 -7.011 -1.068 -7.038 958 HG11 VAL 23 HG11 VAL 23 -7.153 0.125 -9.815 959 HG12 VAL 23 HG12 VAL 23 -8.479 -0.639 -8.936 960 HG13 VAL 23 HG13 VAL 23 -7.081 -1.599 -9.425 961 HG21 VAL 23 HG21 VAL 23 -4.915 -1.363 -8.260 962 HG22 VAL 23 HG22 VAL 23 -4.711 -0.190 -6.953 963 HG23 VAL 23 HG23 VAL 23 -4.854 0.367 -8.623 964 H MET 24 H MET 24 -5.034 2.124 -6.441 965 HA MET 24 HA MET 24 -4.715 1.137 -3.802 966 HB2 MET 24 HB2 MET 24 -3.423 3.604 -5.021 967 HB3 MET 24 HB3 MET 24 -2.803 2.643 -3.688 968 HG2 MET 24 HG2 MET 24 -2.247 0.837 -5.153 969 HG3 MET 24 HG3 MET 24 -3.121 1.585 -6.496 970 HE1 MET 24 HE1 MET 24 -2.297 4.707 -6.166 971 HE2 MET 24 HE2 MET 24 -2.347 3.852 -7.711 972 HE3 MET 24 HE3 MET 24 -0.906 4.754 -7.251 973 H THR 25 H THR 25 -5.635 4.343 -5.089 974 HA THR 25 HA THR 25 -6.053 5.689 -2.660 975 HB THR 25 HB THR 25 -7.513 6.325 -5.274 976 HG1 THR 25 HG1 THR 25 -5.452 7.663 -5.517 977 HG21 THR 25 HG21 THR 25 -7.223 8.678 -4.551 978 HG22 THR 25 HG22 THR 25 -6.414 8.136 -3.078 979 HG23 THR 25 HG23 THR 25 -8.123 7.763 -3.335 980 H HIS 26 H HIS 26 -8.115 3.552 -4.507 981 HA HIS 26 HA HIS 26 -10.613 4.158 -3.240 982 HB2 HIS 26 HB2 HIS 26 -9.711 1.785 -4.933 983 HB3 HIS 26 HB3 HIS 26 -11.352 1.945 -4.308 984 HD1 HIS 26 HD1 HIS 26 -12.562 2.302 -6.524 985 HD2 HIS 26 HD2 HIS 26 -9.356 4.887 -6.042 986 HE1 HIS 26 HE1 HIS 26 -12.742 3.975 -8.387 987 HE2 HIS 26 HE2 HIS 26 -10.797 5.511 -8.071 988 H VAL 27 H VAL 27 -8.232 1.453 -2.838 989 HA VAL 27 HA VAL 27 -9.676 0.189 -0.741 990 HB VAL 27 HB VAL 27 -7.733 -1.220 -0.311 991 HG11 VAL 27 HG11 VAL 27 -8.030 -0.745 -3.300 992 HG12 VAL 27 HG12 VAL 27 -9.061 -1.765 -2.299 993 HG13 VAL 27 HG13 VAL 27 -7.372 -2.203 -2.547 994 HG21 VAL 27 HG21 VAL 27 -6.100 0.607 -2.110 995 HG22 VAL 27 HG22 VAL 27 -5.548 -0.922 -1.421 996 HG23 VAL 27 HG23 VAL 27 -5.923 0.437 -0.362 997 H CYS 28 H CYS 28 -7.014 2.501 -0.729 998 HA CYS 28 HA CYS 28 -6.544 2.643 2.033 999 HB2 CYS 28 HB2 CYS 28 -6.068 4.688 -0.175 1000 HB3 CYS 28 HB3 CYS 28 -5.386 4.792 1.449 1001 HG CYS 28 HG CYS 28 -4.219 3.238 -1.172 1002 H GLY 29 H GLY 29 -8.887 4.204 -0.049 1003 HA2 GLY 29 HA2 GLY 29 -9.763 6.312 1.595 1004 HA3 GLY 29 HA3 GLY 29 -10.692 5.541 0.315 1005 H LEU 30 H LEU 30 -11.133 3.019 1.137 1006 HA LEU 30 HA LEU 30 -13.361 3.314 2.827 1007 HB2 LEU 30 HB2 LEU 30 -11.957 0.940 1.635 1008 HB3 LEU 30 HB3 LEU 30 -13.137 0.642 2.896 1009 HG LEU 30 HG LEU 30 -14.221 0.370 0.759 1010 HD11 LEU 30 HD11 LEU 30 -15.175 2.972 1.999 1011 HD12 LEU 30 HD12 LEU 30 -15.599 1.345 2.536 1012 HD13 LEU 30 HD13 LEU 30 -16.113 1.904 0.949 1013 HD21 LEU 30 HD21 LEU 30 -14.444 2.141 -0.925 1014 HD22 LEU 30 HD22 LEU 30 -12.755 1.703 -0.682 1015 HD23 LEU 30 HD23 LEU 30 -13.385 3.195 0.019 1016 H PHE 31 H PHE 31 -10.153 2.011 3.558 1017 HA PHE 31 HA PHE 31 -10.882 1.193 6.240 1018 HB2 PHE 31 HB2 PHE 31 -8.185 1.186 4.824 1019 HB3 PHE 31 HB3 PHE 31 -8.501 0.459 6.400 1020 HD1 PHE 31 HD2 PHE 31 -10.455 -1.320 6.488 1021 HD2 PHE 31 HD1 PHE 31 -8.462 -0.174 2.883 1022 HE1 PHE 31 HE2 PHE 31 -11.247 -3.376 5.386 1023 HE2 PHE 31 HE1 PHE 31 -9.268 -2.228 1.786 1024 HZ PHE 31 HZ PHE 31 -10.659 -3.831 3.037 1025 H ALA 32 H ALA 32 -9.212 3.967 4.813 1026 HA ALA 32 HA ALA 32 -8.199 5.080 7.253 1027 HB1 ALA 32 HB1 ALA 32 -7.856 7.149 5.968 1028 HB2 ALA 32 HB2 ALA 32 -8.834 6.506 4.643 1029 HB3 ALA 32 HB3 ALA 32 -7.299 5.745 5.056 1030 H ARG 33 H ARG 33 -11.273 5.391 5.504 1031 HA ARG 33 HA ARG 33 -12.219 7.578 7.179 1032 HB2 ARG 33 HB2 ARG 33 -14.166 7.636 5.762 1033 HB3 ARG 33 HB3 ARG 33 -12.752 7.445 4.734 1034 HG2 ARG 33 HG2 ARG 33 -13.256 4.989 4.588 1035 HG3 ARG 33 HG3 ARG 33 -14.728 5.279 5.512 1036 HD2 ARG 33 HD2 ARG 33 -14.102 6.538 2.817 1037 HD3 ARG 33 HD3 ARG 33 -15.162 5.145 3.071 1038 HE ARG 33 HE ARG 33 -16.282 6.955 4.693 1039 HH11 ARG 33 HH11 ARG 33 -15.267 7.294 1.337 1040 HH12 ARG 33 HH12 ARG 33 -16.476 8.488 0.976 1041 HH21 ARG 33 HH21 ARG 33 -17.861 8.502 4.205 1042 HH22 ARG 33 HH22 ARG 33 -17.948 9.172 2.608 1043 H ARG 34 H ARG 34 -12.114 4.215 7.580 1044 HA ARG 34 HA ARG 34 -14.564 3.802 8.966 1045 HB2 ARG 34 HB2 ARG 34 -13.408 1.839 8.179 1046 HB3 ARG 34 HB3 ARG 34 -11.911 2.307 8.971 1047 HG2 ARG 34 HG2 ARG 34 -12.899 0.427 10.156 1048 HG3 ARG 34 HG3 ARG 34 -12.949 1.846 11.196 1049 HD2 ARG 34 HD2 ARG 34 -15.315 0.817 9.585 1050 HD3 ARG 34 HD3 ARG 34 -15.016 0.414 11.275 1051 HE ARG 34 HE ARG 34 -15.808 3.037 10.201 1052 HH11 ARG 34 HH11 ARG 34 -15.315 1.006 13.026 1053 HH12 ARG 34 HH12 ARG 34 -16.081 2.128 14.104 1054 HH21 ARG 34 HH21 ARG 34 -16.774 4.497 11.635 1055 HH22 ARG 34 HH22 ARG 34 -16.902 4.095 13.318 1056 H ALA 35 H ALA 35 -11.292 3.878 10.366 1057 HA ALA 35 HA ALA 35 -11.634 5.712 12.430 1058 HB1 ALA 35 HB1 ALA 35 -12.158 4.267 14.394 1059 HB2 ALA 35 HB2 ALA 35 -12.429 2.894 13.314 1060 HB3 ALA 35 HB3 ALA 35 -13.500 4.293 13.245 1061 H PHE 36 H PHE 36 -10.659 2.344 12.004 1062 HA PHE 36 HA PHE 36 -8.271 2.594 13.568 1063 HB2 PHE 36 HB2 PHE 36 -9.432 0.345 11.879 1064 HB3 PHE 36 HB3 PHE 36 -7.882 0.197 12.701 1065 HD1 PHE 36 HD2 PHE 36 -7.813 0.544 15.242 1066 HD2 PHE 36 HD1 PHE 36 -11.457 -0.086 13.091 1067 HE1 PHE 36 HE2 PHE 36 -8.936 -0.098 17.329 1068 HE2 PHE 36 HE1 PHE 36 -12.569 -0.714 15.194 1069 HZ PHE 36 HZ PHE 36 -11.310 -0.728 17.306 1070 H ASN 37 H ASN 37 -6.222 2.801 12.939 1071 HA ASN 37 HA ASN 37 -5.542 3.723 10.293 1072 HB2 ASN 37 HB2 ASN 37 -3.610 2.954 12.533 1073 HB3 ASN 37 HB3 ASN 37 -3.272 3.987 11.147 1074 HD21 ASN 37 HD21 ASN 37 -2.603 5.696 12.458 1075 HD22 ASN 37 HD22 ASN 37 -3.703 6.628 13.409 1076 H VAL 38 H VAL 38 -4.766 2.477 8.655 1077 HA VAL 38 HA VAL 38 -4.364 -0.355 8.923 1078 HB VAL 38 HB VAL 38 -3.600 1.507 6.629 1079 HG11 VAL 38 HG11 VAL 38 -3.763 -1.523 6.718 1080 HG12 VAL 38 HG12 VAL 38 -2.288 -0.563 6.605 1081 HG13 VAL 38 HG13 VAL 38 -3.445 -0.556 5.273 1082 HG21 VAL 38 HG21 VAL 38 -6.047 -0.266 6.963 1083 HG22 VAL 38 HG22 VAL 38 -5.656 0.698 5.534 1084 HG23 VAL 38 HG23 VAL 38 -6.026 1.498 7.062 1085 H GLU 39 H GLU 39 -2.606 -1.173 9.864 1086 HA GLU 39 HA GLU 39 -0.449 0.606 10.602 1087 HB2 GLU 39 HB2 GLU 39 -1.626 -1.104 12.134 1088 HB3 GLU 39 HB3 GLU 39 -0.683 -2.342 11.313 1089 HG2 GLU 39 HG2 GLU 39 0.355 -1.680 13.433 1090 HG3 GLU 39 HG3 GLU 39 1.396 -1.279 12.066 1091 H GLY 40 H GLY 40 -0.983 -2.079 8.405 1092 HA2 GLY 40 HA2 GLY 40 1.690 -1.712 7.219 1093 HA3 GLY 40 HA3 GLY 40 1.227 -3.323 7.764 1094 H ILE 41 H ILE 41 1.815 -2.337 5.068 1095 HA ILE 41 HA ILE 41 -0.594 -3.366 3.700 1096 HB ILE 41 HB ILE 41 1.045 -0.993 2.636 1097 HG12 ILE 41 HG12 ILE 41 -1.818 -0.938 3.702 1098 HG13 ILE 41 HG13 ILE 41 -0.413 -0.305 4.548 1099 HG21 ILE 41 HG21 ILE 41 -0.648 -0.859 0.826 1100 HG22 ILE 41 HG22 ILE 41 -1.466 -2.280 1.481 1101 HG23 ILE 41 HG23 ILE 41 0.167 -2.426 0.827 1102 HD11 ILE 41 HD11 ILE 41 -1.494 0.728 1.928 1103 HD12 ILE 41 HD12 ILE 41 -0.099 1.367 2.803 1104 HD13 ILE 41 HD13 ILE 41 -1.708 1.462 3.517 1105 H LEU 42 H LEU 42 -0.074 -4.602 1.897 1106 HA LEU 42 HA LEU 42 2.672 -4.793 0.921 1107 HB2 LEU 42 HB2 LEU 42 2.578 -6.480 2.719 1108 HB3 LEU 42 HB3 LEU 42 1.115 -7.173 2.038 1109 HG LEU 42 HG LEU 42 2.347 -8.046 0.123 1110 HD11 LEU 42 HD11 LEU 42 4.820 -6.713 1.249 1111 HD12 LEU 42 HD12 LEU 42 3.963 -6.246 -0.221 1112 HD13 LEU 42 HD13 LEU 42 4.771 -7.809 -0.133 1113 HD21 LEU 42 HD21 LEU 42 3.852 -9.634 1.275 1114 HD22 LEU 42 HD22 LEU 42 2.315 -9.443 2.115 1115 HD23 LEU 42 HD23 LEU 42 3.765 -8.648 2.736 1116 H CYS 43 H CYS 43 2.683 -5.421 -1.251 1117 HA CYS 43 HA CYS 43 0.244 -6.261 -2.594 1118 HB2 CYS 43 HB2 CYS 43 -0.129 -3.864 -2.569 1119 HB3 CYS 43 HB3 CYS 43 1.512 -3.543 -3.111 1120 HG CYS 43 HG CYS 43 -0.621 -5.300 -5.088 1121 H LEU 44 H LEU 44 1.208 -8.029 -3.429 1122 HA LEU 44 HA LEU 44 3.595 -7.704 -5.121 1123 HB2 LEU 44 HB2 LEU 44 2.447 -10.023 -3.652 1124 HB3 LEU 44 HB3 LEU 44 3.050 -10.404 -5.254 1125 HG LEU 44 HG LEU 44 5.283 -9.574 -4.671 1126 HD11 LEU 44 HD11 LEU 44 5.873 -8.885 -2.389 1127 HD12 LEU 44 HD12 LEU 44 4.167 -8.934 -1.933 1128 HD13 LEU 44 HD13 LEU 44 4.728 -7.780 -3.147 1129 HD21 LEU 44 HD21 LEU 44 4.246 -11.522 -2.596 1130 HD22 LEU 44 HD22 LEU 44 5.936 -11.293 -3.048 1131 HD23 LEU 44 HD23 LEU 44 4.788 -11.926 -4.224 1132 HA PRO 45 HA PRO 45 0.694 -7.489 -8.614 1133 HB2 PRO 45 HB2 PRO 45 2.642 -7.231 -10.557 1134 HB3 PRO 45 HB3 PRO 45 2.111 -5.877 -9.539 1135 HG2 PRO 45 HG2 PRO 45 4.516 -7.648 -9.193 1136 HG3 PRO 45 HG3 PRO 45 4.405 -5.875 -9.094 1137 HD2 PRO 45 HD2 PRO 45 4.439 -7.380 -6.870 1138 HD3 PRO 45 HD3 PRO 45 3.421 -5.920 -6.973 1139 H ILE 46 H ILE 46 -0.189 -9.256 -9.573 1140 HA ILE 46 HA ILE 46 1.240 -11.744 -9.870 1141 HB ILE 46 HB ILE 46 -1.457 -10.960 -11.072 1142 HG12 ILE 46 HG12 ILE 46 -1.577 -10.750 -8.634 1143 HG13 ILE 46 HG13 ILE 46 -2.463 -12.183 -9.130 1144 HG21 ILE 46 HG21 ILE 46 -1.858 -13.399 -11.225 1145 HG22 ILE 46 HG22 ILE 46 -0.217 -13.704 -10.653 1146 HG23 ILE 46 HG23 ILE 46 -0.475 -12.899 -12.203 1147 HD11 ILE 46 HD11 ILE 46 0.291 -12.136 -7.884 1148 HD12 ILE 46 HD12 ILE 46 -0.578 -13.586 -8.394 1149 HD13 ILE 46 HD13 ILE 46 -1.221 -12.583 -7.093 1150 H GLN 47 H GLN 47 2.900 -11.614 -11.242 1151 HA GLN 47 HA GLN 47 3.219 -9.931 -13.452 1152 HB2 GLN 47 HB2 GLN 47 5.184 -11.390 -14.017 1153 HB3 GLN 47 HB3 GLN 47 5.130 -10.885 -12.340 1154 HG2 GLN 47 HG2 GLN 47 4.225 -13.093 -11.689 1155 HG3 GLN 47 HG3 GLN 47 4.306 -13.613 -13.372 1156 HE21 GLN 47 HE21 GLN 47 5.634 -14.710 -10.976 1157 HE22 GLN 47 HE22 GLN 47 7.325 -14.699 -11.335 1158 H ASP 48 H ASP 48 1.455 -12.850 -13.253 1159 HA ASP 48 HA ASP 48 1.800 -13.759 -15.943 1160 HB2 ASP 48 HB2 ASP 48 1.367 -15.314 -14.078 1161 HB3 ASP 48 HB3 ASP 48 -0.211 -14.583 -13.808 1162 H SER 49 H SER 49 -0.641 -11.824 -14.227 1163 HA SER 49 HA SER 49 -1.980 -11.113 -16.745 1164 HB2 SER 49 HB2 SER 49 -3.522 -12.363 -14.428 1165 HB3 SER 49 HB3 SER 49 -4.236 -11.695 -15.895 1166 HG SER 49 HG SER 49 -2.466 -13.442 -16.703 1167 H ASP 50 H ASP 50 -3.806 -9.458 -16.322 1168 HA ASP 50 HA ASP 50 -2.747 -7.239 -14.844 1169 HB2 ASP 50 HB2 ASP 50 -5.434 -7.567 -16.257 1170 HB3 ASP 50 HB3 ASP 50 -4.843 -6.045 -15.595 1171 H LYS 51 H LYS 51 -2.681 -8.280 -12.740 1172 HA LYS 51 HA LYS 51 -4.707 -7.224 -11.060 1173 HB2 LYS 51 HB2 LYS 51 -5.248 -9.374 -9.824 1174 HB3 LYS 51 HB3 LYS 51 -5.976 -9.214 -11.416 1175 HG2 LYS 51 HG2 LYS 51 -4.400 -10.783 -12.373 1176 HG3 LYS 51 HG3 LYS 51 -3.479 -10.838 -10.867 1177 HD2 LYS 51 HD2 LYS 51 -5.307 -11.934 -9.704 1178 HD3 LYS 51 HD3 LYS 51 -6.384 -11.721 -11.089 1179 HE2 LYS 51 HE2 LYS 51 -3.859 -13.407 -11.129 1180 HE3 LYS 51 HE3 LYS 51 -5.481 -14.042 -10.851 1181 HZ1 LYS 51 HZ1 LYS 51 -6.133 -13.265 -13.039 1182 HZ2 LYS 51 HZ2 LYS 51 -4.795 -14.294 -13.152 1183 HZ3 LYS 51 HZ3 LYS 51 -4.590 -12.628 -13.300 1184 H SER 52 H SER 52 -4.153 -7.584 -8.727 1185 HA SER 52 HA SER 52 -1.418 -8.256 -8.058 1186 HB2 SER 52 HB2 SER 52 -1.208 -5.933 -9.013 1187 HB3 SER 52 HB3 SER 52 -2.381 -5.357 -7.829 1188 HG SER 52 HG SER 52 0.033 -5.226 -7.385 1189 H HIS 53 H HIS 53 -1.391 -8.869 -5.902 1190 HA HIS 53 HA HIS 53 -3.943 -8.725 -4.430 1191 HB2 HIS 53 HB2 HIS 53 -1.452 -10.437 -4.019 1192 HB3 HIS 53 HB3 HIS 53 -2.826 -10.448 -2.917 1193 HD1 HIS 53 HD1 HIS 53 -3.415 -12.900 -3.354 1194 HD2 HIS 53 HD2 HIS 53 -3.409 -10.592 -6.806 1195 HE1 HIS 53 HE1 HIS 53 -4.421 -14.351 -5.135 1196 HE2 HIS 53 HE2 HIS 53 -4.590 -12.857 -7.139 1197 H ILE 54 H ILE 54 -4.115 -7.021 -3.129 1198 HA ILE 54 HA ILE 54 -1.827 -5.896 -1.677 1199 HB ILE 54 HB ILE 54 -4.701 -4.876 -2.036 1200 HG12 ILE 54 HG12 ILE 54 -3.563 -2.873 -3.084 1201 HG13 ILE 54 HG13 ILE 54 -2.022 -3.701 -2.920 1202 HG21 ILE 54 HG21 ILE 54 -4.069 -2.880 -0.692 1203 HG22 ILE 54 HG22 ILE 54 -2.516 -3.632 -0.320 1204 HG23 ILE 54 HG23 ILE 54 -4.011 -4.359 0.272 1205 HD11 ILE 54 HD11 ILE 54 -4.332 -4.645 -4.606 1206 HD12 ILE 54 HD12 ILE 54 -2.733 -5.387 -4.501 1207 HD13 ILE 54 HD13 ILE 54 -2.914 -3.774 -5.190 1208 H TRP 55 H TRP 55 -1.419 -7.101 0.125 1209 HA TRP 55 HA TRP 55 -3.526 -8.115 1.858 1210 HB2 TRP 55 HB2 TRP 55 -0.474 -8.112 2.037 1211 HB3 TRP 55 HB3 TRP 55 -1.519 -8.836 3.260 1212 HD1 TRP 55 HD1 TRP 55 -2.949 -11.040 2.497 1213 HE1 TRP 55 HE1 TRP 55 -2.506 -12.793 0.680 1214 HE3 TRP 55 HE3 TRP 55 0.490 -8.492 -0.283 1215 HZ2 TRP 55 HZ2 TRP 55 -0.936 -13.075 -1.622 1216 HZ3 TRP 55 HZ3 TRP 55 1.410 -9.568 -2.291 1217 HH2 TRP 55 HH2 TRP 55 0.715 -11.819 -2.950 1218 H LEU 56 H LEU 56 -4.547 -6.713 3.044 1219 HA LEU 56 HA LEU 56 -3.374 -4.121 3.813 1220 HB2 LEU 56 HB2 LEU 56 -5.464 -4.418 2.299 1221 HB3 LEU 56 HB3 LEU 56 -6.309 -4.978 3.725 1222 HG LEU 56 HG LEU 56 -6.839 -2.631 3.145 1223 HD11 LEU 56 HD11 LEU 56 -5.394 -2.786 5.804 1224 HD12 LEU 56 HD12 LEU 56 -7.047 -3.319 5.492 1225 HD13 LEU 56 HD13 LEU 56 -6.634 -1.615 5.339 1226 HD21 LEU 56 HD21 LEU 56 -3.919 -2.013 3.713 1227 HD22 LEU 56 HD22 LEU 56 -5.186 -0.825 3.397 1228 HD23 LEU 56 HD23 LEU 56 -4.711 -1.959 2.135 1229 H LEU 57 H LEU 57 -2.570 -4.209 5.865 1230 HA LEU 57 HA LEU 57 -3.625 -6.079 7.868 1231 HB2 LEU 57 HB2 LEU 57 -1.103 -4.409 7.697 1232 HB3 LEU 57 HB3 LEU 57 -1.596 -5.137 9.213 1233 HG LEU 57 HG LEU 57 -1.347 -7.370 8.298 1234 HD11 LEU 57 HD11 LEU 57 -0.598 -6.106 5.649 1235 HD12 LEU 57 HD12 LEU 57 -2.034 -7.077 6.001 1236 HD13 LEU 57 HD13 LEU 57 -0.437 -7.819 6.058 1237 HD21 LEU 57 HD21 LEU 57 1.083 -7.411 7.952 1238 HD22 LEU 57 HD22 LEU 57 0.620 -6.349 9.282 1239 HD23 LEU 57 HD23 LEU 57 1.081 -5.658 7.723 1240 H VAL 58 H VAL 58 -5.482 -5.153 8.579 1241 HA VAL 58 HA VAL 58 -5.173 -2.828 10.374 1242 HB VAL 58 HB VAL 58 -6.390 -2.129 8.246 1243 HG11 VAL 58 HG11 VAL 58 -8.584 -3.997 9.158 1244 HG12 VAL 58 HG12 VAL 58 -7.585 -4.169 7.712 1245 HG13 VAL 58 HG13 VAL 58 -8.708 -2.814 7.846 1246 HG21 VAL 58 HG21 VAL 58 -6.698 -0.851 10.313 1247 HG22 VAL 58 HG22 VAL 58 -8.015 -1.919 10.803 1248 HG23 VAL 58 HG23 VAL 58 -8.199 -0.883 9.385 1249 H ASN 59 H ASN 59 -6.411 -3.097 12.320 1250 HA ASN 59 HA ASN 59 -7.224 -5.840 12.850 1251 HB2 ASN 59 HB2 ASN 59 -7.803 -4.827 15.202 1252 HB3 ASN 59 HB3 ASN 59 -6.130 -5.045 14.718 1253 HD21 ASN 59 HD21 ASN 59 -5.565 -3.549 16.307 1254 HD22 ASN 59 HD22 ASN 59 -5.741 -1.848 16.043 1255 H ASP 60 H ASP 60 -9.191 -6.615 13.040 1256 HA ASP 60 HA ASP 60 -11.244 -5.593 11.458 1257 HB2 ASP 60 HB2 ASP 60 -10.935 -7.990 11.725 1258 HB3 ASP 60 HB3 ASP 60 -11.205 -7.887 13.463 1259 H ASP 61 H ASP 61 -13.251 -4.793 11.874 1260 HA ASP 61 HA ASP 61 -14.152 -4.186 14.588 1261 HB2 ASP 61 HB2 ASP 61 -12.991 -2.144 13.936 1262 HB3 ASP 61 HB3 ASP 61 -13.765 -2.137 12.358 1263 H GLN 62 H GLN 62 -16.442 -3.768 14.623 1264 HA GLN 62 HA GLN 62 -18.003 -5.564 13.152 1265 HB2 GLN 62 HB2 GLN 62 -18.923 -3.095 14.697 1266 HB3 GLN 62 HB3 GLN 62 -19.949 -4.449 14.231 1267 HG2 GLN 62 HG2 GLN 62 -18.663 -5.948 15.686 1268 HG3 GLN 62 HG3 GLN 62 -17.586 -4.627 16.125 1269 HE21 GLN 62 HE21 GLN 62 -19.774 -2.650 16.366 1270 HE22 GLN 62 HE22 GLN 62 -20.608 -3.051 17.829 1271 H ARG 63 H ARG 63 -17.536 -2.074 12.744 1272 HA ARG 63 HA ARG 63 -19.336 -1.903 10.459 1273 HB2 ARG 63 HB2 ARG 63 -19.204 -0.017 12.091 1274 HB3 ARG 63 HB3 ARG 63 -17.525 0.263 11.631 1275 HG2 ARG 63 HG2 ARG 63 -18.201 0.854 9.354 1276 HG3 ARG 63 HG3 ARG 63 -19.877 0.435 9.701 1277 HD2 ARG 63 HD2 ARG 63 -18.355 2.666 11.077 1278 HD3 ARG 63 HD3 ARG 63 -19.403 2.896 9.678 1279 HE ARG 63 HE ARG 63 -20.246 2.113 12.393 1280 HH11 ARG 63 HH11 ARG 63 -21.146 3.207 9.165 1281 HH12 ARG 63 HH12 ARG 63 -22.778 3.581 9.619 1282 HH21 ARG 63 HH21 ARG 63 -22.358 2.615 12.971 1283 HH22 ARG 63 HH22 ARG 63 -23.462 3.241 11.791 1284 H LEU 64 H LEU 64 -15.886 -2.258 11.056 1285 HA LEU 64 HA LEU 64 -14.755 -1.410 8.650 1286 HB2 LEU 64 HB2 LEU 64 -13.494 -2.306 10.659 1287 HB3 LEU 64 HB3 LEU 64 -13.942 -3.924 10.157 1288 HG LEU 64 HG LEU 64 -12.733 -3.135 7.860 1289 HD11 LEU 64 HD11 LEU 64 -10.771 -1.772 8.257 1290 HD12 LEU 64 HD12 LEU 64 -11.237 -1.527 9.943 1291 HD13 LEU 64 HD13 LEU 64 -12.232 -0.861 8.640 1292 HD21 LEU 64 HD21 LEU 64 -10.711 -4.255 8.562 1293 HD22 LEU 64 HD22 LEU 64 -12.118 -5.111 9.188 1294 HD23 LEU 64 HD23 LEU 64 -11.159 -4.086 10.261 1295 H GLU 65 H GLU 65 -16.342 -4.468 9.434 1296 HA GLU 65 HA GLU 65 -15.927 -5.908 7.057 1297 HB2 GLU 65 HB2 GLU 65 -18.278 -6.079 8.986 1298 HB3 GLU 65 HB3 GLU 65 -17.805 -7.315 7.821 1299 HG2 GLU 65 HG2 GLU 65 -15.647 -7.586 9.014 1300 HG3 GLU 65 HG3 GLU 65 -16.166 -6.387 10.197 1301 H GLN 66 H GLN 66 -18.367 -3.526 7.906 1302 HA GLN 66 HA GLN 66 -20.065 -3.799 5.634 1303 HB2 GLN 66 HB2 GLN 66 -20.712 -2.647 7.763 1304 HB3 GLN 66 HB3 GLN 66 -19.579 -1.354 7.402 1305 HG2 GLN 66 HG2 GLN 66 -20.914 -0.858 5.333 1306 HG3 GLN 66 HG3 GLN 66 -22.088 -2.064 5.855 1307 HE21 GLN 66 HE21 GLN 66 -21.835 -1.284 8.730 1308 HE22 GLN 66 HE22 GLN 66 -22.676 0.217 8.861 1309 H MET 67 H MET 67 -17.169 -1.890 6.326 1310 HA MET 67 HA MET 67 -17.140 -0.378 3.884 1311 HB2 MET 67 HB2 MET 67 -14.698 -1.003 5.595 1312 HB3 MET 67 HB3 MET 67 -14.960 0.389 4.548 1313 HG2 MET 67 HG2 MET 67 -16.333 -0.190 7.181 1314 HG3 MET 67 HG3 MET 67 -15.150 1.075 6.857 1315 HE1 MET 67 HE1 MET 67 -15.984 2.368 4.172 1316 HE2 MET 67 HE2 MET 67 -15.721 3.362 5.604 1317 HE3 MET 67 HE3 MET 67 -17.180 3.574 4.639 1318 H ILE 68 H ILE 68 -15.849 -3.471 4.927 1319 HA ILE 68 HA ILE 68 -14.311 -4.153 2.624 1320 HB ILE 68 HB ILE 68 -15.578 -5.906 4.787 1321 HG12 ILE 68 HG12 ILE 68 -12.655 -5.052 4.477 1322 HG13 ILE 68 HG13 ILE 68 -13.800 -4.292 5.574 1323 HG21 ILE 68 HG21 ILE 68 -14.065 -7.725 4.055 1324 HG22 ILE 68 HG22 ILE 68 -13.525 -6.725 2.705 1325 HG23 ILE 68 HG23 ILE 68 -15.200 -7.267 2.782 1326 HD11 ILE 68 HD11 ILE 68 -12.387 -5.804 6.787 1327 HD12 ILE 68 HD12 ILE 68 -12.809 -7.138 5.714 1328 HD13 ILE 68 HD13 ILE 68 -14.033 -6.437 6.777 1329 H SER 69 H SER 69 -17.707 -4.567 3.545 1330 HA SER 69 HA SER 69 -18.509 -6.197 1.337 1331 HB2 SER 69 HB2 SER 69 -20.176 -4.382 3.133 1332 HB3 SER 69 HB3 SER 69 -20.824 -5.597 2.029 1333 HG SER 69 HG SER 69 -18.932 -6.325 3.977 1334 H GLN 70 H GLN 70 -18.336 -2.706 1.914 1335 HA GLN 70 HA GLN 70 -19.761 -1.861 -0.408 1336 HB2 GLN 70 HB2 GLN 70 -19.307 -0.516 1.752 1337 HB3 GLN 70 HB3 GLN 70 -17.689 -0.230 1.140 1338 HG2 GLN 70 HG2 GLN 70 -20.221 0.621 -0.303 1339 HG3 GLN 70 HG3 GLN 70 -19.341 1.652 0.810 1340 HE21 GLN 70 HE21 GLN 70 -16.687 0.831 -0.166 1341 HE22 GLN 70 HE22 GLN 70 -16.507 1.575 -1.709 1342 H ILE 71 H ILE 71 -16.293 -2.137 0.413 1343 HA ILE 71 HA ILE 71 -15.248 -1.047 -1.960 1344 HB ILE 71 HB ILE 71 -13.984 -1.260 0.212 1345 HG12 ILE 71 HG12 ILE 71 -12.620 -2.274 -2.318 1346 HG13 ILE 71 HG13 ILE 71 -12.717 -0.609 -1.755 1347 HG21 ILE 71 HG21 ILE 71 -12.823 -3.314 0.796 1348 HG22 ILE 71 HG22 ILE 71 -13.507 -4.136 -0.610 1349 HG23 ILE 71 HG23 ILE 71 -14.560 -3.611 0.702 1350 HD11 ILE 71 HD11 ILE 71 -10.522 -1.468 -1.378 1351 HD12 ILE 71 HD12 ILE 71 -11.151 -2.856 -0.499 1352 HD13 ILE 71 HD13 ILE 71 -11.305 -1.232 0.183 1353 H ASP 72 H ASP 72 -16.179 -4.312 -1.120 1354 HA ASP 72 HA ASP 72 -14.978 -5.819 -3.138 1355 HB2 ASP 72 HB2 ASP 72 -15.987 -6.942 -1.267 1356 HB3 ASP 72 HB3 ASP 72 -17.547 -6.174 -1.546 1357 H LYS 73 H LYS 73 -17.819 -3.754 -3.217 1358 HA LYS 73 HA LYS 73 -18.922 -4.880 -5.647 1359 HB2 LYS 73 HB2 LYS 73 -19.784 -2.303 -4.279 1360 HB3 LYS 73 HB3 LYS 73 -20.721 -3.297 -5.391 1361 HG2 LYS 73 HG2 LYS 73 -19.933 -3.958 -2.543 1362 HG3 LYS 73 HG3 LYS 73 -21.557 -3.648 -3.156 1363 HD2 LYS 73 HD2 LYS 73 -21.494 -5.745 -4.443 1364 HD3 LYS 73 HD3 LYS 73 -19.823 -6.028 -3.942 1365 HE2 LYS 73 HE2 LYS 73 -20.630 -6.124 -1.560 1366 HE3 LYS 73 HE3 LYS 73 -22.285 -6.024 -2.165 1367 HZ1 LYS 73 HZ1 LYS 73 -21.944 -8.085 -3.367 1368 HZ2 LYS 73 HZ2 LYS 73 -21.576 -8.313 -1.729 1369 HZ3 LYS 73 HZ3 LYS 73 -20.333 -8.154 -2.862 1370 H LEU 74 H LEU 74 -16.459 -2.642 -5.016 1371 HA LEU 74 HA LEU 74 -16.763 -1.033 -7.418 1372 HB2 LEU 74 HB2 LEU 74 -14.529 -1.261 -5.364 1373 HB3 LEU 74 HB3 LEU 74 -14.345 -0.318 -6.829 1374 HG LEU 74 HG LEU 74 -14.877 1.214 -5.062 1375 HD11 LEU 74 HD11 LEU 74 -15.948 1.709 -7.204 1376 HD12 LEU 74 HD12 LEU 74 -16.908 2.301 -5.855 1377 HD13 LEU 74 HD13 LEU 74 -17.392 0.830 -6.704 1378 HD21 LEU 74 HD21 LEU 74 -17.330 -0.446 -4.415 1379 HD22 LEU 74 HD22 LEU 74 -16.872 1.081 -3.651 1380 HD23 LEU 74 HD23 LEU 74 -15.858 -0.341 -3.450 1381 H GLU 75 H GLU 75 -15.595 -1.254 -9.314 1382 HA GLU 75 HA GLU 75 -15.012 -3.906 -10.174 1383 HB2 GLU 75 HB2 GLU 75 -14.393 -1.283 -11.591 1384 HB3 GLU 75 HB3 GLU 75 -14.460 -2.878 -12.339 1385 HG2 GLU 75 HG2 GLU 75 -16.874 -3.014 -11.821 1386 HG3 GLU 75 HG3 GLU 75 -16.800 -1.416 -11.078 1387 H ASP 76 H ASP 76 -13.068 -1.527 -8.681 1388 HA ASP 76 HA ASP 76 -10.446 -2.150 -9.457 1389 HB2 ASP 76 HB2 ASP 76 -11.379 -1.476 -6.612 1390 HB3 ASP 76 HB3 ASP 76 -9.770 -1.232 -7.283 1391 H VAL 77 H VAL 77 -12.433 -3.497 -6.840 1392 HA VAL 77 HA VAL 77 -10.541 -5.566 -6.145 1393 HB VAL 77 HB VAL 77 -13.339 -4.887 -5.105 1394 HG11 VAL 77 HG11 VAL 77 -11.421 -6.967 -3.988 1395 HG12 VAL 77 HG12 VAL 77 -12.960 -7.302 -4.781 1396 HG13 VAL 77 HG13 VAL 77 -12.936 -6.448 -3.238 1397 HG21 VAL 77 HG21 VAL 77 -12.150 -4.063 -3.117 1398 HG22 VAL 77 HG22 VAL 77 -11.579 -3.234 -4.566 1399 HG23 VAL 77 HG23 VAL 77 -10.599 -4.510 -3.837 1400 H VAL 78 H VAL 78 -10.343 -7.087 -7.661 1401 HA VAL 78 HA VAL 78 -12.475 -8.396 -9.093 1402 HB VAL 78 HB VAL 78 -9.649 -9.499 -8.646 1403 HG11 VAL 78 HG11 VAL 78 -11.221 -11.075 -9.689 1404 HG12 VAL 78 HG12 VAL 78 -9.962 -10.593 -10.825 1405 HG13 VAL 78 HG13 VAL 78 -11.581 -9.900 -10.960 1406 HG21 VAL 78 HG21 VAL 78 -10.481 -7.491 -10.774 1407 HG22 VAL 78 HG22 VAL 78 -8.925 -8.323 -10.701 1408 HG23 VAL 78 HG23 VAL 78 -9.382 -7.198 -9.422 1409 H LYS 79 H LYS 79 -10.462 -9.121 -6.257 1410 HA LYS 79 HA LYS 79 -12.447 -11.055 -5.261 1411 HB2 LYS 79 HB2 LYS 79 -9.425 -11.517 -5.224 1412 HB3 LYS 79 HB3 LYS 79 -10.602 -12.506 -4.370 1413 HG2 LYS 79 HG2 LYS 79 -11.532 -13.289 -6.482 1414 HG3 LYS 79 HG3 LYS 79 -10.452 -12.220 -7.378 1415 HD2 LYS 79 HD2 LYS 79 -8.489 -13.461 -6.581 1416 HD3 LYS 79 HD3 LYS 79 -9.504 -14.465 -5.544 1417 HE2 LYS 79 HE2 LYS 79 -9.612 -14.419 -8.579 1418 HE3 LYS 79 HE3 LYS 79 -8.791 -15.638 -7.603 1419 HZ1 LYS 79 HZ1 LYS 79 -10.938 -16.432 -8.275 1420 HZ2 LYS 79 HZ2 LYS 79 -11.699 -15.076 -7.626 1421 HZ3 LYS 79 HZ3 LYS 79 -10.944 -16.185 -6.603 1422 H VAL 80 H VAL 80 -12.797 -10.868 -3.111 1423 HA VAL 80 HA VAL 80 -10.893 -9.314 -1.443 1424 HB VAL 80 HB VAL 80 -13.090 -8.162 -1.555 1425 HG11 VAL 80 HG11 VAL 80 -14.327 -10.681 -0.395 1426 HG12 VAL 80 HG12 VAL 80 -14.585 -10.042 -2.019 1427 HG13 VAL 80 HG13 VAL 80 -15.152 -9.132 -0.617 1428 HG21 VAL 80 HG21 VAL 80 -11.763 -8.002 0.510 1429 HG22 VAL 80 HG22 VAL 80 -12.602 -9.402 1.179 1430 HG23 VAL 80 HG23 VAL 80 -13.490 -7.909 0.861 1431 H GLN 81 H GLN 81 -10.006 -10.436 0.243 1432 HA GLN 81 HA GLN 81 -11.159 -13.016 1.101 1433 HB2 GLN 81 HB2 GLN 81 -9.573 -13.473 -0.796 1434 HB3 GLN 81 HB3 GLN 81 -8.276 -12.721 0.128 1435 HG2 GLN 81 HG2 GLN 81 -8.414 -14.473 1.820 1436 HG3 GLN 81 HG3 GLN 81 -9.809 -15.188 1.010 1437 HE21 GLN 81 HE21 GLN 81 -6.348 -14.674 0.825 1438 HE22 GLN 81 HE22 GLN 81 -6.039 -15.862 -0.388 1439 H ARG 82 H ARG 82 -10.581 -13.594 3.211 1440 HA ARG 82 HA ARG 82 -9.201 -11.501 4.808 1441 HB2 ARG 82 HB2 ARG 82 -11.443 -13.389 5.684 1442 HB3 ARG 82 HB3 ARG 82 -10.614 -12.221 6.714 1443 HG2 ARG 82 HG2 ARG 82 -11.456 -10.398 5.180 1444 HG3 ARG 82 HG3 ARG 82 -12.434 -11.623 4.370 1445 HD2 ARG 82 HD2 ARG 82 -13.749 -10.385 6.043 1446 HD3 ARG 82 HD3 ARG 82 -13.612 -12.092 6.482 1447 HE ARG 82 HE ARG 82 -11.566 -11.083 7.848 1448 HH11 ARG 82 HH11 ARG 82 -14.859 -9.860 7.654 1449 HH12 ARG 82 HH12 ARG 82 -14.814 -9.156 9.237 1450 HH21 ARG 82 HH21 ARG 82 -11.540 -10.207 9.921 1451 HH22 ARG 82 HH22 ARG 82 -12.933 -9.353 10.512 1452 H ASN 83 H ASN 83 -7.173 -12.383 4.738 1453 HA ASN 83 HA ASN 83 -6.656 -15.179 5.460 1454 HB2 ASN 83 HB2 ASN 83 -4.620 -12.961 4.872 1455 HB3 ASN 83 HB3 ASN 83 -4.299 -14.688 4.947 1456 HD21 ASN 83 HD21 ASN 83 -3.471 -14.775 2.864 1457 HD22 ASN 83 HD22 ASN 83 -4.432 -14.540 1.445 1458 H GLN 84 H GLN 84 -5.299 -15.732 7.280 1459 HA GLN 84 HA GLN 84 -5.810 -14.086 9.647 1460 HB2 GLN 84 HB2 GLN 84 -4.485 -16.837 9.511 1461 HB3 GLN 84 HB3 GLN 84 -5.179 -16.057 10.934 1462 HG2 GLN 84 HG2 GLN 84 -7.422 -16.200 9.901 1463 HG3 GLN 84 HG3 GLN 84 -6.723 -16.998 8.498 1464 HE21 GLN 84 HE21 GLN 84 -7.728 -17.381 11.790 1465 HE22 GLN 84 HE22 GLN 84 -7.521 -19.094 11.869 1466 H SER 85 H SER 85 -4.163 -13.362 11.047 1467 HA SER 85 HA SER 85 -1.924 -12.332 9.600 1468 HB2 SER 85 HB2 SER 85 -3.219 -10.933 11.166 1469 HB3 SER 85 HB3 SER 85 -2.647 -11.912 12.497 1470 HG SER 85 HG SER 85 -1.398 -10.036 12.273 1471 H ASP 86 H ASP 86 -0.744 -14.092 9.094 1472 HA ASP 86 HA ASP 86 0.753 -15.565 11.098 1473 HB2 ASP 86 HB2 ASP 86 -0.018 -16.720 9.074 1474 HB3 ASP 86 HB3 ASP 86 0.784 -15.537 8.048 1475 HA PRO 87 HA PRO 87 3.931 -12.320 11.314 1476 HB2 PRO 87 HB2 PRO 87 5.982 -13.883 12.364 1477 HB3 PRO 87 HB3 PRO 87 4.640 -13.237 13.330 1478 HG2 PRO 87 HG2 PRO 87 4.907 -15.970 12.086 1479 HG3 PRO 87 HG3 PRO 87 4.428 -15.536 13.746 1480 HD2 PRO 87 HD2 PRO 87 2.563 -16.155 11.957 1481 HD3 PRO 87 HD3 PRO 87 2.296 -14.791 13.073 1482 H THR 88 H THR 88 4.572 -15.450 9.809 1483 HA THR 88 HA THR 88 6.820 -14.422 8.229 1484 HB THR 88 HB THR 88 7.062 -16.871 7.570 1485 HG1 THR 88 HG1 THR 88 4.865 -17.483 8.042 1486 HG21 THR 88 HG21 THR 88 8.415 -15.954 9.426 1487 HG22 THR 88 HG22 THR 88 7.963 -17.631 9.745 1488 HG23 THR 88 HG23 THR 88 7.113 -16.316 10.560 1489 H MET 89 H MET 89 3.613 -14.188 7.868 1490 HA MET 89 HA MET 89 2.840 -15.253 5.430 1491 HB2 MET 89 HB2 MET 89 1.268 -14.106 6.957 1492 HB3 MET 89 HB3 MET 89 2.038 -12.557 6.632 1493 HG2 MET 89 HG2 MET 89 -0.095 -12.806 5.422 1494 HG3 MET 89 HG3 MET 89 1.261 -12.639 4.302 1495 HE1 MET 89 HE1 MET 89 -0.168 -13.573 2.248 1496 HE2 MET 89 HE2 MET 89 -1.587 -13.708 3.291 1497 HE3 MET 89 HE3 MET 89 -1.082 -15.079 2.304 1498 H PHE 90 H PHE 90 4.611 -12.246 6.079 1499 HA PHE 90 HA PHE 90 4.591 -11.068 3.537 1500 HB2 PHE 90 HB2 PHE 90 6.870 -10.934 5.571 1501 HB3 PHE 90 HB3 PHE 90 6.596 -9.797 4.257 1502 HD1 PHE 90 HD1 PHE 90 4.768 -8.136 4.392 1503 HD2 PHE 90 HD2 PHE 90 5.543 -10.838 7.624 1504 HE1 PHE 90 HE1 PHE 90 3.417 -6.733 5.901 1505 HE2 PHE 90 HE2 PHE 90 4.192 -9.428 9.118 1506 HZ PHE 90 HZ PHE 90 3.134 -7.380 8.261 1507 H ASN 91 H ASN 91 6.937 -13.304 4.986 1508 HA ASN 91 HA ASN 91 8.654 -13.428 2.696 1509 HB2 ASN 91 HB2 ASN 91 9.420 -13.856 5.080 1510 HB3 ASN 91 HB3 ASN 91 8.551 -15.390 5.038 1511 HD21 ASN 91 HD21 ASN 91 10.295 -16.769 5.129 1512 HD22 ASN 91 HD22 ASN 91 11.539 -16.859 3.933 1513 H LYS 92 H LYS 92 5.875 -15.217 3.842 1514 HA LYS 92 HA LYS 92 6.086 -17.699 2.625 1515 HB2 LYS 92 HB2 LYS 92 4.310 -16.972 4.279 1516 HB3 LYS 92 HB3 LYS 92 3.502 -16.103 2.979 1517 HG2 LYS 92 HG2 LYS 92 3.341 -18.366 1.768 1518 HG3 LYS 92 HG3 LYS 92 3.849 -19.105 3.287 1519 HD2 LYS 92 HD2 LYS 92 1.323 -17.486 2.776 1520 HD3 LYS 92 HD3 LYS 92 1.431 -19.211 3.135 1521 HE2 LYS 92 HE2 LYS 92 2.077 -16.926 5.031 1522 HE3 LYS 92 HE3 LYS 92 0.680 -17.997 5.106 1523 HZ1 LYS 92 HZ1 LYS 92 2.366 -18.633 6.699 1524 HZ2 LYS 92 HZ2 LYS 92 3.511 -18.817 5.472 1525 HZ3 LYS 92 HZ3 LYS 92 2.174 -19.844 5.538 1526 H ILE 93 H ILE 93 4.373 -14.831 1.333 1527 HA ILE 93 HA ILE 93 4.022 -16.122 -1.251 1528 HB ILE 93 HB ILE 93 2.661 -14.316 -1.958 1529 HG12 ILE 93 HG12 ILE 93 4.102 -12.422 -1.037 1530 HG13 ILE 93 HG13 ILE 93 2.374 -12.181 -0.915 1531 HG21 ILE 93 HG21 ILE 93 2.036 -14.861 0.971 1532 HG22 ILE 93 HG22 ILE 93 1.566 -15.863 -0.404 1533 HG23 ILE 93 HG23 ILE 93 0.895 -14.241 -0.227 1534 HD11 ILE 93 HD11 ILE 93 4.172 -13.020 1.340 1535 HD12 ILE 93 HD12 ILE 93 2.441 -12.681 1.443 1536 HD13 ILE 93 HD13 ILE 93 3.571 -11.397 1.031 1537 H ALA 94 H ALA 94 6.228 -13.806 0.163 1538 HA ALA 94 HA ALA 94 7.270 -12.554 -2.126 1539 HB1 ALA 94 HB1 ALA 94 9.269 -12.079 -0.765 1540 HB2 ALA 94 HB2 ALA 94 8.747 -13.269 0.432 1541 HB3 ALA 94 HB3 ALA 94 7.791 -11.810 0.166 1542 H VAL 95 H VAL 95 8.378 -15.535 -0.481 1543 HA VAL 95 HA VAL 95 10.363 -16.189 -2.468 1544 HB VAL 95 HB VAL 95 10.649 -18.330 -1.293 1545 HG11 VAL 95 HG11 VAL 95 10.417 -16.012 0.657 1546 HG12 VAL 95 HG12 VAL 95 11.795 -16.362 -0.390 1547 HG13 VAL 95 HG13 VAL 95 11.365 -17.484 0.901 1548 HG21 VAL 95 HG21 VAL 95 8.261 -17.541 0.427 1549 HG22 VAL 95 HG22 VAL 95 9.311 -18.934 0.700 1550 HG23 VAL 95 HG23 VAL 95 8.310 -18.858 -0.749 1551 H PHE 96 H PHE 96 6.971 -16.656 -2.244 1552 HA PHE 96 HA PHE 96 6.803 -18.911 -4.061 1553 HB2 PHE 96 HB2 PHE 96 5.085 -18.598 -2.326 1554 HB3 PHE 96 HB3 PHE 96 4.663 -17.020 -2.976 1555 HD1 PHE 96 HD1 PHE 96 4.740 -20.661 -3.871 1556 HD2 PHE 96 HD2 PHE 96 2.917 -16.857 -4.607 1557 HE1 PHE 96 HE1 PHE 96 3.095 -21.728 -5.354 1558 HE2 PHE 96 HE2 PHE 96 1.279 -17.938 -6.094 1559 HZ PHE 96 HZ PHE 96 1.371 -20.371 -6.472 1560 H PHE 97 H PHE 97 6.889 -15.435 -4.317 1561 HA PHE 97 HA PHE 97 5.535 -15.182 -6.826 1562 HB2 PHE 97 HB2 PHE 97 5.586 -13.317 -5.232 1563 HB3 PHE 97 HB3 PHE 97 7.341 -13.223 -5.341 1564 HD1 PHE 97 HD1 PHE 97 4.548 -13.390 -7.879 1565 HD2 PHE 97 HD2 PHE 97 7.999 -11.264 -6.497 1566 HE1 PHE 97 HE1 PHE 97 4.356 -11.836 -9.767 1567 HE2 PHE 97 HE2 PHE 97 7.787 -9.707 -8.396 1568 HZ PHE 97 HZ PHE 97 5.970 -9.998 -10.034 1569 H GLN 98 H GLN 98 8.887 -15.756 -5.951 1570 HA GLN 98 HA GLN 98 10.202 -14.691 -8.170 1571 HB2 GLN 98 HB2 GLN 98 12.122 -16.119 -7.532 1572 HB3 GLN 98 HB3 GLN 98 11.413 -15.313 -6.142 1573 HG2 GLN 98 HG2 GLN 98 10.289 -17.410 -5.493 1574 HG3 GLN 98 HG3 GLN 98 10.977 -18.214 -6.903 1575 HE21 GLN 98 HE21 GLN 98 12.102 -19.739 -5.669 1576 HE22 GLN 98 HE22 GLN 98 13.468 -19.330 -4.693 Start of MODEL 17 1 H1 GLY 1 H1 GLY 1 3.211 -1.723 -22.257 2 H2 GLY 1 H2 GLY 1 2.274 -0.500 -21.570 3 H3 GLY 1 H3 GLY 1 2.772 -1.811 -20.632 4 HA2 GLY 1 HA3 GLY 1 4.564 0.207 -21.853 5 HA3 GLY 1 HA2 GLY 1 4.084 0.182 -20.166 6 H SER 2 H SER 2 4.919 -1.439 -18.784 7 HA SER 2 HA SER 2 7.612 -2.216 -19.280 8 HB2 SER 2 HB2 SER 2 5.772 -3.197 -17.043 9 HB3 SER 2 HB3 SER 2 7.541 -3.096 -17.016 10 HG SER 2 HG SER 2 7.015 -1.271 -16.048 11 H MET 3 H MET 3 8.448 -4.157 -20.011 12 HA MET 3 HA MET 3 6.943 -5.846 -21.628 13 HB2 MET 3 HB2 MET 3 9.628 -6.404 -20.299 14 HB3 MET 3 HB3 MET 3 8.923 -7.430 -21.543 15 HG2 MET 3 HG2 MET 3 8.958 -5.500 -23.107 16 HG3 MET 3 HG3 MET 3 9.779 -4.546 -21.867 17 HE1 MET 3 HE1 MET 3 12.631 -5.285 -24.490 18 HE2 MET 3 HE2 MET 3 11.690 -4.033 -23.679 19 HE3 MET 3 HE3 MET 3 10.927 -5.068 -24.892 20 H GLN 4 H GLN 4 8.404 -6.846 -18.507 21 HA GLN 4 HA GLN 4 6.053 -7.692 -17.276 22 HB2 GLN 4 HB2 GLN 4 6.149 -9.522 -19.061 23 HB3 GLN 4 HB3 GLN 4 7.634 -10.099 -18.315 24 HG2 GLN 4 HG2 GLN 4 5.663 -11.421 -17.630 25 HG3 GLN 4 HG3 GLN 4 6.428 -10.629 -16.253 26 HE21 GLN 4 HE21 GLN 4 5.318 -8.963 -15.183 27 HE22 GLN 4 HE22 GLN 4 3.638 -8.653 -15.443 28 H ASN 5 H ASN 5 9.509 -8.394 -17.670 29 HA ASN 5 HA ASN 5 9.924 -9.256 -14.948 30 HB2 ASN 5 HB2 ASN 5 11.240 -10.070 -16.967 31 HB3 ASN 5 HB3 ASN 5 12.035 -8.503 -17.017 32 HD21 ASN 5 HD21 ASN 5 13.285 -11.037 -16.698 33 HD22 ASN 5 HD22 ASN 5 14.097 -11.040 -15.172 34 H THR 6 H THR 6 9.893 -7.825 -13.328 35 HA THR 6 HA THR 6 10.685 -5.037 -13.700 36 HB THR 6 HB THR 6 8.605 -5.349 -12.542 37 HG1 THR 6 HG1 THR 6 9.010 -3.976 -10.955 38 HG21 THR 6 HG21 THR 6 8.876 -7.620 -11.624 39 HG22 THR 6 HG22 THR 6 8.385 -6.488 -10.361 40 HG23 THR 6 HG23 THR 6 10.064 -7.021 -10.462 41 H THR 7 H THR 7 12.905 -5.369 -14.040 42 HA THR 7 HA THR 7 14.609 -6.417 -11.916 43 HB THR 7 HB THR 7 16.483 -5.692 -13.468 44 HG1 THR 7 HG1 THR 7 15.772 -5.100 -15.633 45 HG21 THR 7 HG21 THR 7 14.347 -7.443 -14.739 46 HG22 THR 7 HG22 THR 7 15.619 -7.984 -13.642 47 HG23 THR 7 HG23 THR 7 16.039 -7.368 -15.241 48 H HIS 8 H HIS 8 14.533 -3.308 -13.679 49 HA HIS 8 HA HIS 8 14.597 -1.745 -11.209 50 HB2 HIS 8 HB2 HIS 8 16.578 -0.421 -11.917 51 HB3 HIS 8 HB3 HIS 8 16.996 -2.108 -11.656 52 HD1 HIS 8 HD1 HIS 8 16.767 0.499 -14.322 53 HD2 HIS 8 HD2 HIS 8 17.774 -3.520 -13.995 54 HE1 HIS 8 HE1 HIS 8 17.842 -0.110 -16.504 55 HE2 HIS 8 HE2 HIS 8 18.270 -2.580 -16.344 56 H ASP 9 H ASP 9 12.840 -2.326 -13.546 57 HA ASP 9 HA ASP 9 12.532 0.007 -15.150 58 HB2 ASP 9 HB2 ASP 9 11.568 -2.231 -15.742 59 HB3 ASP 9 HB3 ASP 9 10.461 -2.108 -14.380 60 H ASN 10 H ASN 10 11.020 -1.149 -12.151 61 HA ASN 10 HA ASN 10 9.791 1.449 -11.628 62 HB2 ASN 10 HB2 ASN 10 8.851 0.384 -9.589 63 HB3 ASN 10 HB3 ASN 10 8.445 -0.504 -11.049 64 HD21 ASN 10 HD21 ASN 10 7.965 -2.314 -9.744 65 HD22 ASN 10 HD22 ASN 10 9.218 -3.302 -9.083 66 H VAL 11 H VAL 11 10.094 2.289 -9.341 67 HA VAL 11 HA VAL 11 12.899 2.167 -8.433 68 HB VAL 11 HB VAL 11 12.771 4.627 -7.868 69 HG11 VAL 11 HG11 VAL 11 13.962 3.897 -9.891 70 HG12 VAL 11 HG12 VAL 11 13.201 5.466 -10.157 71 HG13 VAL 11 HG13 VAL 11 12.473 4.006 -10.834 72 HG21 VAL 11 HG21 VAL 11 10.260 4.654 -9.596 73 HG22 VAL 11 HG22 VAL 11 11.065 6.071 -8.918 74 HG23 VAL 11 HG23 VAL 11 10.301 4.893 -7.848 75 H ILE 12 H ILE 12 13.160 2.405 -6.219 76 HA ILE 12 HA ILE 12 10.858 1.394 -4.681 77 HB ILE 12 HB ILE 12 13.841 1.326 -4.004 78 HG12 ILE 12 HG12 ILE 12 13.327 0.036 -6.077 79 HG13 ILE 12 HG13 ILE 12 13.917 -0.975 -4.769 80 HG21 ILE 12 HG21 ILE 12 13.230 -0.459 -2.410 81 HG22 ILE 12 HG22 ILE 12 11.525 -0.214 -2.804 82 HG23 ILE 12 HG23 ILE 12 12.447 1.076 -2.026 83 HD11 ILE 12 HD11 ILE 12 11.052 -0.710 -5.660 84 HD12 ILE 12 HD12 ILE 12 11.635 -1.739 -4.348 85 HD13 ILE 12 HD13 ILE 12 12.146 -2.047 -6.006 86 H LEU 13 H LEU 13 9.821 3.308 -4.050 87 HA LEU 13 HA LEU 13 11.407 5.455 -2.756 88 HB2 LEU 13 HB2 LEU 13 8.528 5.542 -3.738 89 HB3 LEU 13 HB3 LEU 13 9.499 6.909 -3.194 90 HG LEU 13 HG LEU 13 9.995 5.265 -5.712 91 HD11 LEU 13 HD11 LEU 13 8.021 6.674 -5.898 92 HD12 LEU 13 HD12 LEU 13 9.324 7.270 -6.921 93 HD13 LEU 13 HD13 LEU 13 8.954 8.091 -5.401 94 HD21 LEU 13 HD21 LEU 13 11.720 6.932 -6.265 95 HD22 LEU 13 HD22 LEU 13 12.118 6.073 -4.780 96 HD23 LEU 13 HD23 LEU 13 11.483 7.720 -4.701 97 H GLU 14 H GLU 14 11.582 4.927 -0.593 98 HA GLU 14 HA GLU 14 9.225 3.999 0.870 99 HB2 GLU 14 HB2 GLU 14 10.746 3.971 2.883 100 HB3 GLU 14 HB3 GLU 14 11.183 2.885 1.582 101 HG2 GLU 14 HG2 GLU 14 12.908 4.487 0.828 102 HG3 GLU 14 HG3 GLU 14 12.498 5.530 2.188 103 H LEU 15 H LEU 15 7.821 5.416 1.476 104 HA LEU 15 HA LEU 15 8.575 8.090 2.409 105 HB2 LEU 15 HB2 LEU 15 5.932 6.763 1.711 106 HB3 LEU 15 HB3 LEU 15 5.971 8.241 2.656 107 HG LEU 15 HG LEU 15 5.546 8.736 0.304 108 HD11 LEU 15 HD11 LEU 15 8.263 9.726 1.134 109 HD12 LEU 15 HD12 LEU 15 6.706 10.406 1.616 110 HD13 LEU 15 HD13 LEU 15 7.202 10.461 -0.073 111 HD21 LEU 15 HD21 LEU 15 8.244 7.544 -0.364 112 HD22 LEU 15 HD22 LEU 15 7.156 8.369 -1.486 113 HD23 LEU 15 HD23 LEU 15 6.678 6.836 -0.765 114 H THR 16 H THR 16 9.228 8.118 4.437 115 HA THR 16 HA THR 16 8.252 6.304 6.492 116 HB THR 16 HB THR 16 10.164 8.685 6.644 117 HG1 THR 16 HG1 THR 16 11.010 6.888 5.493 118 HG21 THR 16 HG21 THR 16 9.544 6.597 8.774 119 HG22 THR 16 HG22 THR 16 9.024 8.287 8.821 120 HG23 THR 16 HG23 THR 16 10.745 7.884 8.903 121 H VAL 17 H VAL 17 6.253 6.751 7.233 122 HA VAL 17 HA VAL 17 5.378 9.554 7.594 123 HB VAL 17 HB VAL 17 3.245 9.110 6.676 124 HG11 VAL 17 HG11 VAL 17 4.921 9.437 4.918 125 HG12 VAL 17 HG12 VAL 17 3.639 8.364 4.354 126 HG13 VAL 17 HG13 VAL 17 5.206 7.693 4.834 127 HG21 VAL 17 HG21 VAL 17 2.717 6.947 7.658 128 HG22 VAL 17 HG22 VAL 17 3.890 6.139 6.619 129 HG23 VAL 17 HG23 VAL 17 2.440 6.861 5.916 130 H ARG 18 H ARG 18 4.059 9.919 9.379 131 HA ARG 18 HA ARG 18 3.542 7.634 11.203 132 HB2 ARG 18 HB2 ARG 18 3.007 9.396 12.908 133 HB3 ARG 18 HB3 ARG 18 4.665 9.443 12.324 134 HG2 ARG 18 HG2 ARG 18 3.988 11.350 10.805 135 HG3 ARG 18 HG3 ARG 18 2.421 11.359 11.626 136 HD2 ARG 18 HD2 ARG 18 5.141 11.844 12.885 137 HD3 ARG 18 HD3 ARG 18 3.878 13.047 12.617 138 HE ARG 18 HE ARG 18 2.626 11.248 14.192 139 HH11 ARG 18 HH11 ARG 18 5.725 12.875 14.563 140 HH12 ARG 18 HH12 ARG 18 5.671 12.839 16.292 141 HH21 ARG 18 HH21 ARG 18 2.575 11.205 16.466 142 HH22 ARG 18 HH22 ARG 18 3.881 11.890 17.379 143 H ASN 19 H ASN 19 1.356 7.354 12.033 144 HA ASN 19 HA ASN 19 -0.406 7.290 9.781 145 HB2 ASN 19 HB2 ASN 19 -0.747 6.241 12.614 146 HB3 ASN 19 HB3 ASN 19 -1.964 6.034 11.356 147 HD21 ASN 19 HD21 ASN 19 -1.803 3.792 11.324 148 HD22 ASN 19 HD22 ASN 19 -0.422 2.948 10.718 149 H HIS 20 H HIS 20 -0.687 9.508 9.479 150 HA HIS 20 HA HIS 20 -2.704 10.975 10.963 151 HB2 HIS 20 HB2 HIS 20 -1.328 11.367 8.266 152 HB3 HIS 20 HB3 HIS 20 -2.637 12.409 8.781 153 HD1 HIS 20 HD1 HIS 20 -1.708 14.545 9.584 154 HD2 HIS 20 HD2 HIS 20 0.730 11.344 10.589 155 HE1 HIS 20 HE1 HIS 20 0.254 15.543 10.778 156 HE2 HIS 20 HE2 HIS 20 1.808 13.611 11.160 157 HA PRO 21 HA PRO 21 -6.415 9.253 9.036 158 HB2 PRO 21 HB2 PRO 21 -7.257 12.051 8.286 159 HB3 PRO 21 HB3 PRO 21 -8.135 10.820 9.222 160 HG2 PRO 21 HG2 PRO 21 -7.041 12.904 10.459 161 HG3 PRO 21 HG3 PRO 21 -6.973 11.283 11.192 162 HD2 PRO 21 HD2 PRO 21 -4.801 12.786 9.739 163 HD3 PRO 21 HD3 PRO 21 -4.692 11.784 11.206 164 H GLY 22 H GLY 22 -5.564 8.199 7.277 165 HA2 GLY 22 HA2 GLY 22 -5.656 7.559 5.085 166 HA3 GLY 22 HA3 GLY 22 -6.367 9.112 4.682 167 H VAL 23 H VAL 23 -3.174 8.083 6.012 168 HA VAL 23 HA VAL 23 -1.693 9.945 4.394 169 HB VAL 23 HB VAL 23 -0.525 7.433 5.681 170 HG11 VAL 23 HG11 VAL 23 0.710 10.089 4.872 171 HG12 VAL 23 HG12 VAL 23 0.957 8.531 4.076 172 HG13 VAL 23 HG13 VAL 23 1.556 8.793 5.711 173 HG21 VAL 23 HG21 VAL 23 -1.726 8.676 7.407 174 HG22 VAL 23 HG22 VAL 23 -0.879 10.157 6.960 175 HG23 VAL 23 HG23 VAL 23 0.018 8.799 7.649 176 H MET 24 H MET 24 -2.234 6.477 4.297 177 HA MET 24 HA MET 24 -0.784 5.806 2.014 178 HB2 MET 24 HB2 MET 24 -2.292 3.763 1.945 179 HB3 MET 24 HB3 MET 24 -1.481 4.046 3.476 180 HG2 MET 24 HG2 MET 24 -4.353 4.837 2.948 181 HG3 MET 24 HG3 MET 24 -3.882 3.298 3.660 182 HE1 MET 24 HE1 MET 24 -1.425 4.224 5.564 183 HE2 MET 24 HE2 MET 24 -2.690 3.103 6.075 184 HE3 MET 24 HE3 MET 24 -2.293 4.498 7.075 185 H THR 25 H THR 25 -3.987 7.247 2.336 186 HA THR 25 HA THR 25 -4.846 6.989 -0.349 187 HB THR 25 HB THR 25 -5.588 9.268 1.540 188 HG1 THR 25 HG1 THR 25 -7.308 7.671 2.150 189 HG21 THR 25 HG21 THR 25 -7.199 7.805 -0.595 190 HG22 THR 25 HG22 THR 25 -6.522 9.429 -0.760 191 HG23 THR 25 HG23 THR 25 -7.791 9.117 0.428 192 H HIS 26 H HIS 26 -2.683 9.259 1.268 193 HA HIS 26 HA HIS 26 -2.548 11.260 -0.761 194 HB2 HIS 26 HB2 HIS 26 -0.528 10.623 1.433 195 HB3 HIS 26 HB3 HIS 26 -0.481 12.056 0.411 196 HD1 HIS 26 HD1 HIS 26 -0.517 12.756 3.184 197 HD2 HIS 26 HD2 HIS 26 -4.063 11.861 1.246 198 HE1 HIS 26 HE1 HIS 26 -2.323 13.801 4.569 199 HE2 HIS 26 HE2 HIS 26 -4.466 13.171 3.420 200 H VAL 27 H VAL 27 -0.326 8.537 0.082 201 HA VAL 27 HA VAL 27 1.569 9.028 -1.945 202 HB VAL 27 HB VAL 27 2.489 6.815 -1.567 203 HG11 VAL 27 HG11 VAL 27 2.904 8.427 0.230 204 HG12 VAL 27 HG12 VAL 27 2.797 6.799 0.893 205 HG13 VAL 27 HG13 VAL 27 1.438 7.915 1.067 206 HG21 VAL 27 HG21 VAL 27 1.401 5.056 -0.215 207 HG22 VAL 27 HG22 VAL 27 0.444 5.440 -1.648 208 HG23 VAL 27 HG23 VAL 27 -0.049 6.057 -0.071 209 H CYS 28 H CYS 28 -1.347 7.046 -1.908 210 HA CYS 28 HA CYS 28 -1.169 5.921 -4.484 211 HB2 CYS 28 HB2 CYS 28 -3.542 6.441 -2.658 212 HB3 CYS 28 HB3 CYS 28 -3.603 5.433 -4.105 213 HG CYS 28 HG CYS 28 -2.883 4.516 -1.113 214 H GLY 29 H GLY 29 -2.561 8.941 -3.270 215 HA2 GLY 29 HA2 GLY 29 -3.934 9.775 -5.595 216 HA3 GLY 29 HA3 GLY 29 -3.385 10.807 -4.288 217 H LEU 30 H LEU 30 -0.596 10.301 -4.472 218 HA LEU 30 HA LEU 30 0.127 12.269 -6.370 219 HB2 LEU 30 HB2 LEU 30 1.584 10.605 -4.365 220 HB3 LEU 30 HB3 LEU 30 2.567 11.187 -5.693 221 HG LEU 30 HG LEU 30 2.769 12.719 -3.829 222 HD11 LEU 30 HD11 LEU 30 2.177 14.839 -4.893 223 HD12 LEU 30 HD12 LEU 30 1.105 14.006 -6.021 224 HD13 LEU 30 HD13 LEU 30 2.844 13.710 -6.068 225 HD21 LEU 30 HD21 LEU 30 0.881 13.998 -2.904 226 HD22 LEU 30 HD22 LEU 30 0.668 12.268 -2.649 227 HD23 LEU 30 HD23 LEU 30 -0.249 13.087 -3.915 228 H PHE 31 H PHE 31 0.613 8.731 -6.350 229 HA PHE 31 HA PHE 31 2.037 8.815 -8.885 230 HB2 PHE 31 HB2 PHE 31 1.138 6.432 -7.226 231 HB3 PHE 31 HB3 PHE 31 2.176 6.343 -8.653 232 HD1 PHE 31 HD2 PHE 31 4.298 7.995 -8.578 233 HD2 PHE 31 HD1 PHE 31 2.236 6.539 -5.122 234 HE1 PHE 31 HE2 PHE 31 6.259 8.502 -7.181 235 HE2 PHE 31 HE1 PHE 31 4.194 7.064 -3.738 236 HZ PHE 31 HZ PHE 31 6.207 8.043 -4.760 237 H ALA 32 H ALA 32 -1.284 8.203 -7.898 238 HA ALA 32 HA ALA 32 -2.237 7.139 -10.364 239 HB1 ALA 32 HB1 ALA 32 -3.557 7.006 -8.292 240 HB2 ALA 32 HB2 ALA 32 -4.482 