NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
637759 | 6gms | 18823 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 24 1H MET 24 -16.541 -13.981 -4.284 2 H2 MET 24 2H MET 24 -15.417 -13.471 -3.128 3 H3 MET 24 3H MET 24 -15.865 -15.098 -3.215 4 HA MET 24 HA MET 24 -13.675 -14.704 -4.169 5 HB2 MET 24 1HB MET 24 -15.116 -16.553 -4.973 6 HB3 MET 24 2HB MET 24 -15.780 -15.485 -6.200 7 HG2 MET 24 1HG MET 24 -14.130 -16.908 -7.192 8 HG3 MET 24 2HG MET 24 -13.531 -15.251 -7.174 9 HE1 MET 24 1HE MET 24 -10.270 -17.374 -6.714 10 HE2 MET 24 2HE MET 24 -11.078 -16.139 -7.679 11 HE3 MET 24 3HE MET 24 -11.675 -17.798 -7.691 12 H GLU 25 H GLU 25 -16.156 -13.426 -6.401 13 HA GLU 25 HA GLU 25 -14.250 -11.885 -7.854 14 HB2 GLU 25 1HB GLU 25 -17.265 -11.708 -7.855 15 HB3 GLU 25 2HB GLU 25 -16.195 -11.002 -9.053 16 HG2 GLU 25 1HG GLU 25 -15.479 -13.209 -9.756 17 HG3 GLU 25 2HG GLU 25 -16.484 -13.948 -8.508 18 H ASN 26 H ASN 26 -17.200 -10.652 -6.295 19 HA ASN 26 HA ASN 26 -17.667 -8.708 -5.214 20 HB2 ASN 26 1HB ASN 26 -14.848 -9.163 -4.213 21 HB3 ASN 26 2HB ASN 26 -15.912 -7.912 -3.578 22 HD21 ASN 26 1HD2 ASN 26 -14.699 -10.391 -2.407 23 HD22 ASN 26 2HD2 ASN 26 -16.036 -11.237 -1.708 24 H TYR 27 H TYR 27 -17.287 -8.162 -7.740 25 HA TYR 27 HA TYR 27 -14.991 -6.668 -8.415 26 HB2 TYR 27 1HB TYR 27 -16.435 -7.880 -10.048 27 HB3 TYR 27 2HB TYR 27 -17.661 -6.637 -9.825 28 HD1 TYR 27 HD1 TYR 27 -17.493 -4.537 -10.951 29 HD2 TYR 27 HD2 TYR 27 -14.235 -7.275 -11.079 30 HE1 TYR 27 HE1 TYR 27 -16.419 -3.174 -12.687 31 HE2 TYR 27 HE2 TYR 27 -13.157 -5.914 -12.820 32 HH TYR 27 HH TYR 27 -13.781 -4.280 -14.526 33 H LEU 28 H LEU 28 -18.120 -5.725 -7.136 34 HA LEU 28 HA LEU 28 -17.918 -2.977 -7.847 35 HB2 LEU 28 1HB LEU 28 -19.571 -4.392 -5.756 36 HB3 LEU 28 2HB LEU 28 -19.693 -2.674 -6.070 37 HG LEU 28 HG LEU 28 -20.260 -4.836 -8.107 38 HD11 LEU 28 1HD1 LEU 28 -22.608 -4.218 -7.806 39 HD12 LEU 28 2HD1 LEU 28 -22.152 -3.112 -6.510 40 HD13 LEU 28 3HD1 LEU 28 -21.913 -4.848 -6.313 41 HD21 LEU 28 1HD2 LEU 28 -19.511 -2.777 -9.144 42 HD22 LEU 28 2HD2 LEU 28 -20.645 -1.843 -8.171 43 HD23 LEU 28 3HD2 LEU 28 -21.248 -2.968 -9.389 44 H ARG 29 H ARG 29 -17.353 -4.710 -4.788 45 HA ARG 29 HA ARG 29 -16.275 -2.459 -3.452 46 HB2 ARG 29 1HB ARG 29 -17.082 -4.292 -2.138 47 HB3 ARG 29 2HB ARG 29 -16.003 -5.424 -2.943 48 HG2 ARG 29 1HG ARG 29 -14.095 -4.475 -1.900 49 HG3 ARG 29 2HG ARG 29 -15.032 -3.117 -1.280 