7.795 -9.571 241 HB3 ALA 32 HB3 ALA 32 -3.750 8.760 -8.283 242 H ARG 33 H ARG 33 -2.060 10.495 -9.110 243 HA ARG 33 HA ARG 33 -3.147 11.702 -11.496 244 HB2 ARG 33 HB2 ARG 33 -2.801 13.826 -10.413 245 HB3 ARG 33 HB3 ARG 33 -3.357 12.698 -9.181 246 HG2 ARG 33 HG2 ARG 33 -0.957 12.415 -8.456 247 HG3 ARG 33 HG3 ARG 33 -0.510 13.691 -9.592 248 HD2 ARG 33 HD2 ARG 33 -2.442 14.000 -7.265 249 HD3 ARG 33 HD3 ARG 33 -0.751 14.506 -7.255 250 HE ARG 33 HE ARG 33 -1.578 15.925 -9.310 251 HH11 ARG 33 HH11 ARG 33 -3.296 15.412 -6.276 252 HH12 ARG 33 HH12 ARG 33 -4.121 16.935 -6.351 253 HH21 ARG 33 HH21 ARG 33 -2.646 17.933 -9.373 254 HH22 ARG 33 HH22 ARG 33 -3.754 18.367 -8.108 255 H ARG 34 H ARG 34 -0.142 10.382 -10.859 256 HA ARG 34 HA ARG 34 1.627 12.280 -12.060 257 HB2 ARG 34 HB2 ARG 34 2.346 10.645 -10.351 258 HB3 ARG 34 HB3 ARG 34 1.955 9.313 -11.419 259 HG2 ARG 34 HG2 ARG 34 4.037 11.334 -12.259 260 HG3 ARG 34 HG3 ARG 34 4.451 10.086 -11.083 261 HD2 ARG 34 HD2 ARG 34 3.373 9.568 -13.875 262 HD3 ARG 34 HD3 ARG 34 5.062 9.458 -13.388 263 HE ARG 34 HE ARG 34 3.289 7.781 -11.843 264 HH11 ARG 34 HH11 ARG 34 5.241 7.894 -14.785 265 HH12 ARG 34 HH12 ARG 34 5.396 6.172 -14.877 266 HH21 ARG 34 HH21 ARG 34 3.518 5.521 -12.016 267 HH22 ARG 34 HH22 ARG 34 4.430 4.845 -13.326 268 H ALA 35 H ALA 35 0.546 9.035 -13.127 269 HA ALA 35 HA ALA 35 -0.248 9.666 -15.730 270 HB1 ALA 35 HB1 ALA 35 2.131 10.206 -16.184 271 HB2 ALA 35 HB2 ALA 35 1.642 8.776 -17.097 272 HB3 ALA 35 HB3 ALA 35 2.617 8.602 -15.631 273 H PHE 36 H PHE 36 1.779 7.194 -14.199 274 HA PHE 36 HA PHE 36 -0.210 5.076 -14.824 275 HB2 PHE 36 HB2 PHE 36 1.882 4.874 -16.161 276 HB3 PHE 36 HB3 PHE 36 2.844 4.907 -14.694 277 HD1 PHE 36 HD2 PHE 36 0.304 2.883 -16.557 278 HD2 PHE 36 HD1 PHE 36 3.323 2.866 -13.520 279 HE1 PHE 36 HE2 PHE 36 0.198 0.428 -16.453 280 HE2 PHE 36 HE1 PHE 36 3.211 0.412 -13.428 281 HZ PHE 36 HZ PHE 36 1.651 -0.810 -14.892 282 H ASN 37 H ASN 37 -0.528 3.512 -13.181 283 HA ASN 37 HA ASN 37 -0.408 4.539 -10.506 284 HB2 ASN 37 HB2 ASN 37 -1.372 1.869 -11.618 285 HB3 ASN 37 HB3 ASN 37 -1.458 2.278 -9.909 286 HD21 ASN 37 HD21 ASN 37 -2.932 2.673 -12.974 287 HD22 ASN 37 HD22 ASN 37 -4.219 3.697 -12.468 288 H VAL 38 H VAL 38 0.116 2.767 -8.743 289 HA VAL 38 HA VAL 38 2.954 2.200 -8.866 290 HB VAL 38 HB VAL 38 0.960 1.492 -6.657 291 HG11 VAL 38 HG11 VAL 38 3.061 0.236 -6.525 292 HG12 VAL 38 HG12 VAL 38 2.963 1.409 -5.205 293 HG13 VAL 38 HG13 VAL 38 3.990 1.739 -6.605 294 HG21 VAL 38 HG21 VAL 38 2.671 3.999 -6.909 295 HG22 VAL 38 HG22 VAL 38 1.693 3.558 -5.506 296 HG23 VAL 38 HG23 VAL 38 0.911 3.923 -7.045 297 H GLU 39 H GLU 39 3.857 0.195 -9.093 298 HA GLU 39 HA GLU 39 2.285 -2.023 -10.097 299 HB2 GLU 39 HB2 GLU 39 4.516 -1.359 -11.054 300 HB3 GLU 39 HB3 GLU 39 5.279 -1.818 -9.536 301 HG2 GLU 39 HG2 GLU 39 4.378 -4.168 -9.925 302 HG3 GLU 39 HG3 GLU 39 3.905 -3.636 -11.539 303 H GLY 40 H GLY 40 4.460 -1.429 -7.300 304 HA2 GLY 40 HA2 GLY 40 3.103 -3.571 -5.748 305 HA3 GLY 40 HA3 GLY 40 4.856 -3.598 -5.918 306 H ILE 41 H ILE 41 3.211 -3.297 -3.482 307 HA ILE 41 HA ILE 41 4.327 -0.743 -2.454 308 HB ILE 41 HB ILE 41 1.513 -1.775 -1.820 309 HG12 ILE 41 HG12 ILE 41 2.317 0.712 -3.400 310 HG13 ILE 41 HG13 ILE 41 1.618 -0.750 -4.084 311 HG21 ILE 41 HG21 ILE 41 1.212 0.298 -0.508 312 HG22 ILE 41 HG22 ILE 41 2.885 0.754 -0.842 313 HG23 ILE 41 HG23 ILE 41 2.539 -0.678 0.128 314 HD11 ILE 41 HD11 ILE 41 -0.449 -0.333 -2.826 315 HD12 ILE 41 HD12 ILE 41 -0.038 0.995 -3.910 316 HD13 ILE 41 HD13 ILE 41 0.254 1.152 -2.177 317 H LEU 42 H LEU 42 5.106 -0.886 -0.333 318 HA LEU 42 HA LEU 42 4.408 -3.193 1.319 319 HB2 LEU 42 HB2 LEU 42 6.417 -3.956 0.123 320 HB3 LEU 42 HB3 LEU 42 7.296 -2.521 0.623 321 HG LEU 42 HG LEU 42 7.336 -3.263 2.953 322 HD11 LEU 42 HD11 LEU 42 5.619 -5.611 2.100 323 HD12 LEU 42 HD12 LEU 42 5.124 -4.260 3.124 324 HD13 LEU 42 HD13 LEU 42 6.352 -5.387 3.693 325 HD21 LEU 42 HD21 LEU 42 9.086 -4.164 1.498 326 HD22 LEU 42 HD22 LEU 42 8.078 -5.564 1.120 327 HD23 LEU 42 HD23 LEU 42 8.668 -5.315 2.766 328 H CYS 43 H CYS 43 3.323 -1.800 2.691 329 HA CYS 43 HA CYS 43 4.714 0.380 4.040 330 HB2 CYS 43 HB2 CYS 43 2.330 0.674 3.560 331 HB3 CYS 43 HB3 CYS 43 1.936 -0.787 4.458 332 HG CYS 43 HG CYS 43 2.301 0.209 6.928 333 H LEU 44 H LEU 44 6.208 -0.290 5.405 334 HA LEU 44 HA LEU 44 5.879 -2.677 7.079 335 HB2 LEU 44 HB2 LEU 44 7.974 -2.049 5.642 336 HB3 LEU 44 HB3 LEU 44 8.315 -0.879 6.901 337 HG LEU 44 HG LEU 44 8.263 -2.898 8.542 338 HD11 LEU 44 HD11 LEU 44 8.734 -5.096 7.567 339 HD12 LEU 44 HD12 LEU 44 8.549 -4.438 5.940 340 HD13 LEU 44 HD13 LEU 44 7.163 -4.501 7.036 341 HD21 LEU 44 HD21 LEU 44 10.604 -3.449 8.085 342 HD22 LEU 44 HD22 LEU 44 10.320 -1.718 7.914 343 HD23 LEU 44 HD23 LEU 44 10.478 -2.731 6.476 344 HA PRO 45 HA PRO 45 4.829 0.524 10.233 345 HB2 PRO 45 HB2 PRO 45 3.613 -1.124 12.044 346 HB3 PRO 45 HB3 PRO 45 2.810 -0.610 10.545 347 HG2 PRO 45 HG2 PRO 45 4.172 -3.222 11.147 348 HG3 PRO 45 HG3 PRO 45 2.633 -2.924 10.303 349 HD2 PRO 45 HD2 PRO 45 5.009 -3.415 8.990 350 HD3 PRO 45 HD3 PRO 45 3.677 -2.472 8.284 351 H ILE 46 H ILE 46 6.388 1.264 11.494 352 HA ILE 46 HA ILE 46 8.372 -0.446 12.788 353 HB ILE 46 HB ILE 46 8.122 2.561 12.402 354 HG12 ILE 46 HG12 ILE 46 10.428 2.254 11.329 355 HG13 ILE 46 HG13 ILE 46 10.205 0.520 11.494 356 HG21 ILE 46 HG21 ILE 46 8.918 2.338 14.678 357 HG22 ILE 46 HG22 ILE 46 10.241 2.879 13.649 358 HG23 ILE 46 HG23 ILE 46 10.166 1.197 14.171 359 HD11 ILE 46 HD11 ILE 46 9.747 1.259 9.253 360 HD12 ILE 46 HD12 ILE 46 8.519 2.380 9.839 361 HD13 ILE 46 HD13 ILE 46 8.277 0.639 10.003 362 H GLN 47 H GLN 47 8.571 -0.695 15.002 363 HA GLN 47 HA GLN 47 6.110 -0.254 16.508 364 HB2 GLN 47 HB2 GLN 47 6.929 -1.952 18.037 365 HB3 GLN 47 HB3 GLN 47 7.084 -2.518 16.382 366 HG2 GLN 47 HG2 GLN 47 9.502 -2.024 16.423 367 HG3 GLN 47 HG3 GLN 47 9.355 -1.430 18.078 368 HE21 GLN 47 HE21 GLN 47 11.035 -3.565 17.139 369 HE22 GLN 47 HE22 GLN 47 10.542 -4.998 17.970 370 H ASP 48 H ASP 48 9.497 0.863 16.622 371 HA ASP 48 HA ASP 48 9.495 1.457 19.414 372 HB2 ASP 48 HB2 ASP 48 11.648 2.543 19.101 373 HB3 ASP 48 HB3 ASP 48 11.604 1.032 18.209 374 H SER 49 H SER 49 8.620 3.323 16.594 375 HA SER 49 HA SER 49 7.474 5.439 18.255 376 HB2 SER 49 HB2 SER 49 9.505 6.067 16.049 377 HB3 SER 49 HB3 SER 49 8.562 7.259 16.945 378 HG SER 49 HG SER 49 10.491 5.473 18.025 379 H ASP 50 H ASP 50 6.131 6.929 16.906 380 HA ASP 50 HA ASP 50 4.428 5.530 15.110 381 HB2 ASP 50 HB2 ASP 50 4.615 8.528 15.690 382 HB3 ASP 50 HB3 ASP 50 3.315 7.761 14.777 383 H LYS 51 H LYS 51 5.830 4.770 13.456 384 HA LYS 51 HA LYS 51 5.787 6.478 11.170 385 HB2 LYS 51 HB2 LYS 51 8.192 6.326 10.544 386 HB3 LYS 51 HB3 LYS 51 7.937 7.282 11.999 387 HG2 LYS 51 HG2 LYS 51 8.693 5.393 13.391 388 HG3 LYS 51 HG3 LYS 51 8.917 4.413 11.938 389 HD2 LYS 51 HD2 LYS 51 10.648 5.981 11.125 390 HD3 LYS 51 HD3 LYS 51 10.410 7.000 12.549 391 HE2 LYS 51 HE2 LYS 51 11.429 4.134 12.566 392 HE3 LYS 51 HE3 LYS 51 12.414 5.583 12.782 393 HZ1 LYS 51 HZ1 LYS 51 11.274 6.062 14.821 394 HZ2 LYS 51 HZ2 LYS 51 11.840 4.470 14.885 395 HZ3 LYS 51 HZ3 LYS 51 10.203 4.774 14.596 396 H SER 52 H SER 52 6.066 5.376 9.238 397 HA SER 52 HA SER 52 6.423 2.474 9.200 398 HB2 SER 52 HB2 SER 52 4.008 3.917 7.991 399 HB3 SER 52 HB3 SER 52 4.360 2.194 7.862 400 HG SER 52 HG SER 52 3.453 3.676 10.051 401 H HIS 53 H HIS 53 7.640 1.920 7.402 402 HA HIS 53 HA HIS 53 8.229 4.028 5.398 403 HB2 HIS 53 HB2 HIS 53 9.636 1.384 6.018 404 HB3 HIS 53 HB3 HIS 53 10.077 2.424 4.668 405 HD1 HIS 53 HD1 HIS 53 12.407 2.986 5.484 406 HD2 HIS 53 HD2 HIS 53 9.474 3.875 8.294 407 HE1 HIS 53 HE1 HIS 53 13.572 4.255 7.303 408 HE2 HIS 53 HE2 HIS 53 11.739 4.959 8.867 409 H ILE 54 H ILE 54 6.759 3.997 3.785 410 HA ILE 54 HA ILE 54 5.673 1.465 2.749 411 HB ILE 54 HB ILE 54 4.855 4.315 1.952 412 HG12 ILE 54 HG12 ILE 54 2.684 3.735 3.248 413 HG13 ILE 54 HG13 ILE 54 3.586 2.418 3.974 414 HG21 ILE 54 HG21 ILE 54 3.527 1.635 1.380 415 HG22 ILE 54 HG22 ILE 54 4.395 2.632 0.212 416 HG23 ILE 54 HG23 ILE 54 2.886 3.215 0.916 417 HD11 ILE 54 HD11 ILE 54 5.109 4.008 4.985 418 HD12 ILE 54 HD12 ILE 54 3.433 4.326 5.432 419 HD13 ILE 54 HD13 ILE 54 4.229 5.338 4.226 420 H TRP 55 H TRP 55 7.040 0.558 1.261 421 HA TRP 55 HA TRP 55 8.624 2.179 -0.569 422 HB2 TRP 55 HB2 TRP 55 8.422 -0.829 -0.110 423 HB3 TRP 55 HB3 TRP 55 9.388 -0.133 -1.409 424 HD1 TRP 55 HD1 TRP 55 11.513 1.383 -0.665 425 HE1 TRP 55 HE1 TRP 55 13.008 1.285 1.412 426 HE3 TRP 55 HE3 TRP 55 8.467 -1.334 2.371 427 HZ2 TRP 55 HZ2 TRP 55 12.922 0.213 3.995 428 HZ3 TRP 55 HZ3 TRP 55 9.256 -1.864 4.628 429 HH2 TRP 55 HH2 TRP 55 11.431 -1.110 5.436 430 H LEU 56 H LEU 56 7.373 3.101 -2.095 431 HA LEU 56 HA LEU 56 5.360 1.614 -3.582 432 HB2 LEU 56 HB2 LEU 56 6.370 4.474 -3.908 433 HB3 LEU 56 HB3 LEU 56 5.111 3.750 -4.890 434 HG LEU 56 HG LEU 56 3.968 5.109 -3.332 435 HD11 LEU 56 HD11 LEU 56 3.797 2.312 -2.200 436 HD12 LEU 56 HD12 LEU 56 2.915 2.937 -3.596 437 HD13 LEU 56 HD13 LEU 56 2.611 3.607 -1.996 438 HD21 LEU 56 HD21 LEU 56 5.776 5.565 -1.773 439 HD22 LEU 56 HD22 LEU 56 5.622 3.951 -1.074 440 HD23 LEU 56 HD23 LEU 56 4.307 5.119 -0.906 441 H LEU 57 H LEU 57 6.146 0.251 -4.998 442 HA LEU 57 HA LEU 57 8.488 0.681 -6.658 443 HB2 LEU 57 HB2 LEU 57 6.430 -1.553 -6.418 444 HB3 LEU 57 HB3 LEU 57 7.576 -1.516 -7.746 445 HG LEU 57 HG LEU 57 9.449 -1.749 -6.185 446 HD11 LEU 57 HD11 LEU 57 9.108 -2.242 -3.797 447 HD12 LEU 57 HD12 LEU 57 7.395 -1.833 -3.968 448 HD13 LEU 57 HD13 LEU 57 8.635 -0.600 -4.230 449 HD21 LEU 57 HD21 LEU 57 9.021 -4.068 -5.483 450 HD22 LEU 57 HD22 LEU 57 8.445 -3.752 -7.121 451 HD23 LEU 57 HD23 LEU 57 7.294 -3.835 -5.783 452 H VAL 58 H VAL 58 8.006 2.401 -7.963 453 HA VAL 58 HA VAL 58 5.705 2.128 -9.839 454 HB VAL 58 HB VAL 58 5.257 3.831 -8.014 455 HG11 VAL 58 HG11 VAL 58 7.526 4.656 -7.635 456 HG12 VAL 58 HG12 VAL 58 6.438 5.993 -8.012 457 HG13 VAL 58 HG13 VAL 58 7.549 5.387 -9.245 458 HG21 VAL 58 HG21 VAL 58 4.087 4.033 -10.157 459 HG22 VAL 58 HG22 VAL 58 5.420 4.981 -10.822 460 HG23 VAL 58 HG23 VAL 58 4.442 5.636 -9.504 461 H ASN 59 H ASN 59 6.197 2.802 -12.016 462 HA ASN 59 HA ASN 59 9.007 2.668 -12.611 463 HB2 ASN 59 HB2 ASN 59 8.361 2.797 -15.003 464 HB3 ASN 59 HB3 ASN 59 7.568 1.513 -14.112 465 HD21 ASN 59 HD21 ASN 59 6.009 1.334 -15.713 466 HD22 ASN 59 HD22 ASN 59 4.737 2.489 -15.903 467 H ASP 60 H ASP 60 10.406 4.183 -13.225 468 HA ASP 60 HA ASP 60 10.104 6.797 -12.268 469 HB2 ASP 60 HB2 ASP 60 12.302 5.836 -12.308 470 HB3 ASP 60 HB3 ASP 60 12.212 5.501 -14.032 471 H ASP 61 H ASP 61 9.920 8.773 -13.283 472 HA ASP 61 HA ASP 61 8.953 8.934 -16.041 473 HB2 ASP 61 HB2 ASP 61 7.050 8.212 -14.517 474 HB3 ASP 61 HB3 ASP 61 7.277 9.688 -13.600 475 H GLN 62 H GLN 62 8.611 11.264 -16.639 476 HA GLN 62 HA GLN 62 10.686 12.991 -15.773 477 HB2 GLN 62 HB2 GLN 62 8.159 13.561 -17.380 478 HB3 GLN 62 HB3 GLN 62 9.462 14.727 -17.154 479 HG2 GLN 62 HG2 GLN 62 11.027 13.313 -18.344 480 HG3 GLN 62 HG3 GLN 62 9.843 12.011 -18.434 481 HE21 GLN 62 HE21 GLN 62 8.522 11.944 -20.175 482 HE22 GLN 62 HE22 GLN 62 8.409 13.177 -21.381 483 H ARG 63 H ARG 63 7.276 12.795 -14.986 484 HA ARG 63 HA ARG 63 7.236 15.149 -13.280 485 HB2 ARG 63 HB2 ARG 63 5.114 13.097 -14.014 486 HB3 ARG 63 HB3 ARG 63 4.837 14.287 -12.754 487 HG2 ARG 63 HG2 ARG 63 3.812 15.057 -14.790 488 HG3 ARG 63 HG3 ARG 63 5.172 16.107 -14.404 489 HD2 ARG 63 HD2 ARG 63 4.983 15.576 -16.837 490 HD3 ARG 63 HD3 ARG 63 6.529 15.063 -16.142 491 HE ARG 63 HE ARG 63 4.999 12.844 -15.905 492 HH11 ARG 63 HH11 ARG 63 5.661 14.875 -18.700 493 HH12 ARG 63 HH12 ARG 63 5.496 13.563 -19.817 494 HH21 ARG 63 HH21 ARG 63 4.889 11.145 -17.359 495 HH22 ARG 63 HH22 ARG 63 5.060 11.444 -19.060 496 H LEU 64 H LEU 64 7.806 11.756 -12.933 497 HA LEU 64 HA LEU 64 6.829 10.966 -10.513 498 HB2 LEU 64 HB2 LEU 64 8.480 9.823 -12.329 499 HB3 LEU 64 HB3 LEU 64 9.678 10.165 -11.113 500 HG LEU 64 HG LEU 64 8.909 7.849 -10.953 501 HD11 LEU 64 HD11 LEU 64 8.299 7.708 -8.611 502 HD12 LEU 64 HD12 LEU 64 7.888 9.425 -8.588 503 HD13 LEU 64 HD13 LEU 64 9.555 8.918 -8.862 504 HD21 LEU 64 HD21 LEU 64 6.121 8.940 -10.465 505 HD22 LEU 64 HD22 LEU 64 6.607 7.243 -10.387 506 HD23 LEU 64 HD23 LEU 64 6.673 8.107 -11.921 507 H GLU 65 H GLU 65 9.987 12.584 -11.003 508 HA GLU 65 HA GLU 65 10.791 12.639 -8.294 509 HB2 GLU 65 HB2 GLU 65 11.696 14.403 -10.603 510 HB3 GLU 65 HB3 GLU 65 12.519 14.264 -9.048 511 HG2 GLU 65 HG2 GLU 65 12.846 11.825 -9.510 512 HG3 GLU 65 HG3 GLU 65 12.155 12.072 -11.112 513 H GLN 66 H GLN 66 8.911 14.868 -10.223 514 HA GLN 66 HA GLN 66 8.926 17.070 -8.384 515 HB2 GLN 66 HB2 GLN 66 6.895 16.449 -10.579 516 HB3 GLN 66 HB3 GLN 66 7.142 18.010 -9.795 517 HG2 GLN 66 HG2 GLN 66 9.128 16.572 -11.588 518 HG3 GLN 66 HG3 GLN 66 8.136 17.956 -12.034 519 HE21 GLN 66 HE21 GLN 66 8.548 19.397 -9.511 520 HE22 GLN 66 HE22 GLN 66 10.170 19.984 -9.562 521 H MET 67 H MET 67 6.822 14.271 -8.939 522 HA MET 67 HA MET 67 4.834 14.882 -6.990 523 HB2 MET 67 HB2 MET 67 5.626 12.353 -8.460 524 HB3 MET 67 HB3 MET 67 4.481 12.258 -7.129 525 HG2 MET 67 HG2 MET 67 3.345 12.375 -9.299 526 HG3 MET 67 HG3 MET 67 2.952 13.758 -8.278 527 HE1 MET 67 HE1 MET 67 1.972 15.147 -10.327 528 HE2 MET 67 HE2 MET 67 2.272 13.759 -11.376 529 HE3 MET 67 HE3 MET 67 2.835 15.361 -11.851 530 H ILE 68 H ILE 68 7.948 13.184 -6.865 531 HA ILE 68 HA ILE 68 7.816 12.218 -4.200 532 HB ILE 68 HB ILE 68 10.278 13.026 -5.827 533 HG12 ILE 68 HG12 ILE 68 9.108 10.239 -5.377 534 HG13 ILE 68 HG13 ILE 68 8.892 11.189 -6.841 535 HG21 ILE 68 HG21 ILE 68 10.168 11.345 -3.287 536 HG22 ILE 68 HG22 ILE 68 10.839 12.970 -3.425 537 HG23 ILE 68 HG23 ILE 68 11.610 11.628 -4.268 538 HD11 ILE 68 HD11 ILE 68 10.601 9.517 -7.153 539 HD12 ILE 68 HD12 ILE 68 11.513 10.141 -5.781 540 HD13 ILE 68 HD13 ILE 68 11.314 11.128 -7.232 541 H SER 69 H SER 69 8.957 15.272 -5.612 542 HA SER 69 HA SER 69 9.886 16.532 -3.250 543 HB2 SER 69 HB2 SER 69 10.552 17.236 -5.548 544 HB3 SER 69 HB3 SER 69 8.911 17.803 -5.848 545 HG SER 69 HG SER 69 10.576 18.760 -3.759 546 H GLN 70 H GLN 70 6.759 16.444 -4.874 547 HA GLN 70 HA GLN 70 5.433 18.480 -3.420 548 HB2 GLN 70 HB2 GLN 70 4.759 17.373 -5.670 549 HB3 GLN 70 HB3 GLN 70 4.099 16.058 -4.716 550 HG2 GLN 70 HG2 GLN 70 3.186 18.948 -4.506 551 HG3 GLN 70 HG3 GLN 70 2.422 17.750 -5.537 552 HE21 GLN 70 HE21 GLN 70 2.621 15.599 -3.503 553 HE22 GLN 70 HE22 GLN 70 1.415 15.974 -2.332 554 H ILE 71 H ILE 71 5.521 14.922 -3.087 555 HA ILE 71 HA ILE 71 3.744 14.873 -0.837 556 HB ILE 71 HB ILE 71 3.943 13.002 -2.506 557 HG12 ILE 71 HG12 ILE 71 4.278 12.333 0.447 558 HG13 ILE 71 HG13 ILE 71 2.770 12.587 -0.425 559 HG21 ILE 71 HG21 ILE 71 6.520 12.274 -1.071 560 HG22 ILE 71 HG22 ILE 71 6.409 12.928 -2.706 561 HG23 ILE 71 HG23 ILE 71 5.724 11.343 -2.350 562 HD11 ILE 71 HD11 ILE 71 3.228 10.545 -1.720 563 HD12 ILE 71 HD12 ILE 71 3.092 10.269 0.016 564 HD13 ILE 71 HD13 ILE 71 4.684 10.295 -0.746 565 H ASP 72 H ASP 72 7.207 15.016 -1.246 566 HA ASP 72 HA ASP 72 8.202 14.204 1.212 567 HB2 ASP 72 HB2 ASP 72 9.811 14.660 -0.461 568 HB3 ASP 72 HB3 ASP 72 9.111 16.223 -0.859 569 H LYS 73 H LYS 73 6.900 17.364 0.249 570 HA LYS 73 HA LYS 73 7.439 18.551 2.853 571 HB2 LYS 73 HB2 LYS 73 6.656 20.658 1.814 572 HB3 LYS 73 HB3 LYS 73 7.959 19.880 0.922 573 HG2 LYS 73 HG2 LYS 73 6.263 18.969 -0.679 574 HG3 LYS 73 HG3 LYS 73 5.015 19.887 0.175 575 HD2 LYS 73 HD2 LYS 73 5.755 21.084 -1.841 576 HD3 LYS 73 HD3 LYS 73 6.182 21.997 -0.392 577 HE2 LYS 73 HE2 LYS 73 8.503 21.218 -0.552 578 HE3 LYS 73 HE3 LYS 73 8.094 20.202 -1.932 579 HZ1 LYS 73 HZ1 LYS 73 7.968 23.172 -1.839 580 HZ2 LYS 73 HZ2 LYS 73 7.538 22.225 -3.170 581 HZ3 LYS 73 HZ3 LYS 73 9.142 22.249 -2.635 582 H LEU 74 H LEU 74 5.241 16.419 2.302 583 HA LEU 74 HA LEU 74 2.865 17.729 3.372 584 HB2 LEU 74 HB2 LEU 74 3.523 14.999 2.335 585 HB3 LEU 74 HB3 LEU 74 2.328 15.023 3.612 586 HG LEU 74 HG LEU 74 1.281 15.007 1.369 587 HD11 LEU 74 HD11 LEU 74 0.054 16.021 3.224 588 HD12 LEU 74 HD12 LEU 74 -0.314 16.835 1.706 589 HD13 LEU 74 HD13 LEU 74 0.775 17.597 2.870 590 HD21 LEU 74 HD21 LEU 74 1.403 16.953 -0.127 591 HD22 LEU 74 HD22 LEU 74 2.991 16.227 0.099 592 HD23 LEU 74 HD23 LEU 74 2.583 17.720 0.943 593 H GLU 75 H GLU 75 1.915 17.135 5.409 594 HA GLU 75 HA GLU 75 3.798 17.310 7.575 595 HB2 GLU 75 HB2 GLU 75 0.757 17.078 7.575 596 HB3 GLU 75 HB3 GLU 75 1.736 17.476 8.989 597 HG2 GLU 75 HG2 GLU 75 2.494 19.553 7.910 598 HG3 GLU 75 HG3 GLU 75 1.590 19.146 6.451 599 H ASP 76 H ASP 76 1.644 14.857 6.336 600 HA ASP 76 HA ASP 76 1.890 12.912 8.374 601 HB2 ASP 76 HB2 ASP 76 1.094 11.323 6.514 602 HB3 ASP 76 HB3 ASP 76 0.045 12.674 6.911 603 H VAL 77 H VAL 77 3.593 13.290 5.270 604 HA VAL 77 HA VAL 77 5.469 11.198 5.633 605 HB VAL 77 HB VAL 77 5.522 13.678 3.853 606 HG11 VAL 77 HG11 VAL 77 7.373 12.627 2.589 607 HG12 VAL 77 HG12 VAL 77 7.453 11.321 3.774 608 HG13 VAL 77 HG13 VAL 77 7.858 12.972 4.251 609 HG21 VAL 77 HG21 VAL 77 4.975 10.757 3.190 610 HG22 VAL 77 HG22 VAL 77 4.972 12.100 2.045 611 HG23 VAL 77 HG23 VAL 77 3.753 12.030 3.321 612 H VAL 78 H VAL 78 6.650 11.210 7.417 613 HA VAL 78 HA VAL 78 7.827 13.466 8.712 614 HB VAL 78 HB VAL 78 8.711 10.542 8.923 615 HG11 VAL 78 HG11 VAL 78 9.001 12.836 10.902 616 HG12 VAL 78 HG12 VAL 78 10.299 12.111 9.952 617 HG13 VAL 78 HG13 VAL 78 9.483 11.162 11.196 618 HG21 VAL 78 HG21 VAL 78 7.133 10.304 10.809 619 HG22 VAL 78 HG22 VAL 78 6.283 10.679 9.306 620 HG23 VAL 78 HG23 VAL 78 6.528 11.939 10.520 621 H LYS 79 H LYS 79 9.008 10.979 6.462 622 HA LYS 79 HA LYS 79 11.139 12.682 5.442 623 HB2 LYS 79 HB2 LYS 79 11.722 9.937 6.665 624 HB3 LYS 79 HB3 LYS 79 12.848 10.813 5.629 625 HG2 LYS 79 HG2 LYS 79 12.959 12.633 7.303 626 HG3 LYS 79 HG3 LYS 79 11.854 11.731 8.344 627 HD2 LYS 79 HD2 LYS 79 13.522 9.890 8.498 628 HD3 LYS 79 HD3 LYS 79 14.620 10.807 7.460 629 HE2 LYS 79 HE2 LYS 79 14.676 12.614 9.188 630 HE3 LYS 79 HE3 LYS 79 13.665 11.610 10.235 631 HZ1 LYS 79 HZ1 LYS 79 15.413 9.920 10.169 632 HZ2 LYS 79 HZ2 LYS 79 15.970 11.370 10.824 633 HZ3 LYS 79 HZ3 LYS 79 16.382 10.939 9.239 634 H VAL 80 H VAL 80 11.772 12.082 3.340 635 HA VAL 80 HA VAL 80 10.450 9.713 2.104 636 HB VAL 80 HB VAL 80 9.783 11.921 1.068 637 HG11 VAL 80 HG11 VAL 80 11.860 13.194 1.387 638 HG12 VAL 80 HG12 VAL 80 11.384 13.193 -0.312 639 HG13 VAL 80 HG13 VAL 80 12.699 12.149 0.235 640 HG21 VAL 80 HG21 VAL 80 9.699 9.859 -0.274 641 HG22 VAL 80 HG22 VAL 80 11.369 10.103 -0.789 642 HG23 VAL 80 HG23 VAL 80 10.115 11.243 -1.285 643 H GLN 81 H GLN 81 11.829 8.335 0.815 644 HA GLN 81 HA GLN 81 14.623 9.109 0.409 645 HB2 GLN 81 HB2 GLN 81 14.778 8.053 2.606 646 HB3 GLN 81 HB3 GLN 81 13.926 6.629 2.032 647 HG2 GLN 81 HG2 GLN 81 15.785 5.970 0.636 648 HG3 GLN 81 HG3 GLN 81 16.603 7.509 0.916 649 HE21 GLN 81 HE21 GLN 81 15.851 4.379 2.276 650 HE22 GLN 81 HE22 GLN 81 16.930 4.489 3.617 651 H ARG 82 H ARG 82 15.263 8.540 -1.517 652 HA ARG 82 HA ARG 82 13.621 6.765 -3.191 653 HB2 ARG 82 HB2 ARG 82 15.936 8.568 -4.034 654 HB3 ARG 82 HB3 ARG 82 14.736 7.809 -5.083 655 HG2 ARG 82 HG2 ARG 82 12.980 9.255 -4.125 656 HG3 ARG 82 HG3 ARG 82 14.170 9.997 -3.050 657 HD2 ARG 82 HD2 ARG 82 14.090 10.156 -6.084 658 HD3 ARG 82 HD3 ARG 82 13.790 11.468 -4.940 659 HE ARG 82 HE ARG 82 16.411 10.283 -4.682 660 HH11 ARG 82 HH11 ARG 82 14.588 12.754 -6.408 661 HH12 ARG 82 HH12 ARG 82 16.002 13.673 -6.807 662 HH21 ARG 82 HH21 ARG 82 18.239 11.467 -5.241 663 HH22 ARG 82 HH22 ARG 82 18.079 12.941 -6.144 664 H ASN 83 H ASN 83 14.395 4.850 -3.948 665 HA ASN 83 HA ASN 83 17.225 4.073 -3.550 666 HB2 ASN 83 HB2 ASN 83 14.851 2.261 -2.868 667 HB3 ASN 83 HB3 ASN 83 16.553 1.841 -2.722 668 HD21 ASN 83 HD21 ASN 83 13.902 3.623 -1.333 669 HD22 ASN 83 HD22 ASN 83 14.643 3.915 0.200 670 H GLN 84 H GLN 84 17.964 2.470 -5.054 671 HA GLN 84 HA GLN 84 16.475 2.286 -7.565 672 HB2 GLN 84 HB2 GLN 84 18.928 2.671 -7.614 673 HB3 GLN 84 HB3 GLN 84 19.197 1.155 -6.759 674 HG2 GLN 84 HG2 GLN 84 18.226 -0.074 -8.710 675 HG3 GLN 84 HG3 GLN 84 18.046 1.465 -9.553 676 HE21 GLN 84 HE21 GLN 84 20.321 -0.921 -8.384 677 HE22 GLN 84 HE22 GLN 84 21.680 -0.353 -9.291 678 H SER 85 H SER 85 15.790 0.260 -8.485 679 HA SER 85 HA SER 85 14.820 -1.602 -6.502 680 HB2 SER 85 HB2 SER 85 13.334 -0.844 -8.292 681 HB3 SER 85 HB3 SER 85 14.392 -1.560 -9.498 682 HG SER 85 HG SER 85 12.555 -2.865 -8.865 683 H ASP 86 H ASP 86 15.654 -3.413 -5.967 684 HA ASP 86 HA ASP 86 17.357 -5.027 -7.716 685 HB2 ASP 86 HB2 ASP 86 18.129 -3.977 -4.949 686 HB3 ASP 86 HB3 ASP 86 18.814 -5.480 -5.563 687 HA PRO 87 HA PRO 87 14.536 -8.191 -6.312 688 HB2 PRO 87 HB2 PRO 87 16.181 -10.452 -6.365 689 HB3 PRO 87 HB3 PRO 87 15.476 -9.700 -7.811 690 HG2 PRO 87 HG2 PRO 87 18.231 -9.322 -6.657 691 HG3 PRO 87 HG3 PRO 87 17.752 -9.587 -8.350 692 HD2 PRO 87 HD2 PRO 87 18.339 -7.122 -7.497 693 HD3 PRO 87 HD3 PRO 87 16.983 -7.375 -8.622 694 H THR 88 H THR 88 17.638 -7.931 -4.675 695 HA THR 88 HA THR 88 16.936 -9.528 -2.389 696 HB THR 88 HB THR 88 19.078 -8.641 -1.442 697 HG1 THR 88 HG1 THR 88 20.374 -7.370 -2.937 698 HG21 THR 88 HG21 THR 88 19.127 -10.686 -2.832 699 HG22 THR 88 HG22 THR 88 20.588 -9.730 -3.083 700 HG23 THR 88 HG23 THR 88 19.300 -9.703 -4.289 701 H MET 89 H MET 89 16.870 -6.081 -3.204 702 HA MET 89 HA MET 89 16.772 -4.854 -0.719 703 HB2 MET 89 HB2 MET 89 16.942 -3.547 -2.766 704 HB3 MET 89 HB3 MET 89 15.373 -4.108 -3.325 705 HG2 MET 89 HG2 MET 89 15.285 -1.777 -2.527 706 HG3 MET 89 HG3 MET 89 14.254 -2.830 -1.557 707 HE1 MET 89 HE1 MET 89 14.107 -0.935 0.386 708 HE2 MET 89 HE2 MET 89 15.095 0.113 -0.635 709 HE3 MET 89 HE3 MET 89 15.539 -0.148 1.052 710 H PHE 90 H PHE 90 14.050 -6.105 -2.655 711 HA PHE 90 HA PHE 90 11.970 -5.411 -0.899 712 HB2 PHE 90 HB2 PHE 90 11.538 -5.943 -3.261 713 HB3 PHE 90 HB3 PHE 90 12.071 -7.602 -3.020 714 HD1 PHE 90 HD1 PHE 90 9.380 -5.154 -2.218 715 HD2 PHE 90 HD2 PHE 90 10.563 -9.273 -2.080 716 HE1 PHE 90 HE1 PHE 90 7.087 -5.806 -1.606 717 HE2 PHE 90 HE2 PHE 90 8.269 -9.905 -1.474 718 HZ PHE 90 HZ PHE 90 6.533 -8.179 -1.239 719 H ASN 91 H ASN 91 13.919 -8.412 -1.168 720 HA ASN 91 HA ASN 91 12.196 -9.894 0.615 721 HB2 ASN 91 HB2 ASN 91 13.448 -11.018 -1.212 722 HB3 ASN 91 HB3 ASN 91 14.970 -10.603 -0.428 723 HD21 ASN 91 HD21 ASN 91 12.066 -12.571 -0.184 724 HD22 ASN 91 HD22 ASN 91 12.688 -13.692 0.975 725 H LYS 92 H LYS 92 15.124 -8.014 0.923 726 HA LYS 92 HA LYS 92 16.032 -8.950 3.440 727 HB2 LYS 92 HB2 LYS 92 17.486 -7.794 1.810 728 HB3 LYS 92 HB3 LYS 92 16.559 -6.313 1.994 729 HG2 LYS 92 HG2 LYS 92 17.850 -7.472 4.453 730 HG3 LYS 92 HG3 LYS 92 18.901 -6.718 3.254 731 HD2 LYS 92 HD2 LYS 92 17.579 -4.611 3.441 732 HD3 LYS 92 HD3 LYS 92 16.544 -5.374 4.651 733 HE2 LYS 92 HE2 LYS 92 18.451 -5.604 6.170 734 HE3 LYS 92 HE3 LYS 92 19.532 -4.925 4.950 735 HZ1 LYS 92 HZ1 LYS 92 18.887 -3.289 6.599 736 HZ2 LYS 92 HZ2 LYS 92 17.260 -3.495 6.211 737 HZ3 LYS 92 HZ3 LYS 92 18.322 -2.853 5.071 738 H ILE 93 H ILE 93 14.152 -6.039 2.516 739 HA ILE 93 HA ILE 93 13.762 -5.110 5.194 740 HB ILE 93 HB ILE 93 12.119 -3.530 4.195 741 HG12 ILE 93 HG12 ILE 93 12.435 -5.344 1.783 742 HG13 ILE 93 HG13 ILE 93 10.958 -4.778 2.538 743 HG21 ILE 93 HG21 ILE 93 14.675 -3.799 2.562 744 HG22 ILE 93 HG22 ILE 93 14.527 -2.999 4.130 745 HG23 ILE 93 HG23 ILE 93 13.697 -2.336 2.723 746 HD11 ILE 93 HD11 ILE 93 11.244 -3.777 0.376 747 HD12 ILE 93 HD12 ILE 93 12.825 -3.140 0.826 748 HD13 ILE 93 HD13 ILE 93 11.369 -2.539 1.621 749 H ALA 94 H ALA 94 11.997 -7.319 3.108 750 HA ALA 94 HA ALA 94 9.594 -7.478 4.649 751 HB1 ALA 94 HB1 ALA 94 9.674 -8.071 2.271 752 HB2 ALA 94 HB2 ALA 94 9.087 -9.428 3.235 753 HB3 ALA 94 HB3 ALA 94 10.748 -9.425 2.628 754 H VAL 95 H VAL 95 12.640 -9.365 4.643 755 HA VAL 95 HA VAL 95 11.605 -11.345 6.489 756 HB VAL 95 HB VAL 95 13.311 -11.955 4.741 757 HG11 VAL 95 HG11 VAL 95 14.781 -9.998 4.858 758 HG12 VAL 95 HG12 VAL 95 15.702 -11.480 5.119 759 HG13 VAL 95 HG13 VAL 95 15.283 -10.448 6.490 760 HG21 VAL 95 HG21 VAL 95 14.633 -13.470 6.191 761 HG22 VAL 95 HG22 VAL 95 12.930 -13.441 6.652 762 HG23 VAL 95 HG23 VAL 95 14.119 -12.553 7.611 763 H PHE 96 H PHE 96 13.575 -8.403 6.712 764 HA PHE 96 HA PHE 96 14.346 -8.738 9.452 765 HB2 PHE 96 HB2 PHE 96 14.379 -6.410 7.520 766 HB3 PHE 96 HB3 PHE 96 14.613 -6.088 9.234 767 HD1 PHE 96 HD1 PHE 96 15.936 -8.711 6.842 768 HD2 PHE 96 HD2 PHE 96 16.844 -5.696 9.734 769 HE1 PHE 96 HE1 PHE 96 18.332 -9.198 6.601 770 HE2 PHE 96 HE2 PHE 96 19.237 -6.193 9.490 771 HZ PHE 96 HZ PHE 96 19.988 -7.941 7.924 772 H PHE 97 H PHE 97 11.825 -6.794 7.828 773 HA PHE 97 HA PHE 97 9.821 -5.999 8.441 774 HB2 PHE 97 HB2 PHE 97 9.303 -8.233 9.326 775 HB3 PHE 97 HB3 PHE 97 10.045 -7.823 10.866 776 HD1 PHE 97 HD1 PHE 97 7.195 -6.968 8.600 777 HD2 PHE 97 HD2 PHE 97 8.752 -6.751 12.589 778 HE1 PHE 97 HE1 PHE 97 5.029 -6.134 9.414 779 HE2 PHE 97 HE2 PHE 97 6.580 -5.920 13.389 780 HZ PHE 97 HZ PHE 97 4.719 -5.611 11.802 781 H GLN 98 H GLN 98 12.443 -5.651 10.691 782 HA GLN 98 HA GLN 98 11.859 -2.883 11.101 783 HB2 GLN 98 HB2 GLN 98 10.513 -3.713 12.950 784 HB3 GLN 98 HB3 GLN 98 11.773 -4.828 13.453 785 HG2 GLN 98 HG2 GLN 98 11.666 -2.999 15.025 786 HG3 GLN 98 HG3 GLN 98 13.185 -2.905 14.146 787 HE21 GLN 98 HE21 GLN 98 11.825 -0.844 15.642 788 HE22 GLN 98 HE22 GLN 98 11.546 0.463 14.553 789 H1 GLY 1 H1 GLY 1 -6.314 -4.439 20.979 790 H2 GLY 1 H2 GLY 1 -6.326 -3.547 19.548 791 H3 GLY 1 H3 GLY 1 -7.183 -2.992 20.897 792 HA2 GLY 1 HA3 GLY 1 -5.168 -1.727 20.646 793 HA3 GLY 1 HA2 GLY 1 -5.131 -2.686 22.119 794 H SER 2 H SER 2 -3.742 -2.198 18.961 795 HA SER 2 HA SER 2 -2.159 -4.573 18.825 796 HB2 SER 2 HB2 SER 2 -0.961 -3.304 16.979 797 HB3 SER 2 HB3 SER 2 -2.708 -3.413 16.769 798 HG SER 2 HG SER 2 -1.492 -1.270 16.537 799 H MET 3 H MET 3 -0.408 -5.022 20.006 800 HA MET 3 HA MET 3 1.010 -2.885 21.482 801 HB2 MET 3 HB2 MET 3 1.003 -5.906 21.945 802 HB3 MET 3 HB3 MET 3 1.835 -4.719 22.946 803 HG2 MET 3 HG2 MET 3 -0.344 -3.732 23.569 804 HG3 MET 3 HG3 MET 3 -1.167 -4.945 22.582 805 HE1 MET 3 HE1 MET 3 -1.997 -6.188 26.221 806 HE2 MET 3 HE2 MET 3 -2.673 -5.798 24.640 807 HE3 MET 3 HE3 MET 3 -1.952 -4.527 25.632 808 H GLN 4 H GLN 4 3.309 -2.947 21.591 809 HA GLN 4 HA GLN 4 4.683 -3.567 19.141 810 HB2 GLN 4 HB2 GLN 4 5.634 -2.440 21.814 811 HB3 GLN 4 HB3 GLN 4 6.729 -2.738 20.472 812 HG2 GLN 4 HG2 GLN 4 6.139 -0.396 20.529 813 HG3 GLN 4 HG3 GLN 4 5.485 -1.145 19.081 814 HE21 GLN 4 HE21 GLN 4 4.007 0.539 18.815 815 HE22 GLN 4 HE22 GLN 4 2.604 0.706 19.807 816 H ASN 5 H ASN 5 4.269 -5.798 19.076 817 HA ASN 5 HA ASN 5 6.165 -7.627 20.128 818 HB2 ASN 5 HB2 ASN 5 4.798 -7.252 22.222 819 HB3 ASN 5 HB3 ASN 5 3.351 -7.742 21.354 820 HD21 ASN 5 HD21 ASN 5 2.975 -9.403 22.852 821 HD22 ASN 5 HD22 ASN 5 3.924 -10.841 22.911 822 H THR 6 H THR 6 5.742 -9.805 19.208 823 HA THR 6 HA THR 6 4.380 -9.717 16.690 824 HB THR 6 HB THR 6 6.400 -11.038 16.833 825 HG1 THR 6 HG1 THR 6 5.443 -12.180 15.362 826 HG21 THR 6 HG21 THR 6 6.625 -13.104 18.131 827 HG22 THR 6 HG22 THR 6 5.012 -12.881 18.809 828 HG23 THR 6 HG23 THR 6 6.299 -11.744 19.214 829 H THR 7 H THR 7 2.297 -9.147 17.313 830 HA THR 7 HA THR 7 0.527 -11.296 18.327 831 HB THR 7 HB THR 7 -0.888 -9.440 19.357 832 HG1 THR 7 HG1 THR 7 1.426 -7.902 18.708 833 HG21 THR 7 HG21 THR 7 0.577 -10.824 20.801 834 HG22 THR 7 HG22 THR 7 0.457 -9.166 21.395 835 HG23 THR 7 HG23 THR 7 1.906 -9.692 20.533 836 H HIS 8 H HIS 8 -1.681 -11.086 17.509 837 HA HIS 8 HA HIS 8 -1.739 -9.864 14.809 838 HB2 HIS 8 HB2 HIS 8 -3.156 -11.777 14.113 839 HB3 HIS 8 HB3 HIS 8 -1.541 -12.246 14.594 840 HD1 HIS 8 HD1 HIS 8 -5.119 -12.743 15.382 841 HD2 HIS 8 HD2 HIS 8 -1.435 -13.854 16.938 842 HE1 HIS 8 HE1 HIS 8 -5.584 -14.665 16.925 843 HE2 HIS 8 HE2 HIS 8 -3.340 -15.336 17.822 844 H ASP 9 H ASP 9 -2.481 -8.067 16.274 845 HA ASP 9 HA ASP 9 -5.298 -8.001 17.003 846 HB2 ASP 9 HB2 ASP 9 -3.554 -6.675 18.229 847 HB3 ASP 9 HB3 ASP 9 -3.291 -5.723 16.771 848 H ASN 10 H ASN 10 -3.368 -7.351 14.208 849 HA ASN 10 HA ASN 10 -5.551 -6.031 12.770 850 HB2 ASN 10 HB2 ASN 10 -3.912 -5.841 10.896 851 HB3 ASN 10 HB3 ASN 10 -3.336 -5.105 12.383 852 HD21 ASN 10 HD21 ASN 10 -1.201 -5.200 11.608 853 HD22 ASN 10 HD22 ASN 10 -0.317 -6.678 11.556 854 H VAL 11 H VAL 11 -5.908 -6.879 10.480 855 HA VAL 11 HA VAL 11 -6.068 -9.827 10.357 856 HB VAL 11 HB VAL 11 -8.280 -9.606 9.154 857 HG11 VAL 11 HG11 VAL 11 -8.238 -10.265 11.519 858 HG12 VAL 11 HG12 VAL 11 -9.673 -9.298 11.175 859 HG13 VAL 11 HG13 VAL 11 -8.299 -8.571 12.014 860 HG21 VAL 11 HG21 VAL 11 -8.269 -6.728 10.155 861 HG22 VAL 11 HG22 VAL 11 -9.617 -7.538 9.353 862 HG23 VAL 11 HG23 VAL 11 -8.122 -7.225 8.468 863 H ILE 12 H ILE 12 -5.844 -10.676 8.282 864 HA ILE 12 HA ILE 12 -4.164 -8.995 6.540 865 HB ILE 12 HB ILE 12 -4.438 -12.037 6.636 866 HG12 ILE 12 HG12 ILE 12 -3.562 -11.112 8.775 867 HG13 ILE 12 HG13 ILE 12 -2.399 -12.130 7.944 868 HG21 ILE 12 HG21 ILE 12 -2.280 -12.073 5.438 869 HG22 ILE 12 HG22 ILE 12 -2.320 -10.311 5.330 870 HG23 ILE 12 HG23 ILE 12 -3.548 -11.273 4.505 871 HD11 ILE 12 HD11 ILE 12 -2.392 -9.120 8.026 872 HD12 ILE 12 HD12 ILE 12 -1.205 -10.135 7.201 873 HD13 ILE 12 HD13 ILE 12 -1.358 -10.204 8.955 874 H LEU 13 H LEU 13 -5.691 -7.975 5.211 875 HA LEU 13 HA LEU 13 -7.734 -9.628 3.832 876 HB2 LEU 13 HB2 LEU 13 -7.555 -6.598 4.023 877 HB3 LEU 13 HB3 LEU 13 -8.909 -7.537 3.400 878 HG LEU 13 HG LEU 13 -7.968 -7.482 6.298 879 HD11 LEU 13 HD11 LEU 13 -9.033 -5.400 5.629 880 HD12 LEU 13 HD12 LEU 13 -10.047 -6.299 6.750 881 HD13 LEU 13 HD13 LEU 13 -10.441 -6.284 5.029 882 HD21 LEU 13 HD21 LEU 13 -9.981 -8.806 6.805 883 HD22 LEU 13 HD22 LEU 13 -8.895 -9.685 5.735 884 HD23 LEU 13 HD23 LEU 13 -10.352 -8.931 5.081 885 H GLU 14 H GLU 14 -6.781 -10.448 1.984 886 HA GLU 14 HA GLU 14 -5.167 -8.699 0.286 887 HB2 GLU 14 HB2 GLU 14 -4.947 -10.713 -1.223 888 HB3 GLU 14 HB3 GLU 14 -4.267 -10.884 0.380 889 HG2 GLU 14 HG2 GLU 14 -6.251 -12.166 1.092 890 HG3 GLU 14 HG3 GLU 14 -6.903 -12.019 -0.539 891 H LEU 15 H LEU 15 -6.157 -7.381 -0.993 892 HA LEU 15 HA LEU 15 -8.648 -8.083 -2.368 893 HB2 LEU 15 HB2 LEU 15 -7.090 -5.498 -2.017 894 HB3 LEU 15 HB3 LEU 15 -8.309 -5.649 -3.269 895 HG LEU 15 HG LEU 15 -9.233 -4.540 -1.300 896 HD11 LEU 15 HD11 LEU 15 -10.450 -7.268 -1.671 897 HD12 LEU 15 HD12 LEU 15 -10.741 -5.843 -2.673 898 HD13 LEU 15 HD13 LEU 15 -11.247 -5.848 -0.987 899 HD21 LEU 15 HD21 LEU 15 -8.680 -7.056 0.286 900 HD22 LEU 15 HD22 LEU 15 -9.541 -5.624 0.861 901 HD23 LEU 15 HD23 LEU 15 -7.829 -5.522 0.463 902 H THR 16 H THR 16 -8.335 -9.261 -4.114 903 HA THR 16 HA THR 16 -5.971 -9.082 -5.801 904 HB THR 16 HB THR 16 -8.538 -10.715 -6.083 905 HG1 THR 16 HG1 THR 16 -7.264 -11.428 -4.355 906 HG21 THR 16 HG21 THR 16 -5.959 -10.924 -7.693 907 HG22 THR 16 HG22 THR 16 -7.486 -10.271 -8.298 908 HG23 THR 16 HG23 THR 16 -7.367 -11.977 -7.847 909 H VAL 17 H VAL 17 -5.904 -7.333 -7.095 910 HA VAL 17 HA VAL 17 -8.372 -6.313 -8.370 911 HB VAL 17 HB VAL 17 -7.793 -4.068 -7.915 912 HG11 VAL 17 HG11 VAL 17 -8.774 -5.150 -5.947 913 HG12 VAL 17 HG12 VAL 17 -7.654 -3.878 -5.455 914 HG13 VAL 17 HG13 VAL 17 -7.163 -5.577 -5.351 915 HG21 VAL 17 HG21 VAL 17 -5.410 -4.054 -8.406 916 HG22 VAL 17 HG22 VAL 17 -5.058 -4.970 -6.940 917 HG23 VAL 17 HG23 VAL 17 -5.666 -3.316 -6.822 918 H ARG 18 H ARG 18 -8.107 -5.500 -10.450 919 HA ARG 18 HA ARG 18 -5.426 -5.757 -11.699 920 HB2 ARG 18 HB2 ARG 18 -6.661 -5.532 -13.876 921 HB3 ARG 18 HB3 ARG 18 -7.110 -6.951 -12.939 922 HG2 ARG 18 HG2 ARG 18 -9.158 -5.693 -12.160 923 HG3 ARG 18 HG3 ARG 18 -8.727 -4.413 -13.301 924 HD2 ARG 18 HD2 ARG 18 -9.393 -7.300 -13.963 925 HD3 ARG 18 HD3 ARG 18 -10.384 -5.883 -14.314 926 HE ARG 18 HE ARG 18 -8.112 -5.306 -15.639 927 HH11 ARG 18 HH11 ARG 18 -10.081 -8.231 -15.648 928 HH12 ARG 18 HH12 ARG 18 -9.641 -8.653 -17.270 929 HH21 ARG 18 HH21 ARG 18 -7.545 -5.892 -17.760 930 HH22 ARG 18 HH22 ARG 18 -8.206 -7.333 -18.470 931 H ASN 19 H ASN 19 -4.600 -3.927 -12.910 932 HA ASN 19 HA ASN 19 -4.743 -1.614 -11.241 933 HB2 ASN 19 HB2 ASN 19 -3.059 -2.213 -13.701 934 HB3 ASN 19 HB3 ASN 19 -2.934 -0.705 -12.796 935 HD21 ASN 19 HD21 ASN 19 -0.817 -1.042 -12.124 936 HD22 ASN 19 HD22 ASN 19 -0.364 -2.252 -10.975 937 H HIS 20 H HIS 20 -6.913 -1.056 -11.611 938 HA HIS 20 HA HIS 20 -7.651 0.612 -13.861 939 HB2 HIS 20 HB2 HIS 20 -8.849 0.100 -11.101 940 HB3 HIS 20 HB3 HIS 20 -9.519 1.313 -12.172 941 HD1 HIS 20 HD1 HIS 20 -11.557 0.421 -13.248 942 HD2 HIS 20 HD2 HIS 20 -8.687 -2.531 -12.744 943 HE1 HIS 20 HE1 HIS 20 -12.587 -1.681 -14.136 944 HE2 HIS 20 HE2 HIS 20 -10.915 -3.482 -13.617 945 HA PRO 21 HA PRO 21 -5.794 4.521 -12.526 946 HB2 PRO 21 HB2 PRO 21 -8.520 5.806 -12.708 947 HB3 PRO 21 HB3 PRO 21 -6.993 6.280 -13.487 948 HG2 PRO 21 HG2 PRO 21 -8.899 5.111 -14.919 949 HG3 PRO 21 HG3 PRO 21 -7.192 4.679 -15.177 950 HD2 PRO 21 HD2 PRO 21 -9.315 3.152 -13.670 951 HD3 PRO 21 HD3 PRO 21 -8.058 2.542 -14.773 952 H GLY 22 H GLY 22 -5.267 4.098 -10.398 953 HA2 GLY 22 HA2 GLY 22 -5.134 4.707 -8.195 954 HA3 GLY 22 HA3 GLY 22 -6.593 5.662 -8.394 955 H VAL 23 H VAL 23 -5.866 2.134 -8.603 956 HA VAL 23 HA VAL 23 -8.266 1.375 -7.211 957 HB VAL 23 HB VAL 23 -5.768 -0.359 -7.476 958 HG11 VAL 23 HG11 VAL 23 -8.706 -1.038 -7.099 959 HG12 VAL 23 HG12 VAL 23 -7.425 -1.216 -5.895 960 HG13 VAL 23 HG13 VAL 23 -7.419 -2.215 -7.346 961 HG21 VAL 23 HG21 VAL 23 -6.378 0.436 -9.704 962 HG22 VAL 23 HG22 VAL 23 -8.043 -0.095 -9.461 963 HG23 VAL 23 HG23 VAL 23 -6.739 -1.284 -9.537 964 H MET 24 H MET 24 -4.866 1.550 -6.347 965 HA MET 24 HA MET 24 -4.972 0.742 -3.686 966 HB2 MET 24 HB2 MET 24 -2.778 1.997 -3.457 967 HB3 MET 24 HB3 MET 24 -2.838 0.832 -4.769 968 HG2 MET 24 HG2 MET 24 -3.242 3.804 -5.165 969 HG3 MET 24 HG3 MET 24 -1.685 3.002 -5.326 970 HE1 MET 24 HE1 MET 24 -2.555 0.224 -6.758 971 HE2 MET 24 HE2 MET 24 -1.158 1.185 -7.254 972 HE3 MET 24 HE3 MET 24 -2.344 0.672 -8.453 973 H THR 25 H THR 25 -5.757 3.854 -5.142 974 HA THR 25 HA THR 25 -5.959 5.399 -2.778 975 HB THR 25 HB THR 25 -7.615 5.813 -5.307 976 HG1 THR 25 HG1 THR 25 -5.632 7.133 -5.861 977 HG21 THR 25 HG21 THR 25 -6.392 7.792 -3.336 978 HG22 THR 25 HG22 THR 25 -8.105 7.368 -3.429 979 HG23 THR 25 HG23 THR 25 -7.331 8.212 -4.771 980 H HIS 26 H HIS 26 -8.142 3.107 -4.337 981 HA HIS 26 HA HIS 26 -10.537 3.757 -2.920 982 HB2 HIS 26 HB2 HIS 26 -9.789 1.155 -4.329 983 HB3 HIS 26 HB3 HIS 26 -11.398 1.549 -3.732 984 HD1 HIS 26 HD1 HIS 26 -11.449 0.892 -6.521 985 HD2 HIS 26 HD2 HIS 26 -10.411 4.723 -5.330 986 HE1 HIS 26 HE1 HIS 26 -11.843 2.349 -8.526 987 HE2 HIS 26 HE2 HIS 26 -11.183 4.662 -7.788 988 H VAL 27 H VAL 27 -8.105 1.117 -2.488 989 HA VAL 27 HA VAL 27 -9.337 -0.091 -0.259 990 HB VAL 27 HB VAL 27 -7.284 -1.301 0.179 991 HG11 VAL 27 HG11 VAL 27 -8.505 -2.028 -1.815 992 HG12 VAL 27 HG12 VAL 27 -6.775 -2.275 -2.042 993 HG13 VAL 27 HG13 VAL 27 -7.582 -0.911 -2.823 994 HG21 VAL 27 HG21 VAL 27 -5.112 -0.814 -0.894 995 HG22 VAL 27 HG22 VAL 27 -5.639 0.533 0.118 996 HG23 VAL 27 HG23 VAL 27 -5.798 0.637 -1.635 997 H CYS 28 H CYS 28 -6.970 2.505 -0.498 998 HA CYS 28 HA CYS 28 -6.461 2.904 2.246 999 HB2 CYS 28 HB2 CYS 28 -6.179 4.729 -0.166 1000 HB3 CYS 28 HB3 CYS 28 -5.519 5.086 1.431 1001 HG CYS 28 HG CYS 28 -4.080 3.495 -0.953 1002 H GLY 29 H GLY 29 -8.869 4.225 0.014 1003 HA2 GLY 29 HA2 GLY 29 -9.954 6.256 1.645 1004 HA3 GLY 29 HA3 GLY 29 -10.754 5.471 0.296 1005 H LEU 30 H LEU 30 -10.772 2.812 1.277 1006 HA LEU 30 HA LEU 30 -13.201 2.846 2.718 1007 HB2 LEU 30 HB2 LEU 30 -11.394 0.734 1.630 1008 HB3 LEU 30 HB3 LEU 30 -12.412 0.217 2.959 1009 HG LEU 30 HG LEU 30 -13.501 -0.335 0.868 1010 HD11 LEU 30 HD11 LEU 30 -15.677 0.736 1.174 1011 HD12 LEU 30 HD12 LEU 30 -14.952 1.990 2.182 1012 HD13 LEU 30 HD13 LEU 30 -14.963 0.310 2.726 1013 HD21 LEU 30 HD21 LEU 30 -14.215 1.345 -0.783 1014 HD22 LEU 30 HD22 LEU 30 -12.461 1.302 -0.630 1015 HD23 LEU 30 HD23 LEU 30 -13.377 2.611 0.122 1016 H PHE 31 H PHE 31 -9.890 2.047 3.756 1017 HA PHE 31 HA PHE 31 -10.763 1.369 6.438 1018 HB2 PHE 31 HB2 PHE 31 -7.960 1.526 5.272 1019 HB3 PHE 31 HB3 PHE 31 -8.356 0.916 6.881 1020 HD1 PHE 31 HD2 PHE 31 -10.285 -0.967 6.895 1021 HD2 PHE 31 HD1 PHE 31 -7.771 -0.096 3.544 1022 HE1 PHE 31 HE2 PHE 31 -10.785 -3.177 5.932 1023 HE2 PHE 31 HE1 PHE 31 -8.289 -2.298 2.588 1024 HZ PHE 31 HZ PHE 31 -9.792 -3.840 3.777 1025 H ALA 32 H ALA 32 -9.408 4.204 4.860 1026 HA ALA 32 HA ALA 32 -8.764 5.701 7.198 1027 HB1 ALA 32 HB1 ALA 32 -7.960 6.356 4.967 1028 HB2 ALA 32 HB2 ALA 32 -8.843 7.682 5.726 1029 HB3 ALA 32 HB3 ALA 32 -9.612 6.717 4.462 1030 H ARG 33 H ARG 33 -11.746 5.498 5.217 1031 HA ARG 33 HA ARG 33 -13.260 7.333 6.862 1032 HB2 ARG 33 HB2 ARG 33 -15.107 6.924 5.376 1033 HB3 ARG 33 HB3 ARG 33 -13.652 6.996 4.388 1034 HG2 ARG 33 HG2 ARG 33 -13.620 4.478 4.359 1035 HG3 ARG 33 HG3 ARG 33 -15.169 4.490 5.206 1036 HD2 ARG 33 HD2 ARG 33 -14.638 5.719 2.478 1037 HD3 ARG 33 HD3 ARG 33 -15.415 4.159 2.761 1038 HE ARG 33 HE ARG 33 -17.066 5.692 4.132 1039 HH11 ARG 33 HH11 ARG 33 -15.647 6.379 0.980 1040 HH12 ARG 33 HH12 ARG 33 -16.989 7.343 0.453 1041 HH21 ARG 33 HH21 ARG 33 -18.831 6.939 3.413 1042 HH22 ARG 33 HH22 ARG 33 -18.795 7.662 1.834 1043 H ARG 34 H ARG 34 -12.346 4.157 7.336 1044 HA ARG 34 HA ARG 34 -14.725 2.983 8.397 1045 HB2 ARG 34 HB2 ARG 34 -12.882 1.666 7.403 1046 HB3 ARG 34 HB3 ARG 34 -11.786 2.206 8.659 1047 HG2 ARG 34 HG2 ARG 34 -14.259 0.656 9.423 1048 HG3 ARG 34 HG3 ARG 34 -12.873 -0.197 8.743 1049 HD2 ARG 34 HD2 ARG 34 -12.808 1.551 11.226 1050 HD3 ARG 34 HD3 ARG 34 -12.876 -0.210 11.206 1051 HE ARG 34 HE ARG 34 -10.630 0.893 9.766 1052 HH11 ARG 34 HH11 ARG 34 -11.714 -0.161 12.957 1053 HH12 ARG 34 HH12 ARG 34 -10.102 -0.463 13.523 1054 HH21 ARG 34 HH21 ARG 34 -8.535 0.481 10.558 1055 HH22 ARG 34 HH22 ARG 34 -8.327 -0.103 12.180 1056 H ALA 35 H ALA 35 -11.672 3.990 9.968 1057 HA ALA 35 HA ALA 35 -12.722 5.528 12.052 1058 HB1 ALA 35 HB1 ALA 35 -13.738 3.433 12.906 1059 HB2 ALA 35 HB2 ALA 35 -12.486 4.003 14.010 1060 HB3 ALA 35 HB3 ALA 35 -12.156 2.651 12.919 1061 H PHE 36 H PHE 36 -10.347 2.908 11.758 1062 HA PHE 36 HA PHE 36 -8.120 4.765 12.391 1063 HB2 PHE 36 HB2 PHE 36 -8.555 3.129 14.220 1064 HB3 PHE 36 HB3 PHE 36 -8.425 1.799 13.082 1065 HD1 PHE 36 HD2 PHE 36 -6.461 4.562 14.681 1066 HD2 PHE 36 HD1 PHE 36 -6.287 0.808 12.625 1067 HE1 PHE 36 HE2 PHE 36 -4.053 4.396 15.166 1068 HE2 PHE 36 HE1 PHE 36 -3.882 0.654 13.118 1069 HZ PHE 36 HZ PHE 36 -2.763 2.444 14.387 1070 H ASN 37 H ASN 37 -6.199 4.442 11.195 1071 HA ASN 37 HA ASN 37 -6.594 3.706 8.456 1072 HB2 ASN 37 HB2 ASN 37 -4.121 4.625 9.982 1073 HB3 ASN 37 HB3 ASN 37 -4.108 4.291 8.253 1074 HD21 ASN 37 HD21 ASN 37 -5.002 6.558 10.694 1075 HD22 ASN 37 HD22 ASN 37 -5.609 7.768 9.629 1076 H VAL 38 H VAL 38 -4.611 2.530 7.384 1077 HA VAL 38 HA VAL 38 -4.557 -0.209 8.328 1078 HB VAL 38 HB VAL 38 -3.055 1.014 5.961 1079 HG11 VAL 38 HG11 VAL 38 -2.184 -1.168 6.655 1080 HG12 VAL 38 HG12 VAL 38 -3.008 -1.306 5.099 1081 HG13 VAL 38 HG13 VAL 38 -3.805 -1.869 6.570 1082 HG21 VAL 38 HG21 VAL 38 -5.815 -0.271 5.956 1083 HG22 VAL 38 HG22 VAL 38 -4.907 0.225 4.523 1084 HG23 VAL 38 HG23 VAL 38 -5.461 1.438 5.680 1085 H GLU 39 H GLU 39 -2.831 -1.199 9.272 1086 HA GLU 39 HA GLU 39 -0.667 0.355 10.400 1087 HB2 GLU 39 HB2 GLU 39 -1.898 -1.442 11.661 1088 HB3 GLU 39 HB3 GLU 39 -1.247 -2.640 10.548 1089 HG2 GLU 39 HG2 GLU 39 1.068 -1.938 11.302 1090 HG3 GLU 39 HG3 GLU 39 0.295 -0.952 12.541 1091 H GLY 40 H GLY 40 -0.967 -2.435 8.164 1092 HA2 GLY 40 HA2 GLY 40 1.651 -1.786 6.924 1093 HA3 GLY 40 HA3 GLY 40 1.350 -3.417 7.520 1094 H ILE 41 H ILE 41 1.866 -2.508 4.765 1095 HA ILE 41 HA ILE 41 -0.545 -3.587 3.416 1096 HB ILE 41 HB ILE 41 1.061 -1.177 2.410 1097 HG12 ILE 41 HG12 ILE 41 -1.817 -1.253 3.432 1098 HG13 ILE 41 HG13 ILE 41 -0.450 -0.551 4.287 1099 HG21 ILE 41 HG21 ILE 41 -0.585 -1.040 0.571 1100 HG22 ILE 41 HG22 ILE 41 -1.377 -2.499 1.172 1101 HG23 ILE 41 HG23 ILE 41 0.273 -2.584 0.553 1102 HD11 ILE 41 HD11 ILE 41 -0.213 1.123 2.504 1103 HD12 ILE 41 HD12 ILE 41 -1.798 1.169 3.271 1104 HD13 ILE 41 HD13 ILE 41 -1.615 0.431 1.680 1105 H LEU 42 H LEU 42 -0.057 -4.930 1.655 1106 HA LEU 42 HA LEU 42 2.646 -4.947 0.546 1107 HB2 LEU 42 HB2 LEU 42 2.776 -6.615 2.347 1108 HB3 LEU 42 HB3 LEU 42 1.362 -7.448 1.719 1109 HG LEU 42 HG LEU 42 2.590 -8.207 -0.254 1110 HD11 LEU 42 HD11 LEU 42 4.940 -6.566 0.733 1111 HD12 LEU 42 HD12 LEU 42 3.952 -6.240 -0.695 1112 HD13 LEU 42 HD13 LEU 42 4.958 -7.685 -0.635 1113 HD21 LEU 42 HD21 LEU 42 2.840 -9.565 1.768 1114 HD22 LEU 42 HD22 LEU 42 4.270 -8.640 2.236 1115 HD23 LEU 42 HD23 LEU 42 4.297 -9.635 0.776 1116 H CYS 43 H CYS 43 1.806 -4.153 -1.362 1117 HA CYS 43 HA CYS 43 -0.225 -5.616 -2.859 1118 HB2 CYS 43 HB2 CYS 43 -0.202 -3.174 -3.049 1119 HB3 CYS 43 HB3 CYS 43 1.468 -3.198 -3.602 1120 HG CYS 43 HG CYS 43 0.995 -4.128 -6.091 1121 H LEU 44 H LEU 44 0.473 -7.506 -3.589 1122 HA LEU 44 HA LEU 44 3.190 -7.906 -4.629 1123 HB2 LEU 44 HB2 LEU 44 1.919 -9.465 -2.941 1124 HB3 LEU 44 HB3 LEU 44 1.020 -10.014 -4.341 1125 HG LEU 44 HG LEU 44 3.345 -10.605 -5.371 1126 HD11 LEU 44 HD11 LEU 44 5.147 -11.025 -3.760 1127 HD12 LEU 44 HD12 LEU 44 4.174 -10.328 -2.464 1128 HD13 LEU 44 HD13 LEU 44 4.720 -9.317 -3.808 1129 HD21 LEU 44 HD21 LEU 44 3.402 -12.792 -4.262 1130 HD22 LEU 44 HD22 LEU 44 1.742 -12.311 -4.607 1131 HD23 LEU 44 HD23 LEU 44 2.371 -12.180 -2.962 1132 HA PRO 45 HA PRO 45 0.965 -7.418 -8.650 1133 HB2 PRO 45 HB2 PRO 45 3.149 -6.909 -10.224 1134 HB3 PRO 45 HB3 PRO 45 2.452 -5.680 -9.147 1135 HG2 PRO 45 HG2 PRO 45 4.876 -7.404 -8.712 1136 HG3 PRO 45 HG3 PRO 45 4.653 -5.672 -8.370 1137 HD2 PRO 45 HD2 PRO 45 4.454 -7.631 -6.439 1138 HD3 PRO 45 HD3 PRO 45 3.597 -6.076 -6.342 1139 H ILE 46 H ILE 46 0.256 -9.224 -9.591 1140 HA ILE 46 HA ILE 46 1.885 -11.624 -9.914 1141 HB ILE 46 HB ILE 46 -1.056 -11.015 -10.392 1142 HG12 ILE 46 HG12 ILE 46 -1.363 -12.952 -8.748 1143 HG13 ILE 46 HG13 ILE 46 0.378 -12.945 -8.511 1144 HG21 ILE 46 HG21 ILE 46 -0.445 -12.419 -12.269 1145 HG22 ILE 46 HG22 ILE 46 -1.411 -13.353 -11.128 1146 HG23 ILE 46 HG23 ILE 46 0.336 -13.581 -11.195 1147 HD11 ILE 46 HD11 ILE 46 -0.769 -11.813 -6.720 1148 HD12 ILE 46 HD12 ILE 46 -1.511 -10.696 -7.865 1149 HD13 ILE 46 HD13 ILE 46 0.237 -10.678 -7.620 1150 H GLN 47 H GLN 47 2.578 -12.455 -11.882 1151 HA GLN 47 HA GLN 47 2.899 -10.462 -13.991 1152 HB2 GLN 47 HB2 GLN 47 4.721 -11.836 -14.809 1153 HB3 GLN 47 HB3 GLN 47 4.891 -11.615 -13.071 1154 HG2 GLN 47 HG2 GLN 47 4.014 -13.884 -12.677 1155 HG3 GLN 47 HG3 GLN 47 3.794 -14.114 -14.413 1156 HE21 GLN 47 HE21 GLN 47 5.362 -15.731 -12.661 1157 HE22 GLN 47 HE22 GLN 47 6.999 -15.645 -13.190 1158 H ASP 48 H ASP 48 1.325 -13.644 -13.583 1159 HA ASP 48 HA ASP 48 1.356 -14.327 -16.350 1160 HB2 ASP 48 HB2 ASP 48 -0.125 -16.200 -15.800 1161 HB3 ASP 48 HB3 ASP 48 1.194 -16.080 -14.648 1162 H SER 49 H SER 49 -0.931 -12.558 -14.383 1163 HA SER 49 HA SER 49 -2.413 -11.706 -16.761 1164 HB2 SER 49 HB2 SER 49 -3.838 -12.939 -14.345 1165 HB3 SER 49 HB3 SER 49 -4.630 -12.176 -15.726 1166 HG SER 49 HG SER 49 -2.975 -14.486 -15.834 1167 H ASP 50 H ASP 50 -3.900 -9.880 -16.225 1168 HA ASP 50 HA ASP 50 -2.687 -7.892 -14.591 1169 HB2 ASP 50 HB2 ASP 50 -5.464 -7.935 -15.879 1170 HB3 ASP 50 HB3 ASP 50 -4.730 -6.518 -15.129 1171 H LYS 51 H LYS 51 -2.560 -8.845 -12.508 1172 HA LYS 51 HA LYS 51 -4.693 -7.998 -10.821 1173 HB2 LYS 51 HB2 LYS 51 -5.090 -10.138 -9.613 1174 HB3 LYS 51 HB3 LYS 51 -5.646 -10.194 -11.281 1175 HG2 LYS 51 HG2 LYS 51 -3.643 -11.489 -11.918 1176 HG3 LYS 51 HG3 LYS 51 -3.070 -11.416 -10.247 1177 HD2 LYS 51 HD2 LYS 51 -5.045 -12.684 -9.489 1178 HD3 LYS 51 HD3 LYS 51 -5.672 -12.722 -11.140 1179 HE2 LYS 51 HE2 LYS 51 -3.092 -14.014 -10.195 1180 HE3 LYS 51 HE3 LYS 51 -4.608 -14.856 -10.518 1181 HZ1 LYS 51 HZ1 LYS 51 -4.441 -14.268 -12.825 1182 HZ2 LYS 51 HZ2 LYS 51 -3.008 -15.022 -12.343 1183 HZ3 LYS 51 HZ3 LYS 51 -3.051 -13.347 -12.546 1184 H SER 52 H SER 52 -4.106 -7.843 -8.660 1185 HA SER 52 HA SER 52 -1.386 -8.479 -7.790 1186 HB2 SER 52 HB2 SER 52 -2.624 -5.682 -7.627 1187 HB3 SER 52 HB3 SER 52 -1.061 -6.163 -6.970 1188 HG SER 52 HG SER 52 -1.832 -5.719 -9.614 1189 H HIS 53 H HIS 53 -1.458 -9.203 -5.675 1190 HA HIS 53 HA HIS 53 -4.021 -8.989 -4.195 1191 HB2 HIS 53 HB2 HIS 53 -1.578 -10.773 -3.751 1192 HB3 HIS 53 HB3 HIS 53 -2.951 -10.715 -2.651 1193 HD1 HIS 53 HD1 HIS 53 -3.728 -13.095 -2.992 1194 HD2 HIS 53 HD2 HIS 53 -3.414 -10.997 -6.566 1195 HE1 HIS 53 HE1 HIS 53 -4.741 -14.574 -4.741 1196 HE2 HIS 53 HE2 HIS 53 -4.713 -13.201 -6.841 1197 H ILE 54 H ILE 54 -4.102 -7.140 -3.040 1198 HA ILE 54 HA ILE 54 -1.718 -6.076 -1.683 1199 HB ILE 54 HB ILE 54 -4.496 -4.786 -1.875 1200 HG12 ILE 54 HG12 ILE 54 -3.288 -3.129 -3.464 1201 HG13 ILE 54 HG13 ILE 54 -2.012 -4.328 -3.584 1202 HG21 ILE 54 HG21 ILE 54 -1.830 -3.630 -0.966 1203 HG22 ILE 54 HG22 ILE 54 -3.195 -4.034 0.076 1204 HG23 ILE 54 HG23 ILE 54 -3.345 -2.729 -1.100 1205 HD11 ILE 54 HD11 ILE 54 -3.572 -5.897 -4.571 1206 HD12 ILE 54 HD12 ILE 54 -3.499 -4.388 -5.477 1207 HD13 ILE 54 HD13 ILE 54 -4.869 -4.711 -4.416 1208 H TRP 55 H TRP 55 -1.405 -7.061 0.278 1209 HA TRP 55 HA TRP 55 -3.637 -7.905 1.950 1210 HB2 TRP 55 HB2 TRP 55 -0.613 -8.145 2.255 1211 HB3 TRP 55 HB3 TRP 55 -1.734 -8.640 3.522 1212 HD1 TRP 55 HD1 TRP 55 -3.383 -10.717 2.938 1213 HE1 TRP 55 HE1 TRP 55 -3.071 -12.727 1.383 1214 HE3 TRP 55 HE3 TRP 55 0.423 -8.917 0.087 1215 HZ2 TRP 55 HZ2 TRP 55 -1.443 -13.459 -0.770 1216 HZ3 TRP 55 HZ3 TRP 55 1.311 -10.341 -1.696 1217 HH2 TRP 55 HH2 TRP 55 0.403 -12.562 -2.125 1218 H LEU 56 H LEU 56 -4.653 -6.195 2.838 1219 HA LEU 56 HA LEU 56 -3.219 -4.011 4.124 1220 HB2 LEU 56 HB2 LEU 56 -6.207 -4.597 3.934 1221 HB3 LEU 56 HB3 LEU 56 -5.520 -3.194 4.732 1222 HG LEU 56 HG LEU 56 -6.289 -2.397 2.647 1223 HD11 LEU 56 HD11 LEU 56 -3.323 -2.831 2.270 1224 HD12 LEU 56 HD12 LEU 56 -4.088 -1.538 3.200 1225 HD13 LEU 56 HD13 LEU 56 -4.325 -1.624 1.456 1226 HD21 LEU 56 HD21 LEU 56 -6.683 -4.510 1.512 1227 HD22 LEU 56 HD22 LEU 56 -4.952 -4.722 1.240 1228 HD23 LEU 56 HD23 LEU 56 -5.815 -3.393 0.459 1229 H LEU 57 H LEU 57 -2.357 -4.515 5.990 1230 HA LEU 57 HA LEU 57 -3.526 -6.245 8.002 1231 HB2 LEU 57 HB2 LEU 57 -0.986 -4.571 7.852 1232 HB3 LEU 57 HB3 LEU 57 -1.505 -5.297 9.363 1233 HG LEU 57 HG LEU 57 -1.243 -7.542 8.413 1234 HD11 LEU 57 HD11 LEU 57 -0.182 -7.924 6.228 1235 HD12 LEU 57 HD12 LEU 57 -0.329 -6.200 5.863 1236 HD13 LEU 57 HD13 LEU 57 -1.778 -7.188 6.091 1237 HD21 LEU 57 HD21 LEU 57 1.210 -7.562 8.250 1238 HD22 LEU 57 HD22 LEU 57 0.641 -6.529 9.561 1239 HD23 LEU 57 HD23 LEU 57 1.209 -5.804 8.054 1240 H VAL 58 H VAL 58 -5.395 -5.226 8.640 1241 HA VAL 58 HA VAL 58 -5.158 -2.553 9.922 1242 HB VAL 58 HB VAL 58 -6.321 -2.460 7.668 1243 HG11 VAL 58 HG11 VAL 58 -7.404 -4.651 7.656 1244 HG12 VAL 58 HG12 VAL 58 -8.594 -3.373 7.401 1245 HG13 VAL 58 HG13 VAL 58 -8.465 -4.154 8.980 1246 HG21 VAL 58 HG21 VAL 58 -6.791 -0.728 9.334 1247 HG22 VAL 58 HG22 VAL 58 -8.069 -1.721 10.041 1248 HG23 VAL 58 HG23 VAL 58 -8.249 -1.086 8.403 1249 H ASN 59 H ASN 59 -6.366 -2.360 11.897 1250 HA ASN 59 HA ASN 59 -6.830 -4.898 13.172 1251 HB2 ASN 59 HB2 ASN 59 -7.331 -3.616 15.226 1252 HB3 ASN 59 HB3 ASN 59 -5.790 -3.212 14.494 1253 HD21 ASN 59 HD21 ASN 59 -5.738 -1.307 15.689 1254 HD22 ASN 59 HD22 ASN 59 -6.688 0.071 15.268 1255 H ASP 60 H ASP 60 -8.657 -5.883 13.745 1256 HA ASP 60 HA ASP 60 -10.897 -5.606 12.081 1257 HB2 ASP 60 HB2 ASP 60 -10.314 -7.789 12.886 1258 HB3 ASP 60 HB3 ASP 60 -10.380 -7.272 14.567 1259 H ASP 61 H ASP 61 -12.983 -4.940 12.456 1260 HA ASP 61 HA ASP 61 -13.614 -3.243 14.759 1261 HB2 ASP 61 HB2 ASP 61 -12.249 -1.924 13.067 1262 HB3 ASP 61 HB3 ASP 61 -13.485 -2.255 11.870 1263 H GLN 62 H GLN 62 -15.937 -2.540 14.646 1264 HA GLN 62 HA GLN 62 -17.722 -4.602 13.870 1265 HB2 GLN 62 HB2 GLN 62 -18.354 -1.683 14.480 1266 HB3 GLN 62 HB3 GLN 62 -19.529 -3.002 14.465 1267 HG2 GLN 62 HG2 GLN 62 -18.457 -4.042 16.376 1268 HG3 GLN 62 HG3 GLN 62 -17.143 -2.864 16.339 1269 HE21 GLN 62 HE21 GLN 62 -17.378 -1.719 18.166 1270 HE22 GLN 62 HE22 GLN 62 -18.832 -0.954 18.703 1271 H ARG 63 H ARG 63 -16.832 -1.550 12.372 1272 HA ARG 63 HA ARG 63 -18.687 -1.757 10.151 1273 HB2 ARG 63 HB2 ARG 63 -16.540 0.283 10.849 1274 HB3 ARG 63 HB3 ARG 63 -17.360 0.313 9.299 1275 HG2 ARG 63 HG2 ARG 63 -18.387 1.930 10.756 1276 HG3 ARG 63 HG3 ARG 63 -19.532 0.623 10.459 1277 HD2 ARG 63 HD2 ARG 63 -19.504 1.429 12.832 1278 HD3 ARG 63 HD3 ARG 63 -19.139 -0.296 12.680 1279 HE ARG 63 HE ARG 63 -16.681 0.846 12.652 1280 HH11 ARG 63 HH11 ARG 63 -19.344 1.238 14.899 1281 HH12 ARG 63 HH12 ARG 63 -18.297 1.550 16.241 1282 HH21 ARG 63 HH21 ARG 63 -15.342 1.126 14.432 1283 HH22 ARG 63 HH22 ARG 63 -16.033 1.490 15.984 1284 H LEU 64 H LEU 64 -15.431 -2.715 10.831 1285 HA LEU 64 HA LEU 64 -13.984 -2.552 8.525 1286 HB2 LEU 64 HB2 LEU 64 -13.564 -3.724 10.930 1287 HB3 LEU 64 HB3 LEU 64 -13.819 -5.178 10.007 1288 HG LEU 64 HG LEU 64 -11.435 -4.725 10.274 1289 HD11 LEU 64 HD11 LEU 64 -10.665 -4.815 7.979 1290 HD12 LEU 64 HD12 LEU 64 -12.237 -4.254 7.403 1291 HD13 LEU 64 HD13 LEU 64 -12.094 -5.820 8.206 1292 HD21 LEU 64 HD21 LEU 64 -11.891 -2.084 8.851 1293 HD22 LEU 64 HD22 LEU 64 -10.328 -2.751 9.340 1294 HD23 LEU 64 HD23 LEU 64 -11.511 -2.294 10.563 1295 H GLU 65 H GLU 65 -16.189 -5.255 9.351 1296 HA GLU 65 HA GLU 65 -15.774 -6.772 6.998 1297 HB2 GLU 65 HB2 GLU 65 -18.114 -6.827 8.942 1298 HB3 GLU 65 HB3 GLU 65 -17.761 -8.070 7.738 1299 HG2 GLU 65 HG2 GLU 65 -15.552 -8.447 8.870 1300 HG3 GLU 65 HG3 GLU 65 -16.043 -7.309 10.123 1301 H GLN 66 H GLN 66 -18.017 -4.206 7.771 1302 HA GLN 66 HA GLN 66 -19.744 -4.510 5.494 1303 HB2 GLN 66 HB2 GLN 66 -19.298 -2.024 7.212 1304 HB3 GLN 66 HB3 GLN 66 -20.672 -2.328 6.149 1305 HG2 GLN 66 HG2 GLN 66 -19.985 -3.856 8.682 1306 HG3 GLN 66 HG3 GLN 66 -21.271 -2.668 8.500 1307 HE21 GLN 66 HE21 GLN 66 -22.161 -3.669 5.883 1308 HE22 GLN 66 HE22 GLN 66 -22.977 -5.154 6.196 1309 H MET 67 H MET 67 -16.815 -2.651 6.213 1310 HA MET 67 HA MET 67 -16.634 -1.228 3.748 1311 HB2 MET 67 HB2 MET 67 -14.658 -1.842 5.964 1312 HB3 MET 67 HB3 MET 67 -14.087 -1.124 4.463 1313 HG2 MET 67 HG2 MET 67 -14.489 0.568 6.198 1314 HG3 MET 67 HG3 MET 67 -15.519 0.808 4.787 1315 HE1 MET 67 HE1 MET 67 -17.109 2.460 6.140 1316 HE2 MET 67 HE2 MET 67 -16.058 2.275 7.546 1317 HE3 MET 67 HE3 MET 67 -17.800 2.063 7.714 1318 H ILE 68 H ILE 68 -15.509 -4.410 4.835 1319 HA ILE 68 HA ILE 68 -13.965 -5.127 2.564 1320 HB ILE 68 HB ILE 68 -15.510 -6.941 4.486 1321 HG12 ILE 68 HG12 ILE 68 -12.537 -6.230 4.482 1322 HG13 ILE 68 HG13 ILE 68 -13.731 -5.517 5.557 1323 HG21 ILE 68 HG21 ILE 68 -13.318 -7.710 2.516 1324 HG22 ILE 68 HG22 ILE 68 -15.021 -8.151 2.391 1325 HG23 ILE 68 HG23 ILE 68 -14.044 -8.787 3.714 1326 HD11 ILE 68 HD11 ILE 68 -12.472 -7.225 6.698 1327 HD12 ILE 68 HD12 ILE 68 -12.921 -8.421 5.484 1328 HD13 ILE 68 HD13 ILE 68 -14.155 -7.728 6.541 1329 H SER 69 H SER 69 -17.401 -5.526 3.375 1330 HA SER 69 HA SER 69 -18.245 -6.918 1.058 1331 HB2 SER 69 HB2 SER 69 -19.559 -6.852 3.165 1332 HB3 SER 69 HB3 SER 69 -19.851 -5.129 2.940 1333 HG SER 69 HG SER 69 -20.637 -7.146 1.106 1334 H GLN 70 H GLN 70 -17.972 -3.494 1.851 1335 HA GLN 70 HA GLN 70 -19.392 -2.406 -0.345 1336 HB2 GLN 70 HB2 GLN 70 -18.697 -1.274 1.887 1337 HB3 GLN 70 HB3 GLN 70 -17.119 -1.032 1.159 1338 HG2 GLN 70 HG2 GLN 70 -19.709 0.073 0.022 1339 HG3 GLN 70 HG3 GLN 70 -18.660 0.961 1.114 1340 HE21 GLN 70 HE21 GLN 70 -16.177 0.010 -0.197 1341 HE22 GLN 70 HE22 GLN 70 -16.083 0.887 -1.678 1342 H ILE 71 H ILE 71 -15.919 -2.960 0.267 1343 HA ILE 71 HA ILE 71 -15.082 -1.883 -2.256 1344 HB ILE 71 HB ILE 71 -13.687 -1.795 -0.164 1345 HG12 ILE 71 HG12 ILE 71 -12.441 -3.000 -2.668 1346 HG13 ILE 71 HG13 ILE 71 -12.625 -1.292 -2.286 1347 HG21 ILE 71 HG21 ILE 71 -13.093 -4.725 -0.689 1348 HG22 ILE 71 HG22 ILE 71 -14.068 -4.102 0.642 1349 HG23 ILE 71 HG23 ILE 71 -12.353 -3.705 0.552 1350 HD11 ILE 71 HD11 ILE 71 -11.026 -1.580 -0.436 1351 HD12 ILE 71 HD12 ILE 71 -10.353 -1.960 -2.021 1352 HD13 ILE 71 HD13 ILE 71 -10.815 -3.266 -0.927 1353 H ASP 72 H ASP 72 -15.889 -5.075 -1.072 1354 HA ASP 72 HA ASP 72 -14.713 -6.778 -2.926 1355 HB2 ASP 72 HB2 ASP 72 -15.793 -7.818 -1.086 1356 HB3 ASP 72 HB3 ASP 72 -17.283 -6.913 -1.314 1357 H LYS 73 H LYS 73 -17.743 -4.955 -3.137 1358 HA LYS 73 HA LYS 73 -18.393 -6.052 -5.763 1359 HB2 LYS 73 HB2 LYS 73 -20.527 -4.829 -5.508 1360 HB3 LYS 73 HB3 LYS 73 -20.190 -5.908 -4.158 1361 HG2 LYS 73 HG2 LYS 73 -19.412 -3.937 -2.831 1362 HG3 LYS 73 HG3 LYS 73 -19.880 -2.888 -4.174 1363 HD2 LYS 73 HD2 LYS 73 -21.615 -2.919 -2.428 1364 HD3 LYS 73 HD3 LYS 73 -22.233 -3.614 -3.930 1365 HE2 LYS 73 HE2 LYS 73 -21.942 -5.877 -3.039 1366 HE3 LYS 73 HE3 LYS 73 -21.191 -5.238 -1.577 1367 HZ1 LYS 73 HZ1 LYS 73 -23.999 -4.813 -2.452 1368 HZ2 LYS 73 HZ2 LYS 73 -23.299 -4.116 -1.080 1369 HZ3 LYS 73 HZ3 LYS 73 -23.480 -5.792 -1.175 1370 H LEU 74 H LEU 74 -16.085 -4.080 -5.266 1371 HA LEU 74 HA LEU 74 -16.742 -1.936 -7.147 1372 HB2 LEU 74 HB2 LEU 74 -14.459 -2.535 -5.309 1373 HB3 LEU 74 HB3 LEU 74 -13.996 -1.758 -6.805 1374 HG LEU 74 HG LEU 74 -14.306 -0.119 -4.979 1375 HD11 LEU 74 HD11 LEU 74 -14.667 0.622 -7.279 1376 HD12 LEU 74 HD12 LEU 74 -15.727 1.484 -6.167 1377 HD13 LEU 74 HD13 LEU 74 -16.379 0.189 -7.176 1378 HD21 LEU 74 HD21 LEU 74 -16.524 0.385 -4.053 1379 HD22 LEU 74 HD22 LEU 74 -16.040 -1.265 -3.674 1380 HD23 LEU 74 HD23 LEU 74 -17.224 -0.969 -4.948 1381 H GLU 75 H GLU 75 -15.567 -1.645 -9.133 1382 HA GLU 75 HA GLU 75 -15.536 -4.018 -10.754 1383 HB2 GLU 75 HB2 GLU 75 -14.837 -1.125 -11.432 1384 HB3 GLU 75 HB3 GLU 75 -15.038 -2.417 -12.620 1385 HG2 GLU 75 HG2 GLU 75 -17.395 -2.675 -11.964 1386 HG3 GLU 75 HG3 GLU 75 -17.199 -1.428 -10.731 1387 H ASP 76 H ASP 76 -13.119 -1.877 -9.441 1388 HA ASP 76 HA ASP 76 -10.833 -2.840 -10.810 1389 HB2 ASP 76 HB2 ASP 76 -9.590 -1.728 -8.853 1390 HB3 ASP 76 HB3 ASP 76 -10.628 -0.698 -9.825 1391 H VAL 77 H VAL 77 -12.165 -3.576 -7.595 1392 HA VAL 77 HA VAL 77 -10.386 -5.685 -6.944 1393 HB VAL 77 HB VAL 77 -13.182 -4.998 -5.915 1394 HG11 VAL 77 HG11 VAL 77 -12.763 -6.530 -4.014 1395 HG12 VAL 77 HG12 VAL 77 -11.261 -7.068 -4.770 1396 HG13 VAL 77 HG13 VAL 77 -12.810 -7.412 -5.544 1397 HG21 VAL 77 HG21 VAL 77 -10.437 -4.592 -4.662 1398 HG22 VAL 77 HG22 VAL 77 -11.984 -4.144 -3.939 1399 HG23 VAL 77 HG23 VAL 77 -11.429 -3.327 -5.402 1400 H VAL 78 H VAL 78 -10.204 -7.339 -8.286 1401 HA VAL 78 HA VAL 78 -12.298 -8.553 -9.812 1402 HB VAL 78 HB VAL 78 -9.595 -9.775 -9.055 1403 HG11 VAL 78 HG11 VAL 78 -11.426 -10.349 -11.420 1404 HG12 VAL 78 HG12 VAL 78 -11.154 -11.406 -10.033 1405 HG13 VAL 78 HG13 VAL 78 -9.836 -11.071 -11.156 1406 HG21 VAL 78 HG21 VAL 78 -8.685 -8.811 -11.139 1407 HG22 VAL 78 HG22 VAL 78 -9.233 -7.543 -10.036 1408 HG23 VAL 78 HG23 VAL 78 -10.218 -7.982 -11.436 1409 H LYS 79 H LYS 79 -10.585 -9.341 -6.799 1410 HA LYS 79 HA LYS 79 -12.817 -10.910 -5.763 1411 HB2 LYS 79 HB2 LYS 79 -10.004 -12.078 -6.051 1412 HB3 LYS 79 HB3 LYS 79 -11.260 -12.778 -5.032 1413 HG2 LYS 79 HG2 LYS 79 -12.656 -13.175 -7.039 1414 HG3 LYS 79 HG3 LYS 79 -11.375 -12.502 -8.051 1415 HD2 LYS 79 HD2 LYS 79 -9.843 -14.317 -7.298 1416 HD3 LYS 79 HD3 LYS 79 -11.134 -14.986 -6.296 1417 HE2 LYS 79 HE2 LYS 79 -12.487 -15.370 -8.356 1418 HE3 LYS 79 HE3 LYS 79 -11.144 -14.766 -9.328 1419 HZ1 LYS 79 HZ1 LYS 79 -9.776 -16.570 -8.423 1420 HZ2 LYS 79 HZ2 LYS 79 -11.113 -17.154 -9.274 1421 HZ3 LYS 79 HZ3 LYS 79 -11.114 -17.171 -7.585 1422 H VAL 80 H VAL 80 -12.814 -10.988 -3.490 1423 HA VAL 80 HA VAL 80 -10.590 -9.629 -2.043 1424 HB VAL 80 HB VAL 80 -12.837 -8.485 -1.802 1425 HG11 VAL 80 HG11 VAL 80 -14.324 -10.439 -1.916 1426 HG12 VAL 80 HG12 VAL 80 -14.622 -9.513 -0.443 1427 HG13 VAL 80 HG13 VAL 80 -13.706 -11.022 -0.367 1428 HG21 VAL 80 HG21 VAL 80 -11.134 -8.238 -0.036 1429 HG22 VAL 80 HG22 VAL 80 -11.759 -9.668 0.787 1430 HG23 VAL 80 HG23 VAL 80 -12.759 -8.218 0.654 1431 H GLN 81 H GLN 81 -9.784 -10.735 -0.155 1432 HA GLN 81 HA GLN 81 -11.087 -13.213 0.704 1433 HB2 GLN 81 HB2 GLN 81 -9.617 -14.076 -1.054 1434 HB3 GLN 81 HB3 GLN 81 -8.231 -13.256 -0.353 1435 HG2 GLN 81 HG2 GLN 81 -8.218 -14.733 1.565 1436 HG3 GLN 81 HG3 GLN 81 -9.771 -15.426 1.098 1437 HE21 GLN 81 HE21 GLN 81 -6.330 -15.387 0.417 1438 HE22 GLN 81 HE22 GLN 81 -6.321 -16.772 -0.613 1439 H ARG 82 H ARG 82 -11.065 -13.341 2.819 1440 HA ARG 82 HA ARG 82 -9.450 -11.490 4.430 1441 HB2 ARG 82 HB2 ARG 82 -11.754 -13.290 5.318 1442 HB3 ARG 82 HB3 ARG 82 -11.059 -11.933 6.208 1443 HG2 ARG 82 HG2 ARG 82 -11.941 -10.369 4.510 1444 HG3 ARG 82 HG3 ARG 82 -12.610 -11.730 3.600 1445 HD2 ARG 82 HD2 ARG 82 -13.429 -10.809 6.379 1446 HD3 ARG 82 HD3 ARG 82 -14.381 -10.688 4.895 1447 HE ARG 82 HE ARG 82 -13.628 -13.394 5.582 1448 HH11 ARG 82 HH11 ARG 82 -16.097 -10.927 6.109 1449 HH12 ARG 82 HH12 ARG 82 -17.309 -12.078 6.567 1450 HH21 ARG 82 HH21 ARG 82 -15.198 -14.866 6.273 1451 HH22 ARG 82 HH22 ARG 82 -16.793 -14.314 6.658 1452 H ASN 83 H ASN 83 -7.887 -12.218 5.801 1453 HA ASN 83 HA ASN 83 -7.532 -15.117 6.327 1454 HB2 ASN 83 HB2 ASN 83 -5.250 -13.216 5.575 1455 HB3 ASN 83 HB3 ASN 83 -5.096 -14.927 5.957 1456 HD21 ASN 83 HD21 ASN 83 -6.083 -12.594 3.551 1457 HD22 ASN 83 HD22 ASN 83 -6.144 -13.701 2.227 1458 H GLN 84 H GLN 84 -6.474 -15.564 8.326 1459 HA GLN 84 HA GLN 84 -6.576 -13.468 10.358 1460 HB2 GLN 84 HB2 GLN 84 -7.399 -15.753 10.903 1461 HB3 GLN 84 HB3 GLN 84 -5.804 -16.421 10.559 1462 HG2 GLN 84 HG2 GLN 84 -4.871 -15.067 12.451 1463 HG3 GLN 84 HG3 GLN 84 -6.500 -14.496 12.808 1464 HE21 GLN 84 HE21 GLN 84 -4.326 -17.222 12.898 1465 HE22 GLN 84 HE22 GLN 84 -5.285 -18.201 13.958 1466 H SER 85 H SER 85 -4.726 -12.765 11.519 1467 HA SER 85 HA SER 85 -2.344 -12.626 9.909 1468 HB2 SER 85 HB2 SER 85 -3.176 -10.591 10.942 1469 HB3 SER 85 HB3 SER 85 -3.027 -11.300 12.540 1470 HG SER 85 HG SER 85 -1.265 -9.906 11.884 1471 H ASP 86 H ASP 86 -0.593 -13.662 10.150 1472 HA ASP 86 HA ASP 86 0.259 -14.979 12.605 1473 HB2 ASP 86 HB2 ASP 86 -0.267 -16.401 9.950 1474 HB3 ASP 86 HB3 ASP 86 0.928 -17.029 11.084 1475 HA PRO 87 HA PRO 87 4.068 -13.017 11.416 1476 HB2 PRO 87 HB2 PRO 87 5.950 -14.799 12.456 1477 HB3 PRO 87 HB3 PRO 87 5.014 -13.653 13.439 1478 HG2 PRO 87 HG2 PRO 87 4.462 -16.565 12.924 1479 HG3 PRO 87 HG3 PRO 87 4.420 -15.669 14.462 1480 HD2 PRO 87 HD2 PRO 87 2.145 -16.214 13.174 1481 HD3 PRO 87 HD3 PRO 87 2.367 -14.633 13.961 1482 H THR 88 H THR 88 3.664 -16.408 10.587 1483 HA THR 88 HA THR 88 5.811 -16.551 8.684 1484 HB THR 88 HB THR 88 4.791 -18.766 8.099 1485 HG1 THR 88 HG1 THR 88 3.024 -19.441 9.508 1486 HG21 THR 88 HG21 THR 88 6.462 -18.639 9.920 1487 HG22 THR 88 HG22 THR 88 5.246 -19.864 10.281 1488 HG23 THR 88 HG23 THR 88 5.181 -18.295 11.088 1489 H MET 89 H MET 89 2.336 -15.897 8.551 1490 HA MET 89 HA MET 89 1.724 -16.358 5.886 1491 HB2 MET 89 HB2 MET 89 -0.006 -15.836 7.516 1492 HB3 MET 89 HB3 MET 89 0.662 -14.234 7.798 1493 HG2 MET 89 HG2 MET 89 -1.387 -14.129 6.448 1494 HG3 MET 89 HG3 MET 89 0.002 -13.538 5.538 1495 HE1 MET 89 HE1 MET 89 -1.340 -13.736 3.217 1496 HE2 MET 89 HE2 MET 89 -2.758 -14.264 4.128 1497 HE3 MET 89 HE3 MET 89 -2.207 -15.195 2.735 1498 H PHE 90 H PHE 90 2.969 -13.366 7.373 1499 HA PHE 90 HA PHE 90 3.021 -11.775 5.052 1500 HB2 PHE 90 HB2 PHE 90 3.076 -10.771 7.291 1501 HB3 PHE 90 HB3 PHE 90 4.633 -11.516 7.628 1502 HD1 PHE 90 HD1 PHE 90 2.919 -8.937 5.542 1503 HD2 PHE 90 HD2 PHE 90 6.696 -10.464 6.887 1504 HE1 PHE 90 HE1 PHE 90 4.064 -6.965 4.613 1505 HE2 PHE 90 HE2 PHE 90 7.819 -8.488 5.956 1506 HZ PHE 90 HZ PHE 90 6.510 -6.741 4.824 1507 H ASN 91 H ASN 91 5.512 -13.898 6.516 1508 HA ASN 91 HA ASN 91 7.623 -12.874 4.819 1509 HB2 ASN 91 HB2 ASN 91 8.090 -13.678 7.123 1510 HB3 ASN 91 HB3 ASN 91 7.616 -15.307 6.653 1511 HD21 ASN 91 HD21 ASN 91 10.043 -12.798 6.239 1512 HD22 ASN 91 HD22 ASN 91 11.275 -13.824 5.591 1513 H LYS 92 H LYS 92 5.409 -15.578 4.764 1514 HA LYS 92 HA LYS 92 6.724 -17.229 2.875 1515 HB2 LYS 92 HB2 LYS 92 5.006 -18.050 4.447 1516 HB3 LYS 92 HB3 LYS 92 3.779 -17.069 3.662 1517 HG2 LYS 92 HG2 LYS 92 5.238 -19.113 1.998 1518 HG3 LYS 92 HG3 LYS 92 4.042 -19.689 3.161 1519 HD2 LYS 92 HD2 LYS 92 2.319 -18.250 2.082 1520 HD3 LYS 92 HD3 LYS 92 3.517 -17.686 0.917 1521 HE2 LYS 92 HE2 LYS 92 3.742 -19.953 0.022 1522 HE3 LYS 92 HE3 LYS 92 2.623 -20.567 1.241 1523 HZ1 LYS 92 HZ1 LYS 92 1.545 -20.245 -0.879 1524 HZ2 LYS 92 HZ2 LYS 92 1.949 -18.604 -0.874 1525 HZ3 LYS 92 HZ3 LYS 92 0.891 -19.216 0.288 1526 H ILE 93 H ILE 93 4.037 -14.886 2.514 1527 HA ILE 93 HA ILE 93 3.796 -15.164 -0.321 1528 HB ILE 93 HB ILE 93 2.328 -13.154 -0.190 1529 HG12 ILE 93 HG12 ILE 93 3.491 -12.971 2.608 1530 HG13 ILE 93 HG13 ILE 93 3.359 -11.712 1.396 1531 HG21 ILE 93 HG21 ILE 93 1.803 -15.170 2.032 1532 HG22 ILE 93 HG22 ILE 93 1.400 -15.382 0.326 1533 HG23 ILE 93 HG23 ILE 93 0.596 -14.129 1.269 1534 HD11 ILE 93 HD11 ILE 93 1.875 -11.281 3.233 1535 HD12 ILE 93 HD12 ILE 93 1.094 -12.850 3.035 1536 HD13 ILE 93 HD13 ILE 93 0.937 -11.617 1.781 1537 H ALA 94 H ALA 94 5.768 -13.148 1.760 1538 HA ALA 94 HA ALA 94 6.654 -11.281 -0.222 1539 HB1 ALA 94 HB1 ALA 94 6.657 -10.743 2.172 1540 HB2 ALA 94 HB2 ALA 94 8.277 -10.580 1.491 1541 HB3 ALA 94 HB3 ALA 94 7.865 -11.996 2.467 1542 H VAL 95 H VAL 95 7.948 -14.379 1.026 1543 HA VAL 95 HA VAL 95 10.453 -14.105 -0.414 1544 HB VAL 95 HB VAL 95 10.349 -15.303 1.799 1545 HG11 VAL 95 HG11 VAL 95 8.252 -16.538 1.528 1546 HG12 VAL 95 HG12 VAL 95 9.575 -17.646 1.898 1547 HG13 VAL 95 HG13 VAL 95 8.967 -17.518 0.245 1548 HG21 VAL 95 HG21 VAL 95 11.915 -17.128 1.180 1549 HG22 VAL 95 HG22 VAL 95 12.279 -15.632 0.316 1550 HG23 VAL 95 HG23 VAL 95 11.446 -16.948 -0.515 1551 H PHE 96 H PHE 96 7.352 -15.749 -0.911 1552 HA PHE 96 HA PHE 96 8.159 -17.269 -3.197 1553 HB2 PHE 96 HB2 PHE 96 5.474 -16.483 -2.034 1554 HB3 PHE 96 HB3 PHE 96 5.537 -17.145 -3.663 1555 HD1 PHE 96 HD1 PHE 96 7.228 -18.038 -0.398 1556 HD2 PHE 96 HD2 PHE 96 4.858 -19.381 -3.697 1557 HE1 PHE 96 HE1 PHE 96 7.217 -20.308 0.535 1558 HE2 PHE 96 HE2 PHE 96 4.858 -21.653 -2.754 1559 HZ PHE 96 HZ PHE 96 6.032 -22.120 -0.639 1560 H PHE 97 H PHE 97 6.319 -14.203 -2.827 1561 HA PHE 97 HA PHE 97 6.069 -12.353 -4.131 1562 HB2 PHE 97 HB2 PHE 97 8.464 -12.202 -3.433 1563 HB3 PHE 97 HB3 PHE 97 8.943 -13.032 -4.903 1564 HD1 PHE 97 HD1 PHE 97 6.994 -9.977 -3.869 1565 HD2 PHE 97 HD2 PHE 97 9.758 -11.667 -6.654 1566 HE1 PHE 97 HE1 PHE 97 7.235 -7.790 -4.963 1567 HE2 PHE 97 HE2 PHE 97 9.995 -9.478 -7.745 1568 HZ PHE 97 HZ PHE 97 8.739 -7.534 -6.898 1569 H GLN 98 H GLN 98 5.490 -15.077 -5.504 1570 HA GLN 98 HA GLN 98 5.421 -14.241 -8.294 1571 HB2 GLN 98 HB2 GLN 98 7.765 -15.237 -7.688 1572 HB3 GLN 98 HB3 GLN 98 6.949 -16.786 -7.599 1573 HG2 GLN 98 HG2 GLN 98 7.934 -16.674 -9.742 1574 HG3 GLN 98 HG3 GLN 98 6.210 -16.414 -9.994 1575 HE21 GLN 98 HE21 GLN 98 8.558 -15.675 -11.628 1576 HE22 GLN 98 HE22 GLN 98 8.418 -13.974 -11.901 Start of MODEL 18 1 H1 GLY 1 H1 GLY 1 6.015 -0.593 -14.472 2 H2 GLY 1 H2 GLY 1 5.623 -0.664 -16.114 3 H3 GLY 1 H3 GLY 1 7.186 -0.236 -15.637 4 HA2 GLY 1 HA3 GLY 1 7.568 -2.416 -14.728 5 HA3 GLY 1 HA2 GLY 1 5.930 -2.879 -15.172 6 H SER 2 H SER 2 8.837 -3.640 -16.043 7 HA SER 2 HA SER 2 9.002 -3.083 -18.857 8 HB2 SER 2 HB2 SER 2 10.909 -4.774 -18.705 9 HB3 SER 2 HB3 SER 2 11.048 -3.411 -17.592 10 HG SER 2 HG SER 2 11.324 -5.755 -16.826 11 H MET 3 H MET 3 9.254 -4.960 -20.440 12 HA MET 3 HA MET 3 7.022 -6.852 -20.267 13 HB2 MET 3 HB2 MET 3 9.062 -6.408 -22.507 14 HB3 MET 3 HB3 MET 3 7.636 -7.433 -22.608 15 HG2 MET 3 HG2 MET 3 7.673 -4.420 -22.337 16 HG3 MET 3 HG3 MET 3 7.215 -5.350 -23.761 17 HE1 MET 3 HE1 MET 3 3.816 -6.993 -22.525 18 HE2 MET 3 HE2 MET 3 5.422 -7.714 -22.426 19 HE3 MET 3 HE3 MET 3 4.934 -6.847 -23.883 20 H GLN 4 H GLN 4 8.787 -7.323 -18.300 21 HA GLN 4 HA GLN 4 9.845 -9.957 -18.693 22 HB2 GLN 4 HB2 GLN 4 11.724 -8.601 -19.600 23 HB3 GLN 4 HB3 GLN 4 11.730 -7.608 -18.151 24 HG2 GLN 4 HG2 GLN 4 13.600 -9.183 -18.146 25 HG3 GLN 4 HG3 GLN 4 12.495 -9.512 -16.811 26 HE21 GLN 4 HE21 GLN 4 13.129 -11.648 -16.563 27 HE22 GLN 4 HE22 GLN 4 12.792 -12.879 -17.730 28 H ASN 5 H ASN 5 10.495 -10.873 -16.531 29 HA ASN 5 HA ASN 5 9.124 -10.239 -14.242 30 HB2 ASN 5 HB2 ASN 5 11.973 -11.313 -14.441 31 HB3 ASN 5 HB3 ASN 5 11.027 -11.322 -12.957 32 HD21 ASN 5 HD21 ASN 5 11.212 -13.574 -12.831 33 HD22 ASN 5 HD22 ASN 5 10.299 -14.621 -13.850 34 H THR 6 H THR 6 9.161 -8.606 -12.799 35 HA THR 6 HA THR 6 9.714 -6.110 -13.448 36 HB THR 6 HB THR 6 9.910 -7.082 -10.566 37 HG1 THR 6 HG1 THR 6 7.444 -6.272 -11.566 38 HG21 THR 6 HG21 THR 6 8.832 -4.932 -9.995 39 HG22 THR 6 HG22 THR 6 8.853 -4.469 -11.696 40 HG23 THR 6 HG23 THR 6 10.372 -4.663 -10.821 41 H THR 7 H THR 7 11.549 -5.285 -14.231 42 HA THR 7 HA THR 7 14.196 -6.018 -13.168 43 HB THR 7 HB THR 7 13.751 -4.354 -15.690 44 HG1 THR 7 HG1 THR 7 13.031 -7.064 -15.304 45 HG21 THR 7 HG21 THR 7 15.656 -5.683 -16.532 46 HG22 THR 7 HG22 THR 7 15.683 -6.618 -15.038 47 HG23 THR 7 HG23 THR 7 16.073 -4.895 -15.009 48 H HIS 8 H HIS 8 15.573 -3.623 -14.048 49 HA HIS 8 HA HIS 8 15.078 -1.807 -11.882 50 HB2 HIS 8 HB2 HIS 8 17.363 -2.376 -12.782 51 HB3 HIS 8 HB3 HIS 8 16.969 -1.501 -14.257 52 HD1 HIS 8 HD1 HIS 8 17.195 1.031 -14.201 53 HD2 HIS 8 HD2 HIS 8 17.720 -0.711 -10.479 54 HE1 HIS 8 HE1 HIS 8 18.094 2.846 -12.735 55 HE2 HIS 8 HE2 HIS 8 18.627 1.698 -10.576 56 H ASP 9 H ASP 9 13.263 -2.144 -14.541 57 HA ASP 9 HA ASP 9 12.771 0.370 -15.634 58 HB2 ASP 9 HB2 ASP 9 11.740 -1.789 -16.402 59 HB3 ASP 9 HB3 ASP 9 10.719 -1.808 -14.969 60 H ASN 10 H ASN 10 11.681 -1.103 -12.593 61 HA ASN 10 HA ASN 10 10.176 1.292 -11.825 62 HB2 ASN 10 HB2 ASN 10 9.307 0.057 -9.980 63 HB3 ASN 10 HB3 ASN 10 9.321 -1.078 -11.323 64 HD21 ASN 10 HD21 ASN 10 10.702 -0.290 -8.220 65 HD22 ASN 10 HD22 ASN 10 11.554 -1.778 -8.009 66 H VAL 11 H VAL 11 10.556 2.134 -9.620 67 HA VAL 11 HA VAL 11 13.359 2.129 -8.740 68 HB VAL 11 HB VAL 11 13.230 4.527 -8.176 69 HG11 VAL 11 HG11 VAL 11 12.535 4.074 -11.102 70 HG12 VAL 11 HG12 VAL 11 14.139 3.930 -10.381 71 HG13 VAL 11 HG13 VAL 11 13.338 5.499 -10.436 72 HG21 VAL 11 HG21 VAL 11 10.511 4.601 -9.541 73 HG22 VAL 11 HG22 VAL 11 11.387 5.987 -8.894 74 HG23 VAL 11 HG23 VAL 11 10.787 4.737 -7.805 75 H ILE 12 H ILE 12 13.604 2.258 -6.528 76 HA ILE 12 HA ILE 12 11.301 1.309 -4.961 77 HB ILE 12 HB ILE 12 14.253 1.355 -4.145 78 HG12 ILE 12 HG12 ILE 12 13.952 0.019 -6.260 79 HG13 ILE 12 HG13 ILE 12 14.518 -0.943 -4.907 80 HG21 ILE 12 HG21 ILE 12 13.596 -0.426 -2.563 81 HG22 ILE 12 HG22 ILE 12 11.919 -0.284 -3.093 82 HG23 ILE 12 HG23 ILE 12 12.705 1.069 -2.278 83 HD11 ILE 12 HD11 ILE 12 11.711 -0.880 -6.013 84 HD12 ILE 12 HD12 ILE 12 12.239 -1.837 -4.627 85 HD13 ILE 12 HD13 ILE 12 12.905 -2.160 -6.226 86 H LEU 13 H LEU 13 10.234 3.309 -4.502 87 HA LEU 13 HA LEU 13 11.760 5.567 -3.438 88 HB2 LEU 13 HB2 LEU 13 8.759 5.263 -3.901 89 HB3 LEU 13 HB3 LEU 13 9.554 6.737 -3.369 90 HG LEU 13 HG LEU 13 9.821 5.397 -6.082 91 HD11 LEU 13 HD11 LEU 13 8.833 7.461 -6.942 92 HD12 LEU 13 HD12 LEU 13 8.717 8.115 -5.307 93 HD13 LEU 13 HD13 LEU 13 7.767 6.700 -5.764 94 HD21 LEU 13 HD21 LEU 13 11.336 7.822 -5.059 95 HD22 LEU 13 HD22 LEU 13 11.323 7.244 -6.727 96 HD23 LEU 13 HD23 LEU 13 12.023 6.245 -5.459 97 H GLU 14 H GLU 14 12.440 5.167 -1.400 98 HA GLU 14 HA GLU 14 10.708 3.914 0.592 99 HB2 GLU 14 HB2 GLU 14 13.203 3.370 0.326 100 HB3 GLU 14 HB3 GLU 14 13.561 4.970 0.954 101 HG2 GLU 14 HG2 GLU 14 12.040 2.823 2.468 102 HG3 GLU 14 HG3 GLU 14 13.760 3.116 2.621 103 H LEU 15 H LEU 15 9.126 5.447 0.958 104 HA LEU 15 HA LEU 15 9.995 8.029 2.097 105 HB2 LEU 15 HB2 LEU 15 7.608 8.769 1.666 106 HB3 LEU 15 HB3 LEU 15 8.608 8.506 0.260 107 HG LEU 15 HG LEU 15 7.318 6.050 0.457 108 HD11 LEU 15 HD11 LEU 15 5.849 6.773 2.259 109 HD12 LEU 15 HD12 LEU 15 4.926 6.454 0.793 110 HD13 LEU 15 HD13 LEU 15 5.261 8.120 1.278 111 HD21 LEU 15 HD21 LEU 15 6.369 8.458 -1.132 112 HD22 LEU 15 HD22 LEU 15 5.956 6.773 -1.464 113 HD23 LEU 15 HD23 LEU 15 7.624 7.318 -1.617 114 H THR 16 H THR 16 10.098 8.029 4.163 115 HA THR 16 HA THR 16 8.745 6.127 5.894 116 HB THR 16 HB THR 16 10.594 8.468 6.612 117 HG1 THR 16 HG1 THR 16 11.277 6.393 5.278 118 HG21 THR 16 HG21 THR 16 9.767 6.026 8.248 119 HG22 THR 16 HG22 THR 16 9.206 7.677 8.519 120 HG23 THR 16 HG23 THR 16 10.906 7.281 8.758 121 H VAL 17 H VAL 17 6.728 6.583 6.497 122 HA VAL 17 HA VAL 17 5.873 9.377 7.027 123 HB VAL 17 HB VAL 17 3.663 8.878 6.341 124 HG11 VAL 17 HG11 VAL 17 3.857 8.132 3.992 125 HG12 VAL 17 HG12 VAL 17 5.470 7.494 4.328 126 HG13 VAL 17 HG13 VAL 17 5.167 9.229 4.438 127 HG21 VAL 17 HG21 VAL 17 3.310 6.699 7.396 128 HG22 VAL 17 HG22 VAL 17 4.367 5.917 6.225 129 HG23 VAL 17 HG23 VAL 17 2.828 6.604 5.700 130 H ARG 18 H ARG 18 4.570 9.682 8.881 131 HA ARG 18 HA ARG 18 4.265 7.386 10.729 132 HB2 ARG 18 HB2 ARG 18 3.904 9.057 12.494 133 HB3 ARG 18 HB3 ARG 18 5.469 9.258 11.722 134 HG2 ARG 18 HG2 ARG 18 4.423 11.127 10.346 135 HG3 ARG 18 HG3 ARG 18 3.011 11.001 11.401 136 HD2 ARG 18 HD2 ARG 18 5.847 11.704 12.209 137 HD3 ARG 18 HD3 ARG 18 4.446 12.776 12.206 138 HE ARG 18 HE ARG 18 3.906 10.587 13.900 139 HH11 ARG 18 HH11 ARG 18 5.993 13.433 13.811 140 HH12 ARG 18 HH12 ARG 18 6.090 13.554 15.540 141 HH21 ARG 18 HH21 ARG 18 4.083 10.733 16.153 142 HH22 ARG 18 HH22 ARG 18 5.003 12.019 16.875 143 H ASN 19 H ASN 19 2.146 7.114 11.703 144 HA ASN 19 HA ASN 19 0.241 7.063 9.567 145 HB2 ASN 19 HB2 ASN 19 0.036 5.996 12.413 146 HB3 ASN 19 HB3 ASN 19 -1.157 5.705 11.149 147 HD21 ASN 19 HD21 ASN 19 -0.868 3.463 11.095 148 HD22 ASN 19 HD22 ASN 19 0.583 2.708 10.545 149 H HIS 20 H HIS 20 -0.046 9.353 9.386 150 HA HIS 20 HA HIS 20 -1.999 10.736 11.011 151 HB2 HIS 20 HB2 HIS 20 -0.879 11.176 8.206 152 HB3 HIS 20 HB3 HIS 20 -2.162 12.178 8.832 153 HD1 HIS 20 HD1 HIS 20 -1.297 14.320 9.617 154 HD2 HIS 20 HD2 HIS 20 1.448 11.265 10.209 155 HE1 HIS 20 HE1 HIS 20 0.729 15.423 10.599 156 HE2 HIS 20 HE2 HIS 20 2.393 13.567 10.914 157 HA PRO 21 HA PRO 21 -5.757 8.857 9.377 158 HB2 PRO 21 HB2 PRO 21 -6.851 11.618 8.862 159 HB3 PRO 21 HB3 PRO 21 -7.529 10.290 9.830 160 HG2 PRO 21 HG2 PRO 21 -6.450 12.403 11.026 161 HG3 PRO 21 HG3 PRO 21 -6.200 10.766 11.682 162 HD2 PRO 21 HD2 PRO 21 -4.301 12.459 10.059 163 HD3 PRO 21 HD3 PRO 21 -3.972 11.426 11.469 164 H GLY 22 H GLY 22 -5.036 7.934 7.481 165 HA2 GLY 22 HA2 GLY 22 -5.500 7.418 5.283 166 HA3 GLY 22 HA3 GLY 22 -6.144 9.031 5.041 167 H VAL 23 H VAL 23 -2.853 8.228 6.247 168 HA VAL 23 HA VAL 23 -1.481 9.835 4.374 169 HB VAL 23 HB VAL 23 -0.266 7.297 5.577 170 HG11 VAL 23 HG11 VAL 23 1.857 8.595 5.373 171 HG12 VAL 23 HG12 VAL 23 0.966 9.898 4.588 172 HG13 VAL 23 HG13 VAL 23 1.083 8.316 3.811 173 HG21 VAL 23 HG21 VAL 23 -1.235 8.606 7.397 174 HG22 VAL 23 HG22 VAL 23 -0.383 10.047 6.842 175 HG23 VAL 23 HG23 VAL 23 0.529 8.661 7.451 176 H MET 24 H MET 24 -2.248 6.415 4.377 177 HA MET 24 HA MET 24 -1.023 5.567 2.042 178 HB2 MET 24 HB2 MET 24 -2.714 3.711 2.073 179 HB3 MET 24 HB3 MET 24 -1.895 3.962 3.603 180 HG2 MET 24 HG2 MET 24 -4.671 5.010 3.007 181 HG3 MET 24 HG3 MET 24 -4.349 3.461 3.784 182 HE1 MET 24 HE1 MET 24 -1.834 4.242 5.702 183 HE2 MET 24 HE2 MET 24 -3.197 3.247 6.217 184 HE3 MET 24 HE3 MET 24 -2.703 4.640 7.183 185 H THR 25 H THR 25 -4.175 7.182 2.465 186 HA THR 25 HA THR 25 -4.985 7.029 -0.270 187 HB THR 25 HB THR 25 -5.860 9.153 1.745 188 HG1 THR 25 HG1 THR 25 -7.548 7.504 2.184 189 HG21 THR 25 HG21 THR 25 -6.694 9.464 -0.582 190 HG22 THR 25 HG22 THR 25 -8.000 9.063 0.533 191 HG23 THR 25 HG23 THR 25 -7.360 7.828 -0.554 192 H HIS 26 H HIS 26 -3.055 9.322 1.610 193 HA HIS 26 HA HIS 26 -2.923 11.461 -0.245 194 HB2 HIS 26 HB2 HIS 26 -1.033 10.665 2.017 195 HB3 HIS 26 HB3 HIS 26 -0.814 12.123 1.058 196 HD1 HIS 26 HD1 HIS 26 -1.057 13.311 3.472 197 HD2 HIS 26 HD2 HIS 26 -4.504 11.553 1.971 198 HE1 HIS 26 HE1 HIS 26 -2.949 14.324 4.771 199 HE2 HIS 26 HE2 HIS 26 -4.986 13.105 3.968 200 H VAL 27 H VAL 27 -0.632 8.765 0.374 201 HA VAL 27 HA VAL 27 1.262 9.540 -1.596 202 HB VAL 27 HB VAL 27 2.399 7.441 -1.192 203 HG11 VAL 27 HG11 VAL 27 2.659 7.471 1.260 204 HG12 VAL 27 HG12 VAL 27 1.165 8.396 1.421 205 HG13 VAL 27 HG13 VAL 27 2.561 9.108 0.611 206 HG21 VAL 27 HG21 VAL 27 0.523 5.859 -1.336 207 HG22 VAL 27 HG22 VAL 27 -0.099 6.419 0.215 208 HG23 VAL 27 HG23 VAL 27 1.453 5.580 0.137 209 H CYS 28 H CYS 28 -1.473 7.308 -1.638 210 HA CYS 28 HA CYS 28 -1.105 6.241 -4.225 211 HB2 CYS 28 HB2 CYS 28 -3.567 6.500 -2.467 212 HB3 CYS 28 HB3 CYS 28 -3.544 5.597 -3.982 213 HG CYS 28 HG CYS 28 -2.856 4.503 -1.049 214 H GLY 29 H GLY 29 -2.703 9.156 -3.040 215 HA2 GLY 29 HA2 GLY 29 -3.974 10.010 -5.424 216 HA3 GLY 29 HA3 GLY 29 -3.470 11.047 -4.091 217 H LEU 30 H LEU 30 -0.714 10.500 -4.137 218 HA LEU 30 HA LEU 30 0.312 12.400 -5.912 219 HB2 LEU 30 HB2 LEU 30 1.424 10.414 -4.002 220 HB3 LEU 30 HB3 LEU 30 2.538 10.862 -5.274 221 HG LEU 30 HG LEU 30 2.829 12.189 -3.198 222 HD11 LEU 30 HD11 LEU 30 1.995 13.849 -5.592 223 HD12 LEU 30 HD12 LEU 30 3.573 13.102 -5.339 224 HD13 LEU 30 HD13 LEU 30 3.026 14.381 -4.260 225 HD21 LEU 30 HD21 LEU 30 1.221 13.931 -2.552 226 HD22 LEU 30 HD22 LEU 30 0.495 12.330 -2.429 227 HD23 LEU 30 HD23 LEU 30 0.094 13.376 -3.794 228 H PHE 31 H PHE 31 0.530 8.840 -6.110 229 HA PHE 31 HA PHE 31 1.955 8.962 -8.641 230 HB2 PHE 31 HB2 PHE 31 0.911 6.556 -7.087 231 HB3 PHE 31 HB3 PHE 31 1.970 6.475 -8.500 232 HD1 PHE 31 HD1 PHE 31 4.266 7.628 -8.385 233 HD2 PHE 31 HD2 PHE 31 1.860 6.956 -4.913 234 HE1 PHE 31 HE1 PHE 31 6.217 8.035 -6.943 235 HE2 PHE 31 HE2 PHE 31 3.820 7.356 -3.478 236 HZ PHE 31 HZ PHE 31 5.999 7.900 -4.492 237 H ALA 32 H ALA 32 -1.377 8.455 -7.683 238 HA ALA 32 HA ALA 32 -2.392 7.521 -10.176 239 HB1 ALA 32 HB1 ALA 32 -3.657 7.312 -8.070 240 HB2 ALA 32 HB2 ALA 32 -4.602 8.154 -9.299 241 HB3 ALA 32 HB3 ALA 32 -3.835 9.067 -7.993 242 H ARG 33 H ARG 33 -1.852 10.787 -8.853 243 HA ARG 33 HA ARG 33 -3.128 12.128 -11.109 244 HB2 ARG 33 HB2 ARG 33 -2.724 14.191 -9.937 245 HB3 ARG 33 HB3 ARG 33 -3.233 13.011 -8.736 246 HG2 ARG 33 HG2 ARG 33 -0.834 12.673 -8.116 247 HG3 ARG 33 HG3 ARG 33 -0.395 13.953 -9.243 248 HD2 ARG 33 HD2 ARG 33 -2.204 14.304 -6.831 249 HD3 ARG 33 HD3 ARG 33 -0.494 14.742 -6.896 250 HE ARG 33 HE ARG 33 -2.182 15.966 -8.927 251 HH11 ARG 33 HH11 ARG 33 -0.742 16.386 -5.734 252 HH12 ARG 33 HH12 ARG 33 -0.909 18.111 -5.765 253 HH21 ARG 33 HH21 ARG 33 -2.390 18.219 -8.940 254 HH22 ARG 33 HH22 ARG 33 -1.843 19.151 -7.583 255 H ARG 34 H ARG 34 -0.115 10.728 -10.663 256 HA ARG 34 HA ARG 34 1.635 12.642 -11.835 257 HB2 ARG 34 HB2 ARG 34 2.505 10.811 -10.438 258 HB3 ARG 34 HB3 ARG 34 1.879 9.615 -11.566 259 HG2 ARG 34 HG2 ARG 34 3.451 10.505 -13.310 260 HG3 ARG 34 HG3 ARG 34 4.132 11.586 -12.089 261 HD2 ARG 34 HD2 ARG 34 5.520 9.582 -12.354 262 HD3 ARG 34 HD3 ARG 34 4.810 9.625 -10.739 263 HE ARG 34 HE ARG 34 3.063 8.043 -11.742 264 HH11 ARG 34 HH11 ARG 34 6.431 8.017 -12.765 265 HH12 ARG 34 HH12 ARG 34 6.395 6.349 -13.230 266 HH21 ARG 34 HH21 ARG 34 3.068 5.855 -12.311 267 HH22 ARG 34 HH22 ARG 34 4.500 5.132 -12.975 268 H ALA 35 H ALA 35 0.568 9.507 -13.155 269 HA ALA 35 HA ALA 35 -0.511 10.323 -15.593 270 HB1 ALA 35 HB1 ALA 35 1.300 9.794 -17.208 271 HB2 ALA 35 HB2 ALA 35 2.432 9.574 -15.867 272 HB3 ALA 35 HB3 ALA 35 1.731 11.161 -16.179 273 H PHE 36 H PHE 36 1.790 7.945 -14.355 274 HA PHE 36 HA PHE 36 0.026 5.701 -15.160 275 HB2 PHE 36 HB2 PHE 36 2.180 5.697 -16.370 276 HB3 PHE 36 HB3 PHE 36 3.066 5.828 -14.858 277 HD1 PHE 36 HD1 PHE 36 0.727 3.540 -16.706 278 HD2 PHE 36 HD2 PHE 36 3.839 3.855 -13.800 279 HE1 PHE 36 HE1 PHE 36 0.881 1.087 -16.602 280 HE2 PHE 36 HE2 PHE 36 3.990 1.408 -13.701 281 HZ PHE 36 HZ PHE 36 2.515 0.017 -15.100 282 H ASN 37 H ASN 37 0.067 3.856 -13.659 283 HA ASN 37 HA ASN 37 -0.292 4.745 -10.915 284 HB2 ASN 37 HB2 ASN 37 -0.889 2.158 -12.397 285 HB3 ASN 37 HB3 ASN 37 -1.109 2.300 -10.660 286 HD21 ASN 37 HD21 ASN 37 -1.842 4.900 -12.995 287 HD22 ASN 37 HD22 ASN 37 -3.540 4.859 -12.722 288 H VAL 38 H VAL 38 0.186 2.614 -9.395 289 HA VAL 38 HA VAL 38 3.086 2.404 -9.161 290 HB VAL 38 HB VAL 38 0.829 1.402 -7.350 291 HG11 VAL 38 HG11 VAL 38 2.551 1.175 -5.586 292 HG12 VAL 38 HG12 VAL 38 3.803 1.586 -6.760 293 HG13 VAL 38 HG13 VAL 38 2.862 0.108 -6.956 294 HG21 VAL 38 HG21 VAL 38 1.323 3.320 -5.902 295 HG22 VAL 38 HG22 VAL 38 0.865 3.866 -7.517 296 HG23 VAL 38 HG23 VAL 38 2.563 3.876 -7.028 297 H GLU 39 H GLU 39 4.241 0.451 -9.255 298 HA GLU 39 HA GLU 39 3.076 -1.892 -10.490 299 HB2 GLU 39 HB2 GLU 39 5.452 -1.204 -10.896 300 HB3 GLU 39 HB3 GLU 39 5.826 -1.512 -9.206 301 HG2 GLU 39 HG2 GLU 39 6.623 -3.367 -10.508 302 HG3 GLU 39 HG3 GLU 39 5.238 -3.922 -9.569 303 H GLY 40 H GLY 40 4.686 -1.284 -7.338 304 HA2 GLY 40 HA2 GLY 40 2.798 -3.063 -5.941 305 HA3 GLY 40 HA3 GLY 40 4.498 -3.518 -5.925 306 H ILE 41 H ILE 41 2.675 -2.713 -3.720 307 HA ILE 41 HA ILE 41 4.101 -0.314 -2.671 308 HB ILE 41 HB ILE 41 1.344 -1.318 -1.783 309 HG12 ILE 41 HG12 ILE 41 1.899 1.076 -3.599 310 HG13 ILE 41 HG13 ILE 41 1.310 -0.481 -4.167 311 HG21 ILE 41 HG21 ILE 41 1.146 0.866 -0.633 312 HG22 ILE 41 HG22 ILE 41 2.766 1.308 -1.173 313 HG23 ILE 41 HG23 ILE 41 2.549 -0.034 -0.049 314 HD11 ILE 41 HD11 ILE 41 -0.710 -0.201 -2.801 315 HD12 ILE 41 HD12 ILE 41 -0.499 1.083 -3.991 316 HD13 ILE 41 HD13 ILE 41 -0.128 1.389 -2.296 317 H LEU 42 H LEU 42 5.248 -0.614 -0.798 318 HA LEU 42 HA LEU 42 4.637 -2.977 0.887 319 HB2 LEU 42 HB2 LEU 42 6.668 -3.388 -0.482 320 HB3 LEU 42 HB3 LEU 42 7.407 -1.936 0.174 321 HG LEU 42 HG LEU 42 7.487 -2.950 2.418 322 HD11 LEU 42 HD11 LEU 42 6.881 -5.305 2.789 323 HD12 LEU 42 HD12 LEU 42 6.222 -5.398 1.154 324 HD13 LEU 42 HD13 LEU 42 5.479 -4.332 2.347 325 HD21 LEU 42 HD21 LEU 42 8.630 -4.787 0.292 326 HD22 LEU 42 HD22 LEU 42 9.158 -4.685 1.974 327 HD23 LEU 42 HD23 LEU 42 9.378 -3.307 0.900 328 H CYS 43 H CYS 43 3.404 -1.626 2.192 329 HA CYS 43 HA CYS 43 4.686 0.573 3.651 330 HB2 CYS 43 HB2 CYS 43 2.375 0.882 2.838 331 HB3 CYS 43 HB3 CYS 43 1.846 -0.524 3.752 332 HG CYS 43 HG CYS 43 3.236 2.110 5.391 333 H LEU 44 H LEU 44 6.150 -0.383 4.938 334 HA LEU 44 HA LEU 44 5.588 -2.783 6.511 335 HB2 LEU 44 HB2 LEU 44 7.723 -2.460 5.222 336 HB3 LEU 44 HB3 LEU 44 8.098 -1.092 6.247 337 HG LEU 44 HG LEU 44 7.889 -2.925 8.201 338 HD11 LEU 44 HD11 LEU 44 8.725 -5.120 7.531 339 HD12 LEU 44 HD12 LEU 44 8.683 -4.638 5.833 340 HD13 LEU 44 HD13 LEU 44 7.180 -4.767 6.755 341 HD21 LEU 44 HD21 LEU 44 10.349 -2.704 6.436 342 HD22 LEU 44 HD22 LEU 44 10.310 -3.240 8.120 343 HD23 LEU 44 HD23 LEU 44 9.890 -1.578 7.718 344 HA PRO 45 HA PRO 45 4.497 0.224 9.818 345 HB2 PRO 45 HB2 PRO 45 3.384 -1.578 11.567 346 HB3 PRO 45 HB3 PRO 45 2.528 -0.982 10.135 347 HG2 PRO 45 HG2 PRO 45 3.978 -3.575 10.506 348 HG3 PRO 45 HG3 PRO 45 2.407 -3.263 9.731 349 HD2 PRO 45 HD2 PRO 45 4.706 -3.606 8.295 350 HD3 PRO 45 HD3 PRO 45 3.371 -2.574 7.740 351 H ILE 46 H ILE 46 5.741 0.929 11.417 352 HA ILE 46 HA ILE 46 7.979 -0.713 12.400 353 HB ILE 46 HB ILE 46 7.531 2.304 12.586 354 HG12 ILE 46 HG12 ILE 46 7.822 1.646 10.246 355 HG13 ILE 46 HG13 ILE 46 9.274 2.468 10.795 356 HG21 ILE 46 HG21 ILE 46 8.991 1.500 14.388 357 HG22 ILE 46 HG22 ILE 46 9.916 2.438 13.218 358 HG23 ILE 46 HG23 ILE 46 10.024 0.677 13.215 359 HD11 ILE 46 HD11 ILE 46 9.824 0.585 9.379 360 HD12 ILE 46 HD12 ILE 46 8.943 -0.516 10.438 361 HD13 ILE 46 HD13 ILE 46 10.404 0.289 11.019 362 H GLN 47 H GLN 47 7.667 -1.671 14.284 363 HA GLN 47 HA GLN 47 5.655 -0.922 16.212 364 HB2 GLN 47 HB2 GLN 47 6.574 -2.830 17.539 365 HB3 GLN 47 HB3 GLN 47 6.194 -3.269 15.885 366 HG2 GLN 47 HG2 GLN 47 8.590 -3.094 15.284 367 HG3 GLN 47 HG3 GLN 47 8.968 -2.707 16.961 368 HE21 GLN 47 HE21 GLN 47 7.904 -5.225 14.763 369 HE22 GLN 47 HE22 GLN 47 8.194 -6.550 15.830 370 H ASP 48 H ASP 48 8.983 -0.218 15.720 371 HA ASP 48 HA ASP 48 9.875 0.307 18.334 372 HB2 ASP 48 HB2 ASP 48 11.496 -0.088 16.609 373 HB3 ASP 48 HB3 ASP 48 10.825 1.166 15.578 374 H SER 49 H SER 49 8.428 2.375 15.878 375 HA SER 49 HA SER 49 7.648 4.390 17.855 376 HB2 SER 49 HB2 SER 49 9.261 5.099 15.357 377 HB3 SER 49 HB3 SER 49 8.530 6.267 16.460 378 HG SER 49 HG SER 49 10.540 4.370 17.137 379 H ASP 50 H ASP 50 5.960 5.873 16.928 380 HA ASP 50 HA ASP 50 4.068 4.456 15.336 381 HB2 ASP 50 HB2 ASP 50 2.648 6.483 15.537 382 HB3 ASP 50 HB3 ASP 50 3.314 6.017 17.092 383 H LYS 51 H LYS 51 5.248 3.984 13.445 384 HA LYS 51 HA LYS 51 5.394 6.012 11.353 385 HB2 LYS 51 HB2 LYS 51 7.880 4.512 12.329 386 HB3 LYS 51 HB3 LYS 51 7.807 5.420 10.823 387 HG2 LYS 51 HG2 LYS 51 7.511 7.511 12.047 388 HG3 LYS 51 HG3 LYS 51 7.436 6.636 13.580 389 HD2 LYS 51 HD2 LYS 51 9.792 5.854 13.203 390 HD3 LYS 51 HD3 LYS 51 9.850 6.839 11.736 391 HE2 LYS 51 HE2 LYS 51 9.485 8.875 13.072 392 HE3 LYS 51 HE3 LYS 51 9.371 7.906 14.542 393 HZ1 LYS 51 HZ1 LYS 51 11.772 8.133 12.811 394 HZ2 LYS 51 HZ2 LYS 51 11.665 7.229 14.234 395 HZ3 LYS 51 HZ3 LYS 51 11.546 8.912 14.293 396 H SER 52 H SER 52 6.127 4.989 9.313 397 HA SER 52 HA SER 52 6.152 2.147 8.987 398 HB2 SER 52 HB2 SER 52 3.681 2.628 8.998 399 HB3 SER 52 HB3 SER 52 3.907 3.751 7.658 400 HG SER 52 HG SER 52 3.617 1.091 7.586 401 H HIS 53 H HIS 53 7.657 1.801 7.397 402 HA HIS 53 HA HIS 53 8.409 4.029 5.599 403 HB2 HIS 53 HB2 HIS 53 9.795 1.370 6.191 404 HB3 