50 HD2 ARG 29 1HD ARG 29 -14.601 -4.695 0.492 51 HD3 ARG 29 2HD ARG 29 -16.324 -4.671 0.117 52 HE ARG 29 HE ARG 29 -14.714 -6.742 -1.151 53 HH11 ARG 29 1HH1 ARG 29 -17.031 -5.846 1.314 54 HH12 ARG 29 2HH1 ARG 29 -17.443 -7.487 1.702 55 HH21 ARG 29 1HH2 ARG 29 -15.260 -8.910 -0.631 56 HH22 ARG 29 2HH2 ARG 29 -16.445 -9.220 0.594 57 H LYS 30 H LYS 30 -14.876 -5.018 -5.413 58 HA LYS 30 HA LYS 30 -12.179 -4.490 -4.907 59 HB2 LYS 30 1HB LYS 30 -13.021 -6.502 -6.080 60 HB3 LYS 30 2HB LYS 30 -13.398 -5.504 -7.476 61 HG2 LYS 30 1HG LYS 30 -11.101 -5.060 -7.887 62 HG3 LYS 30 2HG LYS 30 -10.628 -5.773 -6.342 63 HD2 LYS 30 1HD LYS 30 -10.165 -7.303 -8.181 64 HD3 LYS 30 2HD LYS 30 -11.406 -7.960 -7.113 65 HE2 LYS 30 1HE LYS 30 -13.139 -7.247 -8.675 66 HE3 LYS 30 2HE LYS 30 -11.912 -6.557 -9.738 67 HZ1 LYS 30 1HZ LYS 30 -12.206 -9.429 -9.036 68 HZ2 LYS 30 2HZ LYS 30 -10.980 -8.783 -10.005 69 HZ3 LYS 30 3HZ LYS 30 -12.583 -8.717 -10.523 70 H ALA 31 H ALA 31 -14.280 -3.211 -7.541 71 HA ALA 31 HA ALA 31 -12.379 -1.512 -8.647 72 HB1 ALA 31 1HB ALA 31 -14.250 -0.355 -9.665 73 HB2 ALA 31 2HB ALA 31 -15.363 -1.123 -8.533 74 HB3 ALA 31 3HB ALA 31 -14.500 -2.100 -9.720 75 H ALA 32 H ALA 32 -14.415 -1.094 -5.823 76 HA ALA 32 HA ALA 32 -13.992 1.699 -5.513 77 HB1 ALA 32 1HB ALA 32 -14.590 -0.365 -3.393 78 HB2 ALA 32 2HB ALA 32 -15.794 0.492 -4.354 79 HB3 ALA 32 3HB ALA 32 -14.770 1.382 -3.227 80 H LEU 33 H LEU 33 -12.417 -1.170 -4.210 81 HA LEU 33 HA LEU 33 -10.388 0.165 -2.771 82 HB2 LEU 33 1HB LEU 33 -10.336 -2.585 -4.031 83 HB3 LEU 33 2HB LEU 33 -9.247 -2.009 -2.780 84 HG LEU 33 HG LEU 33 -12.229 -2.362 -2.447 85 HD11 LEU 33 1HD1 LEU 33 -9.961 -4.074 -1.454 86 HD12 LEU 33 2HD1 LEU 33 -11.096 -4.499 -2.737 87 HD13 LEU 33 3HD1 LEU 33 -11.671 -4.294 -1.081 88 HD21 LEU 33 1HD2 LEU 33 -10.075 -1.735 -0.435 89 HD22 LEU 33 2HD2 LEU 33 -11.774 -2.041 -0.071 90 HD23 LEU 33 3HD2 LEU 33 -11.315 -0.622 -1.012 91 H THR 34 H THR 34 -10.715 -0.881 -6.093 92 HA THR 34 HA THR 34 -8.072 -0.411 -6.947 93 HB THR 34 HB THR 34 -10.613 -0.141 -8.575 94 HG1 THR 34 HG1 THR 34 -10.135 -2.229 -7.425 95 HG21 THR 34 1HG2 THR 34 -9.160 -0.673 -10.484 96 HG22 THR 34 2HG2 THR 34 -7.759 -0.673 -9.413 97 HG23 THR 34 3HG2 THR 34 -8.660 0.818 -9.686 98 H ASP 35 H ASP 35 -10.927 1.672 -6.741 99 HA ASP 35 HA ASP 35 -9.700 3.927 -7.968 100 HB2 ASP 35 1HB ASP 35 -12.129 3.755 -7.887 101 HB3 ASP 35 2HB ASP 35 -12.093 3.772 -6.123 102 H MET 36 H MET 36 -10.047 2.785 -4.673 103 HA MET 36 HA MET 36 -8.945 4.995 -3.342 104 HB2 MET 36 1HB MET 36 -10.048 3.069 -2.212 105 HB3 MET 36 2HB MET 36 -8.649 2.075 -2.593 106 HG2 MET 36 1HG MET 36 -8.605 2.878 -0.294 107 HG3 MET 36 2HG MET 36 -7.237 3.482 -1.231 108 HE1 MET 36 1HE MET 36 -10.952 6.092 -0.377 109 HE2 MET 36 2HE MET 36 -10.863 4.382 0.049 110 HE3 MET 36 3HE MET 36 -10.886 4.870 -1.646 111 H LEU 37 H LEU 37 -7.424 2.134 -4.757 112 HA LEU 37 HA LEU 37 -4.756 2.836 -4.196 113 HB2 LEU 37 1HB LEU 37 -5.445 0.590 -4.878 114 HB3 LEU 37 2HB LEU 37 -5.915 1.203 -6.461 115 HG LEU 37 HG LEU 37 -3.482 1.840 -6.803 116 HD11 LEU 37 1HD1 LEU 37 -1.827 0.690 -5.443 117 HD12 LEU 37 2HD1 LEU 37 -3.102 0.038 -4.414 118 HD13 LEU 37 3HD1 LEU 37 -2.797 1.775 -4.449 119 HD21 LEU 37 1HD2 LEU 37 -4.530 -0.113 -7.840 120 HD22 LEU 37 2HD2 LEU 37 -4.131 -1.078 -6.421 121 HD23 LEU 37 3HD2 LEU 37 -2.843 -0.419 -7.429 122 H GLN 38 H GLN 38 -6.899 3.588 -6.901 123 HA GLN 38 HA GLN 38 -4.968 4.890 -8.505 124 HB2 GLN 38 1HB GLN 38 -7.969 5.214 -8.431 125 HB3 GLN 38 2HB GLN 38 -6.924 5.906 -9.663 126 HG2 GLN 38 1HG GLN 38 -7.433 2.997 -9.119 127 HG3 GLN 38 2HG GLN 38 -7.894 3.926 -10.543 128 HE21 GLN 38 1HE2 GLN 38 -5.325 2.315 -8.886 129 HE22 GLN 38 2HE2 GLN 38 -4.175 2.367 -10.179 130 H THR 39 H THR 39 -6.810 5.902 -5.763 131 HA THR 39 HA THR 39 -6.382 8.713 -6.119 132 HB THR 39 HB THR 39 -7.011 7.221 -3.559 133 HG1 THR 39 HG1 THR 39 -8.562 6.806 -5.232 134 HG21 THR 39 1HG2 THR 39 -7.997 9.354 -2.846 135 HG22 THR 39 2HG2 THR 39 -7.499 10.095 -4.367 136 HG23 THR 39 3HG2 THR 39 -6.282 9.540 -3.218 137 H PHE 40 H PHE 40 -4.682 6.067 -4.571 138 HA PHE 40 HA PHE 40 -2.760 7.667 -3.213 139 HB2 PHE 40 1HB PHE 40 -3.168 5.372 -2.506 140 HB3 PHE 40 2HB PHE 40 -2.644 4.771 -4.075 141 HD1 PHE 40 HD1 PHE 40 -1.158 7.268 -1.722 142 HD2 PHE 40 HD2 PHE 40 -0.703 3.592 -3.823 143 HE1 PHE 40 HE1 PHE 40 1.159 7.100 -0.917 144 HE2 PHE 40 HE2 PHE 40 1.614 3.415 -3.018 145 HZ PHE 40 HZ PHE 40 2.549 5.172 -1.564 146 H VAL 41 H VAL 41 -2.979 6.302 -6.421 147 HA VAL 41 HA VAL 41 -0.412 6.318 -7.322 148 HB VAL 41 HB VAL 41 -2.917 7.038 -8.825 149 HG11 VAL 41 1HG1 VAL 41 -0.187 6.460 -9.962 150 HG12 VAL 41 2HG1 VAL 41 -0.989 8.032 -9.966 151 HG13 VAL 41 3HG1 VAL 41 -1.673 6.691 -10.886 152 HG21 VAL 41 1HG2 VAL 41 -1.240 4.539 -8.727 153 HG22 VAL 41 2HG2 VAL 41 -2.698 4.769 -9.692 154 HG23 VAL 41 3HG2 VAL 41 -2.795 