HIS 53 HB3 HIS 53 10.365 2.533 4.997 405 HD1 HIS 53 HD1 HIS 53 12.237 3.883 5.876 406 HD2 HIS 53 HD2 HIS 53 9.572 2.874 8.883 407 HE1 HIS 53 HE1 HIS 53 13.254 4.750 7.994 408 HE2 HIS 53 HE2 HIS 53 11.742 3.914 9.802 409 H ILE 54 H ILE 54 7.500 4.052 3.623 410 HA ILE 54 HA ILE 54 6.373 1.575 2.484 411 HB ILE 54 HB ILE 54 5.869 4.477 1.638 412 HG12 ILE 54 HG12 ILE 54 3.467 3.952 2.349 413 HG13 ILE 54 HG13 ILE 54 4.074 2.476 3.084 414 HG21 ILE 54 HG21 ILE 54 4.678 1.909 0.508 415 HG22 ILE 54 HG22 ILE 54 5.794 2.997 -0.321 416 HG23 ILE 54 HG23 ILE 54 4.166 3.544 0.078 417 HD11 ILE 54 HD11 ILE 54 4.874 5.273 3.862 418 HD12 ILE 54 HD12 ILE 54 5.405 3.777 4.637 419 HD13 ILE 54 HD13 ILE 54 3.709 4.253 4.705 420 H TRP 55 H TRP 55 7.929 0.534 1.310 421 HA TRP 55 HA TRP 55 9.608 2.008 -0.587 422 HB2 TRP 55 HB2 TRP 55 9.307 -0.975 -0.010 423 HB3 TRP 55 HB3 TRP 55 10.349 -0.332 -1.276 424 HD1 TRP 55 HD1 TRP 55 12.690 0.692 -0.514 425 HE1 TRP 55 HE1 TRP 55 13.991 0.653 1.686 426 HE3 TRP 55 HE3 TRP 55 8.945 -0.809 2.593 427 HZ2 TRP 55 HZ2 TRP 55 13.511 0.064 4.395 428 HZ3 TRP 55 HZ3 TRP 55 9.463 -1.075 4.971 429 HH2 TRP 55 HH2 TRP 55 11.689 -0.652 5.869 430 H LEU 56 H LEU 56 8.431 2.851 -2.112 431 HA LEU 56 HA LEU 56 6.064 1.539 -3.227 432 HB2 LEU 56 HB2 LEU 56 6.200 3.970 -2.274 433 HB3 LEU 56 HB3 LEU 56 7.055 4.376 -3.747 434 HG LEU 56 HG LEU 56 4.645 5.002 -3.783 435 HD11 LEU 56 HD11 LEU 56 4.076 4.181 -6.001 436 HD12 LEU 56 HD12 LEU 56 5.304 2.919 -5.881 437 HD13 LEU 56 HD13 LEU 56 5.782 4.618 -5.915 438 HD21 LEU 56 HD21 LEU 56 4.074 2.024 -3.701 439 HD22 LEU 56 HD22 LEU 56 2.886 3.304 -3.959 440 HD23 LEU 56 HD23 LEU 56 3.731 3.189 -2.419 441 H LEU 57 H LEU 57 6.466 0.303 -4.954 442 HA LEU 57 HA LEU 57 8.774 0.693 -6.713 443 HB2 LEU 57 HB2 LEU 57 6.720 -1.510 -6.359 444 HB3 LEU 57 HB3 LEU 57 7.682 -1.438 -7.826 445 HG LEU 57 HG LEU 57 9.748 -1.724 -6.535 446 HD11 LEU 57 HD11 LEU 57 9.732 -2.266 -4.139 447 HD12 LEU 57 HD12 LEU 57 8.012 -1.868 -4.058 448 HD13 LEU 57 HD13 LEU 57 9.196 -0.618 -4.456 449 HD21 LEU 57 HD21 LEU 57 8.615 -3.710 -7.373 450 HD22 LEU 57 HD22 LEU 57 7.653 -3.823 -5.897 451 HD23 LEU 57 HD23 LEU 57 9.401 -4.060 -5.835 452 H VAL 58 H VAL 58 8.498 2.144 -8.272 453 HA VAL 58 HA VAL 58 6.168 2.063 -10.056 454 HB VAL 58 HB VAL 58 5.646 3.717 -8.186 455 HG11 VAL 58 HG11 VAL 58 7.923 5.361 -9.333 456 HG12 VAL 58 HG12 VAL 58 7.892 4.583 -7.749 457 HG13 VAL 58 HG13 VAL 58 6.771 5.897 -8.102 458 HG21 VAL 58 HG21 VAL 58 4.518 3.923 -10.331 459 HG22 VAL 58 HG22 VAL 58 5.844 4.901 -10.968 460 HG23 VAL 58 HG23 VAL 58 4.836 5.522 -9.658 461 H ASN 59 H ASN 59 6.727 2.986 -12.173 462 HA ASN 59 HA ASN 59 9.520 2.813 -12.820 463 HB2 ASN 59 HB2 ASN 59 8.854 3.359 -15.115 464 HB3 ASN 59 HB3 ASN 59 7.754 2.167 -14.436 465 HD21 ASN 59 HD21 ASN 59 7.437 4.140 -16.635 466 HD22 ASN 59 HD22 ASN 59 6.003 5.014 -16.241 467 H ASP 60 H ASP 60 10.981 4.460 -13.432 468 HA ASP 60 HA ASP 60 10.697 7.029 -12.227 469 HB2 ASP 60 HB2 ASP 60 12.853 7.589 -13.257 470 HB3 ASP 60 HB3 ASP 60 12.921 5.974 -12.573 471 H ASP 61 H ASP 61 10.447 9.083 -13.254 472 HA ASP 61 HA ASP 61 9.084 9.116 -15.860 473 HB2 ASP 61 HB2 ASP 61 7.483 8.519 -13.872 474 HB3 ASP 61 HB3 ASP 61 7.693 10.188 -13.372 475 H GLN 62 H GLN 62 8.553 11.363 -16.525 476 HA GLN 62 HA GLN 62 10.619 13.271 -15.959 477 HB2 GLN 62 HB2 GLN 62 7.980 13.605 -17.449 478 HB3 GLN 62 HB3 GLN 62 9.295 14.783 -17.448 479 HG2 GLN 62 HG2 GLN 62 10.782 13.144 -18.541 480 HG3 GLN 62 HG3 GLN 62 9.484 11.950 -18.510 481 HE21 GLN 62 HE21 GLN 62 9.507 11.708 -20.744 482 HE22 GLN 62 HE22 GLN 62 8.919 12.925 -21.822 483 H ARG 63 H ARG 63 7.384 12.736 -14.803 484 HA ARG 63 HA ARG 63 7.177 15.167 -13.235 485 HB2 ARG 63 HB2 ARG 63 5.437 12.660 -13.330 486 HB3 ARG 63 HB3 ARG 63 5.065 14.083 -12.367 487 HG2 ARG 63 HG2 ARG 63 5.253 14.018 -15.391 488 HG3 ARG 63 HG3 ARG 63 3.760 13.969 -14.456 489 HD2 ARG 63 HD2 ARG 63 4.368 16.219 -13.506 490 HD3 ARG 63 HD3 ARG 63 5.742 16.257 -14.618 491 HE ARG 63 HE ARG 63 3.613 15.790 -16.251 492 HH11 ARG 63 HH11 ARG 63 4.341 18.313 -13.893 493 HH12 ARG 63 HH12 ARG 63 3.403 19.514 -14.721 494 HH21 ARG 63 HH21 ARG 63 2.385 17.393 -17.310 495 HH22 ARG 63 HH22 ARG 63 2.302 18.994 -16.650 496 H LEU 64 H LEU 64 8.469 11.982 -12.786 497 HA LEU 64 HA LEU 64 7.580 11.085 -10.365 498 HB2 LEU 64 HB2 LEU 64 9.250 10.085 -12.185 499 HB3 LEU 64 HB3 LEU 64 10.482 10.627 -11.078 500 HG LEU 64 HG LEU 64 9.906 8.191 -10.886 501 HD11 LEU 64 HD11 LEU 64 9.830 8.036 -8.462 502 HD12 LEU 64 HD12 LEU 64 9.358 9.732 -8.345 503 HD13 LEU 64 HD13 LEU 64 10.944 9.301 -8.983 504 HD21 LEU 64 HD21 LEU 64 7.511 8.300 -11.357 505 HD22 LEU 64 HD22 LEU 64 7.225 9.141 -9.832 506 HD23 LEU 64 HD23 LEU 64 7.812 7.477 -9.828 507 H GLU 65 H GLU 65 10.586 12.975 -10.797 508 HA GLU 65 HA GLU 65 11.194 13.082 -8.012 509 HB2 GLU 65 HB2 GLU 65 12.841 15.028 -8.929 510 HB3 GLU 65 HB3 GLU 65 13.199 13.317 -9.074 511 HG2 GLU 65 HG2 GLU 65 13.708 14.466 -11.138 512 HG3 GLU 65 HG3 GLU 65 12.399 13.318 -11.381 513 H GLN 66 H GLN 66 9.364 15.215 -10.121 514 HA GLN 66 HA GLN 66 9.112 17.396 -8.268 515 HB2 GLN 66 HB2 GLN 66 7.246 16.573 -10.536 516 HB3 GLN 66 HB3 GLN 66 7.204 18.117 -9.692 517 HG2 GLN 66 HG2 GLN 66 9.461 17.092 -11.431 518 HG3 GLN 66 HG3 GLN 66 8.282 18.320 -11.878 519 HE21 GLN 66 HE21 GLN 66 11.134 17.630 -10.008 520 HE22 GLN 66 HE22 GLN 66 11.527 19.268 -9.613 521 H MET 67 H MET 67 7.361 14.373 -8.838 522 HA MET 67 HA MET 67 5.189 14.907 -7.043 523 HB2 MET 67 HB2 MET 67 6.159 12.144 -7.907 524 HB3 MET 67 HB3 MET 67 4.566 12.569 -7.286 525 HG2 MET 67 HG2 MET 67 5.752 13.232 -9.977 526 HG3 MET 67 HG3 MET 67 4.327 12.261 -9.631 527 HE1 MET 67 HE1 MET 67 2.761 14.147 -7.501 528 HE2 MET 67 HE2 MET 67 1.975 13.329 -8.851 529 HE3 MET 67 HE3 MET 67 1.732 15.059 -8.603 530 H ILE 68 H ILE 68 8.353 13.372 -6.745 531 HA ILE 68 HA ILE 68 8.253 12.511 -4.058 532 HB ILE 68 HB ILE 68 10.624 13.486 -5.722 533 HG12 ILE 68 HG12 ILE 68 9.752 10.639 -5.029 534 HG13 ILE 68 HG13 ILE 68 9.447 11.436 -6.569 535 HG21 ILE 68 HG21 ILE 68 12.113 12.372 -4.072 536 HG22 ILE 68 HG22 ILE 68 10.719 12.026 -3.051 537 HG23 ILE 68 HG23 ILE 68 11.204 13.695 -3.334 538 HD11 ILE 68 HD11 ILE 68 12.152 10.778 -5.426 539 HD12 ILE 68 HD12 ILE 68 11.851 11.589 -6.965 540 HD13 ILE 68 HD13 ILE 68 11.319 9.926 -6.723 541 H SER 69 H SER 69 9.101 15.624 -5.522 542 HA SER 69 HA SER 69 9.866 17.005 -3.165 543 HB2 SER 69 HB2 SER 69 10.477 17.752 -5.454 544 HB3 SER 69 HB3 SER 69 8.784 18.104 -5.795 545 HG SER 69 HG SER 69 10.008 19.293 -3.566 546 H GLN 70 H GLN 70 6.771 16.551 -4.812 547 HA GLN 70 HA GLN 70 5.318 18.519 -3.320 548 HB2 GLN 70 HB2 GLN 70 4.770 17.734 -5.660 549 HB3 GLN 70 HB3 GLN 70 4.208 16.215 -4.988 550 HG2 GLN 70 HG2 GLN 70 2.969 18.760 -3.955 551 HG3 GLN 70 HG3 GLN 70 2.535 18.231 -5.573 552 HE21 GLN 70 HE21 GLN 70 2.361 17.432 -2.169 553 HE22 GLN 70 HE22 GLN 70 1.142 16.226 -2.319 554 H ILE 71 H ILE 71 5.683 14.971 -3.082 555 HA ILE 71 HA ILE 71 3.815 14.696 -0.907 556 HB ILE 71 HB ILE 71 4.310 12.845 -2.512 557 HG12 ILE 71 HG12 ILE 71 4.755 12.202 0.436 558 HG13 ILE 71 HG13 ILE 71 3.212 12.270 -0.407 559 HG21 ILE 71 HG21 ILE 71 6.326 11.474 -2.298 560 HG22 ILE 71 HG22 ILE 71 6.953 12.570 -1.064 561 HG23 ILE 71 HG23 ILE 71 6.729 13.140 -2.716 562 HD11 ILE 71 HD11 ILE 71 3.862 10.315 -1.737 563 HD12 ILE 71 HD12 ILE 71 3.890 9.989 -0.006 564 HD13 ILE 71 HD13 ILE 71 5.402 10.249 -0.871 565 H ASP 72 H ASP 72 7.240 15.291 -1.191 566 HA ASP 72 HA ASP 72 8.215 14.542 1.320 567 HB2 ASP 72 HB2 ASP 72 9.794 15.032 -0.395 568 HB3 ASP 72 HB3 ASP 72 9.090 16.602 -0.723 569 H LYS 73 H LYS 73 6.609 17.523 0.297 570 HA LYS 73 HA LYS 73 7.159 18.907 2.789 571 HB2 LYS 73 HB2 LYS 73 5.857 20.796 1.754 572 HB3 LYS 73 HB3 LYS 73 7.270 20.276 0.845 573 HG2 LYS 73 HG2 LYS 73 5.779 18.985 -0.691 574 HG3 LYS 73 HG3 LYS 73 4.382 19.605 0.202 575 HD2 LYS 73 HD2 LYS 73 4.772 20.889 -1.874 576 HD3 LYS 73 HD3 LYS 73 4.958 21.909 -0.445 577 HE2 LYS 73 HE2 LYS 73 7.379 21.775 -0.612 578 HE3 LYS 73 HE3 LYS 73 7.259 20.628 -1.947 579 HZ1 LYS 73 HZ1 LYS 73 6.185 22.363 -3.259 580 HZ2 LYS 73 HZ2 LYS 73 7.725 22.833 -2.755 581 HZ3 LYS 73 HZ3 LYS 73 6.359 23.461 -1.986 582 H LEU 74 H LEU 74 5.066 16.500 2.292 583 HA LEU 74 HA LEU 74 2.786 17.535 3.798 584 HB2 LEU 74 HB2 LEU 74 3.527 14.821 2.668 585 HB3 LEU 74 HB3 LEU 74 2.322 14.906 3.937 586 HG LEU 74 HG LEU 74 1.266 14.779 1.722 587 HD11 LEU 74 HD11 LEU 74 -0.299 16.665 1.928 588 HD12 LEU 74 HD12 LEU 74 0.810 17.476 3.035 589 HD13 LEU 74 HD13 LEU 74 0.060 15.948 3.499 590 HD21 LEU 74 HD21 LEU 74 1.414 16.604 0.087 591 HD22 LEU 74 HD22 LEU 74 2.994 15.874 0.361 592 HD23 LEU 74 HD23 LEU 74 2.608 17.432 1.093 593 H GLU 75 H GLU 75 2.350 17.122 5.941 594 HA GLU 75 HA GLU 75 4.511 16.656 7.791 595 HB2 GLU 75 HB2 GLU 75 1.504 16.875 8.258 596 HB3 GLU 75 HB3 GLU 75 2.719 16.853 9.537 597 HG2 GLU 75 HG2 GLU 75 3.673 18.953 8.698 598 HG3 GLU 75 HG3 GLU 75 2.509 18.967 7.374 599 H ASP 76 H ASP 76 2.256 14.663 6.178 600 HA ASP 76 HA ASP 76 2.114 12.372 7.802 601 HB2 ASP 76 HB2 ASP 76 2.264 12.459 4.748 602 HB3 ASP 76 HB3 ASP 76 1.592 11.165 5.729 603 H VAL 77 H VAL 77 4.335 13.241 5.199 604 HA VAL 77 HA VAL 77 6.085 10.990 5.558 605 HB VAL 77 HB VAL 77 6.304 13.483 3.791 606 HG11 VAL 77 HG11 VAL 77 8.105 12.321 2.569 607 HG12 VAL 77 HG12 VAL 77 8.050 10.990 3.727 608 HG13 VAL 77 HG13 VAL 77 8.560 12.594 4.253 609 HG21 VAL 77 HG21 VAL 77 5.675 11.973 1.956 610 HG22 VAL 77 HG22 VAL 77 4.435 11.968 3.210 611 HG23 VAL 77 HG23 VAL 77 5.566 10.617 3.080 612 H VAL 78 H VAL 78 7.460 10.923 7.174 613 HA VAL 78 HA VAL 78 8.526 13.180 8.600 614 HB VAL 78 HB VAL 78 9.512 10.281 8.680 615 HG11 VAL 78 HG11 VAL 78 9.689 12.490 10.770 616 HG12 VAL 78 HG12 VAL 78 11.021 11.882 9.781 617 HG13 VAL 78 HG13 VAL 78 10.252 10.829 10.968 618 HG21 VAL 78 HG21 VAL 78 7.072 10.319 9.046 619 HG22 VAL 78 HG22 VAL 78 7.268 11.509 10.338 620 HG23 VAL 78 HG23 VAL 78 7.931 9.882 10.526 621 H LYS 79 H LYS 79 9.909 10.673 6.463 622 HA LYS 79 HA LYS 79 11.816 12.600 5.316 623 HB2 LYS 79 HB2 LYS 79 12.564 9.891 6.495 624 HB3 LYS 79 HB3 LYS 79 13.572 10.705 5.301 625 HG2 LYS 79 HG2 LYS 79 13.804 12.639 6.854 626 HG3 LYS 79 HG3 LYS 79 12.876 11.747 8.064 627 HD2 LYS 79 HD2 LYS 79 14.600 10.001 8.149 628 HD3 LYS 79 HD3 LYS 79 15.501 10.787 6.849 629 HE2 LYS 79 HE2 LYS 79 16.532 11.262 9.010 630 HE3 LYS 79 HE3 LYS 79 15.885 12.750 8.315 631 HZ1 LYS 79 HZ1 LYS 79 14.580 11.102 10.403 632 HZ2 LYS 79 HZ2 LYS 79 13.974 12.540 9.764 633 HZ3 LYS 79 HZ3 LYS 79 15.398 12.554 10.672 634 H VAL 80 H VAL 80 12.359 12.158 3.134 635 HA VAL 80 HA VAL 80 11.062 9.796 1.872 636 HB VAL 80 HB VAL 80 9.971 12.008 1.221 637 HG11 VAL 80 HG11 VAL 80 11.103 13.521 -0.345 638 HG12 VAL 80 HG12 VAL 80 12.600 12.601 -0.168 639 HG13 VAL 80 HG13 VAL 80 11.927 13.465 1.215 640 HG21 VAL 80 HG21 VAL 80 9.754 10.041 -0.230 641 HG22 VAL 80 HG22 VAL 80 11.262 10.444 -1.053 642 HG23 VAL 80 HG23 VAL 80 9.860 11.508 -1.205 643 H GLN 81 H GLN 81 12.336 8.660 0.368 644 HA GLN 81 HA GLN 81 15.031 9.595 -0.300 645 HB2 GLN 81 HB2 GLN 81 15.269 8.280 1.839 646 HB3 GLN 81 HB3 GLN 81 14.557 6.881 1.043 647 HG2 GLN 81 HG2 GLN 81 16.455 6.848 -0.560 648 HG3 GLN 81 HG3 GLN 81 17.168 8.233 0.262 649 HE21 GLN 81 HE21 GLN 81 16.564 4.806 0.432 650 HE22 GLN 81 HE22 GLN 81 17.580 4.482 1.786 651 H ARG 82 H ARG 82 15.028 9.399 -2.464 652 HA ARG 82 HA ARG 82 13.447 7.318 -3.770 653 HB2 ARG 82 HB2 ARG 82 13.916 8.473 -5.853 654 HB3 ARG 82 HB3 ARG 82 13.379 9.630 -4.655 655 HG2 ARG 82 HG2 ARG 82 15.087 10.870 -5.538 656 HG3 ARG 82 HG3 ARG 82 16.035 9.974 -4.353 657 HD2 ARG 82 HD2 ARG 82 16.590 8.309 -6.174 658 HD3 ARG 82 HD3 ARG 82 15.764 9.374 -7.319 659 HE ARG 82 HE ARG 82 17.604 10.969 -6.040 660 HH11 ARG 82 HH11 ARG 82 17.798 8.061 -8.024 661 HH12 ARG 82 HH12 ARG 82 19.376 8.442 -8.624 662 HH21 ARG 82 HH21 ARG 82 19.677 11.418 -6.811 663 HH22 ARG 82 HH22 ARG 82 20.439 10.342 -7.939 664 H ASN 83 H ASN 83 14.287 5.440 -4.399 665 HA ASN 83 HA ASN 83 17.222 5.136 -4.778 666 HB2 ASN 83 HB2 ASN 83 15.379 2.958 -3.656 667 HB3 ASN 83 HB3 ASN 83 17.134 2.918 -3.765 668 HD21 ASN 83 HD21 ASN 83 14.393 4.217 -2.027 669 HD22 ASN 83 HD22 ASN 83 15.264 4.752 -0.641 670 H GLN 84 H GLN 84 17.761 3.683 -6.494 671 HA GLN 84 HA GLN 84 15.544 2.499 -8.028 672 HB2 GLN 84 HB2 GLN 84 16.687 3.225 -10.178 673 HB3 GLN 84 HB3 GLN 84 15.889 4.499 -9.269 674 HG2 GLN 84 HG2 GLN 84 18.152 5.133 -8.348 675 HG3 GLN 84 HG3 GLN 84 18.866 3.990 -9.490 676 HE21 GLN 84 HE21 GLN 84 18.290 4.370 -11.803 677 HE22 GLN 84 HE22 GLN 84 18.137 5.993 -12.357 678 H SER 85 H SER 85 15.929 0.477 -7.616 679 HA SER 85 HA SER 85 18.426 -0.823 -8.330 680 HB2 SER 85 HB2 SER 85 18.779 -0.035 -5.953 681 HB3 SER 85 HB3 SER 85 17.359 -0.959 -5.467 682 HG SER 85 HG SER 85 19.818 -1.807 -5.569 683 H ASP 86 H ASP 86 18.074 -3.271 -7.480 684 HA ASP 86 HA ASP 86 15.966 -4.362 -9.037 685 HB2 ASP 86 HB2 ASP 86 17.737 -5.714 -6.939 686 HB3 ASP 86 HB3 ASP 86 16.737 -6.556 -8.118 687 HA PRO 87 HA PRO 87 12.672 -4.574 -5.909 688 HB2 PRO 87 HB2 PRO 87 11.097 -6.544 -6.918 689 HB3 PRO 87 HB3 PRO 87 11.279 -4.993 -7.765 690 HG2 PRO 87 HG2 PRO 87 12.712 -7.586 -8.287 691 HG3 PRO 87 HG3 PRO 87 11.893 -6.507 -9.441 692 HD2 PRO 87 HD2 PRO 87 14.583 -6.425 -9.076 693 HD3 PRO 87 HD3 PRO 87 13.643 -4.964 -9.455 694 H THR 88 H THR 88 15.109 -6.810 -6.164 695 HA THR 88 HA THR 88 14.355 -8.805 -4.291 696 HB THR 88 HB THR 88 16.817 -9.161 -4.051 697 HG1 THR 88 HG1 THR 88 18.052 -7.728 -5.643 698 HG21 THR 88 HG21 THR 88 15.925 -8.773 -6.941 699 HG22 THR 88 HG22 THR 88 15.652 -10.219 -5.963 700 HG23 THR 88 HG23 THR 88 17.294 -9.751 -6.406 701 H MET 89 H MET 89 15.363 -5.481 -3.984 702 HA MET 89 HA MET 89 16.041 -5.270 -1.292 703 HB2 MET 89 HB2 MET 89 16.212 -3.406 -2.902 704 HB3 MET 89 HB3 MET 89 14.460 -3.328 -3.035 705 HG2 MET 89 HG2 MET 89 15.345 -1.524 -1.631 706 HG3 MET 89 HG3 MET 89 14.296 -2.594 -0.699 707 HE1 MET 89 HE1 MET 89 16.393 -0.450 0.599 708 HE2 MET 89 HE2 MET 89 17.027 -1.423 1.924 709 HE3 MET 89 HE3 MET 89 15.304 -1.457 1.555 710 H PHE 90 H PHE 90 12.866 -5.355 -2.845 711 HA PHE 90 HA PHE 90 11.106 -4.887 -0.731 712 HB2 PHE 90 HB2 PHE 90 10.601 -5.081 -3.222 713 HB3 PHE 90 HB3 PHE 90 10.707 -6.819 -3.067 714 HD1 PHE 90 HD1 PHE 90 9.013 -7.823 -1.161 715 HD2 PHE 90 HD2 PHE 90 8.482 -4.141 -3.268 716 HE1 PHE 90 HE1 PHE 90 6.579 -7.958 -0.802 717 HE2 PHE 90 HE2 PHE 90 6.058 -4.273 -2.892 718 HZ PHE 90 HZ PHE 90 5.102 -6.182 -1.664 719 H ASN 91 H ASN 91 12.454 -7.978 -1.896 720 HA ASN 91 HA ASN 91 11.300 -9.679 0.083 721 HB2 ASN 91 HB2 ASN 91 12.059 -10.542 -2.092 722 HB3 ASN 91 HB3 ASN 91 13.712 -10.054 -1.752 723 HD21 ASN 91 HD21 ASN 91 11.252 -12.439 -1.137 724 HD22 ASN 91 HD22 ASN 91 12.277 -13.568 -0.326 725 H LYS 92 H LYS 92 14.317 -7.896 -0.157 726 HA LYS 92 HA LYS 92 15.935 -9.225 1.704 727 HB2 LYS 92 HB2 LYS 92 16.632 -7.527 -0.072 728 HB3 LYS 92 HB3 LYS 92 16.025 -6.263 0.983 729 HG2 LYS 92 HG2 LYS 92 18.400 -6.345 1.250 730 HG3 LYS 92 HG3 LYS 92 17.680 -6.998 2.723 731 HD2 LYS 92 HD2 LYS 92 19.610 -8.347 2.042 732 HD3 LYS 92 HD3 LYS 92 18.132 -9.301 1.918 733 HE2 LYS 92 HE2 LYS 92 18.084 -8.935 -0.521 734 HE3 LYS 92 HE3 LYS 92 19.530 -7.926 -0.409 735 HZ1 LYS 92 HZ1 LYS 92 20.018 -10.203 -1.117 736 HZ2 LYS 92 HZ2 LYS 92 19.406 -10.798 0.343 737 HZ3 LYS 92 HZ3 LYS 92 20.783 -9.820 0.339 738 H ILE 93 H ILE 93 13.886 -6.360 2.065 739 HA ILE 93 HA ILE 93 14.423 -6.014 4.894 740 HB ILE 93 HB ILE 93 12.771 -4.135 4.693 741 HG12 ILE 93 HG12 ILE 93 12.318 -5.441 2.004 742 HG13 ILE 93 HG13 ILE 93 11.158 -4.700 3.091 743 HG21 ILE 93 HG21 ILE 93 15.171 -3.757 4.251 744 HG22 ILE 93 HG22 ILE 93 14.171 -2.714 3.242 745 HG23 ILE 93 HG23 ILE 93 14.927 -4.149 2.546 746 HD11 ILE 93 HD11 ILE 93 13.059 -3.252 1.268 747 HD12 ILE 93 HD12 ILE 93 11.901 -2.501 2.364 748 HD13 ILE 93 HD13 ILE 93 11.328 -3.491 1.026 749 H ALA 94 H ALA 94 11.894 -7.470 2.885 750 HA ALA 94 HA ALA 94 9.887 -7.710 4.876 751 HB1 ALA 94 HB1 ALA 94 10.365 -9.430 2.426 752 HB2 ALA 94 HB2 ALA 94 9.444 -7.926 2.478 753 HB3 ALA 94 HB3 ALA 94 8.866 -9.339 3.362 754 H VAL 95 H VAL 95 12.644 -9.751 4.036 755 HA VAL 95 HA VAL 95 11.875 -11.883 5.873 756 HB VAL 95 HB VAL 95 12.980 -12.337 3.636 757 HG11 VAL 95 HG11 VAL 95 15.427 -12.140 3.424 758 HG12 VAL 95 HG12 VAL 95 15.496 -11.309 4.980 759 HG13 VAL 95 HG13 VAL 95 14.655 -10.565 3.619 760 HG21 VAL 95 HG21 VAL 95 12.885 -14.080 5.358 761 HG22 VAL 95 HG22 VAL 95 14.390 -13.499 6.068 762 HG23 VAL 95 HG23 VAL 95 14.393 -14.204 4.450 763 H PHE 96 H PHE 96 13.601 -8.936 6.074 764 HA PHE 96 HA PHE 96 15.330 -9.758 8.297 765 HB2 PHE 96 HB2 PHE 96 16.237 -8.214 6.583 766 HB3 PHE 96 HB3 PHE 96 14.985 -7.033 6.958 767 HD1 PHE 96 HD1 PHE 96 17.886 -8.871 8.471 768 HD2 PHE 96 HD2 PHE 96 15.372 -5.418 8.678 769 HE1 PHE 96 HE1 PHE 96 19.329 -7.915 10.217 770 HE2 PHE 96 HE2 PHE 96 16.825 -4.464 10.418 771 HZ PHE 96 HZ PHE 96 18.805 -5.715 11.189 772 H PHE 97 H PHE 97 12.579 -7.575 7.683 773 HA PHE 97 HA PHE 97 12.271 -6.965 10.538 774 HB2 PHE 97 HB2 PHE 97 10.837 -5.868 8.078 775 HB3 PHE 97 HB3 PHE 97 10.511 -5.359 9.730 776 HD1 PHE 97 HD2 PHE 97 12.314 -4.161 11.043 777 HD2 PHE 97 HD1 PHE 97 12.701 -4.932 6.856 778 HE1 PHE 97 HE2 PHE 97 14.062 -2.439 10.880 779 HE2 PHE 97 HE1 PHE 97 14.448 -3.213 6.701 780 HZ PHE 97 HZ PHE 97 15.127 -1.963 8.712 781 H GLN 98 H GLN 98 11.819 -9.353 10.736 782 HA GLN 98 HA GLN 98 8.891 -9.802 10.644 783 HB2 GLN 98 HB2 GLN 98 9.502 -12.298 10.792 784 HB3 GLN 98 HB3 GLN 98 9.796 -11.497 9.255 785 HG2 GLN 98 HG2 GLN 98 12.178 -11.387 9.691 786 HG3 GLN 98 HG3 GLN 98 11.957 -12.015 11.324 787 HE21 GLN 98 HE21 GLN 98 13.596 -13.083 9.146 788 HE22 GLN 98 HE22 GLN 98 13.035 -14.692 8.872 789 H1 GLY 1 H1 GLY 1 -8.186 -3.399 19.063 790 H2 GLY 1 H2 GLY 1 -8.484 -4.120 20.561 791 H3 GLY 1 H3 GLY 1 -7.250 -4.714 19.569 792 HA2 GLY 1 HA3 GLY 1 -6.010 -2.682 19.812 793 HA3 GLY 1 HA2 GLY 1 -7.299 -2.023 20.803 794 H SER 2 H SER 2 -4.701 -4.400 20.646 795 HA SER 2 HA SER 2 -4.743 -4.673 23.602 796 HB2 SER 2 HB2 SER 2 -3.428 -6.807 23.215 797 HB3 SER 2 HB3 SER 2 -5.069 -6.850 22.573 798 HG SER 2 HG SER 2 -4.283 -6.589 20.531 799 H MET 3 H MET 3 -2.866 -4.235 24.739 800 HA MET 3 HA MET 3 -0.902 -2.539 23.460 801 HB2 MET 3 HB2 MET 3 -1.109 -3.507 26.344 802 HB3 MET 3 HB3 MET 3 0.073 -2.337 25.765 803 HG2 MET 3 HG2 MET 3 -2.930 -1.975 25.787 804 HG3 MET 3 HG3 MET 3 -1.776 -1.212 26.878 805 HE1 MET 3 HE1 MET 3 0.630 -0.413 24.843 806 HE2 MET 3 HE2 MET 3 -0.000 0.669 26.087 807 HE3 MET 3 HE3 MET 3 0.136 1.226 24.420 808 H GLN 4 H GLN 4 -0.152 -4.088 21.987 809 HA GLN 4 HA GLN 4 2.261 -5.417 22.673 810 HB2 GLN 4 HB2 GLN 4 0.622 -7.127 23.528 811 HB3 GLN 4 HB3 GLN 4 -0.123 -7.201 21.939 812 HG2 GLN 4 HG2 GLN 4 1.336 -9.136 22.358 813 HG3 GLN 4 HG3 GLN 4 1.909 -8.177 20.994 814 HE21 GLN 4 HE21 GLN 4 4.026 -8.902 21.130 815 HE22 GLN 4 HE22 GLN 4 5.085 -8.507 22.438 816 H ASN 5 H ASN 5 3.274 -6.327 20.630 817 HA ASN 5 HA ASN 5 2.884 -5.104 18.187 818 HB2 ASN 5 HB2 ASN 5 3.721 -7.995 18.696 819 HB3 ASN 5 HB3 ASN 5 3.897 -7.177 17.148 820 HD21 ASN 5 HD21 ASN 5 6.125 -7.529 17.163 821 HD22 ASN 5 HD22 ASN 5 7.185 -6.627 18.183 822 H THR 6 H THR 6 1.449 -5.361 16.484 823 HA THR 6 HA THR 6 -1.015 -6.745 16.796 824 HB THR 6 HB THR 6 -1.132 -6.226 14.181 825 HG1 THR 6 HG1 THR 6 0.451 -4.119 14.283 826 HG21 THR 6 HG21 THR 6 -1.808 -3.885 14.660 827 HG22 THR 6 HG22 THR 6 -1.062 -4.000 16.254 828 HG23 THR 6 HG23 THR 6 -2.459 -5.004 15.858 829 H THR 7 H THR 7 -0.393 -8.832 17.319 830 HA THR 7 HA THR 7 0.697 -10.547 15.175 831 HB THR 7 HB THR 7 0.466 -11.231 18.142 832 HG1 THR 7 HG1 THR 7 2.498 -9.874 16.698 833 HG21 THR 7 HG21 THR 7 2.213 -12.897 17.647 834 HG22 THR 7 HG22 THR 7 2.225 -12.411 15.949 835 HG23 THR 7 HG23 THR 7 0.794 -13.178 16.641 836 H HIS 8 H HIS 8 -1.852 -10.159 17.554 837 HA HIS 8 HA HIS 8 -3.673 -11.890 15.976 838 HB2 HIS 8 HB2 HIS 8 -4.799 -12.543 18.064 839 HB3 HIS 8 HB3 HIS 8 -3.088 -12.940 18.179 840 HD1 HIS 8 HD1 HIS 8 -1.624 -11.319 19.738 841 HD2 HIS 8 HD2 HIS 8 -5.748 -10.866 20.050 842 HE1 HIS 8 HE1 HIS 8 -1.999 -9.965 21.825 843 HE2 HIS 8 HE2 HIS 8 -4.492 -9.754 22.022 844 H ASP 9 H ASP 9 -2.920 -8.811 16.660 845 HA ASP 9 HA ASP 9 -5.554 -7.814 17.496 846 HB2 ASP 9 HB2 ASP 9 -3.357 -7.108 18.622 847 HB3 ASP 9 HB3 ASP 9 -2.979 -6.225 17.148 848 H ASN 10 H ASN 10 -3.660 -8.162 14.669 849 HA ASN 10 HA ASN 10 -5.500 -6.399 13.145 850 HB2 ASN 10 HB2 ASN 10 -3.809 -6.193 11.440 851 HB3 ASN 10 HB3 ASN 10 -2.996 -5.920 12.978 852 HD21 ASN 10 HD21 ASN 10 -3.310 -8.065 10.252 853 HD22 ASN 10 HD22 ASN 10 -1.960 -9.068 10.643 854 H VAL 11 H VAL 11 -5.924 -7.262 10.914 855 HA VAL 11 HA VAL 11 -6.185 -10.186 10.772 856 HB VAL 11 HB VAL 11 -8.334 -9.979 9.580 857 HG11 VAL 11 HG11 VAL 11 -8.453 -8.567 12.269 858 HG12 VAL 11 HG12 VAL 11 -8.421 -10.311 12.007 859 HG13 VAL 11 HG13 VAL 11 -9.803 -9.367 11.455 860 HG21 VAL 11 HG21 VAL 11 -8.276 -6.995 10.180 861 HG22 VAL 11 HG22 VAL 11 -9.602 -7.879 9.428 862 HG23 VAL 11 HG23 VAL 11 -8.061 -7.726 8.589 863 H ILE 12 H ILE 12 -5.874 -11.027 8.723 864 HA ILE 12 HA ILE 12 -4.231 -9.353 6.937 865 HB ILE 12 HB ILE 12 -4.579 -12.395 6.871 866 HG12 ILE 12 HG12 ILE 12 -3.715 -11.663 9.122 867 HG13 ILE 12 HG13 ILE 12 -2.588 -12.676 8.239 868 HG21 ILE 12 HG21 ILE 12 -2.407 -12.384 5.692 869 HG22 ILE 12 HG22 ILE 12 -2.381 -10.620 5.749 870 HG23 ILE 12 HG23 ILE 12 -3.631 -11.455 4.825 871 HD11 ILE 12 HD11 ILE 12 -2.417 -9.683 8.579 872 HD12 ILE 12 HD12 ILE 12 -1.282 -10.670 7.655 873 HD13 ILE 12 HD13 ILE 12 -1.437 -10.900 9.396 874 H LEU 13 H LEU 13 -5.860 -8.261 5.717 875 HA LEU 13 HA LEU 13 -8.057 -9.782 4.517 876 HB2 LEU 13 HB2 LEU 13 -7.364 -6.820 4.293 877 HB3 LEU 13 HB3 LEU 13 -8.798 -7.577 3.614 878 HG LEU 13 HG LEU 13 -8.149 -7.211 6.559 879 HD11 LEU 13 HD11 LEU 13 -10.158 -5.819 6.590 880 HD12 LEU 13 HD12 LEU 13 -10.404 -6.093 4.864 881 HD13 LEU 13 HD13 LEU 13 -8.986 -5.205 5.427 882 HD21 LEU 13 HD21 LEU 13 -10.507 -8.694 5.350 883 HD22 LEU 13 HD22 LEU 13 -10.316 -8.278 7.055 884 HD23 LEU 13 HD23 LEU 13 -9.194 -9.401 6.296 885 H GLU 14 H GLU 14 -7.336 -11.035 2.874 886 HA GLU 14 HA GLU 14 -5.407 -10.035 0.920 887 HB2 GLU 14 HB2 GLU 14 -5.352 -12.406 1.898 888 HB3 GLU 14 HB3 GLU 14 -6.802 -12.758 0.973 889 HG2 GLU 14 HG2 GLU 14 -4.144 -11.910 -0.223 890 HG3 GLU 14 HG3 GLU 14 -4.677 -13.571 -0.060 891 H LEU 15 H LEU 15 -6.525 -8.481 -0.211 892 HA LEU 15 HA LEU 15 -8.899 -9.359 -1.733 893 HB2 LEU 15 HB2 LEU 15 -9.299 -6.880 -2.100 894 HB3 LEU 15 HB3 LEU 15 -9.532 -7.476 -0.477 895 HG LEU 15 HG LEU 15 -6.912 -6.559 -0.332 896 HD11 LEU 15 HD11 LEU 15 -6.950 -5.571 -2.556 897 HD12 LEU 15 HD12 LEU 15 -6.817 -4.321 -1.323 898 HD13 LEU 15 HD13 LEU 15 -8.363 -4.599 -2.132 899 HD21 LEU 15 HD21 LEU 15 -9.413 -4.959 0.304 900 HD22 LEU 15 HD22 LEU 15 -7.799 -4.652 0.950 901 HD23 LEU 15 HD23 LEU 15 -8.637 -6.147 1.353 902 H THR 16 H THR 16 -8.457 -10.028 -3.642 903 HA THR 16 HA THR 16 -6.010 -9.421 -5.089 904 HB THR 16 HB THR 16 -8.410 -11.145 -5.917 905 HG1 THR 16 HG1 THR 16 -6.785 -11.632 -3.978 906 HG21 THR 16 HG21 THR 16 -5.565 -11.066 -7.027 907 HG22 THR 16 HG22 THR 16 -6.998 -10.432 -7.840 908 HG23 THR 16 HG23 THR 16 -6.852 -12.165 -7.547 909 H VAL 17 H VAL 17 -5.975 -7.593 -6.236 910 HA VAL 17 HA VAL 17 -8.388 -6.642 -7.682 911 HB VAL 17 HB VAL 17 -7.691 -4.396 -7.448 912 HG11 VAL 17 HG11 VAL 17 -7.537 -4.006 -5.012 913 HG12 VAL 17 HG12 VAL 17 -7.122 -5.707 -4.769 914 HG13 VAL 17 HG13 VAL 17 -8.710 -5.268 -5.401 915 HG21 VAL 17 HG21 VAL 17 -5.303 -4.568 -7.951 916 HG22 VAL 17 HG22 VAL 17 -4.993 -5.336 -6.397 917 HG23 VAL 17 HG23 VAL 17 -5.515 -3.651 -6.456 918 H ARG 18 H ARG 18 -8.050 -5.876 -9.809 919 HA ARG 18 HA ARG 18 -5.380 -6.334 -11.013 920 HB2 ARG 18 HB2 ARG 18 -6.530 -6.321 -13.182 921 HB3 ARG 18 HB3 ARG 18 -7.165 -7.571 -12.126 922 HG2 ARG 18 HG2 ARG 18 -9.091 -5.993 -11.597 923 HG3 ARG 18 HG3 ARG 18 -8.483 -4.951 -12.889 924 HD2 ARG 18 HD2 ARG 18 -9.463 -7.808 -13.151 925 HD3 ARG 18 HD3 ARG 18 -10.253 -6.354 -13.763 926 HE ARG 18 HE ARG 18 -7.675 -6.533 -14.894 927 HH11 ARG 18 HH11 ARG 18 -10.777 -8.200 -15.086 928 HH12 ARG 18 HH12 ARG 18 -10.515 -8.743 -16.714 929 HH21 ARG 18 HH21 ARG 18 -7.333 -7.289 -17.014 930 HH22 ARG 18 HH22 ARG 18 -8.567 -8.227 -17.800 931 H ASN 19 H ASN 19 -4.549 -4.607 -12.377 932 HA ASN 19 HA ASN 19 -4.659 -2.207 -10.822 933 HB2 ASN 19 HB2 ASN 19 -2.951 -2.888 -13.252 934 HB3 ASN 19 HB3 ASN 19 -2.766 -1.430 -12.279 935 HD21 ASN 19 HD21 ASN 19 -0.677 -1.887 -11.533 936 HD22 ASN 19 HD22 ASN 19 -0.318 -3.221 -10.493 937 H HIS 20 H HIS 20 -6.839 -1.635 -11.310 938 HA HIS 20 HA HIS 20 -7.470 -0.076 -13.661 939 HB2 HIS 20 HB2 HIS 20 -8.707 -0.322 -10.883 940 HB3 HIS 20 HB3 HIS 20 -9.314 0.833 -12.042 941 HD1 HIS 20 HD1 HIS 20 -11.347 0.002 -13.110 942 HD2 HIS 20 HD2 HIS 20 -8.736 -3.093 -12.207 943 HE1 HIS 20 HE1 HIS 20 -12.521 -2.092 -13.834 944 HE2 HIS 20 HE2 HIS 20 -10.906 -3.946 -13.316 945 HA PRO 21 HA PRO 21 -5.410 3.782 -12.554 946 HB2 PRO 21 HB2 PRO 21 -7.993 5.253 -13.054 947 HB3 PRO 21 HB3 PRO 21 -6.390 5.495 -13.781 948 HG2 PRO 21 HG2 PRO 21 -8.339 4.349 -15.181 949 HG3 PRO 21 HG3 PRO 21 -6.662 3.764 -15.317 950 HD2 PRO 21 HD2 PRO 21 -8.958 2.565 -13.767 951 HD3 PRO 21 HD3 PRO 21 -7.711 1.759 -14.745 952 H GLY 22 H GLY 22 -5.072 3.511 -10.365 953 HA2 GLY 22 HA2 GLY 22 -5.001 4.522 -8.289 954 HA3 GLY 22 HA3 GLY 22 -6.501 5.360 -8.648 955 H VAL 23 H VAL 23 -5.996 1.803 -8.760 956 HA VAL 23 HA VAL 23 -8.191 1.165 -7.103 957 HB VAL 23 HB VAL 23 -5.682 -0.581 -7.268 958 HG11 VAL 23 HG11 VAL 23 -7.325 -2.426 -6.904 959 HG12 VAL 23 HG12 VAL 23 -8.605 -1.227 -6.725 960 HG13 VAL 23 HG13 VAL 23 -7.282 -1.285 -5.558 961 HG21 VAL 23 HG21 VAL 23 -6.368 -0.022 -9.545 962 HG22 VAL 23 HG22 VAL 23 -8.018 -0.543 -9.197 963 HG23 VAL 23 HG23 VAL 23 -6.698 -1.718 -9.187 964 H MET 24 H MET 24 -4.780 1.552 -6.398 965 HA MET 24 HA MET 24 -4.696 0.937 -3.699 966 HB2 MET 24 HB2 MET 24 -2.629 2.360 -3.646 967 HB3 MET 24 HB3 MET 24 -2.660 1.184 -4.946 968 HG2 MET 24 HG2 MET 24 -3.338 4.108 -5.331 969 HG3 MET 24 HG3 MET 24 -1.729 3.431 -5.569 970 HE1 MET 24 HE1 MET 24 -2.459 0.575 -6.961 971 HE2 MET 24 HE2 MET 24 -1.159 1.633 -7.514 972 HE3 MET 24 HE3 MET 24 -2.361 1.035 -8.660 973 H THR 25 H THR 25 -5.644 3.992 -5.269 974 HA THR 25 HA THR 25 -5.961 5.506 -2.863 975 HB THR 25 HB THR 25 -7.396 6.020 -5.510 976 HG1 THR 25 HG1 THR 25 -5.420 7.330 -5.897 977 HG21 THR 25 HG21 THR 25 -8.054 7.494 -3.611 978 HG22 THR 25 HG22 THR 25 -7.198 8.386 -4.868 979 HG23 THR 25 HG23 THR 25 -6.360 7.942 -3.382 980 H HIS 26 H HIS 26 -8.068 3.386 -4.756 981 HA HIS 26 HA HIS 26 -10.563 3.990 -3.538 982 HB2 HIS 26 HB2 HIS 26 -9.617 1.470 -4.976 983 HB3 HIS 26 HB3 HIS 26 -11.272 1.697 -4.419 984 HD1 HIS 26 HD1 HIS 26 -11.797 1.356 -7.046 985 HD2 HIS 26 HD2 HIS 26 -9.870 4.883 -6.024 986 HE1 HIS 26 HE1 HIS 26 -12.135 2.897 -8.993 987 HE2 HIS 26 HE2 HIS 26 -10.870 4.979 -8.396 988 H VAL 27 H VAL 27 -8.203 1.362 -2.892 989 HA VAL 27 HA VAL 27 -9.694 0.153 -0.797 990 HB VAL 27 HB VAL 27 -7.782 -1.260 -0.359 991 HG11 VAL 27 HG11 VAL 27 -7.308 -2.183 -2.595 992 HG12 VAL 27 HG12 VAL 27 -7.912 -0.706 -3.349 993 HG13 VAL 27 HG13 VAL 27 -9.008 -1.743 -2.433 994 HG21 VAL 27 HG21 VAL 27 -5.980 0.406 -0.261 995 HG22 VAL 27 HG22 VAL 27 -6.063 0.638 -2.006 996 HG23 VAL 27 HG23 VAL 27 -5.537 -0.914 -1.346 997 H CYS 28 H CYS 28 -7.125 2.572 -0.843 998 HA CYS 28 HA CYS 28 -6.717 2.786 1.947 999 HB2 CYS 28 HB2 CYS 28 -6.174 4.700 -0.347 1000 HB3 CYS 28 HB3 CYS 28 -5.647 4.995 1.312 1001 HG CYS 28 HG CYS 28 -4.056 3.428 -0.991 1002 H GLY 29 H GLY 29 -8.990 4.308 -0.280 1003 HA2 GLY 29 HA2 GLY 29 -10.117 6.256 1.441 1004 HA3 GLY 29 HA3 GLY 29 -10.905 5.529 0.043 1005 H LEU 30 H LEU 30 -10.839 2.836 0.899 1006 HA LEU 30 HA LEU 30 -13.249 2.544 2.289 1007 HB2 LEU 30 HB2 LEU 30 -11.096 0.757 1.295 1008 HB3 LEU 30 HB3 LEU 30 -11.996 0.083 2.635 1009 HG LEU 30 HG LEU 30 -12.857 -0.629 0.420 1010 HD11 LEU 30 HD11 LEU 30 -14.847 0.997 2.026 1011 HD12 LEU 30 HD12 LEU 30 -14.335 -0.659 2.363 1012 HD13 LEU 30 HD13 LEU 30 -15.231 -0.302 0.890 1013 HD21 LEU 30 HD21 LEU 30 -14.119 0.908 -1.023 1014 HD22 LEU 30 HD22 LEU 30 -12.434 1.406 -0.898 1015 HD23 LEU 30 HD23 LEU 30 -13.675 2.271 0.010 1016 H PHE 31 H PHE 31 -9.930 2.077 3.497 1017 HA PHE 31 HA PHE 31 -10.856 1.384 6.160 1018 HB2 PHE 31 HB2 PHE 31 -8.026 1.713 5.067 1019 HB3 PHE 31 HB3 PHE 31 -8.431 1.076 6.664 1020 HD1 PHE 31 HD1 PHE 31 -9.901 -1.036 6.803 1021 HD2 PHE 31 HD2 PHE 31 -8.070 0.249 3.159 1022 HE1 PHE 31 HE1 PHE 31 -10.284 -3.256 5.817 1023 HE2 PHE 31 HE2 PHE 31 -8.452 -1.978 2.183 1024 HZ PHE 31 HZ PHE 31 -9.562 -3.731 3.509 1025 H ALA 32 H ALA 32 -9.583 4.245 4.584 1026 HA ALA 32 HA ALA 32 -9.084 5.819 6.905 1027 HB1 ALA 32 HB1 ALA 32 -8.190 6.411 4.683 1028 HB2 ALA 32 HB2 ALA 32 -9.112 7.743 5.376 1029 HB3 ALA 32 HB3 ALA 32 -9.824 6.743 4.105 1030 H ARG 33 H ARG 33 -12.011 5.249 4.954 1031 HA ARG 33 HA ARG 33 -13.587 7.248 6.388 1032 HB2 ARG 33 HB2 ARG 33 -15.368 6.748 4.847 1033 HB3 ARG 33 HB3 ARG 33 -13.875 6.774 3.916 1034 HG2 ARG 33 HG2 ARG 33 -13.818 4.275 4.015 1035 HG3 ARG 33 HG3 ARG 33 -15.377 4.304 4.835 1036 HD2 ARG 33 HD2 ARG 33 -14.849 5.389 2.051 1037 HD3 ARG 33 HD3 ARG 33 -15.588 3.828 2.414 1038 HE ARG 33 HE ARG 33 -16.919 6.140 3.570 1039 HH11 ARG 33 HH11 ARG 33 -16.853 3.923 0.820 1040 HH12 ARG 33 HH12 ARG 33 -18.482 4.289 0.353 1041 HH21 ARG 33 HH21 ARG 33 -19.035 6.602 2.936 1042 HH22 ARG 33 HH22 ARG 33 -19.723 5.806 1.552 1043 H ARG 34 H ARG 34 -12.652 4.115 7.093 1044 HA ARG 34 HA ARG 34 -15.050 2.944 8.096 1045 HB2 ARG 34 HB2 ARG 34 -13.102 1.560 7.480 1046 HB3 ARG 34 HB3 ARG 34 -12.118 2.349 8.707 1047 HG2 ARG 34 HG2 ARG 34 -13.603 1.386 10.475 1048 HG3 ARG 34 HG3 ARG 34 -14.500 0.530 9.215 1049 HD2 ARG 34 HD2 ARG 34 -12.865 -0.949 10.293 1050 HD3 ARG 34 HD3 ARG 34 -12.449 -0.703 8.594 1051 HE ARG 34 HE ARG 34 -10.838 1.064 9.511 1052 HH11 ARG 34 HH11 ARG 34 -11.600 -1.882 11.284 1053 HH12 ARG 34 HH12 ARG 34 -10.083 -1.905 12.119 1054 HH21 ARG 34 HH21 ARG 34 -8.871 1.002 10.617 1055 HH22 ARG 34 HH22 ARG 34 -8.544 -0.276 11.744 1056 H ALA 35 H ALA 35 -12.170 4.006 9.893 1057 HA ALA 35 HA ALA 35 -13.292 5.805 11.683 1058 HB1 ALA 35 HB1 ALA 35 -13.486 4.495 13.783 1059 HB2 ALA 35 HB2 ALA 35 -13.193 3.007 12.878 1060 HB3 ALA 35 HB3 ALA 35 -14.646 3.950 12.570 1061 H PHE 36 H PHE 36 -11.120 2.994 11.720 1062 HA PHE 36 HA PHE 36 -8.846 4.685 12.614 1063 HB2 PHE 36 HB2 PHE 36 -9.446 2.958 14.279 1064 HB3 PHE 36 HB3 PHE 36 -9.395 1.705 13.049 1065 HD1 PHE 36 HD1 PHE 36 -7.205 4.214 14.780 1066 HD2 PHE 36 HD2 PHE 36 -7.396 0.466 12.741 1067 HE1 PHE 36 HE1 PHE 36 -4.851 3.785 15.339 1068 HE2 PHE 36 HE2 PHE 36 -5.039 0.042 13.301 1069 HZ PHE 36 HZ PHE 36 -3.764 1.701 14.602 1070 H ASN 37 H ASN 37 -6.742 4.050 11.697 1071 HA ASN 37 HA ASN 37 -6.930 3.710 8.820 1072 HB2 ASN 37 HB2 ASN 37 -4.674 4.425 10.727 1073 HB3 ASN 37 HB3 ASN 37 -4.384 4.151 9.014 1074 HD21 ASN 37 HD21 ASN 37 -7.264 5.782 10.363 1075 HD22 ASN 37 HD22 ASN 37 -6.887 7.317 9.679 1076 H VAL 38 H VAL 38 -4.648 2.612 8.049 1077 HA VAL 38 HA VAL 38 -4.873 -0.251 8.571 1078 HB VAL 38 HB VAL 38 -3.116 1.325 6.609 1079 HG11 VAL 38 HG11 VAL 38 -2.786 -0.833 5.433 1080 HG12 VAL 38 HG12 VAL 38 -3.655 -1.664 6.725 1081 HG13 VAL 38 HG13 VAL 38 -2.124 -0.860 7.068 1082 HG21 VAL 38 HG21 VAL 38 -4.706 0.645 4.866 1083 HG22 VAL 38 HG22 VAL 38 -5.523 1.581 6.120 1084 HG23 VAL 38 HG23 VAL 38 -5.703 -0.176 6.070 1085 H GLU 39 H GLU 39 -3.206 -1.506 9.481 1086 HA GLU 39 HA GLU 39 -1.045 -0.262 10.944 1087 HB2 GLU 39 HB2 GLU 39 -2.187 -2.348 11.746 1088 HB3 GLU 39 HB3 GLU 39 -1.576 -3.212 10.340 1089 HG2 GLU 39 HG2 GLU 39 -0.234 -3.770 12.274 1090 HG3 GLU 39 HG3 GLU 39 0.745 -2.841 11.139 1091 H GLY 40 H GLY 40 -1.156 -2.661 8.258 1092 HA2 GLY 40 HA2 GLY 40 1.155 -1.395 6.938 1093 HA3 GLY 40 HA3 GLY 40 1.322 -3.071 7.445 1094 H ILE 41 H ILE 41 1.341 -1.865 4.738 1095 HA ILE 41 HA ILE 41 -0.958 -3.277 3.476 1096 HB ILE 41 HB ILE 41 0.662 -0.986 2.239 1097 HG12 ILE 41 HG12 ILE 41 -2.139 -0.767 3.441 1098 HG13 ILE 41 HG13 ILE 41 -0.674 -0.209 4.240 1099 HG21 ILE 41 HG21 ILE 41 -1.141 -0.891 0.550 1100 HG22 ILE 41 HG22 ILE 41 -1.959 -2.245 1.329 1101 HG23 ILE 41 HG23 ILE 41 -0.382 -2.486 0.578 1102 HD11 ILE 41 HD11 ILE 41 -0.291 1.373 2.399 1103 HD12 ILE 41 HD12 ILE 41 -1.826 1.635 3.226 1104 HD13 ILE 41 HD13 ILE 41 -1.801 0.843 1.652 1105 H LEU 42 H LEU 42 -0.445 -4.856 2.006 1106 HA LEU 42 HA LEU 42 2.314 -5.025 0.959 1107 HB2 LEU 42 HB2 LEU 42 2.055 -6.629 2.842 1108 HB3 LEU 42 HB3 LEU 42 0.681 -7.363 2.030 1109 HG LEU 42 HG LEU 42 2.141 -8.175 0.218 1110 HD11 LEU 42 HD11 LEU 42 4.587 -7.949 0.336 1111 HD12 LEU 42 HD12 LEU 42 4.427 -6.876 1.728 1112 HD13 LEU 42 HD13 LEU 42 3.797 -6.384 0.155 1113 HD21 LEU 42 HD21 LEU 42 3.237 -8.867 2.960 1114 HD22 LEU 42 HD22 LEU 42 3.423 -9.828 1.490 1115 HD23 LEU 42 HD23 LEU 42 1.825 -9.596 2.189 1116 H CYS 43 H CYS 43 1.520 -4.074 -0.907 1117 HA CYS 43 HA CYS 43 -0.487 -5.463 -2.533 1118 HB2 CYS 43 HB2 CYS 43 -0.563 -2.996 -2.407 1119 HB3 CYS 43 HB3 CYS 43 1.080 -2.894 -3.027 1120 HG CYS 43 HG CYS 43 -1.327 -4.394 -4.902 1121 H LEU 44 H LEU 44 0.472 -7.323 -3.130 1122 HA LEU 44 HA LEU 44 3.221 -7.471 -4.118 1123 HB2 LEU 44 HB2 LEU 44 2.263 -9.122 -2.478 1124 HB3 LEU 44 HB3 LEU 44 1.115 -9.622 -3.701 1125 HG LEU 44 HG LEU 44 3.345 -10.154 -5.102 1126 HD11 LEU 44 HD11 LEU 44 5.162 -10.996 -3.703 1127 HD12 LEU 44 HD12 LEU 44 4.329 -10.436 -2.250 1128 HD13 LEU 44 HD13 LEU 44 4.911 -9.269 -3.443 1129 HD21 LEU 44 HD21 LEU 44 2.326 -11.994 -2.913 1130 HD22 LEU 44 HD22 LEU 44 3.225 -12.479 -4.355 1131 HD23 LEU 44 HD23 LEU 44 1.610 -11.796 -4.516 1132 HA PRO 45 HA PRO 45 1.243 -7.022 -8.255 1133 HB2 PRO 45 HB2 PRO 45 3.546 -6.606 -9.696 1134 HB3 PRO 45 HB3 PRO 45 2.794 -5.336 -8.712 1135 HG2 PRO 45 HG2 PRO 45 5.130 -7.090 -8.044 1136 HG3 PRO 45 HG3 PRO 45 4.920 -5.345 -7.775 1137 HD2 PRO 45 HD2 PRO 45 4.551 -7.185 -5.791 1138 HD3 PRO 45 HD3 PRO 45 3.652 -5.654 -5.858 1139 H ILE 46 H ILE 46 0.721 -8.585 -9.644 1140 HA ILE 46 HA ILE 46 2.148 -11.158 -9.582 1141 HB ILE 46 HB ILE 46 -0.631 -10.482 -10.653 1142 HG12 ILE 46 HG12 ILE 46 -0.569 -10.170 -8.226 1143 HG13 ILE 46 HG13 ILE 46 -1.472 -11.633 -8.589 1144 HG21 ILE 46 HG21 ILE 46 0.302 -12.461 -11.767 1145 HG22 ILE 46 HG22 ILE 46 -1.016 -12.922 -10.692 1146 HG23 ILE 46 HG23 ILE 46 0.657 -13.201 -10.203 1147 HD11 ILE 46 HD11 ILE 46 -0.064 -11.941 -6.646 1148 HD12 ILE 46 HD12 ILE 46 1.371 -11.498 -7.569 1149 HD13 ILE 46 HD13 ILE 46 0.493 -12.980 -7.959 1150 H GLN 47 H GLN 47 3.536 -11.513 -11.176 1151 HA GLN 47 HA GLN 47 3.585 -10.038 -13.660 1152 HB2 GLN 47 HB2 GLN 47 5.562 -11.473 -14.190 1153 HB3 GLN 47 HB3 GLN 47 5.682 -10.685 -12.629 1154 HG2 GLN 47 HG2 GLN 47 4.996 -12.776 -11.510 1155 HG3 GLN 47 HG3 GLN 47 4.921 -13.576 -13.077 1156 HE21 GLN 47 HE21 GLN 47 7.040 -12.253 -10.633 1157 HE22 GLN 47 HE22 GLN 47 8.491 -12.969 -11.232 1158 H ASP 48 H ASP 48 2.240 -13.015 -12.570 1159 HA ASP 48 HA ASP 48 2.163 -14.526 -14.941 1160 HB2 ASP 48 HB2 ASP 48 1.870 -15.654 -12.842 1161 HB3 ASP 48 HB3 ASP 48 0.544 -14.605 -12.368 1162 H SER 49 H SER 49 -0.097 -12.223 -13.541 1163 HA SER 49 HA SER 49 -1.483 -11.829 -16.084 1164 HB2 SER 49 HB2 SER 49 -2.993 -12.587 -13.535 1165 HB3 SER 49 HB3 SER 49 -3.736 -12.089 -15.057 1166 HG SER 49 HG SER 49 -2.068 -14.370 -14.730 1167 H ASP 50 H ASP 50 -2.807 -9.806 -16.008 1168 HA ASP 50 HA ASP 50 -1.500 -7.700 -14.604 1169 HB2 ASP 50 HB2 ASP 50 -3.202 -6.203 -15.639 1170 HB3 ASP 50 HB3 ASP 50 -2.495 -7.294 -16.822 1171 H LYS 51 H LYS 51 -1.668 -8.375 -12.421 1172 HA LYS 51 HA LYS 51 -4.115 -7.732 -10.967 1173 HB2 LYS 51 HB2 LYS 51 -2.875 -10.535 -10.888 1174 HB3 LYS 51 HB3 LYS 51 -4.067 -9.954 -9.730 1175 HG2 LYS 51 HG2 LYS 51 -5.758 -9.790 -11.487 1176 HG3 LYS 51 HG3 LYS 51 -4.567 -10.240 -12.710 1177 HD2 LYS 51 HD2 LYS 51 -4.302 -12.466 -11.578 1178 HD3 LYS 51 HD3 LYS 51 -5.579 -12.007 -10.446 1179 HE2 LYS 51 HE2 LYS 51 -7.194 -11.848 -12.291 1180 HE3 LYS 51 HE3 LYS 51 -5.920 -12.208 -13.460 1181 HZ1 LYS 51 HZ1 LYS 51 -6.876 -14.052 -11.333 1182 HZ2 LYS 51 HZ2 LYS 51 -5.672 -14.395 -12.467 1183 HZ3 LYS 51 HZ3 LYS 51 -7.266 -14.152 -12.976 1184 H SER 52 H SER 52 -3.713 -7.971 -8.614 1185 HA SER 52 HA SER 52 -1.061 -8.191 -7.565 1186 HB2 SER 52 HB2 SER 52 -1.107 -5.783 -8.296 1187 HB3 SER 52 HB3 SER 52 -2.528 -5.517 -7.284 1188 HG SER 52 HG SER 52 0.060 -5.497 -6.588 1189 H HIS 53 H HIS 53 -1.338 -9.235 -5.634 1190 HA HIS 53 HA HIS 53 -4.004 -9.231 -4.349 1191 HB2 HIS 53 HB2 HIS 53 -1.551 -10.994 -3.879 1192 HB3 HIS 53 HB3 HIS 53 -3.034 -11.097 -2.938 1193 HD1 HIS 53 HD1 HIS 53 -4.437 -12.993 -3.676 1194 HD2 HIS 53 HD2 HIS 53 -2.335 -11.365 -6.852 1195 HE1 HIS 53 HE1 HIS 53 -4.945 -14.472 -5.641 1196 HE2 HIS 53 HE2 HIS 53 -3.496 -13.587 -7.487 1197 H ILE 54 H ILE 54 -4.312 -7.814 -2.722 1198 HA ILE 54 HA ILE 54 -1.998 -6.679 -1.286 1199 HB ILE 54 HB ILE 54 -4.887 -5.659 -1.371 1200 HG12 ILE 54 HG12 ILE 54 -3.818 -3.615 -2.480 1201 HG13 ILE 54 HG13 ILE 54 -2.339 -4.551 -2.638 1202 HG21 ILE 54 HG21 ILE 54 -2.473 -4.475 0.064 1203 HG22 ILE 54 HG22 ILE 54 -3.891 -5.199 0.826 1204 HG23 ILE 54 HG23 ILE 54 -4.053 -3.697 -0.082 1205 HD11 ILE 54 HD11 ILE 54 -4.989 -5.238 -3.897 1206 HD12 ILE 54 HD12 ILE 54 -3.470 -6.115 -4.107 1207 HD13 ILE 54 HD13 ILE 54 -3.625 -4.464 -4.703 1208 H TRP 55 H TRP 55 -1.523 -7.936 0.467 1209 HA TRP 55 HA TRP 55 -3.646 -8.887 2.253 1210 HB2 TRP 55 HB2 TRP 55 -0.603 -9.059 2.418 1211 HB3 TRP 55 HB3 TRP 55 -1.677 -9.646 3.684 1212 HD1 TRP 55 HD1 TRP 55 -2.883 -11.986 3.264 1213 HE1 TRP 55 HE1 TRP 55 -2.568 -13.835 1.527 1214 HE3 TRP 55 HE3 TRP 55 -0.116 -9.405 -0.146 1215 HZ2 TRP 55 HZ2 TRP 55 -1.313 -14.172 -0.970 1216 HZ3 TRP 55 HZ3 TRP 55 0.587 -10.576 -2.179 1217 HH2 TRP 55 HH2 TRP 55 0.009 -12.908 -2.595 1218 H LEU 56 H LEU 56 -4.607 -7.230 3.148 1219 HA LEU 56 HA LEU 56 -3.191 -4.811 3.980 1220 HB2 LEU 56 HB2 LEU 56 -5.338 -4.948 2.496 1221 HB3 LEU 56 HB3 LEU 56 -6.197 -5.316 3.976 1222 HG LEU 56 HG LEU 56 -6.402 -2.937 3.265 1223 HD11 LEU 56 HD11 LEU 56 -6.011 -1.870 5.415 1224 HD12 LEU 56 HD12 LEU 56 -4.978 -3.206 5.925 1225 HD13 LEU 56 HD13 LEU 56 -6.697 -3.478 5.634 1226 HD21 LEU 56 HD21 LEU 56 -3.427 -2.725 3.824 1227 HD22 LEU 56 HD22 LEU 56 -4.514 -1.385 3.447 1228 HD23 LEU 56 HD23 LEU 56 -4.201 -2.628 2.240 1229 H LEU 57 H LEU 57 -2.459 -4.840 6.015 1230 HA LEU 57 HA LEU 57 -3.611 -6.520 8.119 1231 HB2 LEU 57 HB2 LEU 57 -1.076 -4.876 7.860 1232 HB3 LEU 57 HB3 LEU 57 -1.632 -5.383 9.447 1233 HG LEU 57 HG LEU 57 -1.411 -7.742 8.818 1234 HD11 LEU 57 HD11 LEU 57 -0.354 -8.448 6.716 1235 HD12 LEU 57 HD12 LEU 57 -0.432 -6.788 6.115 1236 HD13 LEU 57 HD13 LEU 57 -1.919 -7.682 6.453 1237 HD21 LEU 57 HD21 LEU 57 0.498 -6.625 9.838 1238 HD22 LEU 57 HD22 LEU 57 1.096 -6.129 8.252 1239 HD23 LEU 57 HD23 LEU 57 1.047 -7.840 8.684 1240 H VAL 58 H VAL 58 -5.297 -5.679 9.149 1241 HA VAL 58 HA VAL 58 -5.232 -2.970 10.263 1242 HB VAL 58 HB VAL 58 -6.312 -2.823 7.958 1243 HG11 VAL 58 HG11 VAL 58 -8.537 -4.508 9.151 1244 HG12 VAL 58 HG12 VAL 58 -7.430 -4.997 7.866 1245 HG13 VAL 58 HG13 VAL 58 -8.576 -3.689 7.584 1246 HG21 VAL 58 HG21 VAL 58 -6.798 -1.129 9.632 1247 HG22 VAL 58 HG22 VAL 58 -8.103 -2.116 10.296 1248 HG23 VAL 58 HG23 VAL 58 -8.235 -1.456 8.664 1249 H ASN 59 H ASN 59 -6.681 -2.828 12.138 1250 HA ASN 59 HA ASN 59 -7.137 -5.327 13.465 1251 HB2 ASN 59 HB2 ASN 59 -8.060 -4.001 15.304 1252 HB3 ASN 59 HB3 ASN 59 -6.591 -3.245 14.699 1253 HD21 ASN 59 HD21 ASN 59 -8.993 -2.143 16.141 1254 HD22 ASN 59 HD22 ASN 59 -9.484 -0.797 15.176 1255 H ASP 60 H ASP 60 -9.098 -6.393 13.944 1256 HA ASP 60 HA ASP 60 -11.250 -6.197 12.084 1257 HB2 ASP 60 HB2 ASP 60 -12.361 -7.925 13.397 1258 HB3 ASP 60 HB3 ASP 60 -10.656 -8.325 13.262 1259 H ASP 61 H ASP 61 -13.399 -5.455 12.447 1260 HA ASP 61 HA ASP 61 -13.810 -3.493 14.594 1261 HB2 ASP 61 HB2 ASP 61 -12.517 -2.487 12.566 1262 HB3 ASP 61 HB3 ASP 61 -14.017 -2.659 11.667 1263 H GLN 62 H GLN 62 -16.017 -2.525 14.457 1264 HA GLN 62 HA GLN 62 -18.076 -4.457 13.940 1265 HB2 GLN 62 HB2 GLN 62 -18.281 -1.485 14.598 1266 HB3 GLN 62 HB3 GLN 62 -19.629 -2.627 14.629 1267 HG2 GLN 62 HG2 GLN 62 -18.511 -3.905 16.429 1268 HG3 GLN 62 HG3 GLN 62 -17.162 -2.769 16.387 1269 HE21 GLN 62 HE21 GLN 62 -17.434 -2.183 18.546 1270 HE22 GLN 62 HE22 GLN 62 -18.768 -1.231 19.095 1271 H ARG 63 