4.775 -7.931 155 HA PRO 42 HA PRO 42 -0.625 11.057 -8.566 156 HB2 PRO 42 1HB PRO 42 -2.502 12.024 -6.487 157 HB3 PRO 42 2HB PRO 42 -2.316 12.538 -8.167 158 HG2 PRO 42 1HG PRO 42 -4.391 11.041 -7.387 159 HG3 PRO 42 2HG PRO 42 -3.638 10.836 -8.979 160 HD2 PRO 42 1HD PRO 42 -3.396 9.148 -6.533 161 HD3 PRO 42 2HD PRO 42 -3.418 8.672 -8.239 162 H TYR 43 H TYR 43 -1.181 10.033 -5.190 163 HA TYR 43 HA TYR 43 0.550 12.018 -4.103 164 HB2 TYR 43 1HB TYR 43 -0.584 9.465 -2.940 165 HB3 TYR 43 2HB TYR 43 0.418 10.591 -2.018 166 HD1 TYR 43 HD1 TYR 43 -2.906 9.819 -3.121 167 HD2 TYR 43 HD2 TYR 43 -0.417 13.008 -1.785 168 HE1 TYR 43 HE1 TYR 43 -4.899 11.136 -2.557 169 HE2 TYR 43 HE2 TYR 43 -2.411 14.326 -1.218 170 HH TYR 43 HH TYR 43 -5.488 13.007 -0.999 171 H ARG 44 H ARG 44 1.026 8.849 -5.424 172 HA ARG 44 HA ARG 44 3.461 8.161 -4.242 173 HB2 ARG 44 1HB ARG 44 2.588 7.599 -7.080 174 HB3 ARG 44 2HB ARG 44 3.890 6.782 -6.228 175 HG2 ARG 44 1HG ARG 44 2.195 6.020 -4.558 176 HG3 ARG 44 2HG ARG 44 0.950 6.671 -5.626 177 HD2 ARG 44 1HD ARG 44 2.925 4.468 -6.232 178 HD3 ARG 44 2HD ARG 44 1.175 4.313 -6.075 179 HE ARG 44 HE ARG 44 1.893 6.140 -8.145 180 HH11 ARG 44 1HH1 ARG 44 1.575 2.731 -7.394 181 HH12 ARG 44 2HH1 ARG 44 1.385 2.257 -9.051 182 HH21 ARG 44 1HH2 ARG 44 1.635 5.520 -10.319 183 HH22 ARG 44 2HH2 ARG 44 1.391 3.848 -10.716 184 H THR 45 H THR 45 2.852 9.935 -7.257 185 HA THR 45 HA THR 45 5.389 10.643 -7.950 186 HB THR 45 HB THR 45 3.034 12.528 -8.057 187 HG1 THR 45 HG1 THR 45 2.353 11.397 -9.834 188 HG21 THR 45 1HG2 THR 45 4.086 13.304 -10.130 189 HG22 THR 45 2HG2 THR 45 5.409 12.166 -9.888 190 HG23 THR 45 3HG2 THR 45 5.173 13.498 -8.756 191 H ALA 46 H ALA 46 3.339 12.238 -5.530 192 HA ALA 46 HA ALA 46 5.123 14.353 -4.933 193 HB1 ALA 46 1HB ALA 46 2.749 14.416 -4.330 194 HB2 ALA 46 2HB ALA 46 3.775 14.675 -2.920 195 HB3 ALA 46 3HB ALA 46 3.008 13.108 -3.178 196 H VAL 47 H VAL 47 4.685 11.140 -3.696 197 HA VAL 47 HA VAL 47 6.540 11.248 -1.552 198 HB VAL 47 HB VAL 47 5.636 8.869 -3.189 199 HG11 VAL 47 1HG1 VAL 47 6.515 7.474 -1.375 200 HG12 VAL 47 2HG1 VAL 47 7.166 8.911 -0.586 201 HG13 VAL 47 3HG1 VAL 47 7.799 8.402 -2.153 202 HG21 VAL 47 1HG2 VAL 47 4.232 8.378 -1.232 203 HG22 VAL 47 2HG2 VAL 47 3.836 9.940 -1.950 204 HG23 VAL 47 3HG2 VAL 47 4.791 9.865 -0.468 205 H GLU 48 H GLU 48 6.866 10.252 -4.939 206 HA GLU 48 HA GLU 48 9.622 9.602 -4.771 207 HB2 GLU 48 1HB GLU 48 8.040 10.440 -7.215 208 HB3 GLU 48 2HB GLU 48 9.602 9.638 -7.220 209 HG2 GLU 48 1HG GLU 48 8.579 7.674 -6.155 210 HG3 GLU 48 2HG GLU 48 7.011 8.486 -6.214 211 H LEU 49 H LEU 49 7.879 12.533 -5.714 212 HA LEU 49 HA LEU 49 10.067 14.110 -6.460 213 HB2 LEU 49 1HB LEU 49 7.398 14.786 -5.241 214 HB3 LEU 49 2HB LEU 49 8.561 16.033 -5.655 215 HG LEU 49 HG LEU 49 7.425 14.061 -7.641 216 HD11 LEU 49 1HD1 LEU 49 6.052 15.934 -8.430 217 HD12 LEU 49 2HD1 LEU 49 6.622 16.913 -7.077 218 HD13 LEU 49 3HD1 LEU 49 5.649 15.473 -6.776 219 HD21 LEU 49 1HD2 LEU 49 8.310 15.680 -9.283 220 HD22 LEU 49 2HD2 LEU 49 9.574 14.938 -8.307 221 HD23 LEU 49 3HD2 LEU 49 9.045 16.584 -7.960 222 H CYS 50 H CYS 50 8.553 13.603 -3.316 223 HA CYS 50 HA CYS 50 10.150 15.305 -1.800 224 HB2 CYS 50 1HB CYS 50 8.241 14.438 -0.743 225 HB3 CYS 50 2HB CYS 50 8.638 12.781 -1.175 226 H ALA 51 H ALA 51 10.522 11.763 -2.102 227 HA ALA 51 HA ALA 51 13.013 11.566 -0.922 228 HB1 ALA 51 1HB ALA 51 11.920 9.812 -3.109 229 HB2 ALA 51 2HB ALA 51 11.532 9.673 -1.395 230 HB3 ALA 51 3HB ALA 51 13.181 9.385 -1.951 231 H LEU 52 H LEU 52 12.265 12.530 -4.197 232 HA LEU 52 HA LEU 52 14.967 12.106 -5.131 233 HB2 LEU 52 1HB LEU 52 12.997 11.854 -6.618 234 HB3 LEU 52 2HB LEU 52 12.682 13.572 -6.457 235 HG LEU 52 HG LEU 52 14.938 13.997 -7.479 236 HD11 LEU 52 1HD1 LEU 52 15.955 12.166 -8.756 237 HD12 LEU 52 2HD1 LEU 52 14.798 11.042 -8.047 238 HD13 LEU 52 3HD1 LEU 52 15.977 11.856 -7.020 239 HD21 LEU 52 1HD2 LEU 52 12.858 14.168 -8.760 240 HD22 LEU 52 2HD2 LEU 52 12.964 12.455 -9.159 241 HD23 LEU 52 3HD2 LEU 52 14.189 13.575 -9.754 242 H GLU 53 H GLU 53 12.938 14.917 -4.368 243 HA GLU 53 HA GLU 53 15.001 16.783 -5.096 244 HB2 GLU 53 1HB GLU 53 12.641 17.336 -5.390 245 HB3 GLU 53 2HB GLU 53 12.375 17.193 -3.658 246 HG2 GLU 53 1HG GLU 53 13.820 19.097 -3.257 247 HG3 GLU 53 2HG GLU 53 14.162 19.219 -4.983 248 H HIS 54 H HIS 54 13.624 15.599 -2.078 249 HA HIS 54 HA HIS 54 15.519 17.193 -0.532 250 HB2 HIS 54 1HB HIS 54 13.336 15.304 0.372 251 HB3 HIS 54 2HB HIS 54 14.371 16.223 1.460 252 HD1 HIS 54 HD1 HIS 54 14.104 18.888 1.313 253 HD2 HIS 54 HD2 HIS 54 11.160 16.646 -0.577 254 HE1 HIS 54 HE1 HIS 54 12.204 20.479 0.899 255 HE2 HIS 54 HE2 HIS 54 10.450 19.116 -0.294 256 H GLY 55 H GLY 55 15.568 14.296 -2.094 257 HA2 GLY 55 1HA GLY 55 16.963 12.487 -2.051 258 HA3 GLY 55 2HA GLY 55 18.033 13.480 -1.077 259 H GLY 56 H GLY 56 14.789 12.638 0.050 260 HA2 GLY 56 