H ARG 63 -16.739 -1.724 12.218 1272 HA ARG 63 HA ARG 63 -18.685 -1.708 10.061 1273 HB2 ARG 63 HB2 ARG 63 -16.010 -0.276 10.380 1274 HB3 ARG 63 HB3 ARG 63 -17.102 -0.036 9.022 1275 HG2 ARG 63 HG2 ARG 63 -17.732 0.607 11.913 1276 HG3 ARG 63 HG3 ARG 63 -17.241 1.774 10.688 1277 HD2 ARG 63 HD2 ARG 63 -19.295 1.161 9.376 1278 HD3 ARG 63 HD3 ARG 63 -19.795 0.140 10.729 1279 HE ARG 63 HE ARG 63 -19.381 2.554 11.903 1280 HH11 ARG 63 HH11 ARG 63 -21.363 1.520 9.178 1281 HH12 ARG 63 HH12 ARG 63 -22.540 2.767 9.416 1282 HH21 ARG 63 HH21 ARG 63 -20.902 4.218 12.155 1283 HH22 ARG 63 HH22 ARG 63 -22.283 4.302 11.104 1284 H LEU 64 H LEU 64 -15.752 -3.389 10.789 1285 HA LEU 64 HA LEU 64 -14.196 -3.299 8.546 1286 HB2 LEU 64 HB2 LEU 64 -13.922 -4.494 10.915 1287 HB3 LEU 64 HB3 LEU 64 -14.406 -5.920 10.037 1288 HG LEU 64 HG LEU 64 -11.926 -5.676 10.350 1289 HD11 LEU 64 HD11 LEU 64 -11.230 -6.295 8.107 1290 HD12 LEU 64 HD12 LEU 64 -12.751 -5.697 7.442 1291 HD13 LEU 64 HD13 LEU 64 -12.749 -7.081 8.536 1292 HD21 LEU 64 HD21 LEU 64 -11.736 -3.247 10.173 1293 HD22 LEU 64 HD22 LEU 64 -12.154 -3.316 8.459 1294 HD23 LEU 64 HD23 LEU 64 -10.654 -4.048 9.034 1295 H GLU 65 H GLU 65 -16.601 -5.862 9.202 1296 HA GLU 65 HA GLU 65 -16.186 -7.213 6.730 1297 HB2 GLU 65 HB2 GLU 65 -18.561 -8.300 7.475 1298 HB3 GLU 65 HB3 GLU 65 -17.017 -8.795 8.145 1299 HG2 GLU 65 HG2 GLU 65 -18.652 -8.560 9.904 1300 HG3 GLU 65 HG3 GLU 65 -17.376 -7.362 10.094 1301 H GLN 66 H GLN 66 -18.406 -4.650 7.675 1302 HA GLN 66 HA GLN 66 -20.028 -4.705 5.305 1303 HB2 GLN 66 HB2 GLN 66 -19.436 -2.370 7.173 1304 HB3 GLN 66 HB3 GLN 66 -20.722 -2.415 5.972 1305 HG2 GLN 66 HG2 GLN 66 -20.500 -4.160 8.433 1306 HG3 GLN 66 HG3 GLN 66 -21.592 -2.799 8.219 1307 HE21 GLN 66 HE21 GLN 66 -20.990 -6.131 7.438 1308 HE22 GLN 66 HE22 GLN 66 -22.534 -6.450 6.733 1309 H MET 67 H MET 67 -16.969 -3.164 6.210 1310 HA MET 67 HA MET 67 -16.715 -1.540 3.866 1311 HB2 MET 67 HB2 MET 67 -14.418 -2.511 5.628 1312 HB3 MET 67 HB3 MET 67 -14.423 -1.116 4.555 1313 HG2 MET 67 HG2 MET 67 -15.859 -1.444 7.184 1314 HG3 MET 67 HG3 MET 67 -14.618 -0.271 6.766 1315 HE1 MET 67 HE1 MET 67 -15.701 0.828 3.910 1316 HE2 MET 67 HE2 MET 67 -15.088 1.868 5.196 1317 HE3 MET 67 HE3 MET 67 -16.654 2.205 4.458 1318 H ILE 68 H ILE 68 -15.724 -4.808 4.751 1319 HA ILE 68 HA ILE 68 -14.282 -5.542 2.433 1320 HB ILE 68 HB ILE 68 -15.978 -7.253 4.316 1321 HG12 ILE 68 HG12 ILE 68 -12.946 -6.892 4.194 1322 HG13 ILE 68 HG13 ILE 68 -14.005 -6.095 5.354 1323 HG21 ILE 68 HG21 ILE 68 -14.781 -9.241 3.426 1324 HG22 ILE 68 HG22 ILE 68 -13.985 -8.223 2.227 1325 HG23 ILE 68 HG23 ILE 68 -15.732 -8.443 2.170 1326 HD11 ILE 68 HD11 ILE 68 -13.561 -9.062 5.113 1327 HD12 ILE 68 HD12 ILE 68 -14.637 -8.269 6.267 1328 HD13 ILE 68 HD13 ILE 68 -12.898 -7.990 6.345 1329 H SER 69 H SER 69 -17.746 -5.600 3.208 1330 HA SER 69 HA SER 69 -18.678 -6.859 0.835 1331 HB2 SER 69 HB2 SER 69 -19.999 -6.703 2.948 1332 HB3 SER 69 HB3 SER 69 -20.172 -4.966 2.703 1333 HG SER 69 HG SER 69 -20.954 -6.519 0.554 1334 H GLN 70 H GLN 70 -18.076 -3.501 1.726 1335 HA GLN 70 HA GLN 70 -19.396 -2.321 -0.530 1336 HB2 GLN 70 HB2 GLN 70 -19.085 -1.236 1.730 1337 HB3 GLN 70 HB3 GLN 70 -17.378 -1.046 1.371 1338 HG2 GLN 70 HG2 GLN 70 -19.363 0.123 -0.568 1339 HG3 GLN 70 HG3 GLN 70 -19.160 0.926 0.981 1340 HE21 GLN 70 HE21 GLN 70 -17.580 0.105 -2.040 1341 HE22 GLN 70 HE22 GLN 70 -16.250 1.186 -1.856 1342 H ILE 71 H ILE 71 -15.998 -3.103 0.264 1343 HA ILE 71 HA ILE 71 -14.926 -1.936 -2.139 1344 HB ILE 71 HB ILE 71 -13.593 -2.167 -0.037 1345 HG12 ILE 71 HG12 ILE 71 -12.393 -3.469 -2.519 1346 HG13 ILE 71 HG13 ILE 71 -12.389 -1.754 -2.126 1347 HG21 ILE 71 HG21 ILE 71 -12.572 -4.297 0.600 1348 HG22 ILE 71 HG22 ILE 71 -13.450 -5.119 -0.691 1349 HG23 ILE 71 HG23 ILE 71 -14.332 -4.395 0.652 1350 HD11 ILE 71 HD11 ILE 71 -10.920 -2.206 -0.216 1351 HD12 ILE 71 HD12 ILE 71 -10.224 -2.743 -1.743 1352 HD13 ILE 71 HD13 ILE 71 -10.919 -3.924 -0.636 1353 H ASP 72 H ASP 72 -16.143 -5.080 -1.238 1354 HA ASP 72 HA ASP 72 -15.001 -6.756 -3.173 1355 HB2 ASP 72 HB2 ASP 72 -16.105 -7.754 -1.306 1356 HB3 ASP 72 HB3 ASP 72 -17.591 -6.871 -1.596 1357 H LYS 73 H LYS 73 -17.831 -4.652 -3.340 1358 HA LYS 73 HA LYS 73 -18.698 -5.708 -5.903 1359 HB2 LYS 73 HB2 LYS 73 -20.534 -4.008 -5.720 1360 HB3 LYS 73 HB3 LYS 73 -20.456 -5.162 -4.395 1361 HG2 LYS 73 HG2 LYS 73 -19.312 -3.441 -2.992 1362 HG3 LYS 73 HG3 LYS 73 -19.495 -2.288 -4.323 1363 HD2 LYS 73 HD2 LYS 73 -21.249 -1.981 -2.613 1364 HD3 LYS 73 HD3 LYS 73 -21.943 -2.458 -4.164 1365 HE2 LYS 73 HE2 LYS 73 -22.230 -4.744 -3.378 1366 HE3 LYS 73 HE3 LYS 73 -21.397 -4.364 -1.867 1367 HZ1 LYS 73 HZ1 LYS 73 -23.177 -2.834 -1.316 1368 HZ2 LYS 73 HZ2 LYS 73 -23.793 -4.382 -1.589 1369 HZ3 LYS 73 HZ3 LYS 73 -23.972 -3.183 -2.767 1370 H LEU 74 H LEU 74 -16.146 -3.835 -5.307 1371 HA LEU 74 HA LEU 74 -16.425 -1.959 -7.529 1372 HB2 LEU 74 HB2 LEU 74 -14.194 -2.641 -5.599 1373 HB3 LEU 74 HB3 LEU 74 -13.792 -1.827 -7.097 1374 HG LEU 74 HG LEU 74 -13.976 -0.224 -5.253 1375 HD11 LEU 74 HD11 LEU 74 -15.493 1.414 -6.284 1376 HD12 LEU 74 HD12 LEU 74 -16.223 0.138 -7.261 1377 HD13 LEU 74 HD13 LEU 74 -14.530 0.571 -7.498 1378 HD21 LEU 74 HD21 LEU 74 -16.102 0.265 -4.131 1379 HD22 LEU 74 HD22 LEU 74 -15.592 -1.392 -3.824 1380 HD23 LEU 74 HD23 LEU 74 -16.879 -1.070 -4.987 1381 H GLU 75 H GLU 75 -15.489 -2.185 -9.542 1382 HA GLU 75 HA GLU 75 -14.984 -4.804 -10.608 1383 HB2 GLU 75 HB2 GLU 75 -14.545 -2.059 -11.862 1384 HB3 GLU 75 HB3 GLU 75 -14.466 -3.590 -12.732 1385 HG2 GLU 75 HG2 GLU 75 -16.842 -3.992 -12.269 1386 HG3 GLU 75 HG3 GLU 75 -16.931 -2.483 -11.362 1387 H ASP 76 H ASP 76 -13.045 -2.399 -9.132 1388 HA ASP 76 HA ASP 76 -10.462 -2.962 -10.080 1389 HB2 ASP 76 HB2 ASP 76 -11.232 -2.257 -7.202 1390 HB3 ASP 76 HB3 ASP 76 -9.668 -2.014 -7.966 1391 H VAL 77 H VAL 77 -12.261 -4.271 -7.338 1392 HA VAL 77 HA VAL 77 -10.317 -6.281 -6.668 1393 HB VAL 77 HB VAL 77 -13.132 -5.734 -5.599 1394 HG11 VAL 77 HG11 VAL 77 -12.585 -7.231 -3.719 1395 HG12 VAL 77 HG12 VAL 77 -11.040 -7.636 -4.472 1396 HG13 VAL 77 HG13 VAL 77 -12.549 -8.107 -5.252 1397 HG21 VAL 77 HG21 VAL 77 -11.979 -4.778 -3.650 1398 HG22 VAL 77 HG22 VAL 77 -11.494 -3.942 -5.127 1399 HG23 VAL 77 HG23 VAL 77 -10.410 -5.121 -4.382 1400 H VAL 78 H VAL 78 -10.130 -8.031 -7.851 1401 HA VAL 78 HA VAL 78 -12.160 -9.201 -9.508 1402 HB VAL 78 HB VAL 78 -9.529 -10.490 -8.608 1403 HG11 VAL 78 HG11 VAL 78 -11.218 -10.970 -11.099 1404 HG12 VAL 78 HG12 VAL 78 -11.085 -12.048 -9.705 1405 HG13 VAL 78 HG13 VAL 78 -9.678 -11.749 -10.725 1406 HG21 VAL 78 HG21 VAL 78 -9.059 -8.249 -9.532 1407 HG22 VAL 78 HG22 VAL 78 -9.945 -8.655 -11.004 1408 HG23 VAL 78 HG23 VAL 78 -8.459 -9.519 -10.602 1409 H LYS 79 H LYS 79 -10.494 -10.186 -6.509 1410 HA LYS 79 HA LYS 79 -12.915 -11.497 -5.478 1411 HB2 LYS 79 HB2 LYS 79 -10.174 -12.830 -5.684 1412 HB3 LYS 79 HB3 LYS 79 -11.401 -13.375 -4.545 1413 HG2 LYS 79 HG2 LYS 79 -12.929 -13.842 -6.452 1414 HG3 LYS 79 HG3 LYS 79 -11.640 -13.370 -7.565 1415 HD2 LYS 79 HD2 LYS 79 -10.216 -15.206 -6.732 1416 HD3 LYS 79 HD3 LYS 79 -11.456 -15.656 -5.558 1417 HE2 LYS 79 HE2 LYS 79 -11.511 -17.160 -7.487 1418 HE3 LYS 79 HE3 LYS 79 -12.999 -16.213 -7.415 1419 HZ1 LYS 79 HZ1 LYS 79 -10.671 -15.627 -9.166 1420 HZ2 LYS 79 HZ2 LYS 79 -12.125 -14.765 -9.124 1421 HZ3 LYS 79 HZ3 LYS 79 -12.108 -16.368 -9.661 1422 H VAL 80 H VAL 80 -13.031 -11.457 -3.192 1423 HA VAL 80 HA VAL 80 -10.808 -10.133 -1.724 1424 HB VAL 80 HB VAL 80 -12.903 -8.687 -1.937 1425 HG11 VAL 80 HG11 VAL 80 -14.885 -9.202 -0.583 1426 HG12 VAL 80 HG12 VAL 80 -14.197 -10.771 -0.156 1427 HG13 VAL 80 HG13 VAL 80 -14.615 -10.418 -1.834 1428 HG21 VAL 80 HG21 VAL 80 -11.290 -8.283 -0.125 1429 HG22 VAL 80 HG22 VAL 80 -12.115 -9.455 0.905 1430 HG23 VAL 80 HG23 VAL 80 -12.934 -7.965 0.431 1431 H GLN 81 H GLN 81 -10.295 -11.058 0.313 1432 HA GLN 81 HA GLN 81 -11.791 -13.361 1.328 1433 HB2 GLN 81 HB2 GLN 81 -10.098 -14.325 -0.278 1434 HB3 GLN 81 HB3 GLN 81 -8.809 -13.565 0.651 1435 HG2 GLN 81 HG2 GLN 81 -9.443 -14.930 2.624 1436 HG3 GLN 81 HG3 GLN 81 -10.714 -15.704 1.682 1437 HE21 GLN 81 HE21 GLN 81 -7.294 -15.561 2.299 1438 HE22 GLN 81 HE22 GLN 81 -6.855 -16.935 1.354 1439 H ARG 82 H ARG 82 -12.075 -12.771 3.409 1440 HA ARG 82 HA ARG 82 -10.087 -11.120 4.771 1441 HB2 ARG 82 HB2 ARG 82 -11.734 -10.872 6.543 1442 HB3 ARG 82 HB3 ARG 82 -12.486 -10.562 4.993 1443 HG2 ARG 82 HG2 ARG 82 -14.165 -11.817 5.902 1444 HG3 ARG 82 HG3 ARG 82 -13.206 -13.148 5.261 1445 HD2 ARG 82 HD2 ARG 82 -12.114 -13.359 7.526 1446 HD3 ARG 82 HD3 ARG 82 -13.230 -12.127 8.125 1447 HE ARG 82 HE ARG 82 -14.829 -14.047 6.987 1448 HH11 ARG 82 HH11 ARG 82 -12.475 -14.015 9.599 1449 HH12 ARG 82 HH12 ARG 82 -13.240 -15.304 10.463 1450 HH21 ARG 82 HH21 ARG 82 -15.769 -15.789 8.092 1451 HH22 ARG 82 HH22 ARG 82 -15.107 -16.311 9.610 1452 H ASN 83 H ASN 83 -8.595 -11.919 6.092 1453 HA ASN 83 HA ASN 83 -8.871 -14.647 7.236 1454 HB2 ASN 83 HB2 ASN 83 -6.213 -13.451 6.300 1455 HB3 ASN 83 HB3 ASN 83 -6.514 -15.101 6.827 1456 HD21 ASN 83 HD21 ASN 83 -6.845 -12.821 4.198 1457 HD22 ASN 83 HD22 ASN 83 -7.235 -13.975 2.980 1458 H GLN 84 H GLN 84 -7.955 -14.838 9.337 1459 HA GLN 84 HA GLN 84 -6.790 -12.434 10.580 1460 HB2 GLN 84 HB2 GLN 84 -8.146 -13.054 12.712 1461 HB3 GLN 84 HB3 GLN 84 -8.977 -12.207 11.417 1462 HG2 GLN 84 HG2 GLN 84 -9.913 -14.392 10.644 1463 HG3 GLN 84 HG3 GLN 84 -9.166 -15.163 12.041 1464 HE21 GLN 84 HE21 GLN 84 -9.718 -13.332 14.055 1465 HE22 GLN 84 HE22 GLN 84 -11.423 -13.233 14.287 1466 H SER 85 H SER 85 -4.803 -13.121 10.768 1467 HA SER 85 HA SER 85 -4.099 -15.452 12.339 1468 HB2 SER 85 HB2 SER 85 -4.415 -16.353 9.994 1469 HB3 SER 85 HB3 SER 85 -3.195 -15.217 9.427 1470 HG SER 85 HG SER 85 -2.832 -17.644 10.415 1471 H ASP 86 H ASP 86 -1.516 -15.602 12.099 1472 HA ASP 86 HA ASP 86 -0.466 -13.267 13.321 1473 HB2 ASP 86 HB2 ASP 86 0.994 -15.691 12.161 1474 HB3 ASP 86 HB3 ASP 86 1.726 -14.482 13.208 1475 HA PRO 87 HA PRO 87 0.999 -10.998 9.666 1476 HB2 PRO 87 HB2 PRO 87 2.931 -9.421 10.749 1477 HB3 PRO 87 HB3 PRO 87 1.222 -9.202 11.187 1478 HG2 PRO 87 HG2 PRO 87 3.359 -10.700 12.683 1479 HG3 PRO 87 HG3 PRO 87 2.193 -9.502 13.295 1480 HD2 PRO 87 HD2 PRO 87 1.764 -12.171 13.551 1481 HD3 PRO 87 HD3 PRO 87 0.430 -11.021 13.319 1482 H THR 88 H THR 88 2.677 -13.479 11.085 1483 HA THR 88 HA THR 88 5.137 -13.496 9.675 1484 HB THR 88 HB THR 88 5.091 -15.951 10.144 1485 HG1 THR 88 HG1 THR 88 3.158 -16.529 11.540 1486 HG21 THR 88 HG21 THR 88 4.227 -14.259 12.529 1487 HG22 THR 88 HG22 THR 88 5.880 -14.411 11.927 1488 HG23 THR 88 HG23 THR 88 5.057 -15.814 12.609 1489 H MET 89 H MET 89 1.839 -14.190 8.765 1490 HA MET 89 HA MET 89 2.129 -15.568 6.356 1491 HB2 MET 89 HB2 MET 89 -0.053 -15.108 7.419 1492 HB3 MET 89 HB3 MET 89 0.128 -13.388 7.100 1493 HG2 MET 89 HG2 MET 89 -1.432 -14.423 5.529 1494 HG3 MET 89 HG3 MET 89 -0.012 -13.812 4.679 1495 HE1 MET 89 HE1 MET 89 -2.144 -15.945 3.413 1496 HE2 MET 89 HE2 MET 89 -1.014 -17.020 2.592 1497 HE3 MET 89 HE3 MET 89 -0.767 -15.275 2.535 1498 H PHE 90 H PHE 90 2.386 -12.119 7.076 1499 HA PHE 90 HA PHE 90 2.692 -10.964 4.553 1500 HB2 PHE 90 HB2 PHE 90 2.397 -9.813 6.804 1501 HB3 PHE 90 HB3 PHE 90 4.082 -10.133 7.147 1502 HD1 PHE 90 HD1 PHE 90 5.765 -9.147 5.214 1503 HD2 PHE 90 HD2 PHE 90 1.847 -7.677 6.091 1504 HE1 PHE 90 HE1 PHE 90 6.384 -6.938 4.318 1505 HE2 PHE 90 HE2 PHE 90 2.467 -5.481 5.180 1506 HZ PHE 90 HZ PHE 90 4.734 -5.107 4.297 1507 H ASN 91 H ASN 91 5.173 -12.266 6.759 1508 HA ASN 91 HA ASN 91 7.444 -11.865 5.074 1509 HB2 ASN 91 HB2 ASN 91 7.663 -12.088 7.512 1510 HB3 ASN 91 HB3 ASN 91 6.992 -13.710 7.465 1511 HD21 ASN 91 HD21 ASN 91 9.832 -11.783 6.953 1512 HD22 ASN 91 HD22 ASN 91 10.924 -13.100 6.713 1513 H LYS 92 H LYS 92 5.176 -14.509 5.559 1514 HA LYS 92 HA LYS 92 6.599 -16.699 4.557 1515 HB2 LYS 92 HB2 LYS 92 4.442 -16.699 5.935 1516 HB3 LYS 92 HB3 LYS 92 3.577 -16.295 4.462 1517 HG2 LYS 92 HG2 LYS 92 3.332 -18.649 4.824 1518 HG3 LYS 92 HG3 LYS 92 4.416 -18.435 3.447 1519 HD2 LYS 92 HD2 LYS 92 5.245 -20.213 4.919 1520 HD3 LYS 92 HD3 LYS 92 6.370 -18.853 4.925 1521 HE2 LYS 92 HE2 LYS 92 5.451 -18.091 7.084 1522 HE3 LYS 92 HE3 LYS 92 4.281 -19.414 7.065 1523 HZ1 LYS 92 HZ1 LYS 92 6.207 -19.893 8.467 1524 HZ2 LYS 92 HZ2 LYS 92 7.230 -19.748 7.130 1525 HZ3 LYS 92 HZ3 LYS 92 6.084 -20.987 7.185 1526 H ILE 93 H ILE 93 4.283 -14.545 2.973 1527 HA ILE 93 HA ILE 93 4.472 -15.812 0.372 1528 HB ILE 93 HB ILE 93 2.901 -13.980 -0.318 1529 HG12 ILE 93 HG12 ILE 93 3.640 -12.945 2.428 1530 HG13 ILE 93 HG13 ILE 93 3.377 -12.056 0.938 1531 HG21 ILE 93 HG21 ILE 93 2.046 -16.111 0.582 1532 HG22 ILE 93 HG22 ILE 93 0.988 -14.769 1.017 1533 HG23 ILE 93 HG23 ILE 93 2.089 -15.448 2.219 1534 HD11 ILE 93 HD11 ILE 93 1.249 -13.210 2.723 1535 HD12 ILE 93 HD12 ILE 93 0.972 -12.332 1.220 1536 HD13 ILE 93 HD13 ILE 93 1.721 -11.516 2.589 1537 H ALA 94 H ALA 94 5.883 -13.035 2.000 1538 HA ALA 94 HA ALA 94 6.856 -11.648 -0.283 1539 HB1 ALA 94 HB1 ALA 94 7.874 -11.609 2.575 1540 HB2 ALA 94 HB2 ALA 94 6.592 -10.592 1.913 1541 HB3 ALA 94 HB3 ALA 94 8.244 -10.418 1.319 1542 H VAL 95 H VAL 95 8.165 -14.254 1.702 1543 HA VAL 95 HA VAL 95 10.750 -14.237 0.350 1544 HB VAL 95 HB VAL 95 10.506 -14.726 2.828 1545 HG11 VAL 95 HG11 VAL 95 9.870 -16.987 3.570 1546 HG12 VAL 95 HG12 VAL 95 9.401 -17.399 1.919 1547 HG13 VAL 95 HG13 VAL 95 8.524 -16.146 2.796 1548 HG21 VAL 95 HG21 VAL 95 12.581 -15.284 1.646 1549 HG22 VAL 95 HG22 VAL 95 11.932 -16.860 1.193 1550 HG23 VAL 95 HG23 VAL 95 12.247 -16.490 2.890 1551 H PHE 96 H PHE 96 7.666 -15.640 -0.217 1552 HA PHE 96 HA PHE 96 8.686 -18.018 -1.606 1553 HB2 PHE 96 HB2 PHE 96 6.698 -18.297 -0.170 1554 HB3 PHE 96 HB3 PHE 96 5.824 -17.078 -1.094 1555 HD1 PHE 96 HD1 PHE 96 7.436 -20.448 -1.382 1556 HD2 PHE 96 HD2 PHE 96 4.589 -17.725 -3.051 1557 HE1 PHE 96 HE1 PHE 96 6.669 -22.190 -2.936 1558 HE2 PHE 96 HE2 PHE 96 3.821 -19.477 -4.598 1559 HZ PHE 96 HZ PHE 96 4.863 -21.711 -4.543 1560 H PHE 97 H PHE 97 6.704 -15.126 -2.329 1561 HA PHE 97 HA PHE 97 6.643 -15.719 -5.180 1562 HB2 PHE 97 HB2 PHE 97 5.415 -13.433 -3.576 1563 HB3 PHE 97 HB3 PHE 97 5.239 -13.622 -5.313 1564 HD1 PHE 97 HD2 PHE 97 3.953 -15.589 -6.237 1565 HD2 PHE 97 HD1 PHE 97 4.023 -14.701 -2.056 1566 HE1 PHE 97 HE2 PHE 97 1.940 -16.967 -5.903 1567 HE2 PHE 97 HE1 PHE 97 2.015 -16.078 -1.729 1568 HZ PHE 97 HZ PHE 97 0.968 -17.210 -3.651 1569 H GLN 98 H GLN 98 9.054 -15.582 -5.116 1570 HA GLN 98 HA GLN 98 9.853 -12.914 -6.081 1571 HB2 GLN 98 HB2 GLN 98 12.196 -13.395 -5.229 1572 HB3 GLN 98 HB3 GLN 98 10.997 -13.063 -3.992 1573 HG2 GLN 98 HG2 GLN 98 10.889 -15.384 -3.352 1574 HG3 GLN 98 HG3 GLN 98 11.883 -15.870 -4.726 1575 HE21 GLN 98 HE21 GLN 98 12.373 -16.348 -1.869 1576 HE22 GLN 98 HE22 GLN 98 13.900 -15.620 -1.520 Start of MODEL 19 1 H1 GLY 1 H1 GLY 1 4.412 -8.629 -9.442 2 H2 GLY 1 H2 GLY 1 4.335 -7.652 -10.815 3 H3 GLY 1 H3 GLY 1 5.607 -7.465 -9.720 4 HA2 GLY 1 HA3 GLY 1 6.345 -9.734 -10.205 5 HA3 GLY 1 HA2 GLY 1 5.095 -9.814 -11.436 6 H SER 2 H SER 2 5.371 -7.114 -12.374 7 HA SER 2 HA SER 2 6.984 -7.709 -14.567 8 HB2 SER 2 HB2 SER 2 5.061 -6.148 -14.642 9 HB3 SER 2 HB3 SER 2 5.964 -4.976 -13.679 10 HG SER 2 HG SER 2 7.194 -4.505 -15.374 11 H MET 3 H MET 3 7.637 -5.373 -11.916 12 HA MET 3 HA MET 3 10.388 -5.003 -12.945 13 HB2 MET 3 HB2 MET 3 10.475 -2.971 -11.573 14 HB3 MET 3 HB3 MET 3 9.085 -2.947 -12.643 15 HG2 MET 3 HG2 MET 3 7.633 -3.593 -10.741 16 HG3 MET 3 HG3 MET 3 9.038 -3.545 -9.676 17 HE1 MET 3 HE1 MET 3 7.532 0.257 -11.865 18 HE2 MET 3 HE2 MET 3 6.880 -1.344 -12.211 19 HE3 MET 3 HE3 MET 3 8.544 -0.951 -12.653 20 H GLN 4 H GLN 4 8.834 -6.910 -10.688 21 HA GLN 4 HA GLN 4 10.472 -6.792 -8.391 22 HB2 GLN 4 HB2 GLN 4 8.949 -9.158 -9.538 23 HB3 GLN 4 HB3 GLN 4 9.705 -9.148 -7.947 24 HG2 GLN 4 HG2 GLN 4 8.198 -7.240 -7.320 25 HG3 GLN 4 HG3 GLN 4 7.379 -7.436 -8.871 26 HE21 GLN 4 HE21 GLN 4 8.588 -10.112 -6.863 27 HE22 GLN 4 HE22 GLN 4 7.033 -10.750 -6.476 28 H ASN 5 H ASN 5 11.047 -8.102 -11.506 29 HA ASN 5 HA ASN 5 13.103 -9.992 -10.975 30 HB2 ASN 5 HB2 ASN 5 12.616 -8.355 -13.506 31 HB3 ASN 5 HB3 ASN 5 13.566 -9.836 -13.398 32 HD21 ASN 5 HD21 ASN 5 10.356 -8.495 -13.521 33 HD22 ASN 5 HD22 ASN 5 9.511 -9.994 -13.680 34 H THR 6 H THR 6 15.388 -9.648 -11.914 35 HA THR 6 HA THR 6 16.696 -7.467 -10.592 36 HB THR 6 HB THR 6 17.863 -9.397 -12.653 37 HG1 THR 6 HG1 THR 6 16.836 -10.018 -10.366 38 HG21 THR 6 HG21 THR 6 20.039 -8.922 -11.518 39 HG22 THR 6 HG22 THR 6 19.243 -7.709 -10.513 40 HG23 THR 6 HG23 THR 6 19.362 -7.468 -12.258 41 H THR 7 H THR 7 15.692 -5.665 -11.464 42 HA THR 7 HA THR 7 16.576 -4.695 -14.087 43 HB THR 7 HB THR 7 14.194 -3.831 -14.553 44 HG1 THR 7 HG1 THR 7 13.723 -5.315 -12.251 45 HG21 THR 7 HG21 THR 7 13.350 -5.926 -15.546 46 HG22 THR 7 HG22 THR 7 14.515 -6.855 -14.597 47 HG23 THR 7 HG23 THR 7 15.082 -5.742 -15.846 48 H HIS 8 H HIS 8 16.555 -2.448 -14.240 49 HA HIS 8 HA HIS 8 15.900 -0.890 -11.803 50 HB2 HIS 8 HB2 HIS 8 18.164 -0.287 -13.762 51 HB3 HIS 8 HB3 HIS 8 17.784 0.609 -12.291 52 HD1 HIS 8 HD1 HIS 8 17.478 -1.805 -10.336 53 HD2 HIS 8 HD2 HIS 8 20.587 -1.357 -13.069 54 HE1 HIS 8 HE1 HIS 8 19.369 -3.204 -9.459 55 HE2 HIS 8 HE2 HIS 8 21.215 -2.941 -11.133 56 H ASP 9 H ASP 9 14.303 -1.628 -14.137 57 HA ASP 9 HA ASP 9 13.665 0.697 -15.656 58 HB2 ASP 9 HB2 ASP 9 12.866 -1.577 -16.260 59 HB3 ASP 9 HB3 ASP 9 11.922 -1.654 -14.776 60 H ASN 10 H ASN 10 13.241 -0.193 -12.403 61 HA ASN 10 HA ASN 10 11.056 1.713 -11.859 62 HB2 ASN 10 HB2 ASN 10 10.611 0.348 -9.875 63 HB3 ASN 10 HB3 ASN 10 10.606 -0.657 -11.317 64 HD21 ASN 10 HD21 ASN 10 11.067 -1.293 -8.450 65 HD22 ASN 10 HD22 ASN 10 12.574 -2.135 -8.411 66 H VAL 11 H VAL 11 11.099 2.696 -9.772 67 HA VAL 11 HA VAL 11 13.681 3.142 -8.470 68 HB VAL 11 HB VAL 11 12.732 5.372 -7.663 69 HG11 VAL 11 HG11 VAL 11 13.181 5.108 -10.659 70 HG12 VAL 11 HG12 VAL 11 14.435 5.274 -9.426 71 HG13 VAL 11 HG13 VAL 11 13.311 6.602 -9.724 72 HG21 VAL 11 HG21 VAL 11 10.332 4.971 -8.135 73 HG22 VAL 11 HG22 VAL 11 10.666 4.937 -9.867 74 HG23 VAL 11 HG23 VAL 11 10.900 6.430 -8.954 75 H ILE 12 H ILE 12 13.714 2.974 -6.374 76 HA ILE 12 HA ILE 12 11.592 1.574 -4.937 77 HB ILE 12 HB ILE 12 14.458 2.135 -4.009 78 HG12 ILE 12 HG12 ILE 12 14.674 0.966 -6.143 79 HG13 ILE 12 HG13 ILE 12 15.104 -0.128 -4.837 80 HG21 ILE 12 HG21 ILE 12 12.938 1.402 -2.238 81 HG22 ILE 12 HG22 ILE 12 14.159 0.173 -2.562 82 HG23 ILE 12 HG23 ILE 12 12.514 -0.038 -3.169 83 HD11 ILE 12 HD11 ILE 12 13.835 -1.268 -6.523 84 HD12 ILE 12 HD12 ILE 12 12.518 -0.107 -6.378 85 HD13 ILE 12 HD13 ILE 12 12.897 -1.190 -5.034 86 H LEU 13 H LEU 13 10.203 3.326 -4.486 87 HA LEU 13 HA LEU 13 11.307 5.698 -3.124 88 HB2 LEU 13 HB2 LEU 13 8.537 5.178 -4.267 89 HB3 LEU 13 HB3 LEU 13 9.056 6.685 -3.513 90 HG LEU 13 HG LEU 13 10.186 5.487 -6.076 91 HD11 LEU 13 HD11 LEU 13 9.200 7.412 -7.187 92 HD12 LEU 13 HD12 LEU 13 8.500 7.962 -5.662 93 HD13 LEU 13 HD13 LEU 13 7.971 6.439 -6.384 94 HD21 LEU 13 HD21 LEU 13 10.959 8.066 -4.666 95 HD22 LEU 13 HD22 LEU 13 11.507 7.561 -6.267 96 HD23 LEU 13 HD23 LEU 13 11.964 6.624 -4.849 97 H GLU 14 H GLU 14 11.700 5.021 -1.103 98 HA GLU 14 HA GLU 14 9.555 3.766 0.478 99 HB2 GLU 14 HB2 GLU 14 11.550 3.836 2.285 100 HB3 GLU 14 HB3 GLU 14 11.414 2.566 1.080 101 HG2 GLU 14 HG2 GLU 14 13.041 3.815 -0.355 102 HG3 GLU 14 HG3 GLU 14 13.234 4.978 0.948 103 H LEU 15 H LEU 15 8.100 5.253 0.941 104 HA LEU 15 HA LEU 15 8.742 7.970 1.767 105 HB2 LEU 15 HB2 LEU 15 6.135 6.484 1.272 106 HB3 LEU 15 HB3 LEU 15 6.137 8.047 2.061 107 HG LEU 15 HG LEU 15 5.569 8.286 -0.272 108 HD11 LEU 15 HD11 LEU 15 8.282 9.472 0.267 109 HD12 LEU 15 HD12 LEU 15 6.724 10.134 0.769 110 HD13 LEU 15 HD13 LEU 15 7.119 10.024 -0.943 111 HD21 LEU 15 HD21 LEU 15 6.677 6.339 -1.240 112 HD22 LEU 15 HD22 LEU 15 8.255 7.088 -0.990 113 HD23 LEU 15 HD23 LEU 15 7.104 7.803 -2.124 114 H THR 16 H THR 16 9.442 8.140 3.814 115 HA THR 16 HA THR 16 8.437 6.472 5.981 116 HB THR 16 HB THR 16 10.456 8.760 5.978 117 HG1 THR 16 HG1 THR 16 11.413 7.010 5.071 118 HG21 THR 16 HG21 THR 16 10.984 8.107 8.305 119 HG22 THR 16 HG22 THR 16 9.694 6.902 8.272 120 HG23 THR 16 HG23 THR 16 9.295 8.620 8.173 121 H VAL 17 H VAL 17 6.346 6.993 6.240 122 HA VAL 17 HA VAL 17 5.584 9.765 6.891 123 HB VAL 17 HB VAL 17 3.322 9.223 6.304 124 HG11 VAL 17 HG11 VAL 17 5.156 8.153 4.126 125 HG12 VAL 17 HG12 VAL 17 4.753 9.848 4.409 126 HG13 VAL 17 HG13 VAL 17 3.499 8.723 3.885 127 HG21 VAL 17 HG21 VAL 17 2.618 6.985 5.436 128 HG22 VAL 17 HG22 VAL 17 3.118 6.942 7.127 129 HG23 VAL 17 HG23 VAL 17 4.209 6.350 5.874 130 H ARG 18 H ARG 18 4.775 10.197 8.851 131 HA ARG 18 HA ARG 18 4.486 8.210 10.946 132 HB2 ARG 18 HB2 ARG 18 3.382 10.259 12.171 133 HB3 ARG 18 HB3 ARG 18 5.105 10.312 11.804 134 HG2 ARG 18 HG2 ARG 18 4.702 11.763 9.879 135 HG3 ARG 18 HG3 ARG 18 2.959 11.637 10.105 136 HD2 ARG 18 HD2 ARG 18 4.760 12.790 12.250 137 HD3 ARG 18 HD3 ARG 18 4.129 13.782 10.934 138 HE ARG 18 HE ARG 18 2.646 12.673 13.185 139 HH11 ARG 18 HH11 ARG 18 2.427 14.268 10.052 140 HH12 ARG 18 HH12 ARG 18 0.809 14.833 10.314 141 HH21 ARG 18 HH21 ARG 18 0.507 13.420 13.502 142 HH22 ARG 18 HH22 ARG 18 -0.273 14.355 12.264 143 H ASN 19 H ASN 19 2.572 7.147 11.514 144 HA ASN 19 HA ASN 19 0.694 6.952 9.340 145 HB2 ASN 19 HB2 ASN 19 1.583 4.945 10.581 146 HB3 ASN 19 HB3 ASN 19 0.596 5.411 11.962 147 HD21 ASN 19 HD21 ASN 19 -0.455 3.304 11.721 148 HD22 ASN 19 HD22 ASN 19 -1.656 3.062 10.509 149 H HIS 20 H HIS 20 -0.130 9.023 9.451 150 HA HIS 20 HA HIS 20 -2.193 9.733 11.399 151 HB2 HIS 20 HB2 HIS 20 -0.789 11.586 10.735 152 HB3 HIS 20 HB3 HIS 20 -0.847 11.140 9.039 153 HD1 HIS 20 HD1 HIS 20 -2.777 12.983 11.679 154 HD2 HIS 20 HD2 HIS 20 -3.081 12.122 7.626 155 HE1 HIS 20 HE1 HIS 20 -4.560 14.499 10.796 156 HE2 HIS 20 HE2 HIS 20 -4.736 13.953 8.352 157 HA PRO 21 HA PRO 21 -5.606 7.900 9.073 158 HB2 PRO 21 HB2 PRO 21 -6.899 10.619 9.410 159 HB3 PRO 21 HB3 PRO 21 -7.583 8.999 9.685 160 HG2 PRO 21 HG2 PRO 21 -6.808 10.438 11.759 161 HG3 PRO 21 HG3 PRO 21 -6.432 8.698 11.706 162 HD2 PRO 21 HD2 PRO 21 -4.603 11.038 11.227 163 HD3 PRO 21 HD3 PRO 21 -4.263 9.477 12.007 164 H GLY 22 H GLY 22 -4.743 7.630 7.041 165 HA2 GLY 22 HA2 GLY 22 -5.499 7.821 4.791 166 HA3 GLY 22 HA3 GLY 22 -5.712 9.544 5.011 167 H VAL 23 H VAL 23 -2.695 8.344 6.261 168 HA VAL 23 HA VAL 23 -1.167 9.822 4.354 169 HB VAL 23 HB VAL 23 0.867 8.772 5.349 170 HG11 VAL 23 HG11 VAL 23 -1.144 9.711 7.405 171 HG12 VAL 23 HG12 VAL 23 -0.162 10.742 6.372 172 HG13 VAL 23 HG13 VAL 23 0.613 9.724 7.584 173 HG21 VAL 23 HG21 VAL 23 -1.046 7.165 7.092 174 HG22 VAL 23 HG22 VAL 23 0.716 7.239 7.263 175 HG23 VAL 23 HG23 VAL 23 -0.005 6.504 5.827 176 H MET 24 H MET 24 -1.952 6.397 4.606 177 HA MET 24 HA MET 24 -0.462 5.494 2.374 178 HB2 MET 24 HB2 MET 24 -1.877 3.463 2.493 179 HB3 MET 24 HB3 MET 24 -1.228 3.916 4.061 180 HG2 MET 24 HG2 MET 24 -4.066 4.461 3.149 181 HG3 MET 24 HG3 MET 24 -3.567 3.111 4.170 182 HE1 MET 24 HE1 MET 24 -5.266 3.682 6.115 183 HE2 MET 24 HE2 MET 24 -5.924 4.940 5.063 184 HE3 MET 24 HE3 MET 24 -5.510 5.315 6.737 185 H THR 25 H THR 25 -3.638 6.984 2.708 186 HA THR 25 HA THR 25 -4.527 6.539 0.022 187 HB THR 25 HB THR 25 -5.480 8.764 1.880 188 HG1 THR 25 HG1 THR 25 -7.059 6.732 2.229 189 HG21 THR 25 HG21 THR 25 -6.436 8.796 -0.416 190 HG22 THR 25 HG22 THR 25 -7.665 8.383 0.782 191 HG23 THR 25 HG23 THR 25 -6.954 7.117 -0.221 192 H HIS 26 H HIS 26 -2.565 8.969 1.636 193 HA HIS 26 HA HIS 26 -2.606 10.967 -0.412 194 HB2 HIS 26 HB2 HIS 26 -0.710 10.517 1.936 195 HB3 HIS 26 HB3 HIS 26 -0.529 11.865 0.819 196 HD1 HIS 26 HD1 HIS 26 -0.853 13.147 3.255 197 HD2 HIS 26 HD2 HIS 26 -4.217 11.404 1.575 198 HE1 HIS 26 HE1 HIS 26 -2.808 14.223 4.386 199 HE2 HIS 26 HE2 HIS 26 -4.818 13.038 3.459 200 H VAL 27 H VAL 27 -0.285 8.343 0.420 201 HA VAL 27 HA VAL 27 1.585 8.983 -1.625 202 HB VAL 27 HB VAL 27 2.665 6.823 -1.206 203 HG11 VAL 27 HG11 VAL 27 1.772 8.124 1.394 204 HG12 VAL 27 HG12 VAL 27 3.121 8.638 0.379 205 HG13 VAL 27 HG13 VAL 27 3.183 7.077 1.198 206 HG21 VAL 27 HG21 VAL 27 0.297 6.100 0.559 207 HG22 VAL 27 HG22 VAL 27 1.784 5.160 0.398 208 HG23 VAL 27 HG23 VAL 27 0.706 5.350 -0.987 209 H CYS 28 H CYS 28 -1.094 6.658 -1.494 210 HA CYS 28 HA CYS 28 -0.773 5.574 -4.090 211 HB2 CYS 28 HB2 CYS 28 -3.179 5.712 -2.235 212 HB3 CYS 28 HB3 CYS 28 -3.126 4.753 -3.713 213 HG CYS 28 HG CYS 28 -2.126 3.940 -0.723 214 H GLY 29 H GLY 29 -2.424 8.423 -2.858 215 HA2 GLY 29 HA2 GLY 29 -4.134 8.938 -5.074 216 HA3 GLY 29 HA3 GLY 29 -3.714 10.056 -3.789 217 H LEU 30 H LEU 30 -0.956 10.240 -4.119 218 HA LEU 30 HA LEU 30 -0.712 12.126 -6.222 219 HB2 LEU 30 HB2 LEU 30 1.132 10.959 -4.173 220 HB3 LEU 30 HB3 LEU 30 1.917 11.606 -5.596 221 HG LEU 30 HG LEU 30 1.894 13.283 -3.836 222 HD11 LEU 30 HD11 LEU 30 0.908 15.180 -5.019 223 HD12 LEU 30 HD12 LEU 30 -0.024 14.088 -6.046 224 HD13 LEU 30 HD13 LEU 30 1.739 14.102 -6.138 225 HD21 LEU 30 HD21 LEU 30 -0.053 12.558 -2.546 226 HD22 LEU 30 HD22 LEU 30 -1.139 13.097 -3.831 227 HD23 LEU 30 HD23 LEU 30 -0.168 14.273 -2.939 228 H PHE 31 H PHE 31 0.346 8.749 -5.894 229 HA PHE 31 HA PHE 31 1.725 8.695 -8.420 230 HB2 PHE 31 HB2 PHE 31 0.894 6.534 -6.457 231 HB3 PHE 31 HB3 PHE 31 1.709 6.154 -7.975 232 HD1 PHE 31 HD1 PHE 31 2.213 8.787 -5.294 233 HD2 PHE 31 HD2 PHE 31 3.989 5.674 -7.637 234 HE1 PHE 31 HE1 PHE 31 4.384 9.247 -4.248 235 HE2 PHE 31 HE2 PHE 31 6.154 6.146 -6.574 236 HZ PHE 31 HZ PHE 31 6.359 7.926 -4.889 237 H ALA 32 H ALA 32 -1.577 8.062 -7.462 238 HA ALA 32 HA ALA 32 -2.476 6.706 -9.803 239 HB1 ALA 32 HB1 ALA 32 -3.717 6.658 -7.671 240 HB2 ALA 32 HB2 ALA 32 -4.744 7.237 -8.985 241 HB3 ALA 32 HB3 ALA 32 -4.061 8.382 -7.822 242 H ARG 33 H ARG 33 -2.155 10.136 -8.961 243 HA ARG 33 HA ARG 33 -3.789 11.061 -11.174 244 HB2 ARG 33 HB2 ARG 33 -3.508 13.266 -10.304 245 HB3 ARG 33 HB3 ARG 33 -3.669 12.206 -8.907 246 HG2 ARG 33 HG2 ARG 33 -1.160 12.218 -8.697 247 HG3 ARG 33 HG3 ARG 33 -1.103 13.424 -9.982 248 HD2 ARG 33 HD2 ARG 33 -2.477 13.735 -7.300 249 HD3 ARG 33 HD3 ARG 33 -0.941 14.466 -7.772 250 HE ARG 33 HE ARG 33 -2.600 15.403 -9.669 251 HH11 ARG 33 HH11 ARG 33 -2.906 15.361 -6.167 252 HH12 ARG 33 HH12 ARG 33 -3.860 16.802 -6.114 253 HH21 ARG 33 HH21 ARG 33 -3.872 17.294 -9.581 254 HH22 ARG 33 HH22 ARG 33 -4.405 17.898 -8.047 255 H ARG 34 H ARG 34 -0.631 10.018 -10.988 256 HA ARG 34 HA ARG 34 0.695 11.845 -12.726 257 HB2 ARG 34 HB2 ARG 34 2.028 10.397 -11.287 258 HB3 ARG 34 HB3 ARG 34 1.254 8.953 -11.937 259 HG2 ARG 34 HG2 ARG 34 2.302 9.522 -14.184 260 HG3 ARG 34 HG3 ARG 34 3.220 10.780 -13.356 261 HD2 ARG 34 HD2 ARG 34 4.490 9.212 -12.139 262 HD3 ARG 34 HD3 ARG 34 3.322 7.909 -12.415 263 HE ARG 34 HE ARG 34 4.524 8.925 -14.824 264 HH11 ARG 34 HH11 ARG 34 4.929 6.589 -12.218 265 HH12 ARG 34 HH12 ARG 34 5.977 5.570 -13.150 266 HH21 ARG 34 HH21 ARG 34 5.884 7.606 -16.003 267 HH22 ARG 34 HH22 ARG 34 6.514 6.153 -15.301 268 H ALA 35 H ALA 35 -0.068 8.435 -13.416 269 HA ALA 35 HA ALA 35 -1.604 8.572 -15.698 270 HB1 ALA 35 HB1 ALA 35 0.023 8.329 -17.564 271 HB2 ALA 35 HB2 ALA 35 1.360 8.599 -16.437 272 HB3 ALA 35 HB3 ALA 35 0.204 9.889 -16.761 273 H PHE 36 H PHE 36 1.393 7.131 -14.510 274 HA PHE 36 HA PHE 36 0.522 4.411 -15.246 275 HB2 PHE 36 HB2 PHE 36 2.743 5.170 -16.108 276 HB3 PHE 36 HB3 PHE 36 3.287 5.444 -14.458 277 HD1 PHE 36 HD1 PHE 36 2.011 2.739 -16.727 278 HD2 PHE 36 HD2 PHE 36 4.371 3.670 -13.279 279 HE1 PHE 36 HE1 PHE 36 2.776 0.405 -16.611 280 HE2 PHE 36 HE2 PHE 36 5.128 1.331 -13.174 281 HZ PHE 36 HZ PHE 36 4.334 -0.301 -14.836 282 H ASN 37 H ASN 37 0.270 2.858 -13.701 283 HA ASN 37 HA ASN 37 -0.257 3.740 -10.988 284 HB2 ASN 37 HB2 ASN 37 -0.553 0.939 -12.158 285 HB3 ASN 37 HB3 ASN 37 -1.287 1.544 -10.675 286 HD21 ASN 37 HD21 ASN 37 -2.656 0.342 -12.845 287 HD22 ASN 37 HD22 ASN 37 -3.735 1.520 -13.494 288 H VAL 38 H VAL 38 0.428 2.338 -9.140 289 HA VAL 38 HA VAL 38 3.269 1.801 -9.173 290 HB VAL 38 HB VAL 38 1.273 1.234 -6.927 291 HG11 VAL 38 HG11 VAL 38 3.414 0.048 -6.649 292 HG12 VAL 38 HG12 VAL 38 3.258 1.328 -5.446 293 HG13 VAL 38 HG13 VAL 38 4.300 1.563 -6.852 294 HG21 VAL 38 HG21 VAL 38 2.943 3.735 -7.379 295 HG22 VAL 38 HG22 VAL 38 1.945 3.406 -5.960 296 HG23 VAL 38 HG23 VAL 38 1.187 3.620 -7.539 297 H GLU 39 H GLU 39 4.210 -0.139 -9.427 298 HA GLU 39 HA GLU 39 2.729 -2.413 -10.349 299 HB2 GLU 39 HB2 GLU 39 5.278 -1.499 -10.768 300 HB3 GLU 39 HB3 GLU 39 5.620 -2.716 -9.556 301 HG2 GLU 39 HG2 GLU 39 4.079 -3.345 -12.082 302 HG3 GLU 39 HG3 GLU 39 5.835 -3.342 -12.042 303 H GLY 40 H GLY 40 4.798 -1.761 -7.486 304 HA2 GLY 40 HA2 GLY 40 3.283 -3.823 -5.933 305 HA3 GLY 40 HA3 GLY 40 5.042 -3.879 -5.997 306 H ILE 41 H ILE 41 3.272 -3.513 -3.666 307 HA ILE 41 HA ILE 41 4.386 -0.944 -2.640 308 HB ILE 41 HB ILE 41 1.565 -1.968 -2.046 309 HG12 ILE 41 HG12 ILE 41 2.387 0.491 -3.654 310 HG13 ILE 41 HG13 ILE 41 1.738 -0.996 -4.333 311 HG21 ILE 41 HG21 ILE 41 1.223 0.122 -0.782 312 HG22 ILE 41 HG22 ILE 41 2.902 0.577 -1.078 313 HG23 ILE 41 HG23 ILE 41 2.533 -0.840 -0.093 314 HD11 ILE 41 HD11 ILE 41 0.278 0.905 -2.503 315 HD12 ILE 41 HD12 ILE 41 -0.373 -0.603 -3.151 316 HD13 ILE 41 HD13 ILE 41 0.048 0.717 -4.241 317 H LEU 42 H LEU 42 5.179 -1.074 -0.535 318 HA LEU 42 HA LEU 42 4.391 -3.267 1.207 319 HB2 LEU 42 HB2 LEU 42 6.264 -4.281 0.033 320 HB3 LEU 42 HB3 LEU 42 7.278 -2.880 0.344 321 HG LEU 42 HG LEU 42 7.396 -3.409 2.731 322 HD11 LEU 42 HD11 LEU 42 5.525 -5.731 2.202 323 HD12 LEU 42 HD12 LEU 42 5.158 -4.270 3.121 324 HD13 LEU 42 HD13 LEU 42 6.367 -5.402 3.720 325 HD21 LEU 42 HD21 LEU 42 7.940 -5.856 1.027 326 HD22 LEU 42 HD22 LEU 42 8.611 -5.547 2.630 327 HD23 LEU 42 HD23 LEU 42 9.026 -4.487 1.287 328 H CYS 43 H CYS 43 3.545 -1.879 2.644 329 HA CYS 43 HA CYS 43 5.043 0.328 3.815 330 HB2 CYS 43 HB2 CYS 43 2.632 0.604 3.502 331 HB3 CYS 43 HB3 CYS 43 2.304 -0.858 4.422 332 HG CYS 43 HG CYS 43 2.822 0.155 6.864 333 H LEU 44 H LEU 44 6.746 -0.513 4.916 334 HA LEU 44 HA LEU 44 6.386 -2.644 6.893 335 HB2 LEU 44 HB2 LEU 44 8.411 -2.584 5.380 336 HB3 LEU 44 HB3 LEU 44 8.906 -1.102 6.179 337 HG LEU 44 HG LEU 44 8.981 -2.425 8.375 338 HD11 LEU 44 HD11 LEU 44 7.541 -4.295 7.728 339 HD12 LEU 44 HD12 LEU 44 9.123 -4.867 8.256 340 HD13 LEU 44 HD13 LEU 44 8.734 -4.821 6.533 341 HD21 LEU 44 HD21 LEU 44 10.874 -3.270 6.161 342 HD22 LEU 44 HD22 LEU 44 11.161 -3.477 7.888 343 HD23 LEU 44 HD23 LEU 44 11.034 -1.859 7.208 344 HA PRO 45 HA PRO 45 5.737 0.955 9.651 345 HB2 PRO 45 HB2 PRO 45 4.127 -0.251 11.476 346 HB3 PRO 45 HB3 PRO 45 3.537 0.208 9.865 347 HG2 PRO 45 HG2 PRO 45 4.337 -2.497 10.870 348 HG3 PRO 45 HG3 PRO 45 2.996 -2.045 9.797 349 HD2 PRO 45 HD2 PRO 45 5.440 -3.067 8.931 350 HD3 PRO 45 HD3 PRO 45 4.308 -2.144 7.920 351 H ILE 46 H ILE 46 7.028 1.605 11.238 352 HA ILE 46 HA ILE 46 8.735 -0.295 12.673 353 HB ILE 46 HB ILE 46 8.790 2.766 12.661 354 HG12 ILE 46 HG12 ILE 46 11.052 2.339 11.397 355 HG13 ILE 46 HG13 ILE 46 10.423 0.727 11.084 356 HG21 ILE 46 HG21 ILE 46 9.690 1.875 14.765 357 HG22 ILE 46 HG22 ILE 46 10.981 2.574 13.789 358 HG23 ILE 46 HG23 ILE 46 10.790 0.822 13.870 359 HD11 ILE 46 HD11 ILE 46 10.096 2.235 9.213 360 HD12 ILE 46 HD12 ILE 46 9.141 3.314 10.230 361 HD13 ILE 46 HD13 ILE 46 8.555 1.688 9.870 362 H GLN 47 H GLN 47 8.196 -0.936 14.705 363 HA GLN 47 HA GLN 47 5.935 0.263 16.116 364 HB2 GLN 47 HB2 GLN 47 6.202 -1.605 17.714 365 HB3 GLN 47 HB3 GLN 47 6.092 -2.168 16.059 366 HG2 GLN 47 HG2 GLN 47 8.535 -2.507 15.994 367 HG3 GLN 47 HG3 GLN 47 8.651 -1.939 17.662 368 HE21 GLN 47 HE21 GLN 47 9.520 -3.902 18.385 369 HE22 GLN 47 HE22 GLN 47 8.586 -5.348 18.506 370 H ASP 48 H ASP 48 9.308 0.641 16.078 371 HA ASP 48 HA ASP 48 9.826 1.193 18.805 372 HB2 ASP 48 HB2 ASP 48 11.620 0.554 17.245 373 HB3 ASP 48 HB3 ASP 48 11.355 2.008 16.292 374 H SER 49 H SER 49 8.890 3.209 16.061 375 HA SER 49 HA SER 49 7.989 5.344 17.859 376 HB2 SER 49 HB2 SER 49 9.762 5.930 15.435 377 HB3 SER 49 HB3 SER 49 9.055 7.127 16.523 378 HG SER 49 HG SER 49 10.366 5.566 18.105 379 H ASP 50 H ASP 50 6.544 6.915 16.649 380 HA ASP 50 HA ASP 50 4.670 5.515 14.969 381 HB2 ASP 50 HB2 ASP 50 4.736 8.473 15.747 382 HB3 ASP 50 HB3 ASP 50 3.387 7.658 14.962 383 H LYS 51 H LYS 51 6.050 4.979 13.225 384 HA LYS 51 HA LYS 51 6.075 6.819 11.023 385 HB2 LYS 51 HB2 LYS 51 8.545 6.753 10.633 386 HB3 LYS 51 HB3 LYS 51 8.134 7.578 12.133 387 HG2 LYS 51 HG2 LYS 51 8.662 5.389 13.347 388 HG3 LYS 51 HG3 LYS 51 9.326 4.800 11.822 389 HD2 LYS 51 HD2 LYS 51 10.284 7.269 13.324 390 HD3 LYS 51 HD3 LYS 51 11.065 5.690 13.364 391 HE2 LYS 51 HE2 LYS 51 10.709 7.351 10.846 392 HE3 LYS 51 HE3 LYS 51 12.169 7.334 11.831 393 HZ1 LYS 51 HZ1 LYS 51 12.433 5.009 11.355 394 HZ2 LYS 51 HZ2 LYS 51 12.332 5.884 9.918 395 HZ3 LYS 51 HZ3 LYS 51 11.008 4.984 10.457 396 H SER 52 H SER 52 6.597 5.741 9.044 397 HA SER 52 HA SER 52 6.924 2.860 8.956 398 HB2 SER 52 HB2 SER 52 4.503 3.076 9.515 399 HB3 SER 52 HB3 SER 52 4.272 4.145 8.130 400 HG SER 52 HG SER 52 3.983 2.407 7.023 401 H HIS 53 H HIS 53 8.003 2.417 7.058 402 HA HIS 53 HA HIS 53 7.955 4.513 4.963 403 HB2 HIS 53 HB2 HIS 53 10.120 3.576 4.156 404 HB3 HIS 53 HB3 HIS 53 10.191 4.245 5.781 405 HD1 HIS 53 HD1 HIS 53 10.463 2.537 7.743 406 HD2 HIS 53 HD2 HIS 53 10.808 0.893 3.965 407 HE1 HIS 53 HE1 HIS 53 11.536 0.306 8.085 408 HE2 HIS 53 HE2 HIS 53 11.933 -0.560 5.768 409 H ILE 54 H ILE 54 6.876 4.136 3.232 410 HA ILE 54 HA ILE 54 5.933 1.443 2.531 411 HB ILE 54 HB ILE 54 4.987 4.173 1.496 412 HG12 ILE 54 HG12 ILE 54 2.821 3.584 2.783 413 HG13 ILE 54 HG13 ILE 54 3.750 2.338 3.595 414 HG21 ILE 54 HG21 ILE 54 4.642 2.407 -0.166 415 HG22 ILE 54 HG22 ILE 54 3.092 2.925 0.497 416 HG23 ILE 54 HG23 ILE 54 3.815 1.405 1.033 417 HD11 ILE 54 HD11 ILE 54 3.502 4.311 4.956 418 HD12 ILE 54 HD12 ILE 54 4.281 5.292 3.716 419 HD13 ILE 54 HD13 ILE 54 5.196 4.038 4.555 420 H TRP 55 H TRP 55 7.144 0.432 0.992 421 HA TRP 55 HA TRP 55 8.784 1.870 -0.916 422 HB2 TRP 55 HB2 TRP 55 8.272 -1.093 -0.423 423 HB3 TRP 55 HB3 TRP 55 9.184 -0.532 -1.819 424 HD1 TRP 55 HD1 TRP 55 11.466 0.947 -1.177 425 HE1 TRP 55 HE1 TRP 55 13.193 0.434 0.653 426 HE3 TRP 55 HE3 TRP 55 8.573 -1.909 1.831 427 HZ2 TRP 55 HZ2 TRP 55 13.295 -1.006 3.081 428 HZ3 TRP 55 HZ3 TRP 55 9.533 -2.812 3.889 429 HH2 TRP 55 HH2 TRP 55 11.846 -2.368 4.505 430 H LEU 56 H LEU 56 7.625 2.849 -2.438 431 HA LEU 56 HA LEU 56 5.506 1.457 -3.902 432 HB2 LEU 56 HB2 LEU 56 6.497 4.341 -4.020 433 HB3 LEU 56 HB3 LEU 56 5.173 3.695 -4.986 434 HG LEU 56 HG LEU 56 5.177 3.811 -1.934 435 HD11 LEU 56 HD11 LEU 56 3.550 5.616 -2.119 436 HD12 LEU 56 HD12 LEU 56 3.712 5.606 -3.879 437 HD13 LEU 56 HD13 LEU 56 5.084 6.060 -2.864 438 HD21 LEU 56 HD21 LEU 56 3.811 1.970 -2.790 439 HD22 LEU 56 HD22 LEU 56 2.945 3.078 -3.860 440 HD23 LEU 56 HD23 LEU 56 2.791 3.234 -2.107 441 H LEU 57 H LEU 57 6.338 0.094 -5.267 442 HA LEU 57 HA LEU 57 8.804 0.538 -6.746 443 HB2 LEU 57 HB2 LEU 57 6.841 -1.815 -6.759 444 HB3 LEU 57 HB3 LEU 57 8.328 -1.753 -7.689 445 HG LEU 57 HG LEU 57 8.795 -3.138 -5.814 446 HD11 LEU 57 HD11 LEU 57 10.584 -1.576 -6.335 447 HD12 LEU 57 HD12 LEU 57 10.568 -1.992 -4.625 448 HD13 LEU 57 HD13 LEU 57 9.949 -0.424 -5.155 449 HD21 LEU 57 HD21 LEU 57 6.909 -2.564 -4.378 450 HD22 LEU 57 HD22 LEU 57 7.653 -1.018 -3.974 451 HD23 LEU 57 HD23 LEU 57 8.416 -2.529 -3.463 452 H VAL 58 H VAL 58 8.530 2.030 -8.252 453 HA VAL 58 HA VAL 58 6.478 1.649 -10.355 454 HB VAL 58 HB VAL 58 5.531 3.243 -8.602 455 HG11 VAL 58 HG11 VAL 58 7.745 5.115 -9.485 456 HG12 VAL 58 HG12 VAL 58 7.578 4.365 -7.896 457 HG13 VAL 58 HG13 VAL 58 6.385 5.546 -8.440 458 HG21 VAL 58 HG21 VAL 58 5.933 4.439 -11.370 459 HG22 VAL 58 HG22 VAL 58 4.698 4.941 -10.211 460 HG23 VAL 58 HG23 VAL 58 4.657 3.313 -10.893 461 H ASN 59 H ASN 59 7.164 2.654 -12.401 462 HA ASN 59 HA ASN 59 10.020 3.091 -12.608 463 HB2 ASN 59 HB2 ASN 59 9.589 3.538 -15.033 464 HB3 ASN 59 HB3 ASN 59 8.940 2.002 -14.477 465 HD21 ASN 59 HD21 ASN 59 7.584 1.964 -16.296 466 HD22 ASN 59 HD22 ASN 59 6.149 2.924 -16.380 467 H ASP 60 H ASP 60 11.078 5.027 -13.209 468 HA ASP 60 HA ASP 60 10.076 7.398 -11.951 469 HB2 ASP 60 HB2 ASP 60 12.448 6.833 -11.819 470 HB3 ASP 60 HB3 ASP 60 12.599 6.868 -13.571 471 H ASP 61 H ASP 61 9.876 9.483 -12.944 472 HA ASP 61 HA ASP 61 9.258 9.666 -15.802 473 HB2 ASP 61 HB2 ASP 61 7.155 9.003 -14.406 474 HB3 ASP 61 HB3 ASP 61 7.255 10.606 -13.695 475 H GLN 62 H GLN 62 8.850 12.081 -16.335 476 HA GLN 62 HA GLN 62 10.820 13.765 -15.072 477 HB2 GLN 62 HB2 GLN 62 8.685 14.407 -17.148 478 HB3 GLN 62 HB3 GLN 62 9.929 15.542 -16.625 479 HG2 GLN 62 HG2 GLN 62 11.676 14.026 -17.468 480 HG3 GLN 62 HG3 GLN 62 10.439 12.875 -17.968 481 HE21 GLN 62 HE21 GLN 62 11.080 12.936 -20.111 482 HE22 GLN 62 HE22 GLN 62 10.817 14.300 -21.136 483 H ARG 63 H ARG 63 7.346 13.397 -14.891 484 HA ARG 63 HA ARG 63 6.893 15.700 -13.188 485 HB2 ARG 63 HB2 ARG 63 5.179 14.946 -14.825 486 HB3 ARG 63 HB3 ARG 63 5.001 13.430 -13.945 487 HG2 ARG 63 HG2 ARG 63 4.098 14.623 -11.994 488 HG3 ARG 63 HG3 ARG 63 4.415 16.179 -12.766 489 HD2 ARG 63 HD2 ARG 63 2.450 14.075 -13.719 490 HD3 ARG 63 HD3 ARG 63 2.038 15.597 -12.923 491 HE ARG 63 HE ARG 63 3.448 16.439 -15.058 492 HH11 ARG 63 HH11 ARG 63 0.733 14.206 -14.872 493 HH12 ARG 63 HH12 ARG 63 0.155 14.597 -16.459 494 HH21 ARG 63 HH21 ARG 63 2.720 16.910 -17.120 495 HH22 ARG 63 HH22 ARG 63 1.295 16.147 -17.744 496 H LEU 64 H LEU 64 7.657 12.345 -12.820 497 HA LEU 64 HA LEU 64 6.657 11.456 -10.452 498 HB2 LEU 64 HB2 LEU 64 8.596 10.591 -12.185 499 HB3 LEU 64 HB3 LEU 64 9.603 10.978 -10.818 500 HG LEU 64 HG LEU 64 9.082 8.600 -10.883 501 HD11 LEU 64 HD11 LEU 64 8.211 8.228 -8.647 502 HD12 LEU 64 HD12 LEU 64 7.669 9.908 -8.564 503 HD13 LEU 64 HD13 LEU 64 9.390 9.535 -8.685 504 HD21 LEU 64 HD21 LEU 64 6.967 8.662 -12.097 505 HD22 LEU 64 HD22 LEU 64 6.152 9.347 -10.689 506 HD23 LEU 64 HD23 LEU 64 6.814 7.712 -10.620 507 H GLU 65 H GLU 65 9.477 13.601 -10.824 508 HA GLU 65 HA GLU 65 10.236 13.654 -8.064 509 HB2 GLU 65 HB2 GLU 65 11.031 15.603 -10.269 510 HB3 GLU 65 HB3 GLU 65 11.875 15.336 -8.743 511 HG2 GLU 65 HG2 GLU 65 12.337 12.984 -9.470 512 HG3 GLU 65 HG3 GLU 65 11.599 13.358 -11.029 513 H GLN 66 H GLN 66 8.358 15.804 -10.149 514 HA GLN 66 HA GLN 66 7.872 17.955 -8.382 515 HB2 GLN 66 HB2 GLN 66 7.402 18.118 -10.781 516 HB3 GLN 66 HB3 GLN 66 6.243 16.797 -10.689 517 HG2 GLN 66 HG2 GLN 66 4.781 18.258 -9.265 518 HG3 GLN 66 HG3 GLN 66 5.915 19.583 -9.532 519 HE21 GLN 66 HE21 GLN 66 6.079 20.480 -11.640 520 HE22 GLN 66 HE22 GLN 66 4.848 20.231 -12.826 521 H MET 67 H MET 67 6.156 14.968 -9.027 522 HA MET 67 HA MET 67 3.900 15.229 -7.357 523 HB2 MET 67 HB2 MET 67 4.115 13.676 -9.290 524 HB3 MET 67 HB3 MET 67 5.355 12.775 -8.438 525 HG2 MET 67 HG2 MET 67 3.617 12.199 -6.707 526 HG3 MET 67 HG3 MET 67 2.418 12.936 -7.771 527 HE1 MET 67 HE1 MET 67 4.903 9.191 -8.815 528 HE2 MET 67 HE2 MET 67 4.957 10.011 -7.257 529 HE3 MET 67 HE3 MET 67 5.628 10.794 -8.691 530 H ILE 68 H ILE 68 7.089 13.773 -6.908 531 HA ILE 68 HA ILE 68 6.802 12.702 -4.316 532 HB ILE 68 HB ILE 68 9.183 13.485 -6.023 533 HG12 ILE 68 HG12 ILE 68 8.295 10.802 -4.870 534 HG13 ILE 68 HG13 ILE 68 7.976 11.362 -6.509 535 HG21 ILE 68 HG21 ILE 68 9.442 12.501 -3.167 536 HG22 ILE 68 HG22 ILE 68 9.957 14.069 -3.786 537 HG23 ILE 68 HG23 ILE 68 10.769 12.602 -4.329 538 HD11 ILE 68 HD11 ILE 68 10.410 11.400 -6.924 539 HD12 ILE 68 HD12 ILE 68 9.784 9.803 -6.526 540 HD13 ILE 68 HD13 ILE 68 10.665 10.725 -5.311 541 H SER 69 H SER 69 8.070 15.860 -5.439 542 HA SER 69 HA SER 69 8.763 16.900 -2.910 543 HB2 SER 69 HB2 SER 69 9.581 17.876 -5.051 544 HB3 SER 69 HB3 SER 69 7.955 18.455 -5.406 545 HG SER 69 HG SER 69 8.669 19.279 -2.954 546 H GLN 70 H GLN 70 5.765 16.956 -4.785 547 HA GLN 70 HA GLN 70 4.324 18.914 -3.403 548 HB2 GLN 70 HB2 GLN 70 3.794 17.717 -5.660 549 HB3 GLN 70 HB3 GLN 70 3.066 16.448 -4.691 550 HG2 GLN 70 HG2 GLN 70 2.186 19.353 -4.646 551 HG3 GLN 70 HG3 GLN 70 1.454 18.118 -5.659 552 HE21 GLN 70 HE21 GLN 70 1.490 16.029 -3.576 553 HE22 GLN 70 HE22 GLN 70 0.271 16.478 -2.441 554 H ILE 71 H ILE 71 4.395 15.363 -3.005 555 HA ILE 71 HA ILE 71 2.635 15.385 -0.740 556 HB ILE 71 HB ILE 71 2.735 13.473 -2.331 557 HG12 ILE 71 HG12 ILE 71 3.234 12.866 0.613 558 HG13 ILE 71 HG13 ILE 71 1.680 13.135 -0.168 559 HG21 ILE 71 HG21 ILE 71 5.167 13.358 -2.698 560 HG22 ILE 71 HG22 ILE 71 4.520 11.793 -2.209 561 HG23 ILE 71 HG23 ILE 71 5.398 12.785 -1.042 562 HD11 ILE 71 HD11 ILE 71 3.515 10.790 -0.558 563 HD12 ILE 71 HD12 ILE 71 2.006 11.058 -1.438 564 HD13 ILE 71 HD13 ILE 71 1.981 10.822 0.309 565 H ASP 72 H ASP 72 6.127 15.449 -1.159 566 HA ASP 72 HA ASP 72 6.940 14.702 1.437 567 HB2 ASP 72 HB2 ASP 72 8.542 14.747 -0.393 568 HB3 ASP 72 HB3 ASP 72 8.288 16.471 -0.657 569 H LYS 73 H LYS 73 5.815 17.763 0.116 570 HA LYS 73 HA LYS 73 6.553 19.475 2.270 571 HB2 LYS 73 HB2 LYS 73 4.363 19.813 0.179 572 HB3 LYS 73 HB3 LYS 73 4.953 21.086 1.245 573 HG2 LYS 73 HG2 LYS 73 7.160 21.014 0.193 574 HG3 LYS 73 HG3 LYS 73 6.682 19.630 -0.773 575 HD2 LYS 73 HD2 LYS 73 6.646 21.676 -2.122 576 HD3 LYS 73 HD3 LYS 73 5.020 21.004 -1.967 577 HE2 LYS 73 HE2 LYS 73 4.488 22.677 -0.236 578 HE3 LYS 73 HE3 LYS 73 6.128 23.322 -0.341 579 HZ1 LYS 73 HZ1 LYS 73 4.168 23.286 -2.572 580 HZ2 LYS 73 HZ2 LYS 73 5.708 23.973 -2.607 581 HZ3 LYS 73 HZ3 LYS 73 4.517 24.631 -1.607 582 H LEU 74 H LEU 74 4.023 17.154 1.958 583 HA LEU 74 HA LEU 74 2.123 18.196 3.819 584 HB2 LEU 74 HB2 LEU 74 2.650 15.449 2.654 585 HB3 LEU 74 HB3 LEU 74 1.550 15.595 4.003 586 HG LEU 74 HG LEU 74 0.352 15.469 1.852 587 HD11 LEU 74 HD11 LEU 74 0.021 18.167 3.187 588 HD12 LEU 74 HD12 LEU 74 -0.704 16.643 3.708 589 HD13 LEU 74 HD13 LEU 74 -1.166 17.351 2.162 590 HD21 LEU 74 HD21 LEU 74 0.431 17.237 0.189 591 HD22 LEU 74 HD22 LEU 74 2.043 16.564 0.427 592 HD23 LEU 74 HD23 LEU 74 1.632 18.122 1.138 593 H GLU 75 H GLU 75 1.733 17.531 5.953 594 HA GLU 75 HA GLU 75 3.955 17.230 7.721 595 HB2 GLU 75 HB2 GLU 75 1.021 16.711 8.356 596 HB3 GLU 75 HB3 GLU 75 2.293 17.163 9.491 597 HG2 GLU 75 HG2 GLU 75 2.421 19.393 8.525 598 HG3 GLU 75 HG3 GLU 75 1.272 18.951 7.261 599 H ASP 76 H ASP 76 2.065 15.020 5.960 600 HA ASP 76 HA ASP 76 2.066 12.702 7.603 601 HB2 ASP 76 HB2 ASP 76 1.853 12.903 4.561 602 HB3 ASP 76 HB3 ASP 76 1.262 11.589 5.578 603 H VAL 77 H VAL 77 4.012 13.616 4.738 604 HA VAL 77 HA VAL 77 5.848 11.402 5.043 605 HB VAL 77 HB VAL 77 5.908 13.785 3.123 606 HG11 VAL 77 HG11 VAL 77 7.621 11.256 3.089 607 HG12 VAL 77 HG12 VAL 77 8.194 12.886 3.450 608 HG13 VAL 77 HG13 VAL 77 7.603 12.501 1.834 609 HG21 VAL 77 HG21 VAL 77 5.075 10.898 2.641 610 HG22 VAL 77 HG22 VAL 77 5.128 12.179 1.428 611 HG23 VAL 77 HG23 VAL 77 3.981 12.281 2.764 612 H VAL 78 H VAL 78 7.145 11.522 6.759 613 HA VAL 78 HA VAL 78 8.322 13.905 7.837 614 HB VAL 78 HB VAL 78 9.320 11.054 8.292 615 HG11 VAL 78 HG11 VAL 78 10.796 12.819 9.164 616 HG12 VAL 78 HG12 VAL 78 10.059 11.919 10.489 617 HG13 VAL 78 HG13 VAL 78 9.454 13.524 10.072 618 HG21 VAL 78 HG21 VAL 78 6.883 11.065 8.657 619 HG22 VAL 78 HG22 VAL 78 7.044 12.419 9.782 620 HG23 VAL 78 HG23 VAL 78 7.753 10.851 10.180 621 H LYS 79 H LYS 79 9.475 11.197 5.857 622 HA LYS 79 HA LYS 79 11.566 12.838 4.637 623 HB2 LYS 79 HB2 LYS 79 12.110 10.166 6.029 624 HB3 LYS 79 HB3 LYS 79 13.204 10.871 4.840 625 HG2 LYS 79 HG2 LYS 79 13.496 12.850 6.303 626 HG3 LYS 79 HG3 LYS 79 12.447 12.095 7.504 627 HD2 LYS 79 HD2 LYS 79 14.062 10.231 7.748 628 HD3 LYS 79 HD3 LYS 79 15.090 10.950 6.505 629 HE2 LYS 79 HE2 LYS 79 14.445 12.164 9.217 630 HE3 LYS 79 HE3 LYS 79 15.978 11.437 8.736 631 HZ1 LYS 79 HZ1 LYS 79 16.220 13.181 7.061 632 HZ2 LYS 79 HZ2 LYS 79 16.088 13.827 8.616 633 HZ3 LYS 79 HZ3 LYS 79 14.767 13.885 7.566 634 H VAL 80 H VAL 80 11.548 12.497 2.506 635 HA VAL 80 HA VAL 80 10.364 10.022 1.410 636 HB VAL 80 HB VAL 80 9.435 12.068 0.421 637 HG11 VAL 80 HG11 VAL 80 11.307 13.635 0.732 638 HG12 VAL 80 HG12 VAL 80 10.747 13.639 -0.940 639 HG13 VAL 80 HG13 VAL 80 12.235 12.791 -0.511 640 HG21 VAL 80 HG21 VAL 80 9.678 10.029 -0.981 641 HG22 VAL 80 HG22 VAL 80 11.211 10.648 -1.598 642 HG23 VAL 80 HG23 VAL 80 9.709 11.511 -1.934 643 H GLN 81 H GLN 81 11.687 8.471 0.673 644 HA GLN 81 HA GLN 81 14.581 9.093 0.328 645 HB2 GLN 81 HB2 GLN 81 13.219 6.645 1.502 646 HB3 GLN 81 HB3 GLN 81 14.922 6.671 1.044 647 HG2 GLN 81 HG2 GLN 81 15.440 8.335 2.696 648 HG3 GLN 81 HG3 GLN 81 13.733 8.636 3.021 649 HE21 GLN 81 HE21 GLN 81 16.350 6.313 3.396 650 HE22 GLN 81 HE22 GLN 81 15.634 5.450 4.712 651 H ARG 82 H ARG 82 15.187 8.955 -1.678 652 HA ARG 82 HA ARG 82 13.662 7.357 -3.653 653 HB2 ARG 82 HB2 ARG 82 15.360 9.874 -4.040 654 HB3 ARG 82 HB3 ARG 82 14.502 9.015 -5.317 655 HG2 ARG 82 HG2 ARG 82 12.354 9.616 -4.339 656 HG3 ARG 82 HG3 ARG 82 13.155 10.390 -2.966 657 HD2 ARG 82 HD2 ARG 82 12.353 11.989 -4.759 658 HD3 ARG 82 HD3 ARG 82 14.075 12.113 -4.379 659 HE ARG 82 HE ARG 82 13.648 10.310 -6.537 660 HH11 ARG 82 HH11 ARG 82 13.707 13.785 -5.922 661 HH12 ARG 82 HH12 ARG 82 14.151 14.167 -7.557 662 HH21 ARG 82 HH21 ARG 82 14.296 10.838 -8.628 663 HH22 ARG 82 HH22 ARG 82 14.483 12.501 -9.080 664 H ASN 83 H ASN 83 14.819 5.475 -3.890 665 HA ASN 83 HA ASN 83 17.696 5.664 -4.661 666 HB2 ASN 83 HB2 ASN 83 16.350 3.447 -3.031 667 HB3 ASN 83 HB3 ASN 83 17.996 3.373 -3.650 668 HD21 ASN 83 HD21 ASN 83 19.598 4.738 -2.719 669 HD22 ASN 83 HD22 ASN 83 19.369 5.433 -1.155 670 H GLN 84 H GLN 84 17.988 4.958 -6.756 671 HA GLN 84 HA GLN 84 15.892 3.313 -8.023 672 HB2 GLN 84 HB2 GLN 84 17.124 3.783 -10.159 673 HB3 GLN 84 HB3 GLN 84 16.541 5.220 -9.334 674 HG2 GLN 84 HG2 GLN 84 18.844 5.624 -8.473 675 HG3 GLN 84 HG3 GLN 84 19.409 4.226 -9.380 676 HE21 GLN 84 HE21 GLN 84 17.666 4.888 -11.706 677 HE22 GLN 84 HE22 GLN 84 18.429 6.217 -12.483 678 H SER 85 H SER 85 16.081 1.235 -7.489 679 HA SER 85 HA SER 85 18.554 -0.278 -7.821 680 HB2 SER 85 HB2 SER 85 18.738 0.782 -5.528 681 HB3 SER 85 HB3 SER 85 17.253 -0.043 -5.059 682 HG SER 85 HG SER 85 19.823 -1.080 -5.503 683 H ASP 86 H ASP 86 17.992 -2.625 -6.741 684 HA ASP 86 HA ASP 86 15.734 -3.701 -8.164 685 HB2 ASP 86 HB2 ASP 86 17.491 -5.065 -6.070 686 HB3 ASP 86 HB3 ASP 86 16.409 -5.873 -7.200 687 HA PRO 87 HA PRO 87 12.687 -3.560 -4.753 688 HB2 PRO 87 HB2 PRO 87 11.391 -5.949 -5.987 689 HB3 PRO 87 HB3 PRO 87 10.756 -4.301 -5.781 690 HG2 PRO 87 HG2 PRO 87 11.421 -5.215 -8.198 691 HG3 PRO 87 HG3 PRO 87 11.719 -3.522 -7.741 692 HD2 PRO 87 HD2 PRO 87 13.680 -5.830 -7.789 693 HD3 PRO 87 HD3 PRO 87 13.859 -4.184 -8.451 694 H THR 88 H THR 88 15.089 -5.719 -4.907 695 HA THR 88 HA THR 88 14.313 -7.916 -3.322 696 HB THR 88 HB THR 88 16.780 -8.238 -2.981 697 HG1 THR 88 HG1 THR 88 18.121 -6.669 -4.202 698 HG21 THR 88 HG21 THR 88 15.732 -9.110 -5.036 699 HG22 THR 88 HG22 THR 88 17.363 -8.532 -5.381 700 HG23 THR 88 HG23 THR 88 15.965 -7.553 -5.838 701 H MET 89 H MET 89 14.634 -4.650 -2.405 702 HA MET 89 HA MET 89 15.430 -4.636 0.237 703 HB2 MET 89 HB2 MET 89 13.041 -3.153 -0.962 704 HB3 MET 89 HB3 MET 89 13.824 -2.745 0.563 705 HG2 MET 89 HG2 MET 89 15.132 -2.637 -2.168 706 HG3 MET 89 HG3 MET 89 14.528 -1.250 -1.255 707 HE1 MET 89 HE1 MET 89 18.418 -0.755 -1.024 708 HE2 MET 89 HE2 MET 89 16.880 0.024 -1.395 709 HE3 MET 89 HE3 MET 89 17.467 -1.297 -2.407 710 H PHE 90 H PHE 90 12.443 -5.833 -1.146 711 HA PHE 90 HA PHE 90 10.851 -6.458 1.026 712 HB2 PHE 90 HB2 PHE 90 10.090 -6.658 -1.279 713 HB3 PHE 90 HB3 PHE 90 11.308 -7.871 -1.638 714 HD1 PHE 90 HD1 PHE 90 8.171 -7.259 0.292 715 HD2 PHE 90 HD2 PHE 90 10.837 -10.199 -1.309 716 HE1 PHE 90 HE1 PHE 90 6.546 -9.025 0.806 717 HE2 PHE 90 HE2 PHE 90 9.202 -11.951 -0.787 718 HZ PHE 90 HZ PHE 90 7.062 -11.365 0.268 719 H ASN 91 H ASN 91 13.305 -8.558 -0.527 720 HA ASN 91 HA ASN 91 13.113 -10.695 1.365 721 HB2 ASN 91 HB2 ASN 91 13.848 -11.116 -0.945 722 HB3 ASN 91 HB3 ASN 91 15.242 -10.061 -0.728 723 HD21 ASN 91 HD21 ASN 91 13.841 -13.161 0.091 724 HD22 ASN 91 HD22 ASN 91 15.303 -13.890 0.662 725 H LYS 92 H LYS 92 15.230 -7.918 0.945 726 HA LYS 92 HA LYS 92 17.348 -8.570 2.658 727 HB2 LYS 92 HB2 LYS 92 16.228 -5.886 1.777 728 HB3 LYS 92 HB3 LYS 92 17.687 -6.017 2.758 729 HG2 LYS 92 HG2 LYS 92 18.856 -7.195 1.000 730 HG3 LYS 92 HG3 LYS 92 17.380 -7.348 0.042 731 HD2 LYS 92 HD2 LYS 92 18.903 -5.572 -0.809 732 HD3 LYS 92 HD3 LYS 92 17.317 -4.952 -0.353 733 HE2 LYS 92 HE2 LYS 92 19.144 -3.451 0.364 734 HE3 LYS 92 HE3 LYS 92 18.241 -4.072 1.745 735 HZ1 LYS 92 HZ1 LYS 92 20.002 -5.685 2.115 736 HZ2 LYS 92 HZ2 LYS 92 20.615 -4.114 2.135 737 HZ3 LYS 92 HZ3 LYS 92 20.859 -5.091 0.783 738 H ILE 93 H ILE 93 14.283 -6.881 3.372 739 HA ILE 93 HA ILE 93 14.948 -6.532 6.174 740 HB ILE 93 HB ILE 93 12.681 -5.651 6.466 741 HG12 ILE 93 HG12 ILE 93 12.182 -6.510 3.578 742 HG13 ILE 93 HG13 ILE 93 11.472 -7.248 4.997 743 HG21 ILE 93 HG21 ILE 93 12.809 -3.721 4.947 744 HG22 ILE 93 HG22 ILE 93 13.946 -4.589 3.912 745 HG23 ILE 93 HG23 ILE 93 14.409 -4.148 5.558 746 HD11 ILE 93 HD11 ILE 93 10.957 -4.474 3.990 747 HD12 ILE 93 HD12 ILE 93 10.293 -5.160 5.471 748 HD13 ILE 93 HD13 ILE 93 9.880 -5.862 3.911 749 H ALA 94 H ALA 94 13.173 -8.893 4.208 750 HA ALA 94 HA ALA 94 11.542 -10.074 6.135 751 HB1 ALA 94 HB1 ALA 94 11.414 -12.004 4.614 752 HB2 ALA 94 HB2 ALA 94 12.818 -11.407 3.723 753 HB3 ALA 94 HB3 ALA 94 11.315 -10.478 3.731 754 H VAL 95 H VAL 95 14.893 -10.892 5.261 755 HA VAL 95 HA VAL 95 15.179 -13.184 6.880 756 HB VAL 95 HB VAL 95 16.701 -12.656 4.999 757 HG11 VAL 95 HG11 VAL 95 16.928 -10.233 5.287 758 HG12 VAL 95 HG12 VAL 95 18.515 -10.999 5.208 759 HG13 VAL 95 HG13 VAL 95 17.866 -10.474 6.764 760 HG21 VAL 95 HG21 VAL 95 17.454 -14.270 6.700 761 HG22 VAL 95 HG22 VAL 95 18.206 -12.967 7.624 762 HG23 VAL 95 HG23 VAL 95 18.824 -13.383 6.022 763 H PHE 96 H PHE 96 15.322 -9.781 7.701 764 HA PHE 96 HA PHE 96 16.588 -10.242 10.306 765 HB2 PHE 96 HB2 PHE 96 15.662 -7.659 8.979 766 HB3 PHE 96 HB3 PHE 96 16.491 -7.750 10.533 767 HD1 PHE 96 HD1 PHE 96 18.648 -9.659 10.123 768 HD2 PHE 96 HD2 PHE 96 17.160 -6.681 7.430 769 HE1 PHE 96 HE1 PHE 96 20.832 -9.576 8.994 770 HE2 PHE 96 HE2 PHE 96 19.349 -6.615 6.311 771 HZ PHE 96 HZ PHE 96 21.182 -8.060 7.086 772 H PHE 97 H PHE 97 13.429 -9.136 9.043 773 HA PHE 97 HA PHE 97 12.369 -8.501 11.639 774 HB2 PHE 97 HB2 PHE 97 11.250 -8.452 8.822 775 HB3 PHE 97 HB3 PHE 97 10.145 -8.317 10.189 776 HD1 PHE 97 HD2 PHE 97 13.302 -6.764 8.824 777 HD2 PHE 97 HD1 PHE 97 9.744 -6.194 11.146 778 HE1 PHE 97 HE2 PHE 97 13.830 -4.373 9.058 779 HE2 PHE 97 HE1 PHE 97 10.288 -3.806 11.375 780 HZ PHE 97 HZ PHE 97 12.328 -2.892 10.338 781 H GLN 98 H GLN 98 11.361 -10.970 9.212 782 HA GLN 98 HA GLN 98 11.188 -13.054 11.125 783 HB2 GLN 98 HB2 GLN 98 8.716 -13.458 11.062 784 HB3 GLN 98 HB3 GLN 98 9.162 -11.984 11.910 785 HG2 GLN 98 HG2 GLN 98 8.560 -10.699 9.813 786 HG3 GLN 98 HG3 GLN 98 7.923 -12.205 9.151 787 HE21 GLN 98 HE21 GLN 98 6.048 -13.129 10.130 788 HE22 GLN 98 HE22 GLN 98 4.997 -12.181 11.124 789 H1 GLY 1 H1 GLY 1 5.062 -1.957 13.957 790 H2 GLY 1 H2 GLY 1 3.889 -2.489 12.860 791 H3 GLY 1 H3 GLY 1 5.443 -2.119 12.324 792 HA2 GLY 1 HA3 GLY 1 5.088 -4.502 12.457 793 HA3 GLY 1 HA2 GLY 1 6.389 -3.945 13.497 794 H SER 2 H SER 2 3.206 -3.131 14.555 795 HA SER 2 HA SER 2 3.664 -4.335 17.087 796 HB2 SER 2 HB2 SER 2 2.395 -2.235 16.838 797 HB3 SER 2 HB3 SER 2 1.129 -3.073 15.941 798 HG SER 2 HG SER 2 1.892 -3.696 18.605 799 H MET 3 H MET 3 1.292 -5.056 14.502 800 HA MET 3 HA MET 3 0.258 -7.368 15.951 801 HB2 MET 3 HB2 MET 3 -1.395 -7.524 14.101 802 HB3 MET 3 HB3 MET 3 -1.362 -5.937 14.851 803 HG2 MET 3 HG2 MET 3 -0.046 -5.064 12.956 804 HG3 MET 3 HG3 MET 3 -0.084 -6.657 12.200 805 HE1 MET 3 HE1 MET 3 -2.396 -3.678 13.517 806 HE2 MET 3 HE2 MET 3 -3.193 -5.111 14.171 807 HE3 MET 3 HE3 MET 3 -3.960 -4.187 12.880 808 H GLN 4 H GLN 4 2.931 -6.973 14.040 809 HA GLN 4 HA GLN 4 2.777 -9.136 12.206 810 HB2 GLN 4 HB2 GLN 4 5.144 -7.606 13.308 811 HB3 GLN 4 HB3 GLN 4 5.315 -8.882 12.110 812 HG2 GLN 4 HG2 GLN 4 3.810 -7.588 10.584 813 HG3 GLN 4 HG3 GLN 4 3.810 -6.275 11.761 814 HE21 GLN 4 HE21 GLN 4 6.650 -8.263 10.975 815 HE22 GLN 4 HE22 GLN 4 7.541 -6.995 10.217 816 H ASN 5 H ASN 5 3.141 -9.198 15.548 817 HA ASN 5 HA ASN 5 4.560 -11.715 15.796 818 HB2 ASN 5 HB2 ASN 5 2.986 -10.046 17.810 819 HB3 ASN 5 HB3 ASN 5 3.916 -11.484 18.225 820 HD21 ASN 5 HD21 ASN 5 4.081 -8.112 17.366 821 HD22 ASN 5 HD22 ASN 5 5.771 -7.918 17.673 822 H THR 6 H THR 6 3.277 -13.311 17.425 823 HA THR 6 HA THR 6 1.140 -14.460 15.919 824 HB THR 6 HB THR 6 2.073 -15.246 18.716 825 HG1 THR 6 HG1 THR 6 3.149 -15.684 16.161 826 HG21 THR 6 HG21 THR 6 -0.058 -16.338 18.050 827 HG22 THR 6 HG22 THR 6 1.259 -17.509 18.091 828 HG23 THR 6 HG23 THR 6 0.689 -16.886 16.542 829 H THR 7 H THR 7 -0.518 -12.968 15.842 830 HA THR 7 HA THR 7 -2.035 -12.418 18.323 831 HB THR 7 HB THR 7 -2.514 -10.091 17.485 832 HG1 THR 7 HG1 THR 7 -0.564 -10.790 15.523 833 HG21 THR 7 HG21 THR 7 -0.354 -9.066 18.077 834 HG22 THR 7 HG22 THR 7 0.453 -10.623 17.882 835 HG23 THR 7 HG23 THR 7 -0.730 -10.397 19.175 836 H HIS 8 H HIS 8 -4.255 -12.400 18.079 837 HA HIS 8 HA HIS 8 -5.365 -13.149 15.422 838 HB2 HIS 8 HB2 HIS 8 -7.170 -14.305 16.607 839 HB3 HIS 8 HB3 HIS 8 -5.622 -14.905 17.184 840 HD1 HIS 8 HD1 HIS 8 -4.974 -14.373 19.651 841 HD2 HIS 8 HD2 HIS 8 -8.724 -12.951 18.540 842 HE1 HIS 8 HE1 HIS 8 -6.138 -13.766 21.792 843 HE2 HIS 8 HE2 HIS 8 -8.431 -12.996 21.097 844 H ASP 9 H ASP 9 -4.896 -10.470 17.019 845 HA ASP 9 HA ASP 9 -7.502 -9.278 17.266 846 HB2 ASP 9 HB2 ASP 9 -5.730 -8.399 18.660 847 HB3 ASP 9 HB3 ASP 9 -4.681 -8.126 17.272 848 H ASN 10 H ASN 10 -4.921 -9.276 14.855 849 HA ASN 10 HA ASN 10 -6.263 -7.339 13.151 850 HB2 ASN 10 HB2 ASN 10 -4.317 -7.508 11.693 851 HB3 ASN 10 HB3 ASN 10 -3.784 -7.292 13.354 852 HD21 ASN 10 HD21 ASN 10 -2.537 -8.514 10.894 853 HD22 ASN 10 HD22 ASN 10 -1.980 -10.060 11.421 854 H VAL 11 H VAL 11 -6.719 -7.790 10.960 855 HA VAL 11 HA VAL 11 -7.289 -10.572 10.212 856 HB VAL 11 HB VAL 11 -9.075 -9.604 8.657 857 HG11 VAL 11 HG11 VAL 11 -9.545 -9.280 11.645 858 HG12 VAL 11 HG12 VAL 11 -9.650 -10.788 10.733 859 HG13 VAL 11 HG13 VAL 11 -10.799 -9.487 10.415 860 HG21 VAL 11 HG21 VAL 11 -8.354 -7.227 8.677 861 HG22 VAL 11 HG22 VAL 11 -8.764 -7.109 10.390 862 HG23 VAL 11 HG23 VAL 11 -10.036 -7.384 9.196 863 H ILE 12 H ILE 12 -6.545 -11.223 8.366 864 HA ILE 12 HA ILE 12 -4.577 -9.690 6.871 865 HB ILE 12 HB ILE 12 -5.342 -12.630 6.518 866 HG12 ILE 12 HG12 ILE 12 -4.759 -12.363 8.878 867 HG13 ILE 12 HG13 ILE 12 -3.466 -13.224 8.056 868 HG21 ILE 12 HG21 ILE 12 -3.987 -11.699 4.704 869 HG22 ILE 12 HG22 ILE 12 -3.076 -12.902 5.618 870 HG23 ILE 12 HG23 ILE 12 -2.759 -11.182 5.864 871 HD11 ILE 12 HD11 ILE 12 -2.575 -11.651 9.634 872 HD12 ILE 12 HD12 ILE 12 -3.452 -10.325 8.874 873 HD13 ILE 12 HD13 ILE 12 -2.154 -11.145 7.999 874 H LEU 13 H LEU 13 -5.929 -8.306 5.688 875 HA LEU 13 HA LEU 13 -8.061 -9.446 4.014 876 HB2 LEU 13 HB2 LEU 13 -7.346 -6.550 4.604 877 HB3 LEU 13 HB3 LEU 13 -8.705 -7.079 3.615 878 HG LEU 13 HG LEU 13 -8.347 -7.606 6.593 879 HD11 LEU 13 HD11 LEU 13 -10.276 -6.158 6.886 880 HD12 LEU 13 HD12 LEU 13 -10.334 -5.842 5.150 881 HD13 LEU 13 HD13 LEU 13 -8.951 -5.301 6.106 882 HD21 LEU 13 HD21 LEU 13 -10.624 -8.457 4.768 883 HD22 LEU 13 HD22 LEU 13 -10.603 -8.606 6.528 884 HD23 LEU 13 HD23 LEU 13 -9.454 -9.520 5.556 885 H GLU 14 H GLU 14 -6.995 -10.424 2.404 886 HA GLU 14 HA GLU 14 -5.064 -8.913 0.771 887 HB2 GLU 14 HB2 GLU 14 -5.046 -11.311 -0.468 888 HB3 GLU 14 HB3 GLU 14 -4.082 -10.976 0.961 889 HG2 GLU 14 HG2 GLU 14 -5.933 -11.988 2.347 890 HG3 GLU 14 HG3 GLU 14 -6.704 -12.473 0.847 891 H LEU 15 H LEU 15 -6.142 -7.492 -0.396 892 HA LEU 15 HA LEU 15 -8.662 -8.053 -1.745 893 HB2 LEU 15 HB2 LEU 15 -6.919 -5.572 -1.483 894 HB3 LEU 15 HB3 LEU 15 -8.234 -5.623 -2.639 895 HG LEU 15 HG LEU 15 -8.911 -4.436 -0.652 896 HD11 LEU 15 HD11 LEU 15 -10.372 -7.059 -0.844 897 HD12 LEU 15 HD12 LEU 15 -10.631 -5.631 -1.851 898 HD13 LEU 15 HD13 LEU 15 -10.989 -5.567 -0.128 899 HD21 LEU 15 HD21 LEU 15 -7.453 -5.437 1.031 900 HD22 LEU 15 HD22 LEU 15 -8.375 -6.941 0.961 901 HD23 LEU 15 HD23 LEU 15 -9.133 -5.465 1.565 902 H THR 16 H THR 16 -8.472 -9.237 -3.551 903 HA THR 16 HA THR 16 -6.207 -9.013 -5.370 904 HB THR 16 HB THR 16 -8.730 -10.725 -5.488 905 HG1 THR 16 HG1 THR 16 -7.398 -11.650 -4.046 906 HG21 THR 16 HG21 THR 16 -7.713 -11.872 -7.427 907 HG22 THR 16 HG22 THR 16 -6.358 -10.742 -7.402 908 HG23 THR 16 HG23 THR 16 -7.980 -10.163 -7.795 909 H VAL 17 H VAL 17 -6.293 -7.033 -6.230 910 HA VAL 17 HA VAL 17 -8.671 -6.187 -7.750 911 HB VAL 17 HB VAL 17 -7.913 -3.917 -7.573 912 HG11 VAL 17 HG11 VAL 17 -7.696 -5.213 -4.829 913 HG12 VAL 17 HG12 VAL 17 -9.188 -4.727 -5.637 914 HG13 VAL 17 HG13 VAL 17 -8.024 -3.501 -5.135 915 HG21 VAL 17 HG21 VAL 17 -5.852 -3.244 -6.329 916 HG22 VAL 17 HG22 VAL 17 -5.503 -4.175 -7.785 917 HG23 VAL 17 HG23 VAL 17 -5.406 -4.951 -6.203 918 H ARG 18 H ARG 18 -8.494 -5.894 -9.880 919 HA ARG 18 HA ARG 18 -6.056 -6.383 -11.376 920 HB2 ARG 18 HB2 ARG 18 -7.557 -5.437 -13.322 921 HB3 ARG 18 HB3 ARG 18 -7.970 -6.989 -12.601 922 HG2 ARG 18 HG2 ARG 18 -9.742 -5.963 -11.270 923 HG3 ARG 18 HG3 ARG 18 -9.288 -4.358 -11.841 924 HD2 ARG 18 HD2 ARG 18 -10.195 -6.533 -13.742 925 HD3 ARG 18 HD3 ARG 18 -11.342 -5.475 -12.919 926 HE ARG 18 HE ARG 18 -9.515 -4.773 -15.074 927 HH11 ARG 18 HH11 ARG 18 -11.703 -3.564 -12.596 928 HH12 ARG 18 HH12 ARG 18 -11.912 -2.017 -13.355 929 HH21 ARG 18 HH21 ARG 18 -9.807 -2.724 -16.066 930 HH22 ARG 18 HH22 ARG 18 -10.836 -1.550 -15.315 931 H ASN 19 H ASN 19 -4.585 -4.815 -12.056 932 HA ASN 19 HA ASN 19 -4.594 -2.451 -10.415 933 HB2 ASN 19 HB2 ASN 19 -2.528 -3.837 -10.830 934 HB3 ASN 19 HB3 ASN 19 -2.489 -3.211 -12.476 935 HD21 ASN 19 HD21 ASN 19 -0.354 -2.346 -11.928 936 HD22 ASN 19 HD22 ASN 19 -0.212 -0.894 -11.011 937 H HIS 20 H HIS 20 -6.412 -1.476 -11.264 938 HA HIS 20 HA HIS 20 -6.281 0.051 -13.758 939 HB2 HIS 20 HB2 HIS 20 -8.452 -0.923 -13.323 940 HB3 HIS 20 HB3 HIS 20 -8.415 -0.474 -11.627 941 HD1 HIS 20 HD1 HIS 20 -9.204 0.895 -15.036 942 HD2 HIS 20 HD2 HIS 20 -9.330 2.127 -11.066 943 HE1 HIS 20 HE1 HIS 20 -10.567 3.005 -15.012 944 HE2 HIS 20 HE2 HIS 20 -10.607 3.735 -12.612 945 HA PRO 21 HA PRO 21 -4.504 3.754 -11.865 946 HB2 PRO 21 HB2 PRO 21 -6.813 5.176 -13.221 947 HB3 PRO 21 HB3 PRO 21 -5.085 5.603 -13.185 948 HG2 PRO 21 HG2 PRO 21 -6.080 4.451 -15.342 949 HG3 PRO 21 HG3 PRO 21 -4.490 3.940 -14.725 950 HD2 PRO 21 HD2 PRO 21 -7.138 2.528 -14.516 951 HD3 PRO 21 HD3 PRO 21 -5.508 1.848 -14.726 952 H GLY 22 H GLY 22 -4.862 3.451 -9.698 953 HA2 GLY 22 HA2 GLY 22 -5.460 4.791 -7.827 954 HA3 GLY 22 HA3 GLY 22 -7.024 5.104 -8.547 955 H VAL 23 H VAL 23 -6.086 1.761 -8.698 956 HA VAL 23 HA VAL 23 -8.196 0.954 -6.952 957 HB VAL 23 HB VAL 23 -7.297 -1.367 -7.133 958 HG11 VAL 23 HG11 VAL 23 -7.390 0.112 -9.771 959 HG12 VAL 23 HG12 VAL 23 -8.778 -0.453 -8.852 960 HG13 VAL 23 HG13 VAL 23 -7.649 -1.619 -9.539 961 HG21 VAL 23 HG21 VAL 23 -5.034 -0.157 -8.776 962 HG22 VAL 23 HG22 VAL 23 -5.358 -1.885 -8.553 963 HG23 VAL 23 HG23 VAL 23 -4.868 -0.890 -7.176 964 H MET 24 H MET 24 -4.727 1.298 -6.459 965 HA MET 24 HA MET 24 -4.629 0.371 -3.784 966 HB2 MET 24 HB2 MET 24 -2.419 1.487 -3.679 967 HB3 MET 24 HB3 MET 24 -2.595 0.493 -5.116 968 HG2 MET 24 HG2 MET 24 -2.857 3.510 -5.066 969 HG3 MET 24 HG3 MET 24 -1.410 2.624 -5.544 970 HE1 MET 24 HE1 MET 24 -1.227 3.795 -7.915 971 HE2 MET 24 HE2 MET 24 -2.568 4.830 -7.417 972 HE3 MET 24 HE3 MET 24 -2.608 4.025 -8.987 973 H THR 25 H THR 25 -5.446 3.480 -5.230 974 HA THR 25 HA THR 25 -5.493 5.002 -2.807 975 HB THR 25 HB THR 25 -7.054 5.636 -5.351 976 HG1 THR 25 HG1 THR 25 -4.780 6.871 -5.523 977 HG21 THR 25 HG21 THR 25 -7.466 7.163 -3.435 978 HG22 THR 25 HG22 THR 25 -6.592 7.988 -4.728 979 HG23 THR 25 HG23 THR 25 -5.728 7.447 -3.287 980 H HIS 26 H HIS 26 -7.782 2.948 -4.510 981 HA HIS 26 HA HIS 26 -10.160 3.713 -3.117 982 HB2 HIS 26 HB2 HIS 26 -9.492 1.231 -4.766 983 HB3 HIS 26 HB3 HIS 26 -11.073 1.488 -4.034 984 HD1 HIS 26 HD1 HIS 26 -11.711 1.284 -6.722 985 HD2 HIS 26 HD2 HIS 26 -9.835 4.779 -5.487 986 HE1 HIS 26 HE1 HIS 26 -12.176 2.974 -8.505 987 HE2 HIS 26 HE2 HIS 26 -10.919 5.025 -7.797 988 H VAL 27 H VAL 27 -7.821 1.008 -2.688 989 HA VAL 27 HA VAL 27 -9.208 -0.187 -0.506 990 HB VAL 27 HB VAL 27 -7.232 -1.566 -0.094 991 HG11 VAL 27 HG11 VAL 27 -7.736 -1.254 -3.075 992 HG12 VAL 27 HG12 VAL 27 -8.688 -2.225 -1.951 993 HG13 VAL 27 HG13 VAL 27 -7.015 -2.667 -2.294 994 HG21 VAL 27 HG21 VAL 27 -5.732 0.170 -2.090 995 HG22 VAL 27 HG22 VAL 27 -5.120 -1.314 -1.352 996 HG23 VAL 27 HG23 VAL 27 -5.442 0.102 -0.350 997 H CYS 28 H CYS 28 -6.566 2.170 -0.659 998 HA CYS 28 HA CYS 28 -6.153 2.388 2.148 999 HB2 CYS 28 HB2 CYS 28 -5.450 4.231 -0.163 1000 HB3 CYS 28 HB3 CYS 28 -4.891 4.471 1.494 1001 HG CYS 28 HG CYS 28 -3.581 2.628 -0.859 1002 H GLY 29 H GLY 29 -8.338 3.941 -0.128 1003 HA2 GLY 29 HA2 GLY 29 -9.056 6.217 1.426 1004 HA3 GLY 29 HA3 GLY 29 -9.918 5.584 0.035 1005 H LEU 30 H LEU 30 -10.627 3.054 0.917 1006 HA LEU 30 HA LEU 30 -12.948 3.561 2.449 1007 HB2 LEU 30 HB2 LEU 30 -11.649 1.135 1.278 1008 HB3 LEU 30 HB3 LEU 30 -12.734 0.823 2.613 1009 HG LEU 30 HG LEU 30 -13.924 0.540 0.515 1010 HD11 LEU 30 HD11 LEU 30 -15.853 2.001 0.871 1011 HD12 LEU 30 HD12 LEU 30 -14.891 3.061 1.905 1012 HD13 LEU 30 HD13 LEU 30 -15.224 1.402 2.404 1013 HD21 LEU 30 HD21 LEU 30 -12.600 1.977 -0.955 1014 HD22 LEU 30 HD22 LEU 30 -13.234 3.421 -0.160 1015 HD23 LEU 30 HD23 LEU 30 -14.315 2.367 -1.080 1016 H PHE 31 H PHE 31 -9.819 2.163 3.319 1017 HA PHE 31 HA PHE 31 -10.573 1.471 6.003 1018 HB2 PHE 31 HB2 PHE 31 -7.913 1.532 4.533 1019 HB3 PHE 31 HB3 PHE 31 -8.026 1.107 6.242 1020 HD1 PHE 31 HD1 PHE 31 -10.015 0.187 3.147 1021 HD2 PHE 31 HD2 PHE 31 -7.863 -1.217 6.573 1022 HE1 PHE 31 HE1 PHE 31 -10.565 -2.126 2.538 1023 HE2 PHE 31 HE2 PHE 31 -8.422 -3.527 5.944 1024 HZ PHE 31 HZ PHE 31 -9.770 -3.987 3.939 1025 H ALA 32 H ALA 32 -9.166 4.300 4.496 1026 HA ALA 32 HA ALA 32 -8.277 5.659 6.828 1027 HB1 ALA 32 HB1 ALA 32 -7.529 6.274 4.557 1028 HB2 ALA 32 HB2 ALA 32 -8.223 7.667 5.392 1029 HB3 ALA 32 HB3 ALA 32 -9.161 6.815 4.157 1030 H ARG 33 H ARG 33 -11.421 5.498 5.175 1031 HA ARG 33 HA ARG 33 -12.536 7.751 6.618 1032 HB2 ARG 33 HB2 ARG 33 -14.513 7.465 5.303 1033 HB3 ARG 33 HB3 ARG 33 -13.158 7.125 4.232 1034 HG2 ARG 33 HG2 ARG 33 -13.554 4.668 4.641 1035 HG3 ARG 33 HG3 ARG 33 -15.017 5.097 5.523 1036 HD2 ARG 33 HD2 ARG 33 -14.442 5.711 2.608 1037 HD3 ARG 33 HD3 ARG 33 -15.504 4.434 3.207 1038 HE ARG 33 HE ARG 33 -16.599 6.628 4.315 1039 HH11 ARG 33 HH11 ARG 33 -15.666 5.960 0.985 1040 HH12 ARG 33 HH12 ARG 33 -16.884 6.997 0.317 1041 HH21 ARG 33 HH21 ARG 33 -18.186 7.985 3.408 1042 HH22 ARG 33 HH22 ARG 33 -18.307 8.141 1.685 1043 H ARG 34 H ARG 34 -12.062 4.529 7.454 1044 HA ARG 34 HA ARG 34 -14.420 3.937 8.926 1045 HB2 ARG 34 HB2 ARG 34 -12.928 2.113 8.279 1046 HB3 ARG 34 HB3 ARG 34 -11.563 2.878 9.090 1047 HG2 ARG 34 HG2 ARG 34 -12.812 2.542 11.287 1048 HG3 ARG 34 HG3 ARG 34 -13.972 1.560 10.391 1049 HD2 ARG 34 HD2 ARG 34 -12.384 -0.141 9.976 1050 HD3 ARG 34 HD3 ARG 34 -11.012 0.927 10.312 1051 HE ARG 34 HE ARG 34 -12.749 0.514 12.573 1052 HH11 ARG 34 HH11 ARG 34 -9.967 -0.807 10.866 1053 HH12 ARG 34 HH12 ARG 34 -9.381 -1.660 12.256 1054 HH21 ARG 34 HH21 ARG 34 -11.969 -0.601 14.369 1055 HH22 ARG 34 HH22 ARG 34 -10.515 -1.541 14.242 1056 H ALA 35 H ALA 35 -11.173 4.489 10.284 1057 HA ALA 35 HA ALA 35 -11.561 6.584 12.029 1058 HB1 ALA 35 HB1 ALA 35 -12.005 5.500 14.221 1059 HB2 ALA 35 HB2 ALA 35 -12.232 3.946 13.410 1060 HB3 ALA 35 HB3 ALA 35 -13.359 5.266 13.112 1061 H PHE 36 H PHE 36 -10.424 3.238 12.023 1062 HA PHE 36 HA PHE 36 -7.837 3.985 13.228 1063 HB2 PHE 36 HB2 PHE 36 -9.143 2.159 14.329 1064 HB3 PHE 36 HB3 PHE 36 -9.102 1.231 12.837 1065 HD1 PHE 36 HD1 PHE 36 -6.853 2.757 15.427 1066 HD2 PHE 36 HD2 PHE 36 -7.295 -0.288 12.450 1067 HE1 PHE 36 HE1 PHE 36 -4.726 1.740 16.140 1068 HE2 PHE 36 HE2 PHE 36 -5.169 -1.295 13.172 1069 HZ PHE 36 HZ PHE 36 -3.884 -0.287 15.015 1070 H ASN 37 H ASN 37 -5.945 3.669 12.133 1071 HA ASN 37 HA ASN 37 -6.085 3.536 9.236 1072 HB2 ASN 37 HB2 ASN 37 -3.618 3.865 10.999 1073 HB3 ASN 37 HB3 ASN 37 -3.734 4.218 9.276 1074 HD21 ASN 37 HD21 ASN 37 -2.851 5.999 11.274 1075 HD22 ASN 37 HD22 ASN 37 -3.950 7.329 11.326 1076 H VAL 38 H VAL 38 -4.405 2.254 8.044 1077 HA VAL 38 HA VAL 38 -4.362 -0.517 8.879 1078 HB VAL 38 HB VAL 38 -2.980 0.743 6.459 1079 HG11 VAL 38 HG11 VAL 38 -2.133 -1.503 7.009 1080 HG12 VAL 38 HG12 VAL 38 -3.059 -1.541 5.508 1081 HG13 VAL 38 HG13 VAL 38 -3.779 -2.145 7.003 1082 HG21 VAL 38 HG21 VAL 38 -5.760 -0.486 6.610 1083 HG22 VAL 38 HG22 VAL 38 -4.953 0.061 5.136 1084 HG23 VAL 38 HG23 VAL 38 -5.396 1.229 6.384 1085 H GLU 39 H GLU 39 -2.702 -1.546 9.842 1086 HA GLU 39 HA GLU 39 -0.500 -0.111 10.981 1087 HB2 GLU 39 HB2 GLU 39 -1.887 -2.375 11.686 1088 HB3 GLU 39 HB3 GLU 39 -0.474 -3.124 10.975 1089 HG2 GLU 39 HG2 GLU 39 -0.244 -1.040 13.159 1090 HG3 GLU 39 HG3 GLU 39 -0.546 -2.731 13.529 1091 H GLY 40 H GLY 40 -0.762 -2.758 8.578 1092 HA2 GLY 40 HA2 GLY 40 1.796 -1.921 7.313 1093 HA3 GLY 40 HA3 GLY 40 1.565 -3.595 7.810 1094 H ILE 41 H ILE 41 1.999 -2.505 5.113 1095 HA ILE 41 HA ILE 41 -0.416 -3.598 3.753 1096 HB ILE 41 HB ILE 41 1.165 -1.153 2.807 1097 HG12 ILE 41 HG12 ILE 41 -1.700 -1.268 3.849 1098 HG13 ILE 41 HG13 ILE 41 -0.326 -0.615 4.730 1099 HG21 ILE 41 HG21 ILE 41 -0.489 -0.955 0.991 1100 HG22 ILE 41 HG22 ILE 41 -1.271 -2.439 1.538 1101 HG23 ILE 41 HG23 ILE 41 0.376 -2.492 0.908 1102 HD11 ILE 41 HD11 ILE 41 -1.485 0.492 2.175 1103 HD12 ILE 41 HD12 ILE 41 -0.081 1.136 3.031 1104 HD13 ILE 41 HD13 ILE 41 -1.669 1.154 3.799 1105 H LEU 42 H LEU 42 0.063 -4.928 1.994 1106 HA LEU 42 HA LEU 42 2.699 -4.863 0.764 1107 HB2 LEU 42 HB2 LEU 42 3.089 -6.448 2.569 1108 HB3 LEU 42 HB3 LEU 42 1.649 -7.362 2.139 1109 HG LEU 42 HG LEU 42 2.690 -8.161 0.073 1110 HD11 LEU 42 HD11 LEU 42 5.103 -6.462 0.754 1111 HD12 LEU 42 HD12 LEU 42 3.975 -6.207 -0.579 1112 HD13 LEU 42 HD13 LEU 42 5.000 -7.638 -0.560 1113 HD21 LEU 42 HD21 LEU 42 4.552 -8.481 2.443 1114 HD22 LEU 42 HD22 LEU 42 4.514 -9.518 1.015 1115 HD23 LEU 42 HD23 LEU 42 3.119 -9.451 2.087 1116 H CYS 43 H CYS 43 1.843 -4.298 -1.145 1117 HA CYS 43 HA CYS 43 -0.251 -5.823 -2.481 1118 HB2 CYS 43 HB2 CYS 43 -0.184 -3.397 -2.816 1119 HB3 CYS 43 HB3 CYS 43 1.483 -3.478 -3.366 1120 HG CYS 43 HG CYS 43 0.988 -4.514 -5.802 1121 H LEU 44 H LEU 44 0.526 -7.835 -2.902 1122 HA LEU 44 HA LEU 44 3.093 -8.226 -4.262 1123 HB2 LEU 44 HB2 LEU 44 2.359 -9.769 -2.398 1124 HB3 LEU 44 HB3 LEU 44 1.040 -10.309 -3.425 1125 HG LEU 44 HG LEU 44 2.810 -11.078 -5.120 1126 HD11 LEU 44 HD11 LEU 44 4.687 -9.722 -4.339 1127 HD12 LEU 44 HD12 LEU 44 5.099 -11.436 -4.320 1128 HD13 LEU 44 HD13 LEU 44 4.712 -10.607 -2.808 1129 HD21 LEU 44 HD21 LEU 44 2.806 -12.422 -2.401 1130 HD22 LEU 44 HD22 LEU 44 3.346 -13.161 -3.911 1131 HD23 LEU 44 HD23 LEU 44 1.660 -12.695 -3.714 1132 HA PRO 45 HA PRO 45 0.379 -7.972 -7.950 1133 HB2 PRO 45 HB2 PRO 45 2.227 -7.001 -9.695 1134 HB3 PRO 45 HB3 PRO 45 1.463 -5.978 -8.460 1135 HG2 PRO 45 HG2 PRO 45 4.190 -7.204 -8.457 1136 HG3 PRO 45 HG3 PRO 45 3.672 -5.610 -7.875 1137 HD2 PRO 45 HD2 PRO 45 4.103 -7.836 -6.257 1138 HD3 PRO 45 HD3 PRO 45 3.131 -6.420 -5.806 1139 H ILE 46 H ILE 46 -0.071 -9.565 -9.303 1140 HA ILE 46 HA ILE 46 1.808 -11.766 -9.751 1141 HB ILE 46 HB ILE 46 -1.143 -11.514 -10.544 1142 HG12 ILE 46 HG12 ILE 46 -1.398 -13.378 -8.716 1143 HG13 ILE 46 HG13 ILE 46 0.181 -12.859 -8.146 1144 HG21 ILE 46 HG21 ILE 46 0.056 -13.029 -12.060 1145 HG22 ILE 46 HG22 ILE 46 -1.053 -13.938 -11.032 1146 HG23 ILE 46 HG23 ILE 46 0.677 -13.946 -10.682 1147 HD11 ILE 46 HD11 ILE 46 -1.636 -11.893 -6.867 1148 HD12 ILE 46 HD12 ILE 46 -2.279 -11.134 -8.323 1149 HD13 ILE 46 HD13 ILE 46 -0.702 -10.648 -7.693 1150 H GLN 47 H GLN 47 2.998 -11.831 -11.603 1151 HA GLN 47 HA GLN 47 2.533 -9.939 -13.771 1152 HB2 GLN 47 HB2 GLN 47 4.616 -10.872 -14.751 1153 HB3 GLN 47 HB3 GLN 47 4.822 -10.337 -13.098 1154 HG2 GLN 47 HG2 GLN 47 4.702 -12.676 -12.313 1155 HG3 GLN 47 HG3 GLN 47 4.523 -13.213 -13.984 1156 HE21 GLN 47 HE21 GLN 47 6.412 -14.440 -13.938 1157 HE22 GLN 47 HE22 GLN 47 7.991 -13.742 -13.883 1158 H ASP 48 H ASP 48 1.631 -13.149 -13.064 1159 HA ASP 48 HA ASP 48 1.607 -14.305 -15.639 1160 HB2 ASP 48 HB2 ASP 48 1.594 -15.668 -13.598 1161 HB3 ASP 48 HB3 ASP 48 0.034 -15.014 -13.123 1162 H SER 49 H SER 49 -0.797 -12.453 -13.828 1163 HA SER 49 HA SER 49 -2.257 -11.844 -16.296 1164 HB2 SER 49 HB2 SER 49 -3.704 -12.879 -13.805 1165 HB3 SER 49 HB3 SER 49 -4.473 -12.299 -15.285 1166 HG SER 49 HG SER 49 -2.809 -14.145 -16.064 1167 H ASP 50 H ASP 50 -3.817 -9.988 -15.915 1168 HA ASP 50 HA ASP 50 -2.554 -7.904 -14.372 1169 HB2 ASP 50 HB2 ASP 50 -5.211 -7.849 -15.888 1170 HB3 ASP 50 HB3 ASP 50 -4.381 -6.440 -15.231 1171 H LYS 51 H LYS 51 -2.689 -8.803 -12.286 1172 HA LYS 51 HA LYS 51 -4.965 -8.054 -10.717 1173 HB2 LYS 51 HB2 LYS 51 -5.416 -10.324 -9.763 1174 HB3 LYS 51 HB3 LYS 51 -5.795 -10.238 -11.479 1175 HG2 LYS 51 HG2 LYS 51 -3.514 -11.306 -11.918 1176 HG3 LYS 51 HG3 LYS 51 -3.415 -11.604 -10.180 1177 HD2 LYS 51 HD2 LYS 51 -5.605 -12.640 -12.028 1178 HD3 LYS 51 HD3 LYS 51 -4.229 -13.580 -11.453 1179 HE2 LYS 51 HE2 LYS 51 -6.330 -12.357 -9.630 1180 HE3 LYS 51 HE3 LYS 51 -6.362 -14.020 -10.213 1181 HZ1 LYS 51 HZ1 LYS 51 -4.275 -14.430 -9.101 1182 HZ2 LYS 51 HZ2 LYS 51 -5.425 -13.863 -8.004 1183 HZ3 LYS 51 HZ3 LYS 51 -4.208 -12.830 -8.552 1184 H SER 52 H SER 52 -4.480 -8.148 -8.452 1185 HA SER 52 HA SER 52 -1.793 -8.735 -7.525 1186 HB2 SER 52 HB2 SER 52 -1.471 -6.536 -8.663 1187 HB3 SER 52 HB3 SER 52 -2.782 -5.844 -7.704 1188 HG SER 52 HG SER 52 -1.321 -5.441 -6.279 1189 H HIS 53 H HIS 53 -2.013 -9.333 -5.388 1190 HA HIS 53 HA HIS 53 -4.489 -8.498 -3.993 1191 HB2 HIS 53 HB2 HIS 53 -4.134 -10.457 -2.485 1192 HB3 HIS 53 HB3 HIS 53 -4.417 -10.886 -4.166 1193 HD1 HIS 53 HD1 HIS 53 -2.387 -11.867 -5.491 1194 HD2 HIS 53 HD2 HIS 53 -1.712 -11.337 -1.441 1195 HE1 HIS 53 HE1 HIS 53 -0.336 -13.202 -4.975 1196 HE2 HIS 53 HE2 HIS 53 -0.094 -13.050 -2.486 1197 H ILE 54 H ILE 54 -4.338 -7.030 -2.529 1198 HA ILE 54 HA ILE 54 -1.761 -6.224 -1.373 1199 HB ILE 54 HB ILE 54 -4.460 -4.766 -1.350 1200 HG12 ILE 54 HG12 ILE 54 -3.242 -3.089 -2.895 1201 HG13 ILE 54 HG13 ILE 54 -2.011 -4.320 -3.110 1202 HG21 ILE 54 HG21 ILE 54 -3.101 -4.169 0.598 1203 HG22 ILE 54 HG22 ILE 54 -3.188 -2.809 -0.522 1204 HG23 ILE 54 HG23 ILE 54 -1.725 -3.794 -0.446 1205 HD11 ILE 54 HD11 ILE 54 -3.546 -4.245 -4.966 1206 HD12 ILE 54 HD12 ILE 54 -4.903 -4.563 -3.886 1207 HD13 ILE 54 HD13 ILE 54 -3.656 -5.790 -4.126 1208 H TRP 55 H TRP 55 -1.349 -7.066 0.626 1209 HA TRP 55 HA TRP 55 -3.443 -7.989 2.405 1210 HB2 TRP 55 HB2 TRP 55 -0.404 -7.925 2.612 1211 HB3 TRP 55 HB3 TRP 55 -1.414 -8.375 3.980 1212 HD1 TRP 55 HD1 TRP 55 -3.058 -10.583 3.512 1213 HE1 TRP 55 HE1 TRP 55 -2.428 -12.771 2.335 1214 HE3 TRP 55 HE3 TRP 55 0.854 -8.901 0.785 1215 HZ2 TRP 55 HZ2 TRP 55 -0.510 -13.667 0.469 1216 HZ3 TRP 55 HZ3 TRP 55 2.036 -10.463 -0.681 1217 HH2 TRP 55 HH2 TRP 55 1.366 -12.799 -0.839 1218 H LEU 56 H LEU 56 -4.545 -6.386 3.333 1219 HA LEU 56 HA LEU 56 -3.192 -4.084 4.545 1220 HB2 LEU 56 HB2 LEU 56 -6.147 -4.712 4.125 1221 HB3 LEU 56 HB3 LEU 56 -5.535 -3.247 4.887 1222 HG LEU 56 HG LEU 56 -4.939 -4.066 2.007 1223 HD11 LEU 56 HD11 LEU 56 -6.446 -2.276 1.315 1224 HD12 LEU 56 HD12 LEU 56 -6.873 -1.961 3.000 1225 HD13 LEU 56 HD13 LEU 56 -7.297 -3.503 2.251 1226 HD21 LEU 56 HD21 LEU 56 -3.150 -2.709 2.975 1227 HD22 LEU 56 HD22 LEU 56 -4.316 -1.482 3.479 1228 HD23 LEU 56 HD23 LEU 56 -4.035 -1.788 1.761 1229 H LEU 57 H LEU 57 -2.339 -4.636 6.401 1230 HA LEU 57 HA LEU 57 -3.524 -6.558 8.235 1231 HB2 LEU 57 HB2 LEU 57 -0.939 -4.932 8.419 1232 HB3 LEU 57 HB3 LEU 57 -1.463 -6.103 9.614 1233 HG LEU 57 HG LEU 57 0.212 -7.198 8.327 1234 HD11 LEU 57 HD11 LEU 57 -1.708 -8.611 8.814 1235 HD12 LEU 57 HD12 LEU 57 -0.913 -9.090 7.319 1236 HD13 LEU 57 HD13 LEU 57 -2.434 -8.194 7.256 1237 HD21 LEU 57 HD21 LEU 57 0.310 -5.711 6.394 1238 HD22 LEU 57 HD22 LEU 57 -1.207 -6.369 5.779 1239 HD23 LEU 57 HD23 LEU 57 0.230 -7.396 5.878 1240 H VAL 58 H VAL 58 -5.261 -5.697 9.147 1241 HA VAL 58 HA VAL 58 -5.049 -3.249 10.770 1242 HB VAL 58 HB VAL 58 -6.019 -2.662 8.481 1243 HG11 VAL 58 HG11 VAL 58 -8.368 -4.381 9.322 1244 HG12 VAL 58 HG12 VAL 58 -7.248 -4.714 7.999 1245 HG13 VAL 58 HG13 VAL 58 -8.322 -3.317 7.913 1246 HG21 VAL 58 HG21 VAL 58 -7.878 -2.206 10.843 1247 HG22 VAL 58 HG22 VAL 58 -7.889 -1.279 9.339 1248 HG23 VAL 58 HG23 VAL 58 -6.483 -1.214 10.403 1249 H ASN 59 H ASN 59 -6.581 -3.297 12.573 1250 HA ASN 59 HA ASN 59 -7.522 -5.941 13.289 1251 HB2 ASN 59 HB2 ASN 59 -8.451 -4.844 15.337 1252 HB3 ASN 59 HB3 ASN 59 -6.737 -4.539 15.089 1253 HD21 ASN 59 HD21 ASN 59 -6.826 -2.754 16.457 1254 HD22 ASN 59 HD22 ASN 59 -7.548 -1.259 15.977 1255 H ASP 60 H ASP 60 -9.708 -6.582 13.594 1256 HA ASP 60 HA ASP 60 -11.501 -5.730 11.527 1257 HB2 ASP 60 HB2 ASP 60 -11.357 -8.086 12.118 1258 HB3 ASP 60 HB3 ASP 60 -11.799 -7.748 13.782 1259 H ASP 61 H ASP 61 -13.706 -5.062 11.852 1260 HA ASP 61 HA ASP 61 -14.450 -3.711 14.332 1261 HB2 ASP 61 HB2 ASP 61 -13.167 -2.100 12.735 1262 HB3 ASP 61 HB3 ASP 61 -14.561 -2.219 11.673 1263 H GLN 62 H GLN 62 -16.817 -2.960 14.119 1264 HA GLN 62 HA GLN 62 -18.471 -4.991 12.932 1265 HB2 GLN 62 HB2 GLN 62 -19.204 -2.319 14.206 1266 HB3 GLN 62 HB3 GLN 62 -20.381 -3.537 13.710 1267 HG2 GLN 62 HG2 GLN 62 -19.414 -5.138 15.305 1268 HG3 GLN 62 HG3 GLN 62 -18.206 -3.946 15.783 1269 HE21 GLN 62 HE21 GLN 62 -18.867 -3.996 17.937 1270 HE22 GLN 62 HE22 GLN 62 -20.358 -3.301 18.471 1271 H ARG 63 H ARG 63 -17.506 -1.745 12.066 1272 HA ARG 63 HA ARG 63 -19.228 -1.517 9.751 1273 HB2 ARG 63 HB2 ARG 63 -18.598 0.470 11.111 1274 HB3 ARG 63 HB3 ARG 63 -16.912 0.255 10.644 1275 HG2 ARG 63 HG2 ARG 63 -17.449 0.757 8.305 1276 HG3 ARG 63 HG3 ARG 63 -19.176 0.799 8.680 1277 HD2 ARG 63 HD2 ARG 63 -17.072 2.716 9.723 1278 HD3 ARG 63 HD3 ARG 63 -18.270 3.067 8.471 1279 HE ARG 63 HE ARG 63 -19.820 2.325 10.557 1280 HH11 ARG 63 HH11 ARG 63 -17.223 4.680 10.333 1281 HH12 ARG 63 HH12 ARG 63 -17.874 5.696 11.578 1282 HH21 ARG 63 HH21 ARG 63 -20.645 3.629 12.201 1283 HH22 ARG 63 HH22 ARG 63 -19.828 5.094 12.646 1284 H LEU 64 H LEU 64 -16.051 -2.687 10.477 1285 HA LEU 64 HA LEU 64 -14.485 -2.448 8.265 1286 HB2 LEU 64 HB2 LEU 64 -14.379 -3.932 10.569 1287 HB3 LEU 64 HB3 LEU 64 -14.598 -5.221 9.422 1288 HG LEU 64 HG LEU 64 -12.249 -4.945 9.999 1289 HD11 LEU 64 HD11 LEU 64 -11.231 -4.747 7.804 1290 HD12 LEU 64 HD12 LEU 64 -12.731 -4.079 7.152 1291 HD13 LEU 64 HD13 LEU 64 -12.689 -5.735 7.768 1292 HD21 LEU 64 HD21 LEU 64 -12.233 -2.588 10.629 1293 HD22 LEU 64 HD22 LEU 64 -12.430 -2.110 8.940 1294 HD23 LEU 64 HD23 LEU 64 -10.957 -2.932 9.462 1295 H GLU 65 H GLU 65 -17.073 -4.851 8.709 1296 HA GLU 65 HA GLU 65 -16.626 -6.269 6.270 1297 HB2 GLU 65 HB2 GLU 65 -19.115 -6.266 8.023 1298 HB3 GLU 65 HB3 GLU 65 -18.648 -7.502 6.855 1299 HG2 GLU 65 HG2 GLU 65 -16.630 -8.004 8.240 1300 HG3 GLU 65 HG3 GLU 65 -17.181 -6.821 9.428 1301 H GLN 66 H GLN 66 -18.875 -3.709 7.248 1302 HA GLN 66 HA GLN 66 -20.449 -3.488 4.910 1303 HB2 GLN 66 HB2 GLN 66 -21.091 -2.377 6.993 1304 HB3 GLN 66 HB3 GLN 66 -19.602 -1.441 7.013 1305 HG2 GLN 66 HG2 GLN 66 -20.389 -0.249 4.951 1306 HG3 GLN 66 HG3 GLN 66 -21.917 -1.121 5.078 1307 HE21 GLN 66 HE21 GLN 66 -23.313 -0.633 6.834 1308 HE22 GLN 66 HE22 GLN 66 -23.171 0.843 7.710 1309 H MET 67 H MET 67 -17.433 -1.995 5.897 1310 HA MET 67 HA MET 67 -16.932 -0.246 3.740 1311 HB2 MET 67 HB2 MET 67 -15.928 -0.085 6.012 1312 HB3 MET 67 HB3 MET 67 -15.069 -1.591 5.745 1313 HG2 MET 67 HG2 MET 67 -13.835 -0.443 3.868 1314 HG3 MET 67 HG3 MET 67 -14.588 1.064 4.396 1315 HE1 MET 67 HE1 MET 67 -11.653 -1.429 6.943 1316 HE2 MET 67 HE2 MET 67 -12.084 -1.811 5.278 1317 HE3 MET 67 HE3 MET 67 -13.281 -1.991 6.564 1318 H ILE 68 H ILE 68 -15.986 -3.576 4.442 1319 HA ILE 68 HA ILE 68 -14.297 -4.096 2.238 1320 HB ILE 68 HB ILE 68 -15.839 -5.844 4.180 1321 HG12 ILE 68 HG12 ILE 68 -12.850 -5.579 3.613 1322 HG13 ILE 68 HG13 ILE 68 -13.713 -4.771 4.917 1323 HG21 ILE 68 HG21 ILE 68 -14.271 -6.953 1.835 1324 HG22 ILE 68 HG22 ILE 68 -16.004 -7.124 2.110 1325 HG23 ILE 68 HG23 ILE 68 -14.860 -7.904 3.200 1326 HD11 ILE 68 HD11 ILE 68 -14.256 -6.989 5.873 1327 HD12 ILE 68 HD12 ILE 68 -12.528 -6.655 5.785 1328 HD13 ILE 68 HD13 ILE 68 -13.272 -7.735 4.610 1329 H SER 69 H SER 69 -17.798 -4.711 2.745 1330 HA SER 69 HA SER 69 -18.317 -5.933 0.258 1331 HB2 SER 69 HB2 SER 69 -19.894 -6.052 2.190 1332 HB3 SER 69 HB3 SER 69 -20.269 -4.343 1.982 1333 HG SER 69 HG SER 69 -20.574 -5.674 -0.355 1334 H GLN 70 H GLN 70 -18.307 -2.553 1.301 1335 HA GLN 70 HA GLN 70 -19.613 -1.338 -0.855 1336 HB2 GLN 70 HB2 GLN 70 -18.902 -0.355 1.455 1337 HB3 GLN 70 HB3 GLN 70 -17.343 -0.039 0.714 1338 HG2 GLN 70 HG2 GLN 70 -19.974 1.081 -0.307 1339 HG3 GLN 70 HG3 GLN 70 -18.917 1.925 0.814 1340 HE21 GLN 70 HE21 GLN 70 -16.431 1.121 -0.574 1341 HE22 GLN 70 HE22 GLN 70 -16.384 2.059 -2.021 1342 H ILE 71 H ILE 71 -16.127 -1.863 -0.256 1343 HA ILE 71 HA ILE 71 -15.336 -0.777 -2.788 1344 HB ILE 71 HB ILE 71 -13.890 -0.641 -0.769 1345 HG12 ILE 71 HG12 ILE 71 -12.701 -1.963 -3.244 1346 HG13 ILE 71 HG13 ILE 71 -12.886 -0.239 -2.945 1347 HG21 ILE 71 HG21 ILE 71 -14.266 -2.883 0.173 1348 HG22 ILE 71 HG22 ILE 71 -12.545 -2.551 -0.020 1349 HG23 ILE 71 HG23 ILE 71 -13.372 -3.606 -1.169 1350 HD11 ILE 71 HD11 ILE 71 -11.033 -2.127 -1.523 1351 HD12 ILE 71 HD12 ILE 71 -11.249 -0.417 -1.125 1352 HD13 ILE 71 HD13 ILE 71 -10.606 -0.884 -2.699 1353 H ASP 72 H ASP 72 -16.080 -4.005 -1.609 1354 HA ASP 72 HA ASP 72 -14.890 -5.550 -3.652 1355 HB2 ASP 72 HB2 ASP 72 -15.605 -6.599 -1.580 1356 HB3 ASP 72 HB3 ASP 72 -17.277 -6.105 -1.835 1357 H LYS 73 H LYS 73 -17.933 -3.804 -3.485 1358 HA LYS 73 HA LYS 73 -19.201 -4.923 -5.780 1359 HB2 LYS 73 HB2 LYS 73 -19.648 -2.233 -4.426 1360 HB3 LYS 73 HB3 LYS 73 -20.716 -2.954 -5.630 1361 HG2 LYS 73 HG2 LYS 73 -21.255 -4.796 -4.122 1362 HG3 LYS 73 HG3 LYS 73 -20.074 -4.223 -2.959 1363 HD2 LYS 73 HD2 LYS 73 -22.335 -3.623 -2.245 1364 HD3 LYS 73 HD3 LYS 73 -21.385 -2.177 -2.591 1365 HE2 LYS 73 HE2 LYS 73 -22.506 -1.957 -4.773 1366 HE3 LYS 73 HE3 LYS 73 -23.430 -3.428 -4.453 1367 HZ1 LYS 73 HZ1 LYS 73 -23.555 -0.939 -2.842 1368 HZ2 LYS 73 HZ2 LYS 73 -24.465 -2.339 -2.577 1369 HZ3 LYS 73 HZ3 LYS 73 -24.706 -1.432 -3.977 1370 H LEU 74 H LEU 74 -16.642 -2.636 -5.444 1371 HA LEU 74 HA LEU 74 -16.883 -1.233 -7.913 1372 HB2 LEU 74 HB2 LEU 74 -14.601 -1.672 -5.973 1373 HB3 LEU 74 HB3 LEU 74 -14.261 -0.973 -7.538 1374 HG LEU 74 HG LEU 74 -14.458 0.752 -5.784 1375 HD11 LEU 74 HD11 LEU 74 -16.687 0.945 -7.833 1376 HD12 LEU 74 HD12 LEU 74 -14.990 1.366 -8.089 1377 HD13 LEU 74 HD13 LEU 74 -15.960 2.290 -6.944 1378 HD21 LEU 74 HD21 LEU 74 -16.552 1.267 -4.672 1379 HD22 LEU 74 HD22 LEU 74 -16.102 -0.405 -4.343 1380 HD23 LEU 74 HD23 LEU 74 -17.368 -0.055 -5.517 1381 H GLU 75 H GLU 75 -15.674 -1.486 -9.805 1382 HA GLU 75 HA GLU 75 -15.385 -4.112 -10.882 1383 HB2 GLU 75 HB2 GLU 75 -14.236 -1.518 -11.995 1384 HB3 GLU 75 HB3 GLU 75 -14.635 -2.980 -12.898 1385 HG2 GLU 75 HG2 GLU 75 -17.010 -2.601 -12.571 1386 HG3 GLU 75 HG3 GLU 75 -16.688 -1.247 -11.486 1387 H ASP 76 H ASP 76 -13.340 -2.050 -9.111 1388 HA ASP 76 HA ASP 76 -10.739 -2.721 -10.017 1389 HB2 ASP 76 HB2 ASP 76 -11.613 -1.689 -7.272 1390 HB3 ASP 76 HB3 ASP 76 -10.018 -1.523 -8.004 1391 H VAL 77 H VAL 77 -12.606 -3.734 -7.135 1392 HA VAL 77 HA VAL 77 -10.715 -5.802 -6.409 1393 HB VAL 77 HB VAL 77 -13.455 -5.107 -5.233 1394 HG11 VAL 77 HG11 VAL 77 -11.318 -6.991 -4.134 1395 HG12 VAL 77 HG12 VAL 77 -12.893 -7.471 -4.771 1396 HG13 VAL 77 HG13 VAL 77 -12.798 -6.514 -3.292 1397 HG21 VAL 77 HG21 VAL 77 -10.664 -4.460 -4.205 1398 HG22 VAL 77 HG22 VAL 77 -12.184 -4.065 -3.398 1399 HG23 VAL 77 HG23 VAL 77 -11.784 -3.309 -4.942 1400 H VAL 78 H VAL 78 -10.655 -7.475 -7.745 1401 HA VAL 78 HA VAL 78 -12.873 -8.660 -9.120 1402 HB VAL 78 HB VAL 78 -10.189 -10.004 -8.518 1403 HG11 VAL 78 HG11 VAL 78 -11.892 -11.514 -9.456 1404 HG12 VAL 78 HG12 VAL 78 -10.592 -11.246 -10.620 1405 HG13 VAL 78 HG13 VAL 78 -12.138 -10.417 -10.821 1406 HG21 VAL 78 HG21 VAL 78 -9.721 -7.782 -9.457 1407 HG22 VAL 78 HG22 VAL 78 -10.790 -8.113 -10.825 1408 HG23 VAL 78 HG23 VAL 78 -9.306 -9.049 -10.617 1409 H LYS 79 H LYS 79 -10.918 -9.511 -6.278 1410 HA LYS 79 HA LYS 79 -13.108 -11.035 -5.083 1411 HB2 LYS 79 HB2 LYS 79 -10.318 -12.181 -5.572 1412 HB3 LYS 79 HB3 LYS 79 -11.435 -12.853 -4.386 1413 HG2 LYS 79 HG2 LYS 79 -13.060 -13.316 -6.201 1414 HG3 LYS 79 HG3 LYS 79 -11.901 -12.692 -7.374 1415 HD2 LYS 79 HD2 LYS 79 -10.308 -14.495 -6.758 1416 HD3 LYS 79 HD3 LYS 79 -11.453 -15.094 -5.553 1417 HE2 LYS 79 HE2 LYS 79 -11.902 -15.033 -8.561 1418 HE3 LYS 79 HE3 LYS 79 -11.544 -16.461 -7.589 1419 HZ1 LYS 79 HZ1 LYS 79 -13.633 -16.088 -6.387 1420 HZ2 LYS 79 HZ2 LYS 79 -13.887 -16.336 -8.036 1421 HZ3 LYS 79 HZ3 LYS 79 -13.985 -14.777 -7.395 1422 H VAL 80 H VAL 80 -13.293 -10.475 -3.005 1423 HA VAL 80 HA VAL 80 -10.977 -9.296 -1.588 1424 HB VAL 80 HB VAL 80 -13.010 -7.937 -1.425 1425 HG11 VAL 80 HG11 VAL 80 -14.747 -9.654 -1.715 1426 HG12 VAL 80 HG12 VAL 80 -15.054 -8.674 -0.280 1427 HG13 VAL 80 HG13 VAL 80 -14.390 -10.301 -0.111 1428 HG21 VAL 80 HG21 VAL 80 -11.432 -8.005 0.492 1429 HG22 VAL 80 HG22 VAL 80 -12.424 -9.250 1.255 1430 HG23 VAL 80 HG23 VAL 80 -13.081 -7.634 0.992 1431 H GLN 81 H GLN 81 -9.877 -10.530 -0.179 1432 HA GLN 81 HA GLN 81 -11.037 -13.148 0.646 1433 HB2 GLN 81 HB2 GLN 81 -8.184 -12.416 -0.094 1434 HB3 GLN 81 HB3 GLN 81 -8.618 -13.929 0.699 1435 HG2 GLN 81 HG2 GLN 81 -9.886 -14.673 -1.192 1436 HG3 GLN 81 HG3 GLN 81 -9.825 -13.081 -1.948 1437 HE21 GLN 81 HE21 GLN 81 -7.958 -15.949 -1.169 1438 HE22 GLN 81 HE22 GLN 81 -6.704 -15.671 -2.318 1439 H ARG 82 H ARG 82 -11.463 -13.218 2.697 1440 HA ARG 82 HA ARG 82 -10.143 -11.395 4.624 1441 HB2 ARG 82 HB2 ARG 82 -12.928 -12.663 4.688 1442 HB3 ARG 82 HB3 ARG 82 -12.263 -11.599 5.922 1443 HG2 ARG 82 HG2 ARG 82 -12.250 -9.726 4.365 1444 HG3 ARG 82 HG3 ARG 82 -12.812 -10.772 3.053 1445 HD2 ARG 82 HD2 ARG 82 -14.621 -9.381 4.123 1446 HD3 ARG 82 HD3 ARG 82 -14.936 -11.120 4.148 1447 HE ARG 82 HE ARG 82 -13.627 -10.299 6.540 1448 HH11 ARG 82 HH11 ARG 82 -16.806 -10.168 5.029 1449 HH12 ARG 82 HH12 ARG 82 -17.644 -10.101 6.547 1450 HH21 ARG 82 HH21 ARG 82 -14.750 -10.299 8.503 1451 HH22 ARG 82 HH22 ARG 82 -16.478 -10.178 8.510 1452 H ASN 83 H ASN 83 -8.601 -12.631 5.616 1453 HA ASN 83 HA ASN 83 -9.440 -15.159 6.957 1454 HB2 ASN 83 HB2 ASN 83 -6.720 -14.524 5.700 1455 HB3 ASN 83 HB3 ASN 83 -7.056 -15.941 6.694 1456 HD21 ASN 83 HD21 ASN 83 -8.353 -17.611 5.836 1457 HD22 ASN 83 HD22 ASN 83 -8.665 -17.731 4.142 1458 H GLN 84 H GLN 84 -9.326 -14.906 9.163 1459 HA GLN 84 HA GLN 84 -7.646 -12.765 10.291 1460 HB2 GLN 84 HB2 GLN 84 -8.769 -13.305 12.451 1461 HB3 GLN 84 HB3 GLN 84 -9.885 -12.851 11.174 1462 HG2 GLN 84 HG2 GLN 84 -10.455 -15.249 10.855 1463 HG3 GLN 84 HG3 GLN 84 -9.388 -15.667 12.192 1464 HE21 GLN 84 HE21 GLN 84 -10.211 -13.272 13.778 1465 HE22 GLN 84 HE22 GLN 84 -11.796 -13.634 14.353 1466 H SER 85 H SER 85 -5.574 -13.292 10.449 1467 HA SER 85 HA SER 85 -4.609 -15.733 11.692 1468 HB2 SER 85 HB2 SER 85 -5.125 -16.416 9.298 1469 HB3 SER 85 HB3 SER 85 -3.969 -15.208 8.741 1470 HG SER 85 HG SER 85 -3.533 -17.662 10.022 1471 H ASP 86 H ASP 86 -2.033 -15.718 11.173 1472 HA ASP 86 HA ASP 86 -0.939 -13.300 12.270 1473 HB2 ASP 86 HB2 ASP 86 0.554 -15.656 11.025 1474 HB3 ASP 86 HB3 ASP 86 1.231 -14.443 12.111 1475 HA PRO 87 HA PRO 87 0.220 -11.264 8.328 1476 HB2 PRO 87 HB2 PRO 87 2.414 -9.918 9.842 1477 HB3 PRO 87 HB3 PRO 87 1.000 -9.205 9.033 1478 HG2 PRO 87 HG2 PRO 87 1.149 -9.272 11.687 1479 HG3 PRO 87 HG3 PRO 87 -0.400 -9.545 10.857 1480 HD2 PRO 87 HD2 PRO 87 1.514 -11.603 11.998 1481 HD3 PRO 87 HD3 PRO 87 -0.249 -11.460 12.229 1482 H THR 88 H THR 88 1.848 -13.738 9.621 1483 HA THR 88 HA THR 88 4.461 -13.602 8.573 1484 HB THR 88 HB THR 88 4.459 -16.104 8.889 1485 HG1 THR 88 HG1 THR 88 2.544 -17.021 9.786 1486 HG21 THR 88 HG21 THR 88 4.990 -14.637 10.798 1487 HG22 THR 88 HG22 THR 88 4.095 -16.059 11.342 1488 HG23 THR 88 HG23 THR 88 3.271 -14.503 11.190 1489 H MET 89 H MET 89 1.496 -13.868 6.899 1490 HA MET 89 HA MET 89 1.966 -15.322 4.606 1491 HB2 MET 89 HB2 MET 89 0.664 -12.562 4.778 1492 HB3 MET 89 HB3 MET 89 0.498 -13.674 3.422 1493 HG2 MET 89 HG2 MET 89 -0.462 -14.198 6.246 1494 HG3 MET 89 HG3 MET 89 -1.476 -13.710 4.884 1495 HE1 MET 89 HE1 MET 89 -2.562 -17.448 5.411 1496 HE2 MET 89 HE2 MET 89 -3.129 -15.791 5.207 1497 HE3 MET 89 HE3 MET 89 -2.200 -16.235 6.640 1498 H PHE 90 H PHE 90 3.278 -12.210 5.520 1499 HA PHE 90 HA PHE 90 4.640 -11.322 3.286 1500 HB2 PHE 90 HB2 PHE 90 4.420 -9.990 5.312 1501 HB3 PHE 90 HB3 PHE 90 5.294 -11.182 6.261 1502 HD1 PHE 90 HD1 PHE 90 5.685 -8.634 3.562 1503 HD2 PHE 90 HD2 PHE 90 7.683 -11.062 6.465 1504 HE1 PHE 90 HE1 PHE 90 7.769 -7.399 3.172 1505 HE2 PHE 90 HE2 PHE 90 9.759 -9.817 6.062 1506 HZ PHE 90 HZ PHE 90 9.801 -7.991 4.419 1507 H ASN 91 H ASN 91 5.863 -13.495 5.852 1508 HA ASN 91 HA ASN 91 8.402 -14.010 4.620 1509 HB2 ASN 91 HB2 ASN 91 8.162 -14.121 7.057 1510 HB3 ASN 91 HB3 ASN 91 6.946 -15.387 6.922 1511 HD21 ASN 91 HD21 ASN 91 10.357 -14.648 6.567 1512 HD22 ASN 91 HD22 ASN 91 10.912 -16.285 6.639 1513 H LYS 92 H LYS 92 5.288 -15.637 4.713 1514 HA LYS 92 HA LYS 92 5.982 -18.203 3.824 1515 HB2 LYS 92 HB2 LYS 92 3.384 -16.629 3.655 1516 HB3 LYS 92 HB3 LYS 92 3.503 -18.307 3.123 1517 HG2 LYS 92 HG2 LYS 92 4.032 -19.061 5.361 1518 HG3 LYS 92 HG3 LYS 92 4.188 -17.400 5.943 1519 HD2 LYS 92 HD2 LYS 92 2.036 -18.469 6.620 1520 HD3 LYS 92 HD3 LYS 92 1.808 -17.010 5.656 1521 HE2 LYS 92 HE2 LYS 92 0.247 -18.828 5.009 1522 HE3 LYS 92 HE3 LYS 92 1.300 -18.361 3.674 1523 HZ1 LYS 92 HZ1 LYS 92 2.690 -20.289 4.175 1524 HZ2 LYS 92 HZ2 LYS 92 1.102 -20.750 3.833 1525 HZ3 LYS 92 HZ3 LYS 92 1.651 -20.734 5.428 1526 H ILE 93 H ILE 93 5.032 -15.297 1.989 1527 HA ILE 93 HA ILE 93 5.236 -16.645 -0.570 1528 HB ILE 93 HB ILE 93 4.828 -14.457 -1.595 1529 HG12 ILE 93 HG12 ILE 93 5.050 -13.300 1.224 1530 HG13 ILE 93 HG13 ILE 93 6.218 -13.074 -0.060 1531 HG21 ILE 93 HG21 ILE 93 2.601 -13.993 -0.655 1532 HG22 ILE 93 HG22 ILE 93 3.008 -14.902 0.802 1533 HG23 ILE 93 HG23 ILE 93 2.893 -15.731 -0.753 1534 HD11 ILE 93 HD11 ILE 93 3.412 -12.026 0.000 1535 HD12 ILE 93 HD12 ILE 93 4.531 -11.858 -1.351 1536 HD13 ILE 93 HD13 ILE 93 4.904 -11.115 0.201 1537 H ALA 94 H ALA 94 7.352 -14.719 1.495 1538 HA ALA 94 HA ALA 94 9.177 -13.741 -0.392 1539 HB1 ALA 94 HB1 ALA 94 10.691 -13.376 1.515 1540 HB2 ALA 94 HB2 ALA 94 9.686 -14.423 2.524 1541 HB3 ALA 94 HB3 ALA 94 9.038 -12.900 1.908 1542 H VAL 95 H VAL 95 9.196 -16.793 1.428 1543 HA VAL 95 HA VAL 95 11.731 -17.719 0.591 1544 HB VAL 95 HB VAL 95 10.542 -18.614 2.576 1545 HG11 VAL 95 HG11 VAL 95 8.247 -18.681 1.722 1546 HG12 VAL 95 HG12 VAL 95 8.713 -20.256 2.369 1547 HG13 VAL 95 HG13 VAL 95 8.670 -19.996 0.622 1548 HG21 VAL 95 HG21 VAL 95 12.365 -19.944 1.592 1549 HG22 VAL 95 HG22 VAL 95 11.209 -20.788 0.558 1550 HG23 VAL 95 HG23 VAL 95 11.137 -20.992 2.310 1551 H PHE 96 H PHE 96 8.621 -17.725 -1.030 1552 HA PHE 96 HA PHE 96 9.457 -19.675 -3.064 1553 HB2 PHE 96 HB2 PHE 96 6.827 -18.177 -2.708 1554 HB3 PHE 96 HB3 PHE 96 7.135 -19.392 -3.949 1555 HD1 PHE 96 HD1 PHE 96 8.530 -21.539 -2.568 1556 HD2 PHE 96 HD2 PHE 96 5.288 -19.108 -1.177 1557 HE1 PHE 96 HE1 PHE 96 7.838 -23.329 -1.032 1558 HE2 PHE 96 HE2 PHE 96 4.612 -20.908 0.359 1559 HZ PHE 96 HZ PHE 96 5.884 -23.014 0.433 1560 H PHE 97 H PHE 97 8.560 -16.222 -2.920 1561 HA PHE 97 HA PHE 97 8.748 -15.887 -5.792 1562 HB2 PHE 97 HB2 PHE 97 7.928 -14.043 -3.517 1563 HB3 PHE 97 HB3 PHE 97 8.160 -13.424 -5.149 1564 HD1 PHE 97 HD2 PHE 97 6.080 -15.744 -3.087 1565 HD2 PHE 97 HD1 PHE 97 6.509 -13.782 -6.867 1566 HE1 PHE 97 HE2 PHE 97 3.784 -16.391 -3.686 1567 HE2 PHE 97 HE1 PHE 97 4.211 -14.435 -7.457 1568 HZ PHE 97 HZ PHE 97 2.848 -15.739 -5.871 1569 H GLN 98 H GLN 98 10.399 -14.445 -2.935 1570 HA GLN 98 HA GLN 98 12.895 -14.180 -4.310 1571 HB2 GLN 98 HB2 GLN 98 11.630 -12.299 -5.357 1572 HB3 GLN 98 HB3 GLN 98 11.350 -11.598 -3.767 1573 HG2 GLN 98 HG2 GLN 98 13.696 -11.111 -3.486 1574 HG3 GLN 98 HG3 GLN 98 14.118 -12.029 -4.934 1575 HE21 GLN 98 HE21 GLN 98 13.744 -11.120 -6.958 1576 HE22 GLN 98 HE22 GLN 98 13.390 -9.445 -7.184 Start of MODEL 20 1 H1 GLY 1 H1 GLY 1 9.790 8.712 -24.701 2 H2 GLY 1 H2 GLY 1 8.157 8.685 -25.146 3 H3 GLY 1 H3 GLY 1 9.352 8.459 -26.315 4 HA2 GLY 1 HA3 GLY 1 8.329 6.356 -25.759 5 HA3 GLY 1 HA2 GLY 1 10.024 6.386 -25.293 6 H SER 2 H SER 2 9.299 4.577 -23.905 7 HA SER 2 HA SER 2 9.124 5.392 -21.188 8 HB2 SER 2 HB2 SER 2 6.984 4.174 -20.613 9 HB3 SER 2 HB3 SER 2 6.715 5.609 -21.600 10 HG SER 2 HG SER 2 6.912 3.878 -23.399 11 H MET 3 H MET 3 9.602 3.649 -19.766 12 HA MET 3 HA MET 3 10.762 1.289 -21.091 13 HB2 MET 3 HB2 MET 3 12.019 0.957 -18.966 14 HB3 MET 3 HB3 MET 3 12.354 2.499 -19.734 15 HG2 MET 3 HG2 MET 3 10.489 2.152 -17.376 16 HG3 MET 3 HG3 MET 3 12.188 2.612 -17.255 17 HE1 MET 3 HE1 MET 3 10.666 6.064 -16.433 18 HE2 MET 3 HE2 MET 3 11.798 4.795 -15.964 19 HE3 MET 3 HE3 MET 3 10.060 4.510 -15.870 20 H GLN 4 H GLN 4 10.173 -0.780 -20.580 21 HA GLN 4 HA GLN 4 7.414 -1.056 -19.726 22 HB2 GLN 4 HB2 GLN 4 9.387 -2.964 -21.027 23 HB3 GLN 4 HB3 GLN 4 7.802 -3.499 -20.493 24 HG2 GLN 4 HG2 GLN 4 7.828 -3.066 -22.897 25 HG3 GLN 4 HG3 GLN 4 6.723 -1.972 -22.074 26 HE21 GLN 4 HE21 GLN 4 7.136 0.243 -22.142 27 HE22 GLN 4 HE22 GLN 4 8.375 0.936 -23.128 28 H ASN 5 H ASN 5 10.293 -3.105 -18.998 29 HA ASN 5 HA ASN 5 9.952 -3.072 -16.166 30 HB2 ASN 5 HB2 ASN 5 7.945 -4.446 -16.728 31 HB3 ASN 5 HB3 ASN 5 8.965 -5.605 -17.566 32 HD21 ASN 5 HD21 ASN 5 8.017 -4.356 -14.434 33 HD22 ASN 5 HD22 ASN 5 8.688 -5.639 -13.497 34 H THR 6 H THR 6 12.099 -2.946 -15.890 35 HA THR 6 HA THR 6 13.618 -5.434 -16.111 36 HB THR 6 HB THR 6 15.038 -2.802 -16.736 37 HG1 THR 6 HG1 THR 6 13.507 -3.075 -18.379 38 HG21 THR 6 HG21 THR 6 16.754 -4.250 -17.739 39 HG22 THR 6 HG22 THR 6 15.768 -5.681 -17.431 40 HG23 THR 6 HG23 THR 6 16.446 -4.769 -16.080 41 H THR 7 H THR 7 15.644 -5.149 -14.556 42 HA THR 7 HA THR 7 14.498 -4.760 -12.009 43 HB THR 7 HB THR 7 16.804 -5.362 -11.162 44 HG1 THR 7 HG1 THR 7 18.114 -6.144 -13.166 45 HG21 THR 7 HG21 THR 7 16.815 -7.657 -12.079 46 HG22 THR 7 HG22 THR 7 15.721 -7.163 -13.371 47 HG23 THR 7 HG23 THR 7 15.168 -7.149 -11.695 48 H HIS 8 H HIS 8 15.848 -2.322 -13.970 49 HA HIS 8 HA HIS 8 16.120 -0.570 -11.583 50 HB2 HIS 8 HB2 HIS 8 17.846 -0.404 -14.098 51 HB3 HIS 8 HB3 HIS 8 17.917 0.706 -12.731 52 HD1 HIS 8 HD1 HIS 8 18.792 -2.824 -13.723 53 HD2 HIS 8 HD2 HIS 8 19.375 -0.235 -10.518 54 HE1 HIS 8 HE1 HIS 8 20.446 -3.972 -12.221 55 HE2 HIS 8 HE2 HIS 8 20.866 -2.346 -10.359 56 H ASP 9 H ASP 9 14.325 -1.213 -14.286 57 HA ASP 9 HA ASP 9 13.554 1.431 -15.115 58 HB2 ASP 9 HB2 ASP 9 12.055 -1.234 -15.284 59 HB3 ASP 9 HB3 ASP 9 11.466 0.269 -15.995 60 H ASN 10 H ASN 10 12.363 -0.950 -12.825 61 HA ASN 10 HA ASN 10 10.325 0.739 -11.676 62 HB2 ASN 10 HB2 ASN 10 9.982 -1.101 -10.082 63 HB3 ASN 10 HB3 ASN 10 10.107 -1.760 -11.708 64 HD21 ASN 10 HD21 ASN 10 11.634 -1.558 -8.568 65 HD22 ASN 10 HD22 ASN 10 12.831 -2.766 -8.852 66 H VAL 11 H VAL 11 10.481 1.889 -9.790 67 HA VAL 11 HA VAL 11 13.181 2.292 -8.687 68 HB VAL 11 HB VAL 11 12.759 4.542 -8.188 69 HG11 VAL 11 HG11 VAL 11 12.089 5.592 -10.282 70 HG12 VAL 11 HG12 VAL 11 11.311 4.100 -10.813 71 HG13 VAL 11 HG13 VAL 11 13.060 4.154 -10.587 72 HG21 VAL 11 HG21 VAL 11 10.552 5.710 -8.304 73 HG22 VAL 11 HG22 VAL 11 10.589 4.441 -7.082 74 HG23 VAL 11 HG23 VAL 11 9.763 4.158 -8.612 75 H ILE 12 H ILE 12 13.482 2.126 -6.626 76 HA ILE 12 HA ILE 12 11.446 1.181 -4.796 77 HB ILE 12 HB ILE 12 14.396 1.822 -4.300 78 HG12 ILE 12 HG12 ILE 12 14.289 0.140 -6.088 79 HG13 ILE 12 HG13 ILE 12 14.883 -0.605 -4.614 80 HG21 ILE 12 HG21 ILE 12 12.473 0.087 -2.729 81 HG22 ILE 12 HG22 ILE 12 13.081 1.676 -2.254 82 HG23 ILE 12 HG23 ILE 12 14.189 0.312 -2.378 83 HD11 ILE 12 HD11 ILE 12 13.387 -2.089 -5.784 84 HD12 ILE 12 HD12 ILE 12 12.108 -0.877 -5.769 85 HD13 ILE 12 HD13 ILE 12 12.655 -1.602 -4.255 86 H LEU 13 H LEU 13 10.143 3.068 -4.827 87 HA LEU 13 HA LEU 13 11.237 5.613 -3.877 88 HB2 LEU 13 HB2 LEU 13 9.466 5.281 -5.780 89 HB3 LEU 13 HB3 LEU 13 8.306 5.043 -4.489 90 HG LEU 13 HG LEU 13 9.971 7.582 -4.831 91 HD11 LEU 13 HD11 LEU 13 8.546 7.290 -6.784 92 HD12 LEU 13 HD12 LEU 13 7.964 8.622 -5.791 93 HD13 LEU 13 HD13 LEU 13 7.127 7.068 -5.755 94 HD21 LEU 13 HD21 LEU 13 9.156 7.290 -2.528 95 HD22 LEU 13 HD22 LEU 13 7.503 7.107 -3.121 96 HD23 LEU 13 HD23 LEU 13 8.352 8.642 -3.325 97 H GLU 14 H GLU 14 11.793 5.102 -1.793 98 HA GLU 14 HA GLU 14 9.749 3.904 -0.042 99 HB2 GLU 14 HB2 GLU 14 11.678 3.166 1.351 100 HB3 GLU 14 HB3 GLU 14 11.646 2.467 -0.259 101 HG2 GLU 14 HG2 GLU 14 13.465 3.844 -0.990 102 HG3 GLU 14 HG3 GLU 14 13.404 4.825 0.474 103 H LEU 15 H LEU 15 8.791 5.230 1.273 104 HA LEU 15 HA LEU 15 10.221 7.603 2.326 105 HB2 LEU 15 HB2 LEU 15 7.770 8.592 2.438 106 HB3 LEU 15 HB3 LEU 15 8.686 8.639 0.950 107 HG LEU 15 HG LEU 15 7.396 6.579 0.174 108 HD11 LEU 15 HD11 LEU 15 6.595 5.731 2.306 109 HD12 LEU 15 HD12 LEU 15 5.248 6.054 1.219 110 HD13 LEU 15 HD13 LEU 15 5.602 7.171 2.541 111 HD21 LEU 15 HD21 LEU 15 5.397 7.841 -0.503 112 HD22 LEU 15 HD22 LEU 15 6.857 8.810 -0.671 113 HD23 LEU 15 HD23 LEU 15 5.768 9.092 0.689 114 H THR 16 H THR 16 9.991 8.100 4.461 115 HA THR 16 HA THR 16 8.756 6.115 6.247 116 HB THR 16 HB THR 16 10.523 8.516 6.942 117 HG1 THR 16 HG1 THR 16 12.193 7.138 6.891 118 HG21 THR 16 HG21 THR 16 10.746 7.436 9.152 119 HG22 THR 16 HG22 THR 16 9.663 6.138 8.655 120 HG23 THR 16 HG23 THR 16 9.047 7.784 8.822 121 H VAL 17 H VAL 17 6.660 6.534 6.672 122 HA VAL 17 HA VAL 17 5.836 9.327 7.264 123 HB VAL 17 HB VAL 17 3.596 8.858 6.638 124 HG11 VAL 17 HG11 VAL 17 5.057 9.239 4.711 125 HG12 VAL 17 HG12 VAL 17 3.719 8.177 4.272 126 HG13 VAL 17 HG13 VAL 17 5.329 7.503 4.544 127 HG21 VAL 17 HG21 VAL 17 4.265 5.896 6.427 128 HG22 VAL 17 HG22 VAL 17 2.723 6.616 5.961 129 HG23 VAL 17 HG23 VAL 17 3.242 6.662 7.644 130 H ARG 18 H ARG 18 4.663 9.627 9.221 131 HA ARG 18 HA ARG 18 4.567 7.306 11.065 132 HB2 ARG 18 HB2 ARG 18 4.159 8.956 12.866 133 HB3 ARG 18 HB3 ARG 18 5.690 9.211 12.047 134 HG2 ARG 18 HG2 ARG 18 4.634 11.065 10.745 135 HG3 ARG 18 HG3 ARG 18 3.160 10.848 11.694 136 HD2 ARG 18 HD2 ARG 18 5.893 11.652 12.739 137 HD3 ARG 18 HD3 ARG 18 4.466 12.683 12.614 138 HE ARG 18 HE ARG 18 4.158 10.316 14.289 139 HH11 ARG 18 HH11 ARG 18 4.999 13.742 14.270 140 HH12 ARG 18 HH12 ARG 18 4.682 13.939 15.966 141 HH21 ARG 18 HH21 ARG 18 3.782 10.590 16.498 142 HH22 ARG 18 HH22 ARG 18 3.995 12.155 17.231 143 H ASN 19 H ASN 19 2.546 6.883 12.203 144 HA ASN 19 HA ASN 19 0.569 6.583 10.174 145 HB2 ASN 19 HB2 ASN 19 1.242 4.805 11.867 146 HB3 ASN 19 HB3 ASN 19 0.318 5.686 13.076 147 HD21 ASN 19 HD21 ASN 19 -0.017 2.942 11.775 148 HD22 ASN 19 HD22 ASN 19 -1.652 2.916 11.234 149 H HIS 20 H HIS 20 -0.043 8.650 9.786 150 HA HIS 20 HA HIS 20 -1.900 10.057 11.590 151 HB2 HIS 20 HB2 HIS 20 -0.558 10.750 8.945 152 HB3 HIS 20 HB3 HIS 20 -1.883 11.718 9.558 153 HD1 HIS 20 HD1 HIS 20 -1.288 12.369 12.324 154 HD2 HIS 20 HD2 HIS 20 1.791 11.900 9.588 155 HE1 HIS 20 HE1 HIS 20 0.663 13.625 13.284 156 HE2 HIS 20 HE2 HIS 20 2.410 13.529 11.485 157 HA PRO 21 HA PRO 21 -5.772 8.609 9.818 158 HB2 PRO 21 HB2 PRO 21 -6.284 11.464 8.921 159 HB3 PRO 21 HB3 PRO 21 -7.364 10.339 9.777 160 HG2 PRO 21 HG2 PRO 21 -6.153 12.253 11.139 161 HG3 PRO 21 HG3 PRO 21 -6.259 10.612 11.828 162 HD2 PRO 21 HD2 PRO 21 -3.896 11.981 10.562 163 HD3 PRO 21 HD3 PRO 21 -3.949 10.867 11.945 164 H GLY 22 H GLY 22 -5.084 7.320 8.145 165 HA2 GLY 22 HA2 GLY 22 -5.131 6.496 6.019 166 HA3 GLY 22 HA3 GLY 22 -6.161 7.857 5.622 167 H VAL 23 H VAL 23 -2.702 7.741 6.581 168 HA VAL 23 HA VAL 23 -1.721 9.579 4.714 169 HB VAL 23 HB VAL 23 -0.132 7.177 5.751 170 HG11 VAL 23 HG11 VAL 23 1.830 8.667 5.486 171 HG12 VAL 23 HG12 VAL 23 0.788 9.922 4.819 172 HG13 VAL 23 HG13 VAL 23 1.005 8.399 3.950 173 HG21 VAL 23 HG21 VAL 23 -1.164 8.344 7.652 174 HG22 VAL 23 HG22 VAL 23 -0.482 9.874 7.099 175 HG23 VAL 23 HG23 VAL 23 0.586 8.574 7.636 176 H MET 24 H MET 24 -2.348 6.166 4.428 177 HA MET 24 HA MET 24 -0.874 5.502 2.135 178 HB2 MET 24 HB2 MET 24 -3.458 4.233 3.124 179 HB3 MET 24 HB3 MET 24 -2.271 3.482 2.058 180 HG2 MET 24 HG2 MET 24 -1.872 4.248 4.955 181 HG3 MET 24 HG3 MET 24 -1.997 2.615 4.297 182 HE1 MET 24 HE1 MET 24 1.791 2.989 5.466 183 HE2 MET 24 HE2 MET 24 0.300 2.077 5.699 184 HE3 MET 24 HE3 MET 24 0.399 3.760 6.225 185 H THR 25 H THR 25 -4.121 6.841 2.517 186 HA THR 25 HA THR 25 -4.940 6.648 -0.206 187 HB THR 25 HB THR 25 -5.945 8.700 1.827 188 HG1 THR 25 HG1 THR 25 -7.531 6.881 2.198 189 HG21 THR 25 HG21 THR 25 -6.840 8.962 -0.477 190 HG22 THR 25 HG22 THR 25 -8.097 8.427 0.639 191 HG23 THR 25 HG23 THR 25 -7.352 7.273 -0.470 192 H HIS 26 H HIS 26 -3.154 9.051 1.667 193 HA HIS 26 HA HIS 26 -3.188 11.182 -0.247 194 HB2 HIS 26 HB2 HIS 26 -1.430 10.648 2.187 195 HB3 HIS 26 HB3 HIS 26 -1.242 12.084 1.184 196 HD1 HIS 26 HD1 HIS 26 -2.325 14.034 2.249 197 HD2 HIS 26 HD2 HIS 26 -4.442 10.538 3.016 198 HE1 HIS 26 HE1 HIS 26 -4.277 14.718 3.670 199 HE2 HIS 26 HE2 HIS 26 -5.534 12.601 4.118 200 H VAL 27 H VAL 27 -0.675 8.741 0.632 201 HA VAL 27 HA VAL 27 1.282 9.683 -1.179 202 HB VAL 27 HB VAL 27 2.559 7.631 -0.746 203 HG11 VAL 27 HG11 VAL 27 2.607 9.369 0.991 204 HG12 VAL 27 HG12 VAL 27 2.781 7.768 1.706 205 HG13 VAL 27 HG13 VAL 27 1.236 8.617 1.812 206 HG21 VAL 27 HG21 VAL 27 0.780 5.937 -0.845 207 HG22 VAL 27 HG22 VAL 27 0.111 6.521 0.678 208 HG23 VAL 27 HG23 VAL 27 1.712 5.774 0.646 209 H CYS 28 H CYS 28 -1.047 7.000 -1.430 210 HA CYS 28 HA CYS 28 -0.397 6.121 -4.022 211 HB2 CYS 28 HB2 CYS 28 -2.983 5.912 -2.432 212 HB3 CYS 28 HB3 CYS 28 -2.680 5.034 -3.931 213 HG CYS 28 HG CYS 28 -1.998 4.142 -0.902 214 H GLY 29 H GLY 29 -2.465 8.711 -2.858 215 HA2 GLY 29 HA2 GLY 29 -3.854 9.437 -5.180 216 HA3 GLY 29 HA3 GLY 29 -3.390 10.528 -3.879 217 H LEU 30 H LEU 30 -0.628 10.485 -4.009 218 HA LEU 30 HA LEU 30 -0.113 12.314 -6.125 219 HB2 LEU 30 HB2 LEU 30 1.608 11.073 -3.992 220 HB3 LEU 30 HB3 LEU 30 2.408 11.871 -5.333 221 HG LEU 30 HG LEU 30 2.254 13.430 -3.500 222 HD11 LEU 30 HD11 LEU 30 2.003 14.393 -5.735 223 HD12 LEU 30 HD12 LEU 30 1.131 15.332 -4.530 224 HD13 LEU 30 HD13 LEU 30 0.247 14.256 -5.614 225 HD21 LEU 30 HD21 LEU 30 0.157 14.205 -2.503 226 HD22 LEU 30 HD22 LEU 30 0.386 12.478 -2.243 227 HD23 LEU 30 HD23 LEU 30 -0.752 13.039 -3.469 228 H PHE 31 H PHE 31 0.640 8.863 -5.783 229 HA PHE 31 HA PHE 31 2.340 8.787 -8.139 230 HB2 PHE 31 HB2 PHE 31 1.132 6.422 -6.646 231 HB3 PHE 31 HB3 PHE 31 2.527 6.392 -7.727 232 HD1 PHE 31 HD2 PHE 31 4.142 8.697 -6.853 233 HD2 PHE 31 HD1 PHE 31 1.947 5.886 -4.484 234 HE1 PHE 31 HE2 PHE 31 5.600 9.171 -4.926 235 HE2 PHE 31 HE1 PHE 31 3.410 6.382 -2.567 236 HZ PHE 31 HZ PHE 31 5.232 8.019 -2.784 237 H ALA 32 H ALA 32 -1.033 8.091 -7.461 238 HA ALA 32 HA ALA 32 -1.693 6.780 -9.921 239 HB1 ALA 32 HB1 ALA 32 -3.508 8.165 -7.912 240 HB2 ALA 32 HB2 ALA 32 -3.013 6.473 -7.859 241 HB3 ALA 32 HB3 ALA 32 -4.026 7.050 -9.182 242 H ARG 33 H ARG 33 -1.745 10.145 -8.818 243 HA ARG 33 HA ARG 33 -3.444 11.138 -10.921 244 HB2 ARG 33 HB2 ARG 33 -3.193 13.289 -9.909 245 HB3 ARG 33 HB3 ARG 33 -3.247 12.124 -8.594 246 HG2 ARG 33 HG2 ARG 33 -0.686 12.233 -8.573 247 HG3 ARG 33 HG3 ARG 33 -0.835 13.621 -9.648 248 HD2 ARG 33 HD2 ARG 33 -1.911 13.378 -6.823 249 HD3 ARG 33 HD3 ARG 33 -0.575 14.395 -7.371 250 HE ARG 33 HE ARG 33 -3.019 15.003 -8.733 251 HH11 ARG 33 HH11 ARG 33 -1.281 15.622 -5.725 252 HH12 ARG 33 HH12 ARG 33 -2.116 17.111 -5.425 253 HH21 ARG 33 HH21 ARG 33 -4.118 16.910 -8.292 254 HH22 ARG 33 HH22 ARG 33 -3.725 17.841 -6.879 255 H ARG 34 H ARG 34 -0.189 10.281 -10.923 256 HA ARG 34 HA ARG 34 0.815 12.095 -12.881 257 HB2 ARG 34 HB2 ARG 34 2.404 10.842 -11.567 258 HB3 ARG 34 HB3 ARG 34 1.638 9.310 -11.964 259 HG2 ARG 34 HG2 ARG 34 2.366 9.669 -14.364 260 HG3 ARG 34 HG3 ARG 34 3.307 11.055 -13.811 261 HD2 ARG 34 HD2 ARG 34 4.779 9.700 -12.556 262 HD3 ARG 34 HD3 ARG 34 3.661 8.332 -12.545 263 HE ARG 34 HE ARG 34 4.743 9.141 -15.136 264 HH11 ARG 34 HH11 ARG 34 4.886 6.895 -12.441 265 HH12 ARG 34 HH12 ARG 34 5.790 5.702 -13.315 266 HH21 ARG 34 HH21 ARG 34 5.930 7.562 -16.286 267 HH22 ARG 34 HH22 ARG 34 6.380 6.082 -15.506 268 H ALA 35 H ALA 35 0.145 8.597 -13.309 269 HA ALA 35 HA ALA 35 -1.571 8.626 -15.502 270 HB1 ALA 35 HB1 ALA 35 -0.032 8.285 -17.430 271 HB2 ALA 35 HB2 ALA 35 1.355 8.604 -16.380 272 HB3 ALA 35 HB3 ALA 35 0.186 9.880 -16.708 273 H PHE 36 H PHE 36 1.520 7.185 -14.506 274 HA PHE 36 HA PHE 36 0.534 4.462 -15.022 275 HB2 PHE 36 HB2 PHE 36 2.776 5.187 -15.939 276 HB3 PHE 36 HB3 PHE 36 3.360 5.381 -14.291 277 HD1 PHE 36 HD2 PHE 36 2.044 2.854 -16.724 278 HD2 PHE 36 HD1 PHE 36 4.225 3.475 -13.096 279 HE1 PHE 36 HE2 PHE 36 2.713 0.482 -16.710 280 HE2 PHE 36 HE1 PHE 36 4.885 1.103 -13.089 281 HZ PHE 36 HZ PHE 36 4.133 -0.394 -14.896 282 H ASN 37 H ASN 37 0.414 2.916 -13.398 283 HA ASN 37 HA ASN 37 -0.005 3.977 -10.678 284 HB2 ASN 37 HB2 ASN 37 -0.893 1.319 -11.875 285 HB3 ASN 37 HB3 ASN 37 -1.444 2.020 -10.357 286 HD21 ASN 37 HD21 ASN 37 -2.764 1.245 -12.991 287 HD22 ASN 37 HD22 ASN 37 -3.742 2.613 -13.382 288 H VAL 38 H VAL 38 0.442 2.351 -8.884 289 HA VAL 38 HA VAL 38 3.222 1.585 -8.997 290 HB VAL 38 HB VAL 38 1.246 1.199 -6.687 291 HG11 VAL 38 HG11 VAL 38 3.275 1.115 -5.269 292 HG12 VAL 38 HG12 VAL 38 4.287 1.239 -6.711 293 HG13 VAL 38 HG13 VAL 38 3.265 -0.178 -6.471 294 HG21 VAL 38 HG21 VAL 38 1.365 3.577 -7.319 295 HG22 VAL 38 HG22 VAL 38 3.126 3.537 -7.215 296 HG23 VAL 38 HG23 VAL 38 2.150 3.311 -5.761 297 H GLU 39 H GLU 39 4.077 -0.459 -8.877 298 HA GLU 39 HA GLU 39 2.443 -2.673 -9.878 299 HB2 GLU 39 HB2 GLU 39 4.541 -2.105 -11.042 300 HB3 GLU 39 HB3 GLU 39 5.453 -2.259 -9.544 301 HG2 GLU 39 HG2 GLU 39 4.807 -4.718 -9.535 302 HG3 GLU 39 HG3 GLU 39 4.156 -4.481 -11.152 303 H GLY 40 H GLY 40 4.684 -1.916 -7.211 304 HA2 GLY 40 HA2 GLY 40 3.526 -4.070 -5.539 305 HA3 GLY 40 HA3 GLY 40 5.268 -3.987 -5.778 306 H ILE 41 H ILE 41 3.561 -3.665 -3.341 307 HA ILE 41 HA ILE 41 4.664 -1.102 -2.342 308 HB ILE 41 HB ILE 41 1.813 -2.115 -1.769 309 HG12 ILE 41 HG12 ILE 41 2.734 0.334 -3.341 310 HG13 ILE 41 HG13 ILE 41 1.945 -1.090 -4.000 311 HG21 ILE 41 HG21 ILE 41 3.162 0.401 -0.709 312 HG22 ILE 41 HG22 ILE 41 2.793 -1.044 0.232 313 HG23 ILE 41 HG23 ILE 41 1.484 -0.069 -0.430 314 HD11 ILE 41 HD11 ILE 41 0.407 0.750 -3.862 315 HD12 ILE 41 HD12 ILE 41 0.703 0.926 -2.135 316 HD13 ILE 41 HD13 ILE 41 -0.092 -0.525 -2.752 317 H LEU 42 H LEU 42 5.347 -1.203 -0.194 318 HA LEU 42 HA LEU 42 4.668 -3.503 1.469 319 HB2 LEU 42 HB2 LEU 42 6.716 -4.286 0.388 320 HB3 LEU 42 HB3 LEU 42 7.544 -2.779 0.753 321 HG LEU 42 HG LEU 42 7.406 -3.321 3.198 322 HD11 LEU 42 HD11 LEU 42 5.454 -4.749 3.239 323 HD12 LEU 42 HD12 LEU 42 6.837 -5.590 3.935 324 HD13 LEU 42 HD13 LEU 42 6.295 -5.986 2.301 325 HD21 LEU 42 HD21 LEU 42 9.422 -3.834 1.954 326 HD22 LEU 42 HD22 LEU 42 8.782 -5.420 1.514 327 HD23 LEU 42 HD23 LEU 42 9.138 -5.043 3.203 328 H CYS 43 H CYS 43 3.566 -2.102 2.849 329 HA CYS 43 HA CYS 43 5.021 0.036 4.223 330 HB2 CYS 43 HB2 CYS 43 2.635 0.410 3.856 331 HB3 CYS 43 HB3 CYS 43 2.223 -1.101 4.666 332 HG CYS 43 HG CYS 43 2.761 -0.284 7.187 333 H LEU 44 H LEU 44 6.632 -0.877 5.328 334 HA LEU 44 HA LEU 44 6.287 -3.162 7.110 335 HB2 LEU 44 HB2 LEU 44 8.346 -2.751 5.661 336 HB3 LEU 44 HB3 LEU 44 8.697 -1.354 6.658 337 HG LEU 44 HG LEU 44 8.815 -3.002 8.648 338 HD11 LEU 44 HD11 LEU 44 8.995 -5.029 6.403 339 HD12 LEU 44 HD12 LEU 44 7.694 -4.902 7.593 340 HD13 LEU 44 HD13 LEU 44 9.320 -5.335 8.112 341 HD21 LEU 44 HD21 LEU 44 11.155 -3.608 8.154 342 HD22 LEU 44 HD22 LEU 44 10.812 -1.945 7.687 343 HD23 LEU 44 HD23 LEU 44 10.909 -3.202 6.452 344 HA PRO 45 HA PRO 45 5.215 0.028 10.292 345 HB2 PRO 45 HB2 PRO 45 4.457 -1.788 12.249 346 HB3 PRO 45 HB3 PRO 45 3.371 -1.228 10.963 347 HG2 PRO 45 HG2 PRO 45 4.938 -3.771 11.126 348 HG3 PRO 45 HG3 PRO 45 3.271 -3.509 10.567 349 HD2 PRO 45 HD2 PRO 45 5.330 -3.824 8.826 350 HD3 PRO 45 HD3 PRO 45 3.944 -2.770 8.466 351 H ILE 46 H ILE 46 7.061 0.885 11.021 352 HA ILE 46 HA ILE 46 9.340 -0.580 11.919 353 HB ILE 46 HB ILE 46 8.666 2.385 12.249 354 HG12 ILE 46 HG12 ILE 46 8.690 1.785 9.867 355 HG13 ILE 46 HG13 ILE 46 10.111 2.748 10.236 356 HG21 ILE 46 HG21 ILE 46 11.092 2.750 12.544 357 HG22 ILE 46 HG22 ILE 46 11.360 1.008 12.508 358 HG23 ILE 46 HG23 ILE 46 10.426 1.726 13.820 359 HD11 ILE 46 HD11 ILE 46 10.667 0.971 8.706 360 HD12 ILE 46 HD12 ILE 46 10.028 -0.243 9.811 361 HD13 ILE 46 HD13 ILE 46 11.470 0.678 10.248 362 H GLN 47 H GLN 47 9.131 -1.769 13.734 363 HA GLN 47 HA GLN 47 7.276 -1.359 15.823 364 HB2 GLN 47 HB2 GLN 47 8.393 -3.217 16.967 365 HB3 GLN 47 HB3 GLN 47 8.206 -3.569 15.261 366 HG2 GLN 47 HG2 GLN 47 10.554 -3.058 14.842 367 HG3 GLN 47 HG3 GLN 47 10.778 -2.601 16.529 368 HE21 GLN 47 HE21 GLN 47 12.170 -4.648 14.982 369 HE22 GLN 47 HE22 GLN 47 11.932 -6.133 15.827 370 H ASP 48 H ASP 48 10.288 0.080 15.281 371 HA ASP 48 HA ASP 48 11.243 0.422 17.921 372 HB2 ASP 48 HB2 ASP 48 12.757 0.473 16.021 373 HB3 ASP 48 HB3 ASP 48 11.908 1.832 15.302 374 H SER 49 H SER 49 9.248 2.444 15.779 375 HA SER 49 HA SER 49 8.496 4.223 17.999 376 HB2 SER 49 HB2 SER 49 9.666 5.266 15.378 377 HB3 SER 49 HB3 SER 49 8.931 6.273 16.627 378 HG SER 49 HG SER 49 11.153 4.574 17.109 379 H ASP 50 H ASP 50 6.702 5.856 17.135 380 HA ASP 50 HA ASP 50 4.655 4.314 15.818 381 HB2 ASP 50 HB2 ASP 50 3.175 6.253 16.214 382 HB3 ASP 50 HB3 ASP 50 4.050 5.822 17.674 383 H LYS 51 H LYS 51 5.762 3.921 13.841 384 HA LYS 51 HA LYS 51 5.075 5.693 11.697 385 HB2 LYS 51 HB2 LYS 51 7.431 5.935 10.800 386 HB3 LYS 51 HB3 LYS 51 7.111 6.858 12.260 387 HG2 LYS 51 HG2 LYS 51 8.405 5.355 13.620 388 HG3 LYS 51 HG3 LYS 51 8.500 4.163 12.324 389 HD2 LYS 51 HD2 LYS 51 10.638 5.396 12.627 390 HD3 LYS 51 HD3 LYS 51 9.960 5.622 11.016 391 HE2 LYS 51 HE2 LYS 51 10.818 7.743 11.830 392 HE3 LYS 51 HE3 LYS 51 9.058 7.839 11.758 393 HZ1 LYS 51 HZ1 LYS 51 9.016 7.382 14.155 394 HZ2 LYS 51 HZ2 LYS 51 9.861 8.791 13.791 395 HZ3 LYS 51 HZ3 LYS 51 10.706 7.385 14.186 396 H SER 52 H SER 52 5.593 4.830 9.636 397 HA SER 52 HA SER 52 6.360 2.019 9.412 398 HB2 SER 52 HB2 SER 52 3.815 3.219 8.208 399 HB3 SER 52 HB3 SER 52 4.405 1.581 7.941 400 HG SER 52 HG SER 52 4.286 1.843 10.534 401 H HIS 53 H HIS 53 7.680 1.750 7.671 402 HA HIS 53 HA HIS 53 8.116 4.011 5.803 403 HB2 HIS 53 HB2 HIS 53 10.032 2.937 7.201 404 HB3 HIS 53 HB3 HIS 53 9.880 1.538 6.150 405 HD1 HIS 53 HD1 HIS 53 11.723 4.571 6.492 406 HD2 HIS 53 HD2 HIS 53 10.322 2.392 3.250 407 HE1 HIS 53 HE1 HIS 53 13.117 5.284 4.545 408 HE2 HIS 53 HE2 HIS 53 12.449 3.745 2.714 409 H ILE 54 H ILE 54 7.474 3.763 3.654 410 HA ILE 54 HA ILE 54 6.378 1.121 2.856 411 HB ILE 54 HB ILE 54 5.390 3.835 1.825 412 HG12 ILE 54 HG12 ILE 54 3.225 3.187 3.138 413 HG13 ILE 54 HG13 ILE 54 4.245 2.082 4.046 414 HG21 ILE 54 HG21 ILE 54 4.274 1.025 1.479 415 HG22 ILE 54 HG22 ILE 54 5.088 1.986 0.239 416 HG23 ILE 54 HG23 ILE 54 3.528 2.507 0.875 417 HD11 ILE 54 HD11 ILE 54 4.579 5.074 3.895 418 HD12 ILE 54 HD12 ILE 54 5.574 3.966 4.843 419 HD13 ILE 54 HD13 ILE 54 3.864 4.168 5.228 420 H TRP 55 H TRP 55 7.438 0.177 1.234 421 HA TRP 55 HA TRP 55 9.164 1.679 -0.612 422 HB2 TRP 55 HB2 TRP 55 8.769 -1.303 -0.051 423 HB3 TRP 55 HB3 TRP 55 9.755 -0.715 -1.389 424 HD1 TRP 55 HD1 TRP 55 12.196 -0.045 -0.835 425 HE1 TRP 55 HE1 TRP 55 13.636 0.130 1.263 426 HE3 TRP 55 HE3 TRP 55 8.584 -0.792 2.639 427 HZ2 TRP 55 HZ2 TRP 55 13.307 -0.090 4.050 428 HZ3 TRP 55 HZ3 TRP 55 9.226 -0.798 4.994 429 HH2 TRP 55 HH2 TRP 55 11.535 -0.458 5.708 430 H LEU 56 H LEU 56 8.117 2.528 -2.312 431 HA LEU 56 HA LEU 56 5.862 1.137 -3.601 432 HB2 LEU 56 HB2 LEU 56 6.887 3.993 -3.946 433 HB3 LEU 56 HB3 LEU 56 5.574 3.299 -4.876 434 HG LEU 56 HG LEU 56 4.534 4.644 -3.249 435 HD11 LEU 56 HD11 LEU 56 3.195 3.137 -1.888 436 HD12 LEU 56 HD12 LEU 56 4.345 1.830 -2.172 437 HD13 LEU 56 HD13 LEU 56 3.425 2.504 -3.518 438 HD21 LEU 56 HD21 LEU 56 6.248 3.414 -1.068 439 HD22 LEU 56 HD22 LEU 56 4.965 4.606 -0.829 440 HD23 LEU 56 HD23 LEU 56 6.409 5.040 -1.739 441 H LEU 57 H LEU 57 6.622 -0.295 -5.009 442 HA LEU 57 HA LEU 57 8.864 0.197 -6.791 443 HB2 LEU 57 HB2 LEU 57 7.051 -2.162 -6.231 444 HB3 LEU 57 HB3 LEU 57 7.983 -2.126 -7.717 445 HG LEU 57 HG LEU 57 10.088 -2.111 -6.478 446 HD11 LEU 57 HD11 LEU 57 10.198 -2.340 -4.034 447 HD12 LEU 57 HD12 LEU 57 8.453 -2.075 -3.928 448 HD13 LEU 57 HD13 LEU 57 9.511 -0.794 -4.530 449 HD21 LEU 57 HD21 LEU 57 9.957 -4.357 -5.479 450 HD22 LEU 57 HD22 LEU 57 9.090 -4.261 -7.012 451 HD23 LEU 57 HD23 LEU 57 8.191 -4.258 -5.493 452 H VAL 58 H VAL 58 8.360 1.694 -8.241 453 HA VAL 58 HA VAL 58 6.303 1.179 -10.268 454 HB VAL 58 HB VAL 58 5.139 2.603 -8.544 455 HG11 VAL 58 HG11 VAL 58 7.040 3.826 -7.617 456 HG12 VAL 58 HG12 VAL 58 5.781 4.943 -8.141 457 HG13 VAL 58 HG13 VAL 58 7.233 4.725 -9.127 458 HG21 VAL 58 HG21 VAL 58 4.421 2.788 -10.880 459 HG22 VAL 58 HG22 VAL 58 5.612 4.058 -11.175 460 HG23 VAL 58 HG23 VAL 58 4.268 4.345 -10.066 461 H ASN 59 H ASN 59 6.961 2.179 -12.330 462 HA ASN 59 HA ASN 59 9.701 3.066 -12.427 463 HB2 ASN 59 HB2 ASN 59 9.393 3.417 -14.821 464 HB3 ASN 59 HB3 ASN 59 8.746 1.861 -14.351 465 HD21 ASN 59 HD21 ASN 59 7.535 1.719 -16.238 466 HD22 ASN 59 HD22 ASN 59 6.108 2.661 -16.494 467 H ASP 60 H ASP 60 10.489 5.198 -12.700 468 HA ASP 60 HA ASP 60 8.721 7.280 -11.690 469 HB2 ASP 60 HB2 ASP 60 10.680 8.599 -11.242 470 HB3 ASP 60 HB3 ASP 60 11.037 6.962 -10.718 471 H ASP 61 H ASP 61 9.089 9.471 -12.588 472 HA ASP 61 HA ASP 61 9.606 9.627 -15.467 473 HB2 ASP 61 HB2 ASP 61 7.082 9.258 -15.009 474 HB3 ASP 61 HB3 ASP 61 7.078 10.844 -14.250 475 H GLN 62 H GLN 62 9.980 11.868 -16.103 476 HA GLN 62 HA GLN 62 11.469 13.451 -14.325 477 HB2 GLN 62 HB2 GLN 62 10.037 14.267 -16.890 478 HB3 GLN 62 HB3 GLN 62 11.265 15.235 -16.077 479 HG2 GLN 62 HG2 GLN 62 12.945 13.479 -16.486 480 HG3 GLN 62 HG3 GLN 62 11.719 12.475 -17.258 481 HE21 GLN 62 HE21 GLN 62 10.920 13.105 -19.321 482 HE22 GLN 62 HE22 GLN 62 11.790 14.209 -20.331 483 H ARG 63 H ARG 63 8.061 13.425 -15.136 484 HA ARG 63 HA ARG 63 7.347 15.819 -13.686 485 HB2 ARG 63 HB2 ARG 63 6.162 15.009 -15.753 486 HB3 ARG 63 HB3 ARG 63 5.544 13.637 -14.837 487 HG2 ARG 63 HG2 ARG 63 4.387 15.243 -13.302 488 HG3 ARG 63 HG3 ARG 63 4.944 16.573 -14.320 489 HD2 ARG 63 HD2 ARG 63 3.061 14.331 -15.125 490 HD3 ARG 63 HD3 ARG 63 2.642 16.027 -14.884 491 HE ARG 63 HE ARG 63 3.951 14.826 -17.181 492 HH11 ARG 63 HH11 ARG 63 3.134 17.878 -15.600 493 HH12 ARG 63 HH12 ARG 63 3.317 18.804 -17.058 494 HH21 ARG 63 HH21 ARG 63 4.186 16.060 -19.066 495 HH22 ARG 63 HH22 ARG 63 3.912 17.773 -19.015 496 H LEU 64 H LEU 64 7.444 12.332 -13.002 497 HA LEU 64 HA LEU 64 5.654 12.113 -10.856 498 HB2 LEU 64 HB2 LEU 64 6.777 10.143 -11.922 499 HB3 LEU 64 HB3 LEU 64 8.287 10.614 -11.170 500 HG LEU 64 HG LEU 64 6.832 10.388 -8.902 501 HD11 LEU 64 HD11 LEU 64 5.231 8.593 -8.934 502 HD12 LEU 64 HD12 LEU 64 5.436 8.381 -10.675 503 HD13 LEU 64 HD13 LEU 64 4.716 9.868 -10.040 504 HD21 LEU 64 HD21 LEU 64 7.669 8.147 -8.553 505 HD22 LEU 64 HD22 LEU 64 8.888 9.118 -9.372 506 HD23 LEU 64 HD23 LEU 64 7.943 7.939 -10.280 507 H GLU 65 H GLU 65 8.989 13.225 -10.942 508 HA GLU 65 HA GLU 65 9.523 13.274 -8.164 509 HB2 GLU 65 HB2 GLU 65 10.831 14.860 -10.398 510 HB3 GLU 65 HB3 GLU 65 11.467 14.697 -8.761 511 HG2 GLU 65 HG2 GLU 65 11.532 12.198 -9.127 512 HG3 GLU 65 HG3 GLU 65 11.115 12.489 -10.809 513 H GLN 66 H GLN 66 7.894 15.568 -10.236 514 HA GLN 66 HA GLN 66 7.866 17.805 -8.459 515 HB2 GLN 66 HB2 GLN 66 5.784 17.039 -10.563 516 HB3 GLN 66 HB3 GLN 66 5.942 18.618 -9.799 517 HG2 GLN 66 HG2 GLN 66 8.003 17.319 -11.598 518 HG3 GLN 66 HG3 GLN 66 6.892 18.599 -12.066 519 HE21 GLN 66 HE21 GLN 66 9.823 18.574 -12.119 520 HE22 GLN 66 HE22 GLN 66 10.335 19.912 -11.154 521 H MET 67 H MET 67 5.687 15.003 -8.883 522 HA MET 67 HA MET 67 3.810 15.633 -6.845 523 HB2 MET 67 HB2 MET 67 4.656 12.925 -7.965 524 HB3 MET 67 HB3 MET 67 3.341 13.123 -6.811 525 HG2 MET 67 HG2 MET 67 2.395 12.892 -8.989 526 HG3 MET 67 HG3 MET 67 2.179 14.572 -8.492 527 HE1 MET 67 HE1 MET 67 1.871 13.499 -11.519 528 HE2 MET 67 HE2 MET 67 2.691 14.789 -12.396 529 HE3 MET 67 HE3 MET 67 1.615 15.185 -11.057 530 H ILE 68 H ILE 68 6.912 13.928 -6.794 531 HA ILE 68 HA ILE 68 6.910 13.094 -4.075 532 HB ILE 68 HB ILE 68 9.305 13.638 -5.901 533 HG12 ILE 68 HG12 ILE 68 7.890 10.981 -5.345 534 HG13 ILE 68 HG13 ILE 68 7.711 11.929 -6.815 535 HG21 ILE 68 HG21 ILE 68 10.597 12.140 -4.395 536 HG22 ILE 68 HG22 ILE 68 9.200 12.016 -3.326 537 HG23 ILE 68 HG23 ILE 68 10.006 13.569 -3.542 538 HD11 ILE 68 HD11 ILE 68 10.246 10.610 -5.853 539 HD12 ILE 68 HD12 ILE 68 10.094 11.602 -7.305 540 HD13 ILE 68 HD13 ILE 68 9.211 10.082 -7.180 541 H SER 69 H SER 69 8.025 16.028 -5.709 542 HA SER 69 HA SER 69 9.297 17.278 -3.476 543 HB2 SER 69 HB2 SER 69 8.267 18.471 -6.075 544 HB3 SER 69 HB3 SER 69 9.285 19.325 -4.913 545 HG SER 69 HG SER 69 10.098 16.843 -5.984 546 H GLN 70 H GLN 70 5.982 17.141 -4.603 547 HA GLN 70 HA GLN 70 5.091 19.363 -2.948 548 HB2 GLN 70 HB2 GLN 70 4.069 18.793 -5.191 549 HB3 GLN 70 HB3 GLN 70 3.444 17.299 -4.517 550 HG2 GLN 70 HG2 GLN 70 2.671 20.015 -3.412 551 HG3 GLN 70 HG3 GLN 70 1.827 19.280 -4.764 552 HE21 GLN 70 HE21 GLN 70 1.964 16.552 -3.675 553 HE22 GLN 70 HE22 GLN 70 0.851 16.515 -2.358 554 H ILE 71 H ILE 71 4.967 15.785 -2.905 555 HA ILE 71 HA ILE 71 3.058 15.557 -0.831 556 HB ILE 71 HB ILE 71 3.475 13.693 -2.430 557 HG12 ILE 71 HG12 ILE 71 3.769 12.986 0.528 558 HG13 ILE 71 HG13 ILE 71 2.268 13.148 -0.377 559 HG21 ILE 71 HG21 ILE 71 5.928 13.788 -2.551 560 HG22 ILE 71 HG22 ILE 71 5.368 12.159 -2.186 561 HG23 ILE 71 HG23 ILE 71 6.042 13.170 -0.905 562 HD11 ILE 71 HD11 ILE 71 4.355 11.007 -0.748 563 HD12 ILE 71 HD12 ILE 71 2.878 11.173 -1.705 564 HD13 ILE 71 HD13 ILE 71 2.779 10.834 0.022 565 H ASP 72 H ASP 72 6.641 15.552 -0.774 566 HA ASP 72 HA ASP 72 6.902 14.502 1.846 567 HB2 ASP 72 HB2 ASP 72 9.218 15.021 1.710 568 HB3 ASP 72 HB3 ASP 72 8.714 14.597 0.085 569 H LYS 73 H LYS 73 6.215 17.698 0.719 570 HA LYS 73 HA LYS 73 6.987 19.265 2.939 571 HB2 LYS 73 HB2 LYS 73 4.766 19.801 0.920 572 HB3 LYS 73 HB3 LYS 73 5.541 21.003 1.941 573 HG2 LYS 73 HG2 LYS 73 6.926 19.410 -0.236 574 HG3 LYS 73 HG3 LYS 73 6.336 21.065 -0.399 575 HD2 LYS 73 HD2 LYS 73 7.916 21.835 1.309 576 HD3 LYS 73 HD3 LYS 73 8.463 20.179 1.590 577 HE2 LYS 73 HE2 LYS 73 8.726 21.617 -1.069 578 HE3 LYS 73 HE3 LYS 73 9.986 21.546 0.149 579 HZ1 LYS 73 HZ1 LYS 73 8.778 19.192 -1.172 580 HZ2 LYS 73 HZ2 LYS 73 10.033 19.162 -0.044 581 HZ3 LYS 73 HZ3 LYS 73 10.279 19.867 -1.558 582 H LEU 74 H LEU 74 4.245 17.180 2.448 583 HA LEU 74 HA LEU 74 2.615 18.360 4.529 584 HB2 LEU 74 HB2 LEU 74 0.944 17.256 3.518 585 HB3 LEU 74 HB3 LEU 74 2.074 16.669 2.327 586 HG LEU 74 HG LEU 74 1.395 15.099 4.860 587 HD11 LEU 74 HD11 LEU 74 -0.668 15.493 3.574 588 HD12 LEU 74 HD12 LEU 74 -0.192 13.800 3.515 589 HD13 LEU 74 HD13 LEU 74 0.099 14.846 2.122 590 HD21 LEU 74 HD21 LEU 74 2.597 14.190 2.216 591 HD22 LEU 74 HD22 LEU 74 2.208 13.156 3.595 592 HD23 LEU 74 HD23 LEU 74 3.470 14.376 3.740 593 H GLU 75 H GLU 75 2.039 17.282 6.508 594 HA GLU 75 HA GLU 75 4.449 16.660 7.934 595 HB2 GLU 75 HB2 GLU 75 1.572 16.841 8.906 596 HB3 GLU 75 HB3 GLU 75 2.986 16.765 9.952 597 HG2 GLU 75 HG2 GLU 75 3.775 18.921 9.078 598 HG3 GLU 75 HG3 GLU 75 2.407 18.982 7.969 599 H ASP 76 H ASP 76 2.204 14.625 6.410 600 HA ASP 76 HA ASP 76 2.280 12.369 8.157 601 HB2 ASP 76 HB2 ASP 76 1.761 12.445 5.152 602 HB3 ASP 76 HB3 ASP 76 1.478 11.062 6.193 603 H VAL 77 H VAL 77 4.026 13.154 5.148 604 HA VAL 77 HA VAL 77 5.906 10.980 5.393 605 HB VAL 77 HB VAL 77 5.755 13.369 3.487 606 HG11 VAL 77 HG11 VAL 77 8.130 12.794 3.775 607 HG12 VAL 77 HG12 VAL 77 7.570 12.340 2.167 608 HG13 VAL 77 HG13 VAL 77 7.784 11.103 3.408 609 HG21 VAL 77 HG21 VAL 77 5.177 11.691 1.791 610 HG22 VAL 77 HG22 VAL 77 4.054 11.596 3.149 611 HG23 VAL 77 HG23 VAL 77 5.342 10.397 2.984 612 H VAL 78 H VAL 78 7.207 11.084 7.093 613 HA VAL 78 HA VAL 78 8.410 13.442 8.206 614 HB VAL 78 HB VAL 78 9.374 10.560 8.604 615 HG11 VAL 78 HG11 VAL 78 10.867 12.285 9.530 616 HG12 VAL 78 HG12 VAL 78 10.115 11.344 10.816 617 HG13 VAL 78 HG13 VAL 78 9.529 12.969 10.461 618 HG21 VAL 78 HG21 VAL 78 6.951 10.571 8.980 619 HG22 VAL 78 HG22 VAL 78 7.102 11.926 10.103 620 HG23 VAL 78 HG23 VAL 78 7.807 10.359 10.508 621 H LYS 79 H LYS 79 9.527 10.746 6.208 622 HA LYS 79 HA LYS 79 11.735 12.326 5.056 623 HB2 LYS 79 HB2 LYS 79 11.979 9.420 5.985 624 HB3 LYS 79 HB3 LYS 79 13.215 10.314 5.109 625 HG2 LYS 79 HG2 LYS 79 13.433 11.864 7.040 626 HG3 LYS 79 HG3 LYS 79 12.227 10.912 7.905 627 HD2 LYS 79 HD2 LYS 79 13.726 8.929 7.824 628 HD3 LYS 79 HD3 LYS 79 14.931 9.881 6.951 629 HE2 LYS 79 HE2 LYS 79 13.960 10.389 9.784 630 HE3 LYS 79 HE3 LYS 79 15.517 9.711 9.320 631 HZ1 LYS 79 HZ1 LYS 79 14.591 12.434 8.602 632 HZ2 LYS 79 HZ2 LYS 79 16.119 11.779 8.300 633 HZ3 LYS 79 HZ3 LYS 79 15.625 12.077 9.890 634 H VAL 80 H VAL 80 12.279 11.672 2.910 635 HA VAL 80 HA VAL 80 10.636 9.598 1.619 636 HB VAL 80 HB VAL 80 9.484 11.815 1.242 637 HG11 VAL 80 HG11 VAL 80 11.408 13.304 1.157 638 HG12 VAL 80 HG12 VAL 80 10.444 13.472 -0.310 639 HG13 VAL 80 HG13 VAL 80 11.957 12.563 -0.346 640 HG21 VAL 80 HG21 VAL 80 9.127 9.967 -0.330 641 HG22 VAL 80 HG22 VAL 80 10.523 10.469 -1.284 642 HG23 VAL 80 HG23 VAL 80 9.100 11.511 -1.185 643 H GLN 81 H GLN 81 11.654 8.557 -0.069 644 HA GLN 81 HA GLN 81 14.184 9.529 -1.160 645 HB2 GLN 81 HB2 GLN 81 14.786 8.265 0.921 646 HB3 GLN 81 HB3 GLN 81 13.946 6.851 0.303 647 HG2 GLN 81 HG2 GLN 81 15.572 6.674 -1.533 648 HG3 GLN 81 HG3 GLN 81 16.392 8.122 -0.958 649 HE21 GLN 81 HE21 GLN 81 15.141 5.567 1.168 650 HE22 GLN 81 HE22 GLN 81 16.689 5.015 1.690 651 H ARG 82 H ARG 82 14.560 8.688 -3.240 652 HA ARG 82 HA ARG 82 12.975 6.407 -4.179 653 HB2 ARG 82 HB2 ARG 82 12.337 7.521 -6.277 654 HB3 ARG 82 HB3 ARG 82 11.687 8.389 -4.900 655 HG2 ARG 82 HG2 ARG 82 12.382 10.186 -6.146 656 HG3 ARG 82 HG3 ARG 82 13.879 9.893 -5.266 657 HD2 ARG 82 HD2 ARG 82 14.674 8.522 -7.249 658 HD3 ARG 82 HD3 ARG 82 13.225 9.038 -8.111 659 HE ARG 82 HE ARG 82 14.043 11.248 -8.161 660 HH11 ARG 82 HH11 ARG 82 16.422 9.041 -6.770 661 HH12 ARG 82 HH12 ARG 82 17.742 10.139 -7.027 662 HH21 ARG 82 HH21 ARG 82 15.773 12.651 -8.471 663 HH22 ARG 82 HH22 ARG 82 17.378 12.186 -7.987 664 H ASN 83 H ASN 83 14.217 4.999 -5.225 665 HA ASN 83 HA ASN 83 16.741 5.734 -6.545 666 HB2 ASN 83 HB2 ASN 83 16.499 3.962 -4.080 667 HB3 ASN 83 HB3 ASN 83 17.787 3.670 -5.238 668 HD21 ASN 83 HD21 ASN 83 19.398 5.328 -5.516 669 HD22 ASN 83 HD22 ASN 83 19.682 6.492 -4.270 670 H GLN 84 H GLN 84 16.722 4.661 -8.463 671 HA GLN 84 HA GLN 84 14.848 2.439 -8.832 672 HB2 GLN 84 HB2 GLN 84 15.765 2.582 -11.302 673 HB3 GLN 84 HB3 GLN 84 14.617 3.760 -10.721 674 HG2 GLN 84 HG2 GLN 84 17.574 4.332 -10.711 675 HG3 GLN 84 HG3 GLN 84 16.598 4.563 -12.159 676 HE21 GLN 84 HE21 GLN 84 14.874 6.133 -12.073 677 HE22 GLN 84 HE22 GLN 84 14.952 7.456 -10.966 678 H SER 85 H SER 85 15.539 0.651 -8.043 679 HA SER 85 HA SER 85 18.163 -0.498 -8.693 680 HB2 SER 85 HB2 SER 85 18.350 0.725 -6.474 681 HB3 SER 85 HB3 SER 85 17.061 -0.294 -5.839 682 HG SER 85 HG SER 85 19.691 -1.002 -6.588 683 H ASP 86 H ASP 86 18.053 -2.826 -7.428 684 HA ASP 86 HA ASP 86 16.265 -4.275 -9.074 685 HB2 ASP 86 HB2 ASP 86 18.583 -4.996 -8.160 686 HB3 ASP 86 HB3 ASP 86 17.749 -5.436 -6.675 687 HA PRO 87 HA PRO 87 12.517 -4.125 -6.590 688 HB2 PRO 87 HB2 PRO 87 11.386 -6.556 -7.494 689 HB3 PRO 87 HB3 PRO 87 11.225 -4.978 -8.282 690 HG2 PRO 87 HG2 PRO 87 13.140 -7.194 -8.905 691 HG3 PRO 87 HG3 PRO 87 12.245 -6.127 -10.012 692 HD2 PRO 87 HD2 PRO 87 14.832 -5.707 -9.528 693 HD3 PRO 87 HD3 PRO 87 13.715 -4.331 -9.682 694 H THR 88 H THR 88 14.739 -6.886 -6.354 695 HA THR 88 HA THR 88 13.524 -8.334 -4.240 696 HB THR 88 HB THR 88 15.851 -9.244 -3.798 697 HG1 THR 88 HG1 THR 88 16.985 -8.186 -6.025 698 HG21 THR 88 HG21 THR 88 15.043 -9.254 -6.730 699 HG22 THR 88 HG22 THR 88 14.401 -10.335 -5.491 700 HG23 THR 88 HG23 THR 88 16.105 -10.422 -5.939 701 H MET 89 H MET 89 14.901 -5.226 -4.088 702 HA MET 89 HA MET 89 15.786 -4.929 -1.499 703 HB2 MET 89 HB2 MET 89 15.750 -3.071 -3.084 704 HB3 MET 89 HB3 MET 89 13.989 -3.077 -3.120 705 HG2 MET 89 HG2 MET 89 14.854 -1.228 -1.764 706 HG3 MET 89 HG3 MET 89 13.930 -2.354 -0.767 707 HE1 MET 89 HE1 MET 89 16.682 -1.130 1.750 708 HE2 MET 89 HE2 MET 89 14.952 -1.315 1.463 709 HE3 MET 89 HE3 MET 89 15.884 -0.151 0.520 710 H PHE 90 H PHE 90 12.353 -5.035 -2.635 711 HA PHE 90 HA PHE 90 11.134 -4.429 -0.172 712 HB2 PHE 90 HB2 PHE 90 9.052 -4.812 -1.163 713 HB3 PHE 90 HB3 PHE 90 10.033 -4.560 -2.592 714 HD1 PHE 90 HD1 PHE 90 8.111 -7.057 -0.638 715 HD2 PHE 90 HD2 PHE 90 10.451 -6.444 -4.166 716 HE1 PHE 90 HE1 PHE 90 7.335 -9.221 -1.535 717 HE2 PHE 90 HE2 PHE 90 9.675 -8.605 -5.051 718 HZ PHE 90 HZ PHE 90 8.120 -9.992 -3.737 719 H ASN 91 H ASN 91 12.100 -7.516 -1.592 720 HA ASN 91 HA ASN 91 10.993 -9.236 0.376 721 HB2 ASN 91 HB2 ASN 91 11.644 -10.015 -1.891 722 HB3 ASN 91 HB3 ASN 91 13.334 -9.687 -1.529 723 HD21 ASN 91 HD21 ASN 91 13.891 -11.846 -1.936 724 HD22 ASN 91 HD22 ASN 91 13.503 -13.125 -0.843 725 H LYS 92 H LYS 92 14.141 -7.661 -0.017 726 HA LYS 92 HA LYS 92 15.667 -9.004 1.868 727 HB2 LYS 92 HB2 LYS 92 16.619 -7.455 0.193 728 HB3 LYS 92 HB3 LYS 92 15.912 -6.083 1.038 729 HG2 LYS 92 HG2 LYS 92 18.309 -6.255 1.528 730 HG3 LYS 92 HG3 LYS 92 17.361 -6.526 2.989 731 HD2 LYS 92 HD2 LYS 92 17.680 -8.980 2.742 732 HD3 LYS 92 HD3 LYS 92 18.626 -8.707 1.276 733 HE2 LYS 92 HE2 LYS 92 20.087 -9.135 3.205 734 HE3 LYS 92 HE3 LYS 92 20.327 -7.498 2.596 735 HZ1 LYS 92 HZ1 LYS 92 20.227 -7.594 5.016 736 HZ2 LYS 92 HZ2 LYS 92 18.663 -8.221 4.948 737 HZ3 LYS 92 HZ3 LYS 92 18.969 -6.658 4.390 738 H ILE 93 H ILE 93 13.856 -5.917 2.423 739 HA ILE 93 HA ILE 93 14.475 -6.028 5.271 740 HB ILE 93 HB ILE 93 13.265 -3.989 5.616 741 HG12 ILE 93 HG12 ILE 93 11.332 -4.586 3.979 742 HG13 ILE 93 HG13 ILE 93 11.794 -2.903 4.131 743 HG21 ILE 93 HG21 ILE 93 14.446 -2.442 4.078 744 HG22 ILE 93 HG22 ILE 93 14.873 -3.805 3.043 745 HG23 ILE 93 HG23 ILE 93 15.503 -3.718 4.689 746 HD11 ILE 93 HD11 ILE 93 12.609 -4.730 1.886 747 HD12 ILE 93 HD12 ILE 93 12.989 -3.010 2.034 748 HD13 ILE 93 HD13 ILE 93 11.318 -3.531 1.842 749 H ALA 94 H ALA 94 11.789 -7.068 3.262 750 HA ALA 94 HA ALA 94 9.716 -7.198 5.169 751 HB1 ALA 94 HB1 ALA 94 8.633 -8.804 3.655 752 HB2 ALA 94 HB2 ALA 94 10.154 -9.015 2.778 753 HB3 ALA 94 HB3 ALA 94 9.331 -7.456 2.752 754 H VAL 95 H VAL 95 12.224 -9.581 4.317 755 HA VAL 95 HA VAL 95 11.368 -11.646 6.103 756 HB VAL 95 HB VAL 95 14.221 -11.210 5.085 757 HG11 VAL 95 HG11 VAL 95 14.489 -13.648 5.380 758 HG12 VAL 95 HG12 VAL 95 12.844 -13.767 6.002 759 HG13 VAL 95 HG13 VAL 95 14.062 -12.868 6.906 760 HG21 VAL 95 HG21 VAL 95 12.003 -12.766 3.726 761 HG22 VAL 95 HG22 VAL 95 13.685 -12.689 3.201 762 HG23 VAL 95 HG23 VAL 95 12.687 -11.239 3.175 763 H PHE 96 H PHE 96 13.627 -8.939 6.364 764 HA PHE 96 HA PHE 96 14.750 -9.791 8.890 765 HB2 PHE 96 HB2 PHE 96 15.961 -8.543 7.003 766 HB3 PHE 96 HB3 PHE 96 15.124 -7.087 7.527 767 HD1 PHE 96 HD1 PHE 96 17.311 -9.845 8.871 768 HD2 PHE 96 HD2 PHE 96 16.220 -5.716 9.126 769 HE1 PHE 96 HE1 PHE 96 19.113 -9.462 10.490 770 HE2 PHE 96 HE2 PHE 96 18.031 -5.342 10.749 771 HZ PHE 96 HZ PHE 96 19.480 -7.217 11.433 772 H PHE 97 H PHE 97 12.011 -7.989 7.946 773 HA PHE 97 HA PHE 97 10.188 -7.356 9.063 774 HB2 PHE 97 HB2 PHE 97 11.653 -8.218 11.577 775 HB3 PHE 97 HB3 PHE 97 9.994 -7.633 11.573 776 HD1 PHE 97 HD1 PHE 97 8.403 -8.878 9.794 777 HD2 PHE 97 HD2 PHE 97 11.944 -10.550 11.519 778 HE1 PHE 97 HE1 PHE 97 7.556 -11.145 9.354 779 HE2 PHE 97 HE2 PHE 97 11.086 -12.815 11.071 780 HZ PHE 97 HZ PHE 97 8.892 -13.110 9.996 781 H GLN 98 H GLN 98 13.199 -5.833 9.925 782 HA GLN 98 HA GLN 98 12.041 -3.239 9.850 783 HB2 GLN 98 HB2 GLN 98 11.480 -4.143 12.259 784 HB3 GLN 98 HB3 GLN 98 13.188 -3.942 12.600 785 HG2 GLN 98 HG2 GLN 98 11.359 -1.691 11.700 786 HG3 GLN 98 HG3 GLN 98 11.704 -2.070 13.381 787 HE21 GLN 98 HE21 GLN 98 14.527 -2.618 13.002 788 HE22 GLN 98 HE22 GLN 98 15.293 -1.109 12.671 789 H1 GLY 1 H1 GLY 1 -14.053 0.424 24.443 790 H2 GLY 1 H2 GLY 1 -15.677 -0.040 24.529 791 H3 GLY 1 H3 GLY 1 -15.148 0.960 23.272 792 HA2 GLY 1 HA3 GLY 1 -14.316 -1.845 23.703 793 HA3 GLY 1 HA2 GLY 1 -15.480 -1.306 22.506 794 H SER 2 H SER 2 -12.231 -1.929 23.139 795 HA SER 2 HA SER 2 -11.374 -1.135 20.490 796 HB2 SER 2 HB2 SER 2 -9.387 0.180 21.422 797 HB3 SER 2 HB3 SER 2 -10.946 0.977 21.616 798 HG SER 2 HG SER 2 -9.911 -0.651 23.687 799 H MET 3 H MET 3 -10.511 -2.991 19.871 800 HA MET 3 HA MET 3 -9.076 -4.827 21.565 801 HB2 MET 3 HB2 MET 3 -8.648 -6.060 19.383 802 HB3 MET 3 HB3 MET 3 -10.338 -5.798 19.767 803 HG2 MET 3 HG2 MET 3 -8.833 -3.990 17.870 804 HG3 MET 3 HG3 MET 3 -9.680 -5.449 17.342 805 HE1 MET 3 HE1 MET 3 -11.974 -2.302 16.304 806 HE2 MET 3 HE2 MET 3 -10.940 -3.581 15.668 807 HE3 MET 3 HE3 MET 3 -10.229 -2.205 16.510 808 H GLN 4 H GLN 4 -6.792 -5.208 21.590 809 HA GLN 4 HA GLN 4 -5.350 -2.661 21.247 810 HB2 GLN 4 HB2 GLN 4 -5.646 -3.846 23.494 811 HB3 GLN 4 HB3 GLN 4 -4.570 -5.099 22.916 812 HG2 GLN 4 HG2 GLN 4 -3.746 -2.194 23.147 813 HG3 GLN 4 HG3 GLN 4 -3.573 -3.350 24.463 814 HE21 GLN 4 HE21 GLN 4 -2.068 -5.094 24.189 815 HE22 GLN 4 HE22 GLN 4 -0.752 -4.954 23.081 816 H ASN 5 H ASN 5 -4.104 -6.040 21.286 817 HA ASN 5 HA ASN 5 -3.515 -6.295 18.571 818 HB2 ASN 5 HB2 ASN 5 -1.345 -5.613 18.170 819 HB3 ASN 5 HB3 ASN 5 -1.702 -4.466 19.442 820 HD21 ASN 5 HD21 ASN 5 0.120 -7.296 18.564 821 HD22 ASN 5 HD22 ASN 5 1.149 -7.304 19.952 822 H THR 6 H THR 6 -3.243 -8.346 18.169 823 HA THR 6 HA THR 6 -1.827 -10.307 19.680 824 HB THR 6 HB THR 6 -3.922 -11.887 19.844 825 HG1 THR 6 HG1 THR 6 -5.259 -9.373 19.886 826 HG21 THR 6 HG21 THR 6 -4.515 -11.220 22.129 827 HG22 THR 6 HG22 THR 6 -3.743 -9.652 21.890 828 HG23 THR 6 HG23 THR 6 -2.768 -11.123 21.887 829 H THR 7 H THR 7 -2.300 -12.575 18.501 830 HA THR 7 HA THR 7 -2.112 -12.099 15.638 831 HB THR 7 HB THR 7 -1.781 -14.628 15.539 832 HG1 THR 7 HG1 THR 7 -2.577 -15.587 17.285 833 HG21 THR 7 HG21 THR 7 0.448 -14.586 16.628 834 HG22 THR 7 HG22 THR 7 0.017 -13.087 17.453 835 HG23 THR 7 HG23 THR 7 0.162 -13.116 15.694 836 H HIS 8 H HIS 8 -4.768 -12.224 17.545 837 HA HIS 8 HA HIS 8 -6.482 -13.069 15.277 838 HB2 HIS 8 HB2 HIS 8 -8.245 -13.669 16.909 839 HB3 HIS 8 HB3 HIS 8 -6.785 -14.601 17.200 840 HD1 HIS 8 HD1 HIS 8 -8.814 -11.782 18.675 841 HD2 HIS 8 HD2 HIS 8 -5.685 -14.300 19.746 842 HE1 HIS 8 HE1 HIS 8 -8.478 -11.433 21.135 843 HE2 HIS 8 HE2 HIS 8 -6.717 -13.097 21.789 844 H ASP 9 H ASP 9 -5.190 -10.439 16.356 845 HA ASP 9 HA ASP 9 -7.578 -8.728 16.746 846 HB2 ASP 9 HB2 ASP 9 -5.486 -8.753 18.325 847 HB3 ASP 9 HB3 ASP 9 -4.657 -7.903 17.042 848 H ASN 10 H ASN 10 -4.372 -8.632 15.144 849 HA ASN 10 HA ASN 10 -5.235 -6.810 13.092 850 HB2 ASN 10 HB2 ASN 10 -3.000 -7.048 12.130 851 HB3 ASN 10 HB3 ASN 10 -2.835 -6.867 13.870 852 HD21 ASN 10 HD21 ASN 10 -2.456 -9.055 11.158 853 HD22 ASN 10 HD22 ASN 10 -1.576 -10.269 12.010 854 H VAL 11 H VAL 11 -5.890 -7.324 11.071 855 HA VAL 11 HA VAL 11 -6.442 -10.162 10.524 856 HB VAL 11 HB VAL 11 -8.401 -9.645 9.347 857 HG11 VAL 11 HG11 VAL 11 -9.786 -8.364 10.888 858 HG12 VAL 11 HG12 VAL 11 -8.352 -7.634 11.613 859 HG13 VAL 11 HG13 VAL 11 -8.640 -9.367 11.771 860 HG21 VAL 11 HG21 VAL 11 -9.166 -7.367 8.659 861 HG22 VAL 11 HG22 VAL 11 -7.666 -7.845 7.872 862 HG23 VAL 11 HG23 VAL 11 -7.624 -6.698 9.207 863 H ILE 12 H ILE 12 -5.838 -10.995 8.715 864 HA ILE 12 HA ILE 12 -4.157 -9.610 6.808 865 HB ILE 12 HB ILE 12 -5.138 -12.508 6.836 866 HG12 ILE 12 HG12 ILE 12 -3.936 -12.104 8.943 867 HG13 ILE 12 HG13 ILE 12 -2.971 -13.136 7.902 868 HG21 ILE 12 HG21 ILE 12 -2.788 -11.241 5.409 869 HG22 ILE 12 HG22 ILE 12 -4.295 -11.791 4.667 870 HG23 ILE 12 HG23 ILE 12 -3.199 -12.958 5.403 871 HD11 ILE 12 HD11 ILE 12 -1.582 -11.545 9.061 872 HD12 ILE 12 HD12 ILE 12 -2.526 -10.197 8.430 873 HD13 ILE 12 HD13 ILE 12 -1.562 -11.189 7.334 874 H LEU 13 H LEU 13 -5.757 -8.159 6.034 875 HA LEU 13 HA LEU 13 -8.146 -9.199 4.702 876 HB2 LEU 13 HB2 LEU 13 -7.990 -7.039 6.175 877 HB3 LEU 13 HB3 LEU 13 -7.265 -6.282 4.772 878 HG LEU 13 HG LEU 13 -10.052 -7.533 4.780 879 HD11 LEU 13 HD11 LEU 13 -9.999 -5.689 6.368 880 HD12 LEU 13 HD12 LEU 13 -10.940 -5.248 4.948 881 HD13 LEU 13 HD13 LEU 13 -9.305 -4.615 5.149 882 HD21 LEU 13 HD21 LEU 13 -9.094 -7.377 2.521 883 HD22 LEU 13 HD22 LEU 13 -8.784 -5.654 2.755 884 HD23 LEU 13 HD23 LEU 13 -10.442 -6.259 2.721 885 H GLU 14 H GLU 14 -7.270 -10.323 3.006 886 HA GLU 14 HA GLU 14 -5.355 -8.943 1.241 887 HB2 GLU 14 HB2 GLU 14 -4.624 -11.232 0.584 888 HB3 GLU 14 HB3 GLU 14 -4.341 -10.840 2.272 889 HG2 GLU 14 HG2 GLU 14 -6.132 -12.261 2.996 890 HG3 GLU 14 HG3 GLU 14 -6.700 -12.501 1.342 891 H LEU 15 H LEU 15 -6.183 -8.206 -0.542 892 HA LEU 15 HA LEU 15 -8.420 -9.632 -1.865 893 HB2 LEU 15 HB2 LEU 15 -8.930 -7.209 -2.797 894 HB3 LEU 15 HB3 LEU 15 -9.484 -7.695 -1.213 895 HG LEU 15 HG LEU 15 -7.482 -6.466 -0.215 896 HD11 LEU 15 HD11 LEU 15 -6.028 -6.339 -2.159 897 HD12 LEU 15 HD12 LEU 15 -6.372 -4.731 -1.530 898 HD13 LEU 15 HD13 LEU 15 -7.185 -5.298 -2.992 899 HD21 LEU 15 HD21 LEU 15 -8.516 -4.243 -0.371 900 HD22 LEU 15 HD22 LEU 15 -9.726 -5.503 -0.150 901 HD23 LEU 15 HD23 LEU 15 -9.492 -4.780 -1.744 902 H THR 16 H THR 16 -8.347 -9.920 -4.053 903 HA THR 16 HA THR 16 -5.812 -9.421 -5.462 904 HB THR 16 HB THR 16 -8.246 -11.044 -6.368 905 HG1 THR 16 HG1 THR 16 -7.108 -12.836 -5.700 906 HG21 THR 16 HG21 THR 16 -6.717 -11.971 -8.079 907 HG22 THR 16 HG22 THR 16 -5.417 -10.926 -7.513 908 HG23 THR 16 HG23 THR 16 -6.854 -10.221 -8.261 909 H VAL 17 H VAL 17 -5.768 -7.462 -6.444 910 HA VAL 17 HA VAL 17 -8.169 -6.545 -7.941 911 HB VAL 17 HB VAL 17 -7.500 -4.278 -7.734 912 HG11 VAL 17 HG11 VAL 17 -8.562 -5.140 -5.705 913 HG12 VAL 17 HG12 VAL 17 -7.431 -3.848 -5.307 914 HG13 VAL 17 HG13 VAL 17 -6.986 -5.533 -5.017 915 HG21 VAL 17 HG21 VAL 17 -4.824 -5.161 -6.581 916 HG22 VAL 17 HG22 VAL 17 -5.370 -3.486 -6.688 917 HG23 VAL 17 HG23 VAL 17 -5.099 -4.419 -8.158 918 H ARG 18 H ARG 18 -7.803 -5.904 -10.119 919 HA ARG 18 HA ARG 18 -5.131 -6.522 -11.244 920 HB2 ARG 18 HB2 ARG 18 -6.221 -6.423 -13.464 921 HB3 ARG 18 HB3 ARG 18 -6.908 -7.659 -12.427 922 HG2 ARG 18 HG2 ARG 18 -8.825 -6.127 -11.948 923 HG3 ARG 18 HG3 ARG 18 -8.148 -4.972 -13.098 924 HD2 ARG 18 HD2 ARG 18 -9.119 -7.785 -13.705 925 HD3 ARG 18 HD3 ARG 18 -9.896 -6.273 -14.183 926 HE ARG 18 HE ARG 18 -7.171 -6.640 -15.163 927 HH11 ARG 18 HH11 ARG 18 -10.585 -7.113 -15.914 928 HH12 ARG 18 HH12 ARG 18 -10.307 -7.219 -17.624 929 HH21 ARG 18 HH21 ARG 18 -6.827 -6.787 -17.388 930 HH22 ARG 18 HH22 ARG 18 -8.174 -7.032 -18.464 931 H ASN 19 H ASN 19 -4.128 -4.918 -12.648 932 HA ASN 19 HA ASN 19 -3.976 -2.530 -11.107 933 HB2 ASN 19 HB2 ASN 19 -2.000 -3.805 -12.076 934 HB3 ASN 19 HB3 ASN 19 -2.411 -3.141 -13.652 935 HD21 ASN 19 HD21 ASN 19 -0.025 -2.783 -11.796 936 HD22 ASN 19 HD22 ASN 19 0.159 -1.075 -11.652 937 H HIS 20 H HIS 20 -5.956 -1.623 -11.427 938 HA HIS 20 HA HIS 20 -6.569 -0.155 -13.904 939 HB2 HIS 20 HB2 HIS 20 -8.091 -0.674 -11.317 940 HB3 HIS 20 HB3 HIS 20 -8.645 0.540 -12.454 941 HD1 HIS 20 HD1 HIS 20 -8.703 -0.674 -15.086 942 HD2 HIS 20 HD2 HIS 20 -9.433 -2.977 -11.714 943 HE1 HIS 20 HE1 HIS 20 -9.973 -2.674 -15.898 944 HE2 HIS 20 HE2 HIS 20 -10.632 -3.901 -13.805 945 HA PRO 21 HA PRO 21 -4.942 3.867 -12.755 946 HB2 PRO 21 HB2 PRO 21 -7.800 4.889 -12.811 947 HB3 PRO 21 HB3 PRO 21 -6.337 5.582 -13.552 948 HG2 PRO 21 HG2 PRO 21 -8.050 4.252 -15.064 949 HG3 PRO 21 HG3 PRO 21 -6.302 4.007 -15.290 950 HD2 PRO 21 HD2 PRO 21 -8.301 2.210 -13.945 951 HD3 PRO 21 HD3 PRO 21 -6.889 1.787 -14.936 952 H GLY 22 H GLY 22 -4.232 3.496 -10.684 953 HA2 GLY 22 HA2 GLY 22 -3.928 4.020 -8.491 954 HA3 GLY 22 HA3 GLY 22 -5.153 5.253 -8.715 955 H VAL 23 H VAL 23 -5.396 1.671 -8.801 956 HA VAL 23 HA VAL 23 -7.758 1.408 -7.331 957 HB VAL 23 HB VAL 23 -5.475 -0.629 -7.286 958 HG11 VAL 23 HG11 VAL 23 -7.287 -2.295 -6.993 959 HG12 VAL 23 HG12 VAL 23 -8.475 -0.995 -6.945 960 HG13 VAL 23 HG13 VAL 23 -7.258 -1.127 -5.671 961 HG21 VAL 23 HG21 VAL 23 -5.975 -0.023 -9.614 962 HG22 VAL 23 HG22 VAL 23 -7.684 -0.378 -9.352 963 HG23 VAL 23 HG23 VAL 23 -6.489 -1.674 -9.261 964 H MET 24 H MET 24 -4.459 1.744 -6.271 965 HA MET 24 HA MET 24 -4.615 0.858 -3.614 966 HB2 MET 24 HB2 MET 24 -2.739 2.953 -4.778 967 HB3 MET 24 HB3 MET 24 -2.468 2.014 -3.310 968 HG2 MET 24 HG2 MET 24 -2.578 0.955 -6.141 969 HG3 MET 24 HG3 MET 24 -1.152 1.080 -5.107 970 HE1 MET 24 HE1 MET 24 -1.856 -2.824 -5.452 971 HE2 MET 24 HE2 MET 24 -0.682 -1.546 -5.758 972 HE3 MET 24 HE3 MET 24 -2.182 -1.607 -6.687 973 H THR 25 H THR 25 -5.286 4.010 -5.064 974 HA THR 25 HA THR 25 -5.610 5.486 -2.642 975 HB THR 25 HB THR 25 -6.923 6.144 -5.324 976 HG1 THR 25 HG1 THR 25 -4.800 7.387 -5.494 977 HG21 THR 25 HG21 THR 25 -7.558 7.629 -3.431 978 HG22 THR 25 HG22 THR 25 -6.569 8.489 -4.613 979 HG23 THR 25 HG23 THR 25 -5.849 7.935 -3.100 980 H HIS 26 H HIS 26 -7.741 3.528 -4.651 981 HA HIS 26 HA HIS 26 -10.245 4.259 -3.468 982 HB2 HIS 26 HB2 HIS 26 -9.416 1.868 -5.171 983 HB3 HIS 26 HB3 HIS 26 -11.067 2.102 -4.602 984 HD1 HIS 26 HD1 HIS 26 -12.493 3.077 -6.371 985 HD2 HIS 26 HD2 HIS 26 -8.599 4.495 -6.638 986 HE1 HIS 26 HE1 HIS 26 -12.468 4.611 -8.355 987 HE2 HIS 26 HE2 HIS 26 -10.117 5.473 -8.488 988 H VAL 27 H VAL 27 -8.104 1.384 -3.056 989 HA VAL 27 HA VAL 27 -9.751 0.071 -1.176 990 HB VAL 27 HB VAL 27 -7.900 -1.476 -0.736 991 HG11 VAL 27 HG11 VAL 27 -9.159 -1.803 -2.818 992 HG12 VAL 27 HG12 VAL 27 -7.486 -2.316 -3.016 993 HG13 VAL 27 HG13 VAL 27 -8.021 -0.776 -3.695 994 HG21 VAL 27 HG21 VAL 27 -6.008 0.084 -0.583 995 HG22 VAL 27 HG22 VAL 27 -6.093 0.392 -2.317 996 HG23 VAL 27 HG23 VAL 27 -5.650 -1.213 -1.727 997 H CYS 28 H CYS 28 -6.857 2.106 -0.732 998 HA CYS 28 HA CYS 28 -6.740 2.045 2.082 999 HB2 CYS 28 HB2 CYS 28 -5.736 4.111 0.085 1000 HB3 CYS 28 HB3 CYS 28 -5.308 4.114 1.796 1001 HG CYS 28 HG CYS 28 -3.847 2.585 -0.654 1002 H GLY 29 H GLY 29 -8.596 3.995 -0.164 1003 HA2 GLY 29 HA2 GLY 29 -9.605 6.001 1.502 1004 HA3 GLY 29 HA3 GLY 29 -10.419 5.333 0.094 1005 H LEU 30 H LEU 30 -10.851 2.701 0.870 1006 HA LEU 30 HA LEU 30 -13.212 2.964 2.439 1007 HB2 LEU 30 HB2 LEU 30 -11.804 0.632 1.170 1008 HB3 LEU 30 HB3 LEU 30 -13.017 0.289 2.389 1009 HG LEU 30 HG LEU 30 -14.051 0.119 0.218 1010 HD11 LEU 30 HD11 LEU 30 -15.465 1.036 1.995 1011 HD12 LEU 30 HD12 LEU 30 -15.935 1.653 0.417 1012 HD13 LEU 30 HD13 LEU 30 -15.019 2.677 1.524 1013 HD21 LEU 30 HD21 LEU 30 -14.213 1.952 -1.397 1014 HD22 LEU 30 HD22 LEU 30 -12.534 1.494 -1.121 1015 HD23 LEU 30 HD23 LEU 30 -13.176 2.961 -0.381 1016 H PHE 31 H PHE 31 -9.959 1.847 3.264 1017 HA PHE 31 HA PHE 31 -10.742 0.773 5.846 1018 HB2 PHE 31 HB2 PHE 31 -7.920 1.306 4.820 1019 HB3 PHE 31 HB3 PHE 31 -8.378 0.241 6.149 1020 HD1 PHE 31 HD2 PHE 31 -10.644 -1.301 5.062 1021 HD2 PHE 31 HD1 PHE 31 -7.023 -0.088 3.124 1022 HE1 PHE 31 HE2 PHE 31 -10.875 -3.152 3.452 1023 HE2 PHE 31 HE1 PHE 31 -7.277 -1.937 1.519 1024 HZ PHE 31 HZ PHE 31 -9.196 -3.468 1.680 1025 H ALA 32 H ALA 32 -9.330 3.756 4.649 1026 HA ALA 32 HA ALA 32 -8.578 4.893 7.170 1027 HB1 ALA 32 HB1 ALA 32 -9.062 6.255 4.495 1028 HB2 ALA 32 HB2 ALA 32 -7.529 5.577 5.046 1029 HB3 ALA 32 HB3 ALA 32 -8.228 6.961 5.885 1030 H ARG 33 H ARG 33 -11.514 4.997 5.193 1031 HA ARG 33 HA ARG 33 -12.687 7.288 6.504 1032 HB2 ARG 33 HB2 ARG 33 -14.544 7.011 5.019 1033 HB3 ARG 33 HB3 ARG 33 -13.101 6.620 4.097 1034 HG2 ARG 33 HG2 ARG 33 -13.623 4.152 4.606 1035 HG3 ARG 33 HG3 ARG 33 -15.194 4.715 5.171 1036 HD2 ARG 33 HD2 ARG 33 -14.055 4.999 2.375 1037 HD3 ARG 33 HD3 ARG 33 -15.384 3.956 2.882 1038 HE ARG 33 HE ARG 33 -15.907 6.721 3.410 1039 HH11 ARG 33 HH11 ARG 33 -16.032 4.290 0.861 1040 HH12 ARG 33 HH12 ARG 33 -17.249 5.131 -0.047 1041 HH21 ARG 33 HH21 ARG 33 -17.478 7.805 2.225 1042 HH22 ARG 33 HH22 ARG 33 -18.071 7.137 0.731 1043 H ARG 34 H ARG 34 -12.400 4.083 7.467 1044 HA ARG 34 HA ARG 34 -14.783 3.806 9.012 1045 HB2 ARG 34 HB2 ARG 34 -13.541 1.809 8.485 1046 HB3 ARG 34 HB3 ARG 34 -12.040 2.489 9.098 1047 HG2 ARG 34 HG2 ARG 34 -13.073 2.449 11.415 1048 HG3 ARG 34 HG3 ARG 34 -14.419 1.537 10.733 1049 HD2 ARG 34 HD2 ARG 34 -13.067 -0.334 10.261 1050 HD3 ARG 34 HD3 ARG 34 -11.571 0.604 10.352 1051 HE ARG 34 HE ARG 34 -13.130 0.316 12.811 1052 HH11 ARG 34 HH11 ARG 34 -10.346 -0.731 10.932 1053 HH12 ARG 34 HH12 ARG 34 -9.555 -1.466 12.291 1054 HH21 ARG 34 HH21 ARG 34 -12.086 -0.631 14.573 1055 HH22 ARG 34 HH22 ARG 34 -10.540 -1.406 14.359 1056 H ALA 35 H ALA 35 -11.426 4.204 10.225 1057 HA ALA 35 HA ALA 35 -11.693 6.414 11.896 1058 HB1 ALA 35 HB1 ALA 35 -12.067 5.403 14.136 1059 HB2 ALA 35 HB2 ALA 35 -12.354 3.829 13.383 1060 HB3 ALA 35 HB3 ALA 35 -13.463 5.164 13.085 1061 H PHE 36 H PHE 36 -10.561 3.042 12.019 1062 HA PHE 36 HA PHE 36 -7.923 3.864 13.040 1063 HB2 PHE 36 HB2 PHE 36 -9.200 2.018 14.204 1064 HB3 PHE 36 HB3 PHE 36 -9.085 1.049 12.740 1065 HD1 PHE 36 HD2 PHE 36 -7.043 2.689 15.415 1066 HD2 PHE 36 HD1 PHE 36 -7.116 -0.276 12.335 1067 HE1 PHE 36 HE2 PHE 36 -4.879 1.810 16.198 1068 HE2 PHE 36 HE1 PHE 36 -4.954 -1.146 13.123 1069 HZ PHE 36 HZ PHE 36 -3.835 -0.106 15.056 1070 H ASN 37 H ASN 37 -6.036 3.446 11.910 1071 HA ASN 37 HA ASN 37 -6.322 3.215 8.989 1072 HB2 ASN 37 HB2 ASN 37 -3.918 4.115 10.637 1073 HB3 ASN 37 HB3 ASN 37 -4.114 4.287 8.896 1074 HD21 ASN 37 HD21 ASN 37 -3.807 6.212 11.252 1075 HD22 ASN 37 HD22 ASN 37 -5.050 7.385 10.991 1076 H VAL 38 H VAL 38 -4.415 2.157 7.859 1077 HA VAL 38 HA VAL 38 -4.170 -0.560 8.800 1078 HB VAL 38 HB VAL 38 -2.942 0.689 6.287 1079 HG11 VAL 38 HG11 VAL 38 -2.851 -1.637 5.445 1080 HG12 VAL 38 HG12 VAL 38 -3.477 -2.220 6.991 1081 HG13 VAL 38 HG13 VAL 38 -1.897 -1.440 6.918 1082 HG21 VAL 38 HG21 VAL 38 -5.390 0.971 6.266 1083 HG22 VAL 38 HG22 VAL 38 -5.610 -0.750 6.583 1084 HG23 VAL 38 HG23 VAL 38 -4.893 -0.217 5.059 1085 H GLU 39 H GLU 39 -2.333 -1.620 9.428 1086 HA GLU 39 HA GLU 39 -0.179 -0.014 10.580 1087 HB2 GLU 39 HB2 GLU 39 -1.314 -1.669 11.990 1088 HB3 GLU 39 HB3 GLU 39 -0.979 -2.949 10.829 1089 HG2 GLU 39 HG2 GLU 39 1.497 -2.545 11.287 1090 HG3 GLU 39 HG3 GLU 39 1.004 -1.509 12.622 1091 H GLY 40 H GLY 40 -0.637 -2.796 8.393 1092 HA2 GLY 40 HA2 GLY 40 2.011 -2.329 7.142 1093 HA3 GLY 40 HA3 GLY 40 1.590 -3.930 7.743 1094 H ILE 41 H ILE 41 2.137 -2.884 4.987 1095 HA ILE 41 HA ILE 41 -0.261 -3.955 3.612 1096 HB ILE 41 HB ILE 41 1.309 -1.469 2.705 1097 HG12 ILE 41 HG12 ILE 41 -1.558 -1.702 3.727 1098 HG13 ILE 41 HG13 ILE 41 -0.222 -0.914 4.549 1099 HG21 ILE 41 HG21 ILE 41 -1.071 -2.791 1.341 1100 HG22 ILE 41 HG22 ILE 41 0.596 -2.825 0.765 1101 HG23 ILE 41 HG23 ILE 41 -0.282 -1.299 0.826 1102 HD11 ILE 41 HD11 ILE 41 -1.701 0.710 3.579 1103 HD12 ILE 41 HD12 ILE 41 -1.509 -0.005 1.980 1104 HD13 ILE 41 HD13 ILE 41 -0.136 0.776 2.772 1105 H LEU 42 H LEU 42 0.228 -5.184 1.786 1106 HA LEU 42 HA LEU 42 2.933 -5.201 0.692 1107 HB2 LEU 42 HB2 LEU 42 3.089 -6.964 2.381 1108 HB3 LEU 42 HB3 LEU 42 1.595 -7.700 1.820 1109 HG LEU 42 HG LEU 42 2.715 -8.259 -0.355 1110 HD11 LEU 42 HD11 LEU 42 4.415 -6.543 -0.446 1111 HD12 LEU 42 HD12 LEU 42 5.157 -8.137 -0.557 1112 HD13 LEU 42 HD13 LEU 42 5.239 -7.231 0.956 1113 HD21 LEU 42 HD21 LEU 42 2.577 -9.926 1.401 1114 HD22 LEU 42 HD22 LEU 42 4.096 -9.357 2.099 1115 HD23 LEU 42 HD23 LEU 42 4.079 -10.102 0.497 1116 H CYS 43 H CYS 43 2.102 -4.368 -1.230 1117 HA CYS 43 HA CYS 43 0.137 -5.914 -2.758 1118 HB2 CYS 43 HB2 CYS 43 0.076 -3.491 -3.057 1119 HB3 CYS 43 HB3 CYS 43 1.783 -3.454 -3.501 1120 HG CYS 43 HG CYS 43 1.510 -4.549 -5.959 1121 H LEU 44 H LEU 44 1.006 -7.836 -3.189 1122 HA LEU 44 HA LEU 44 3.674 -8.190 -4.317 1123 HB2 LEU 44 HB2 LEU 44 2.616 -9.755 -2.611 1124 HB3 LEU 44 HB3 LEU 44 1.442 -10.205 -3.833 1125 HG LEU 44 HG LEU 44 3.456 -11.004 -5.250 1126 HD11 LEU 44 HD11 LEU 44 4.860 -10.812 -2.572 1127 HD12 LEU 44 HD12 LEU 44 5.226 -9.857 -4.014 1128 HD13 LEU 44 HD13 LEU 44 5.486 -11.599 -4.023 1129 HD21 LEU 44 HD21 LEU 44 3.541 -13.183 -4.096 1130 HD22 LEU 44 HD22 LEU 44 1.896 -12.561 -4.178 1131 HD23 LEU 44 HD23 LEU 44 2.798 -12.461 -2.665 1132 HA PRO 45 HA PRO 45 1.563 -7.685 -8.403 1133 HB2 PRO 45 HB2 PRO 45 3.887 -7.657 -9.913 1134 HB3 PRO 45 HB3 PRO 45 3.231 -6.222 -9.105 1135 HG2 PRO 45 HG2 PRO 45 5.441 -8.029 -8.212 1136 HG3 PRO 45 HG3 PRO 45 5.337 -6.254 -8.145 1137 HD2 PRO 45 HD2 PRO 45 4.878 -7.800 -5.959 1138 HD3 PRO 45 HD3 PRO 45 4.019 -6.267 -6.226 1139 H ILE 46 H ILE 46 0.610 -9.546 -8.909 1140 HA ILE 46 HA ILE 46 1.849 -12.123 -8.846 1141 HB ILE 46 HB ILE 46 -0.806 -11.284 -10.105 1142 HG12 ILE 46 HG12 ILE 46 -0.797 -10.709 -7.715 1143 HG13 ILE 46 HG13 ILE 46 -1.864 -12.079 -7.981 1144 HG21 ILE 46 HG21 ILE 46 -1.464 -13.658 -9.900 1145 HG22 ILE 46 HG22 ILE 46 0.151 -14.060 -9.317 1146 HG23 ILE 46 HG23 ILE 46 -0.068 -13.460 -10.962 1147 HD11 ILE 46 HD11 ILE 46 -0.615 -12.372 -5.945 1148 HD12 ILE 46 HD12 ILE 46 0.914 -12.170 -6.798 1149 HD13 ILE 46 HD13 ILE 46 -0.097 -13.582 -7.119 1150 H GLN 47 H GLN 47 3.441 -12.497 -10.268 1151 HA GLN 47 HA GLN 47 3.857 -11.201 -12.737 1152 HB2 GLN 47 HB2 GLN 47 5.714 -12.771 -13.066 1153 HB3 GLN 47 HB3 GLN 47 5.685 -12.176 -11.419 1154 HG2 GLN 47 HG2 GLN 47 4.734 -14.266 -10.613 1155 HG3 GLN 47 HG3 GLN 47 4.618 -14.882 -12.261 1156 HE21 GLN 47 HE21 GLN 47 6.032 -16.049 -10.025 1157 HE22 GLN 47 HE22 GLN 47 7.695 -16.154 -10.475 1158 H ASP 48 H ASP 48 1.882 -13.848 -11.956 1159 HA ASP 48 HA ASP 48 2.007 -15.387 -14.319 1160 HB2 ASP 48 HB2 ASP 48 1.251 -16.328 -12.192 1161 HB3 ASP 48 HB3 ASP 48 -0.093 -15.198 -12.113 1162 H SER 49 H SER 49 -0.098 -12.714 -13.289 1163 HA SER 49 HA SER 49 -1.179 -12.379 -16.006 1164 HB2 SER 49 HB2 SER 49 -2.957 -12.724 -13.552 1165 HB3 SER 49 HB3 SER 49 -3.525 -12.234 -15.147 1166 HG SER 49 HG SER 49 -2.118 -14.659 -14.728 1167 H ASP 50 H ASP 50 -2.658 -10.276 -16.025 1168 HA ASP 50 HA ASP 50 -1.155 -8.118 -14.840 1169 HB2 ASP 50 HB2 ASP 50 -2.697 -6.603 -16.046 1170 HB3 ASP 50 HB3 ASP 50 -2.053 -7.839 -17.111 1171 H LYS 51 H LYS 51 -1.417 -8.716 -12.643 1172 HA LYS 51 HA LYS 51 -3.515 -7.342 -11.259 1173 HB2 LYS 51 HB2 LYS 51 -4.343 -9.362 -9.970 1174 HB3 LYS 51 HB3 LYS 51 -4.830 -9.325 -11.657 1175 HG2 LYS 51 HG2 LYS 51 -3.291 -11.073 -12.250 1176 HG3 LYS 51 HG3 LYS 51 -2.460 -10.956 -10.698 1177 HD2 LYS 51 HD2 LYS 51 -3.920 -12.963 -10.833 1178 HD3 LYS 51 HD3 LYS 51 -4.399 -11.877 -9.529 1179 HE2 LYS 51 HE2 LYS 51 -6.386 -12.693 -10.647 1180 HE3 LYS 51 HE3 LYS 51 -6.213 -10.978 -11.010 1181 HZ1 LYS 51 HZ1 LYS 51 -5.209 -11.639 -13.147 1182 HZ2 LYS 51 HZ2 LYS 51 -6.810 -12.148 -12.983 1183 HZ3 LYS 51 HZ3 LYS 51 -5.548 -13.255 -12.790 1184 H SER 52 H SER 52 -3.256 -7.367 -8.996 1185 HA SER 52 HA SER 52 -0.747 -8.337 -7.841 1186 HB2 SER 52 HB2 SER 52 -1.768 -5.458 -7.616 1187 HB3 SER 52 HB3 SER 52 -0.354 -6.117 -6.796 1188 HG SER 52 HG SER 52 0.034 -6.663 -9.308 1189 H HIS 53 H HIS 53 -1.134 -9.195 -5.853 1190 HA HIS 53 HA HIS 53 -3.807 -8.888 -4.611 1191 HB2 HIS 53 HB2 HIS 53 -2.748 -11.200 -5.186 1192 HB3 HIS 53 HB3 HIS 53 -1.646 -10.910 -3.851 1193 HD1 HIS 53 HD1 HIS 53 -4.751 -12.480 -4.596 1194 HD2 HIS 53 HD2 HIS 53 -3.241 -10.500 -1.282 1195 HE1 HIS 53 HE1 HIS 53 -6.135 -13.268 -2.662 1196 HE2 HIS 53 HE2 HIS 53 -4.984 -12.305 -0.672 1197 H ILE 54 H ILE 54 -3.972 -7.732 -2.678 1198 HA ILE 54 HA ILE 54 -1.449 -6.740 -1.468 1199 HB ILE 54 HB ILE 54 -4.127 -5.248 -1.463 1200 HG12 ILE 54 HG12 ILE 54 -2.838 -3.578 -3.003 1201 HG13 ILE 54 HG13 ILE 54 -1.732 -4.905 -3.324 1202 HG21 ILE 54 HG21 ILE 54 -1.337 -4.368 -0.628 1203 HG22 ILE 54 HG22 ILE 54 -2.683 -4.730 0.454 1204 HG23 ILE 54 HG23 ILE 54 -2.776 -3.346 -0.634 1205 HD11 ILE 54 HD11 ILE 54 -4.687 -4.882 -3.917 1206 HD12 ILE 54 HD12 ILE 54 -3.567 -6.197 -4.280 1207 HD13 ILE 54 HD13 ILE 54 -3.384 -4.636 -5.081 1208 H TRP 55 H TRP 55 -1.108 -7.422 0.548 1209 HA TRP 55 HA TRP 55 -3.270 -8.447 2.255 1210 HB2 TRP 55 HB2 TRP 55 -0.216 -8.512 2.457 1211 HB3 TRP 55 HB3 TRP 55 -1.264 -9.052 3.769 1212 HD1 TRP 55 HD1 TRP 55 -2.174 -11.474 3.612 1213 HE1 TRP 55 HE1 TRP 55 -2.073 -13.382 1.923 1214 HE3 TRP 55 HE3 TRP 55 -0.023 -8.975 -0.233 1215 HZ2 TRP 55 HZ2 TRP 55 -1.132 -13.804 -0.696 1216 HZ3 TRP 55 HZ3 TRP 55 0.446 -10.199 -2.290 1217 HH2 TRP 55 HH2 TRP 55 -0.085 -12.561 -2.533 1218 H LEU 56 H LEU 56 -4.310 -6.917 3.384 1219 HA LEU 56 HA LEU 56 -2.909 -4.556 4.456 1220 HB2 LEU 56 HB2 LEU 56 -5.894 -5.164 4.235 1221 HB3 LEU 56 HB3 LEU 56 -5.237 -3.730 5.000 1222 HG LEU 56 HG LEU 56 -5.965 -3.019 2.877 1223 HD11 LEU 56 HD11 LEU 56 -3.978 -2.241 1.709 1224 HD12 LEU 56 HD12 LEU 56 -2.984 -3.404 2.589 1225 HD13 LEU 56 HD13 LEU 56 -3.797 -2.100 3.458 1226 HD21 LEU 56 HD21 LEU 56 -4.553 -5.357 1.556 1227 HD22 LEU 56 HD22 LEU 56 -5.423 -4.067 0.720 1228 HD23 LEU 56 HD23 LEU 56 -6.295 -5.172 1.779 1229 H LEU 57 H LEU 57 -1.998 -5.065 6.332 1230 HA LEU 57 HA LEU 57 -3.264 -6.697 8.377 1231 HB2 LEU 57 HB2 LEU 57 -0.570 -5.344 8.079 1232 HB3 LEU 57 HB3 LEU 57 -1.109 -5.841 9.672 1233 HG LEU 57 HG LEU 57 -1.176 -8.188 8.989 1234 HD11 LEU 57 HD11 LEU 57 -0.392 -8.957 6.789 1235 HD12 LEU 57 HD12 LEU 57 -0.333 -7.283 6.221 1236 HD13 LEU 57 HD13 LEU 57 -1.878 -8.015 6.676 1237 HD21 LEU 57 HD21 LEU 57 1.239 -8.545 8.643 1238 HD22 LEU 57 HD22 LEU 57 0.920 -7.300 9.853 1239 HD23 LEU 57 HD23 LEU 57 1.429 -6.836 8.228 1240 H VAL 58 H VAL 58 -4.965 -5.655 9.188 1241 HA VAL 58 HA VAL 58 -4.610 -3.227 10.776 1242 HB VAL 58 HB VAL 58 -5.377 -2.415 8.513 1243 HG11 VAL 58 HG11 VAL 58 -6.636 -4.360 7.741 1244 HG12 VAL 58 HG12 VAL 58 -7.625 -2.906 7.649 1245 HG13 VAL 58 HG13 VAL 58 -7.885 -4.066 8.956 1246 HG21 VAL 58 HG21 VAL 58 -5.990 -1.105 10.492 1247 HG22 VAL 58 HG22 VAL 58 -7.469 -2.050 10.691 1248 HG23 VAL 58 HG23 VAL 58 -7.264 -1.014 9.276 1249 H ASN 59 H ASN 59 -6.172 -3.233 12.589 1250 HA ASN 59 HA ASN 59 -7.488 -5.755 13.040 1251 HB2 ASN 59 HB2 ASN 59 -8.377 -4.794 15.114 1252 HB3 ASN 59 HB3 ASN 59 -6.659 -4.494 14.969 1253 HD21 ASN 59 HD21 ASN 59 -6.748 -2.865 16.504 1254 HD22 ASN 59 HD22 ASN 59 -7.434 -1.311 16.171 1255 H ASP 60 H ASP 60 -9.709 -6.242 12.878 1256 HA ASP 60 HA ASP 60 -11.189 -4.588 10.989 1257 HB2 ASP 60 HB2 ASP 60 -12.649 -6.455 10.632 1258 HB3 ASP 60 HB3 ASP 60 -11.017 -7.103 10.679 1259 H ASP 61 H ASP 61 -13.548 -4.483 11.328 1260 HA ASP 61 HA ASP 61 -14.469 -4.208 14.097 1261 HB2 ASP 61 HB2 ASP 61 -13.564 -1.960 13.224 1262 HB3 ASP 61 HB3 ASP 61 -14.850 -1.988 12.024 1263 H GLN 62 H GLN 62 -16.828 -4.188 14.168 1264 HA GLN 62 HA GLN 62 -18.178 -5.916 12.418 1265 HB2 GLN 62 HB2 GLN 62 -19.339 -3.767 14.245 1266 HB3 GLN 62 HB3 GLN 62 -20.261 -5.090 13.529 1267 HG2 GLN 62 HG2 GLN 62 -18.922 -6.727 14.793 1268 HG3 GLN 62 HG3 GLN 62 -17.963 -5.420 15.487 1269 HE21 GLN 62 HE21 GLN 62 -18.916 -4.088 17.087 1270 HE22 GLN 62 HE22 GLN 62 -20.358 -4.557 17.924 1271 H ARG 63 H ARG 63 -17.811 -2.433 12.419 1272 HA ARG 63 HA ARG 63 -19.616 -1.882 10.241 1273 HB2 ARG 63 HB2 ARG 63 -19.149 -0.282 12.134 1274 HB3 ARG 63 HB3 ARG 63 -17.518 -0.061 11.512 1275 HG2 ARG 63 HG2 ARG 63 -18.500 0.810 9.377 1276 HG3 ARG 63 HG3 ARG 63 -20.107 0.679 10.096 1277 HD2 ARG 63 HD2 ARG 63 -17.832 2.455 11.043 1278 HD3 ARG 63 HD3 ARG 63 -19.322 2.980 10.258 1279 HE ARG 63 HE ARG 63 -18.955 2.194 13.031 1280 HH11 ARG 63 HH11 ARG 63 -21.353 2.879 10.532 1281 HH12 ARG 63 HH12 ARG 63 -22.621 3.176 11.679 1282 HH21 ARG 63 HH21 ARG 63 -20.615 2.595 14.494 1283 HH22 ARG 63 HH22 ARG 63 -22.201 3.015 13.920 1284 H LEU 64 H LEU 64 -16.124 -2.506 10.582 1285 HA LEU 64 HA LEU 64 -15.113 -1.366 8.218 1286 HB2 LEU 64 HB2 LEU 64 -13.657 -2.356 10.003 1287 HB3 LEU 64 HB3 LEU 64 -14.175 -3.957 9.516 1288 HG LEU 64 HG LEU 64 -13.187 -3.168 7.122 1289 HD11 LEU 64 HD11 LEU 64 -11.208 -1.808 7.280 1290 HD12 LEU 64 HD12 LEU 64 -11.453 -1.577 9.013 1291 HD13 LEU 64 HD13 LEU 64 -12.605 -0.895 7.854 1292 HD21 LEU 64 HD21 LEU 64 -11.100 -4.294 7.580 1293 HD22 LEU 64 HD22 LEU 64 -12.421 -5.153 8.368 1294 HD23 LEU 64 HD23 LEU 64 -11.345 -4.128 9.317 1295 H GLU 65 H GLU 65 -16.745 -4.434 8.767 1296 HA GLU 65 HA GLU 65 -16.227 -5.679 6.281 1297 HB2 GLU 65 HB2 GLU 65 -18.499 -6.168 8.239 1298 HB3 GLU 65 HB3 GLU 65 -18.075 -7.223 6.888 1299 HG2 GLU 65 HG2 GLU 65 -15.769 -7.457 7.914 1300 HG3 GLU 65 HG3 GLU 65 -16.380 -6.609 9.327 1301 H GLN 66 H GLN 66 -18.625 -3.317 7.213 1302 HA GLN 66 HA GLN 66 -20.349 -3.538 4.945 1303 HB2 GLN 66 HB2 GLN 66 -19.780 -1.068 6.655 1304 HB3 GLN 66 HB3 GLN 66 -21.142 -1.266 5.554 1305 HG2 GLN 66 HG2 GLN 66 -20.641 -2.893 8.062 1306 HG3 GLN 66 HG3 GLN 66 -21.815 -1.594 7.895 1307 HE21 GLN 66 HE21 GLN 66 -22.217 -4.424 8.630 1308 HE22 GLN 66 HE22 GLN 66 -23.345 -5.054 7.487 1309 H MET 67 H MET 67 -17.411 -1.617 5.607 1310 HA MET 67 HA MET 67 -17.220 -0.279 3.108 1311 HB2 MET 67 HB2 MET 67 -15.021 -1.090 5.059 1312 HB3 MET 67 HB3 MET 67 -14.734 -0.094 3.636 1313 HG2 MET 67 HG2 MET 67 -14.859 1.341 5.536 1314 HG3 MET 67 HG3 MET 67 -16.326 1.590 4.584 1315 HE1 MET 67 HE1 MET 67 -15.928 2.522 7.645 1316 HE2 MET 67 HE2 MET 67 -17.503 2.088 8.307 1317 HE3 MET 67 HE3 MET 67 -17.395 2.831 6.712 1318 H ILE 68 H ILE 68 -16.074 -3.439 4.220 1319 HA ILE 68 HA ILE 68 -14.635 -4.234 1.903 1320 HB ILE 68 HB ILE 68 -15.987 -6.005 4.002 1321 HG12 ILE 68 HG12 ILE 68 -13.077 -5.065 3.878 1322 HG13 ILE 68 HG13 ILE 68 -14.300 -4.409 4.958 1323 HG21 ILE 68 HG21 ILE 68 -14.410 -7.791 3.289 1324 HG22 ILE 68 HG22 ILE 68 -13.809 -6.741 2.007 1325 HG23 ILE 68 HG23 ILE 68 -15.479 -7.302 1.972 1326 HD11 ILE 68 HD11 ILE 68 -13.235 -7.230 4.993 1327 HD12 ILE 68 HD12 ILE 68 -14.502 -6.600 6.048 1328 HD13 ILE 68 HD13 ILE 68 -12.870 -5.941 6.141 1329 H SER 69 H SER 69 -18.021 -4.540 2.854 1330 HA SER 69 HA SER 69 -18.895 -6.238 0.716 1331 HB2 SER 69 HB2 SER 69 -20.471 -4.461 2.617 1332 HB3 SER 69 HB3 SER 69 -21.194 -5.639 1.516 1333 HG SER 69 HG SER 69 -19.203 -6.371 3.382 1334 H GLN 70 H GLN 70 -18.495 -2.782 1.068 1335 HA GLN 70 HA GLN 70 -20.080 -2.136 -1.285 1336 HB2 GLN 70 HB2 GLN 70 -19.906 -0.628 0.730 1337 HB3 GLN 70 HB3 GLN 70 -18.207 -0.364 0.384 1338 HG2 GLN 70 HG2 GLN 70 -20.399 0.384 -1.575 1339 HG3 GLN 70 HG3 GLN 70 -19.868 1.470 -0.302 1340 HE21 GLN 70 HE21 GLN 70 -17.039 0.721 -0.536 1341 HE22 GLN 70 HE22 GLN 70 -16.475 1.454 -1.991 1342 H ILE 71 H ILE 71 -16.624 -2.422 -0.379 1343 HA ILE 71 HA ILE 71 -15.593 -1.122 -2.678 1344 HB ILE 71 HB ILE 71 -14.259 -1.303 -0.586 1345 HG12 ILE 71 HG12 ILE 71 -12.927 -2.429 -3.095 1346 HG13 ILE 71 HG13 ILE 71 -13.050 -0.734 -2.632 1347 HG21 ILE 71 HG21 ILE 71 -14.794 -3.619 0.050 1348 HG22 ILE 71 HG22 ILE 71 -13.054 -3.346 0.029 1349 HG23 ILE 71 HG23 ILE 71 -13.827 -4.220 -1.297 1350 HD11 ILE 71 HD11 ILE 71 -11.432 -2.858 -1.232 1351 HD12 ILE 71 HD12 ILE 71 -11.575 -1.173 -0.715 1352 HD13 ILE 71 HD13 ILE 71 -10.823 -1.563 -2.260 1353 H ASP 72 H ASP 72 -16.171 -4.571 -1.943 1354 HA ASP 72 HA ASP 72 -14.579 -5.615 -4.035 1355 HB2 ASP 72 HB2 ASP 72 -15.506 -7.748 -3.524 1356 HB3 ASP 72 HB3 ASP 72 -15.384 -6.882 -2.004 1357 H LYS 73 H LYS 73 -17.799 -4.350 -4.005 1358 HA LYS 73 HA LYS 73 -18.895 -5.510 -6.335 1359 HB2 LYS 73 HB2 LYS 73 -19.521 -2.792 -5.099 1360 HB3 LYS 73 HB3 LYS 73 -20.558 -3.684 -6.203 1361 HG2 LYS 73 HG2 LYS 73 -19.774 -4.605 -3.422 1362 HG3 LYS 73 HG3 LYS 73 -21.302 -3.829 -3.847 1363 HD2 LYS 73 HD2 LYS 73 -21.897 -5.708 -5.300 1364 HD3 LYS 73 HD3 LYS 73 -20.333 -6.476 -5.000 1365 HE2 LYS 73 HE2 LYS 73 -22.387 -5.905 -2.844 1366 HE3 LYS 73 HE3 LYS 73 -22.226 -7.436 -3.680 1367 HZ1 LYS 73 HZ1 LYS 73 -20.089 -6.161 -2.074 1368 HZ2 LYS 73 HZ2 LYS 73 -20.010 -7.676 -2.817 1369 HZ3 LYS 73 HZ3 LYS 73 -21.085 -7.417 -1.542 1370 H LEU 74 H LEU 74 -16.566 -2.955 -5.937 1371 HA LEU 74 HA LEU 74 -16.938 -1.816 -8.571 1372 HB2 LEU 74 HB2 LEU 74 -15.856 -0.049 -7.709 1373 HB3 LEU 74 HB3 LEU 74 -15.761 -0.882 -6.179 1374 HG LEU 74 HG LEU 74 -13.539 -1.035 -8.268 1375 HD11 LEU 74 HD11 LEU 74 -13.899 1.324 -7.650 1376 HD12 LEU 74 HD12 LEU 74 -12.368 0.725 -7.025 1377 HD13 LEU 74 HD13 LEU 74 -13.748 0.911 -5.939 1378 HD21 LEU 74 HD21 LEU 74 -13.498 -1.589 -5.274 1379 HD22 LEU 74 HD22 LEU 74 -12.115 -1.675 -6.370 1380 HD23 LEU 74 HD23 LEU 74 -13.452 -2.807 -6.554 1381 H GLU 75 H GLU 75 -15.310 -1.855 -10.254 1382 HA GLU 75 HA GLU 75 -14.779 -4.608 -10.878 1383 HB2 GLU 75 HB2 GLU 75 -14.284 -2.092 -12.503 1384 HB3 GLU 75 HB3 GLU 75 -14.188 -3.734 -13.131 1385 HG2 GLU 75 HG2 GLU 75 -16.578 -4.068 -12.713 1386 HG3 GLU 75 HG3 GLU 75 -16.690 -2.466 -11.982 1387 H ASP 76 H ASP 76 -12.842 -2.272 -9.398 1388 HA ASP 76 HA ASP 76 -10.277 -3.028 -10.402 1389 HB2 ASP 76 HB2 ASP 76 -10.983 -1.755 -7.725 1390 HB3 ASP 76 HB3 ASP 76 -9.360 -1.892 -8.380 1391 H VAL 77 H VAL 77 -12.036 -3.842 -7.403 1392 HA VAL 77 HA VAL 77 -10.217 -5.941 -6.627 1393 HB VAL 77 HB VAL 77 -12.927 -5.062 -5.516 1394 HG11 VAL 77 HG11 VAL 77 -12.703 -7.475 -5.090 1395 HG12 VAL 77 HG12 VAL 77 -12.548 -6.563 -3.591 1396 HG13 VAL 77 HG13 VAL 77 -11.109 -7.222 -4.375 1397 HG21 VAL 77 HG21 VAL 77 -11.621 -4.232 -3.610 1398 HG22 VAL 77 HG22 VAL 77 -11.026 -3.520 -5.110 1399 HG23 VAL 77 HG23 VAL 77 -10.129 -4.834 -4.340 1400 H VAL 78 H VAL 78 -10.125 -7.619 -7.940 1401 HA VAL 78 HA VAL 78 -12.306 -8.829 -9.359 1402 HB VAL 78 HB VAL 78 -9.620 -10.157 -8.722 1403 HG11 VAL 78 HG11 VAL 78 -11.301 -11.640 -9.740 1404 HG12 VAL 78 HG12 VAL 78 -9.965 -11.346 -10.851 1405 HG13 VAL 78 HG13 VAL 78 -11.502 -10.515 -11.091 1406 HG21 VAL 78 HG21 VAL 78 -9.127 -7.921 -9.603 1407 HG22 VAL 78 HG22 VAL 78 -10.168 -8.214 -10.999 1408 HG23 VAL 78 HG23 VAL 78 -8.694 -9.161 -10.783 1409 H LYS 79 H LYS 79 -10.370 -9.668 -6.519 1410 HA LYS 79 HA LYS 79 -12.525 -11.328 -5.370 1411 HB2 LYS 79 HB2 LYS 79 -9.554 -12.080 -5.383 1412 HB3 LYS 79 HB3 LYS 79 -10.823 -12.949 -4.530 1413 HG2 LYS 79 HG2 LYS 79 -11.872 -13.518 -6.712 1414 HG3 LYS 79 HG3 LYS 79 -10.549 -12.689 -7.528 1415 HD2 LYS 79 HD2 LYS 79 -8.924 -14.299 -6.567 1416 HD3 LYS 79 HD3 LYS 79 -10.237 -15.116 -5.711 1417 HE2 LYS 79 HE2 LYS 79 -9.920 -14.930 -8.723 1418 HE3 LYS 79 HE3 LYS 79 -9.620 -16.353 -7.733 1419 HZ1 LYS 79 HZ1 LYS 79 -12.252 -15.008 -7.977 1420 HZ2 LYS 79 HZ2 LYS 79 -11.929 -16.463 -7.175 1421 HZ3 LYS 79 HZ3 LYS 79 -11.790 -16.373 -8.857 1422 H VAL 80 H VAL 80 -12.505 -11.361 -3.059 1423 HA VAL 80 HA VAL 80 -10.570 -9.638 -1.659 1424 HB VAL 80 HB VAL 80 -12.597 -8.223 -2.168 1425 HG11 VAL 80 HG11 VAL 80 -14.353 -9.904 -2.053 1426 HG12 VAL 80 HG12 VAL 80 -14.707 -8.581 -0.943 1427 HG13 VAL 80 HG13 VAL 80 -14.088 -10.114 -0.321 1428 HG21 VAL 80 HG21 VAL 80 -11.140 -7.652 -0.275 1429 HG22 VAL 80 HG22 VAL 80 -12.078 -8.692 0.798 1430 HG23 VAL 80 HG23 VAL 80 -12.817 -7.248 0.099 1431 H GLN 81 H GLN 81 -10.154 -10.261 0.447 1432 HA GLN 81 HA GLN 81 -11.735 -12.327 1.769 1433 HB2 GLN 81 HB2 GLN 81 -10.124 -13.567 0.294 1434 HB3 GLN 81 HB3 GLN 81 -8.782 -12.744 1.076 1435 HG2 GLN 81 HG2 GLN 81 -9.322 -13.853 3.206 1436 HG3 GLN 81 HG3 GLN 81 -10.712 -14.638 2.457 1437 HE21 GLN 81 HE21 GLN 81 -7.552 -14.258 0.882 1438 HE22 GLN 81 HE22 GLN 81 -7.156 -15.934 0.893 1439 H ARG 82 H ARG 82 -11.450 -12.258 4.024 1440 HA ARG 82 HA ARG 82 -9.262 -10.688 5.169 1441 HB2 ARG 82 HB2 ARG 82 -10.748 -9.435 6.682 1442 HB3 ARG 82 HB3 ARG 82 -11.128 -9.078 5.009 1443 HG2 ARG 82 HG2 ARG 82 -13.269 -9.254 5.832 1444 HG3 ARG 82 HG3 ARG 82 -13.012 -10.943 5.404 1445 HD2 ARG 82 HD2 ARG 82 -12.330 -11.366 7.804 1446 HD3 ARG 82 HD3 ARG 82 -12.776 -9.701 8.168 1447 HE ARG 82 HE ARG 82 -15.042 -10.224 7.804 1448 HH11 ARG 82 HH11 ARG 82 -13.014 -13.093 7.598 1449 HH12 ARG 82 HH12 ARG 82 -14.344 -14.182 7.814 1450 HH21 ARG 82 HH21 ARG 82 -16.758 -11.660 8.083 1451 HH22 ARG 82 HH22 ARG 82 -16.463 -13.380 8.090 1452 H ASN 83 H ASN 83 -8.367 -11.744 6.822 1453 HA ASN 83 HA ASN 83 -9.801 -13.750 8.423 1454 HB2 ASN 83 HB2 ASN 83 -7.473 -14.353 6.550 1455 HB3 ASN 83 HB3 ASN 83 -7.700 -15.314 8.003 1456 HD21 ASN 83 HD21 ASN 83 -9.618 -16.624 8.165 1457 HD22 ASN 83 HD22 ASN 83 -10.490 -17.088 6.744 1458 H GLN 84 H GLN 84 -9.235 -13.340 10.507 1459 HA GLN 84 HA GLN 84 -6.877 -11.693 11.053 1460 HB2 GLN 84 HB2 GLN 84 -7.757 -11.918 13.531 1461 HB3 GLN 84 HB3 GLN 84 -8.561 -10.850 12.408 1462 HG2 GLN 84 HG2 GLN 84 -9.585 -13.639 12.907 1463 HG3 GLN 84 HG3 GLN 84 -9.995 -12.305 13.980 1464 HE21 GLN 84 HE21 GLN 84 -11.189 -10.513 13.082 1465 HE22 GLN 84 HE22 GLN 84 -12.212 -10.755 11.714 1466 H SER 85 H SER 85 -5.101 -12.745 10.962 1467 HA SER 85 HA SER 85 -4.607 -15.219 12.464 1468 HB2 SER 85 HB2 SER 85 -5.254 -15.834 10.085 1469 HB3 SER 85 HB3 SER 85 -3.907 -14.860 9.500 1470 HG SER 85 HG SER 85 -3.870 -17.288 10.940 1471 H ASP 86 H ASP 86 -2.062 -15.669 11.934 1472 HA ASP 86 HA ASP 86 -0.723 -13.688 13.428 1473 HB2 ASP 86 HB2 ASP 86 -0.211 -16.229 13.247 1474 HB3 ASP 86 HB3 ASP 86 0.663 -15.847 11.769 1475 HA PRO 87 HA PRO 87 0.287 -10.701 10.202 1476 HB2 PRO 87 HB2 PRO 87 2.591 -9.621 11.434 1477 HB3 PRO 87 HB3 PRO 87 0.919 -9.107 11.718 1478 HG2 PRO 87 HG2 PRO 87 2.589 -11.008 13.321 1479 HG3 PRO 87 HG3 PRO 87 1.459 -9.752 13.875 1480 HD2 PRO 87 HD2 PRO 87 0.739 -12.318 13.901 1481 HD3 PRO 87 HD3 PRO 87 -0.433 -11.066 13.421 1482 H THR 88 H THR 88 2.636 -13.154 11.218 1483 HA THR 88 HA THR 88 4.715 -12.652 9.368 1484 HB THR 88 HB THR 88 5.350 -15.082 9.727 1485 HG1 THR 88 HG1 THR 88 3.623 -15.495 11.780 1486 HG21 THR 88 HG21 THR 88 4.767 -13.527 12.278 1487 HG22 THR 88 HG22 THR 88 6.202 -13.335 11.267 1488 HG23 THR 88 HG23 THR 88 5.916 -14.858 12.110 1489 H MET 89 H MET 89 1.567 -13.749 8.689 1490 HA MET 89 HA MET 89 1.757 -15.237 6.383 1491 HB2 MET 89 HB2 MET 89 -0.401 -14.625 7.346 1492 HB3 MET 89 HB3 MET 89 -0.124 -12.922 7.003 1493 HG2 MET 89 HG2 MET 89 -1.706 -13.903 5.410 1494 HG3 MET 89 HG3 MET 89 -0.239 -13.383 4.581 1495 HE1 MET 89 HE1 MET 89 -1.247 -16.567 2.498 1496 HE2 MET 89 HE2 MET 89 -0.868 -14.845 2.424 1497 HE3 MET 89 HE3 MET 89 -2.360 -15.393 3.193 1498 H PHE 90 H PHE 90 2.164 -11.656 6.709 1499 HA PHE 90 HA PHE 90 2.352 -11.077 3.957 1500 HB2 PHE 90 HB2 PHE 90 2.844 -8.857 4.506 1501 HB3 PHE 90 HB3 PHE 90 2.097 -9.391 5.997 1502 HD1 PHE 90 HD1 PHE 90 5.263 -8.307 4.415 1503 HD2 PHE 90 HD2 PHE 90 3.466 -9.605 8.073 1504 HE1 PHE 90 HE1 PHE 90 7.257 -7.563 5.663 1505 HE2 PHE 90 HE2 PHE 90 5.459 -8.863 9.311 1506 HZ PHE 90 HZ PHE 90 7.352 -7.844 8.108 1507 H ASN 91 H ASN 91 4.819 -11.964 6.327 1508 HA ASN 91 HA ASN 91 7.110 -11.568 4.692 1509 HB2 ASN 91 HB2 ASN 91 7.225 -11.692 7.169 1510 HB3 ASN 91 HB3 ASN 91 6.714 -13.377 7.120 1511 HD21 ASN 91 HD21 ASN 91 8.588 -14.056 8.177 1512 HD22 ASN 91 HD22 ASN 91 10.136 -14.082 7.416 1513 H LYS 92 H LYS 92 4.981 -14.335 5.293 1514 HA LYS 92 HA LYS 92 6.497 -16.425 4.271 1515 HB2 LYS 92 HB2 LYS 92 4.451 -16.748 5.611 1516 HB3 LYS 92 HB3 LYS 92 3.464 -16.146 4.286 1517 HG2 LYS 92 HG2 LYS 92 3.336 -18.586 4.402 1518 HG3 LYS 92 HG3 LYS 92 4.124 -18.092 2.903 1519 HD2 LYS 92 HD2 LYS 92 6.344 -18.602 3.904 1520 HD3 LYS 92 HD3 LYS 92 5.552 -19.089 5.407 1521 HE2 LYS 92 HE2 LYS 92 6.178 -21.048 4.062 1522 HE3 LYS 92 HE3 LYS 92 4.425 -20.937 4.216 1523 HZ1 LYS 92 HZ1 LYS 92 5.154 -21.499 1.959 1524 HZ2 LYS 92 HZ2 LYS 92 5.987 -20.029 1.851 1525 HZ3 LYS 92 HZ3 LYS 92 4.302 -20.038 1.996 1526 H ILE 93 H ILE 93 3.986 -14.536 2.489 1527 HA ILE 93 HA ILE 93 4.643 -15.865 -0.003 1528 HB ILE 93 HB ILE 93 2.966 -14.575 -1.130 1529 HG12 ILE 93 HG12 ILE 93 3.472 -12.367 0.151 1530 HG13 ILE 93 HG13 ILE 93 1.822 -12.675 -0.349 1531 HG21 ILE 93 HG21 ILE 93 0.928 -15.162 0.149 1532 HG22 ILE 93 HG22 ILE 93 1.914 -15.457 1.581 1533 HG23 ILE 93 HG23 ILE 93 2.116 -16.468 0.149 1534 HD11 ILE 93 HD11 ILE 93 2.899 -13.081 2.429 1535 HD12 ILE 93 HD12 ILE 93 1.226 -13.304 1.907 1536 HD13 ILE 93 HD13 ILE 93 1.957 -11.703 1.865 1537 H ALA 94 H ALA 94 5.609 -12.895 1.580 1538 HA ALA 94 HA ALA 94 6.516 -11.395 -0.634 1539 HB1 ALA 94 HB1 ALA 94 7.873 -10.128 0.975 1540 HB2 ALA 94 HB2 ALA 94 7.612 -11.377 2.196 1541 HB3 ALA 94 HB3 ALA 94 6.252 -10.421 1.612 1542 H VAL 95 H VAL 95 8.168 -13.818 1.384 1543 HA VAL 95 HA VAL 95 10.716 -13.666 0.094 1544 HB VAL 95 HB VAL 95 9.568 -16.100 1.553 1545 HG11 VAL 95 HG11 VAL 95 11.929 -16.705 1.970 1546 HG12 VAL 95 HG12 VAL 95 12.468 -15.295 1.058 1547 HG13 VAL 95 HG13 VAL 95 11.602 -16.596 0.239 1548 HG21 VAL 95 HG21 VAL 95 11.133 -13.789 2.746 1549 HG22 VAL 95 HG22 VAL 95 10.651 -15.258 3.594 1550 HG23 VAL 95 HG23 VAL 95 9.426 -14.134 3.013 1551 H PHE 96 H PHE 96 7.859 -15.722 -0.305 1552 HA PHE 96 HA PHE 96 9.048 -17.460 -2.277 1553 HB2 PHE 96 HB2 PHE 96 7.256 -18.065 -0.516 1554 HB3 PHE 96 HB3 PHE 96 6.087 -17.266 -1.560 1555 HD1 PHE 96 HD1 PHE 96 8.720 -19.956 -1.626 1556 HD2 PHE 96 HD2 PHE 96 4.992 -18.582 -3.197 1557 HE1 PHE 96 HE1 PHE 96 8.454 -22.067 -2.857 1558 HE2 PHE 96 HE2 PHE 96 4.729 -20.694 -4.425 1559 HZ PHE 96 HZ PHE 96 6.459 -22.443 -4.257 1560 H PHE 97 H PHE 97 7.760 -14.380 -2.403 1561 HA PHE 97 HA PHE 97 6.600 -13.054 -3.777 1562 HB2 PHE 97 HB2 PHE 97 7.663 -12.786 -6.068 1563 HB3 PHE 97 HB3 PHE 97 8.747 -12.659 -4.699 1564 HD1 PHE 97 HD1 PHE 97 10.501 -14.352 -4.318 1565 HD2 PHE 97 HD2 PHE 97 7.862 -14.642 -7.675 1566 HE1 PHE 97 HE1 PHE 97 12.010 -15.994 -5.367 1567 HE2 PHE 97 HE2 PHE 97 9.373 -16.284 -8.709 1568 HZ PHE 97 HZ PHE 97 11.441 -16.963 -7.560 1569 H GLN 98 H GLN 98 5.122 -15.213 -3.285 1570 HA GLN 98 HA GLN 98 3.190 -15.263 -5.397 1571 HB2 GLN 98 HB2 GLN 98 4.930 -17.005 -6.158 1572 HB3 GLN 98 HB3 GLN 98 4.508 -17.952 -4.754 1573 HG2 GLN 98 HG2 GLN 98 2.474 -17.190 -6.863 1574 HG3 GLN 98 HG3 GLN 98 3.482 -18.620 -7.004 1575 HE21 GLN 98 HE21 GLN 98 3.314 -19.268 -4.115 1576 HE22 GLN 98 HE22 GLN 98 1.722 -19.885 -3.879
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