1HA GLY 56 15.993 10.813 1.946 261 HA3 GLY 56 2HA GLY 56 15.300 12.279 2.627 262 H LEU 57 H LEU 57 14.520 9.208 2.502 263 HA LEU 57 HA LEU 57 11.735 9.525 1.820 264 HB2 LEU 57 1HB LEU 57 13.186 7.410 3.417 265 HB3 LEU 57 2HB LEU 57 11.458 7.386 3.128 266 HG LEU 57 HG LEU 57 13.542 7.318 0.943 267 HD11 LEU 57 1HD1 LEU 57 13.001 4.956 0.725 268 HD12 LEU 57 2HD1 LEU 57 11.906 5.065 2.102 269 HD13 LEU 57 3HD1 LEU 57 13.640 5.301 2.332 270 HD21 LEU 57 1HD2 LEU 57 11.456 8.230 0.159 271 HD22 LEU 57 2HD2 LEU 57 10.552 6.925 0.925 272 HD23 LEU 57 3HD2 LEU 57 11.616 6.580 -0.438 273 H ASP 58 H ASP 58 13.793 10.179 4.452 274 HA ASP 58 HA ASP 58 12.027 10.020 6.606 275 HB2 ASP 58 1HB ASP 58 14.395 10.092 6.989 276 HB3 ASP 58 2HB ASP 58 14.519 11.668 6.217 277 H THR 59 H THR 59 12.380 12.448 4.172 278 HA THR 59 HA THR 59 11.108 14.495 5.764 279 HB THR 59 HB THR 59 11.314 15.801 3.594 280 HG1 THR 59 HG1 THR 59 11.471 13.824 2.277 281 HG21 THR 59 1HG2 THR 59 13.831 14.600 4.755 282 HG22 THR 59 2HG2 THR 59 12.961 15.995 5.395 283 HG23 THR 59 3HG2 THR 59 13.738 16.089 3.816 284 H CYS 60 H CYS 60 10.037 11.871 4.050 285 HA CYS 60 HA CYS 60 7.891 13.238 2.659 286 HB2 CYS 60 1HB CYS 60 8.556 10.291 2.737 287 HB3 CYS 60 2HB CYS 60 7.447 11.083 1.624 288 H ASP 61 H ASP 61 7.348 13.775 5.111 289 HA ASP 61 HA ASP 61 5.436 11.761 6.092 290 HB2 ASP 61 1HB ASP 61 6.679 14.153 7.475 291 HB3 ASP 61 2HB ASP 61 5.426 13.143 8.188 292 H GLY 62 H GLY 62 3.314 12.430 6.680 293 HA2 GLY 62 1HA GLY 62 2.167 14.183 4.746 294 HA3 GLY 62 2HA GLY 62 1.310 13.374 6.052 295 H GLY 63 H GLY 63 2.066 16.313 4.832 296 HA2 GLY 63 1HA GLY 63 1.113 18.244 5.927 297 HA3 GLY 63 2HA GLY 63 1.646 17.573 7.463 298 H SER 64 H SER 64 4.053 17.106 5.195 299 HA SER 64 HA SER 64 5.267 19.720 5.554 300 HB2 SER 64 1HB SER 64 5.866 18.450 7.593 301 HB3 SER 64 2HB SER 64 6.573 17.187 6.589 302 HG SER 64 HG SER 64 7.421 19.898 6.768 303 H ASN 65 H ASN 65 7.400 19.833 4.369 304 HA ASN 65 HA ASN 65 8.526 19.738 2.408 305 HB2 ASN 65 1HB ASN 65 8.095 16.799 2.930 306 HB3 ASN 65 2HB ASN 65 9.130 17.407 1.641 307 HD21 ASN 65 1HD2 ASN 65 8.718 17.134 5.095 308 HD22 ASN 65 2HD2 ASN 65 10.350 17.532 5.518 309 H GLY 66 H GLY 66 5.788 20.269 2.039 310 HA2 GLY 66 1HA GLY 66 4.613 20.731 0.086 311 HA3 GLY 66 2HA GLY 66 5.655 19.607 -0.777 312 H ILE 67 H ILE 67 4.892 17.733 1.633 313 HA ILE 67 HA ILE 67 2.777 16.438 0.169 314 HB ILE 67 HB ILE 67 4.150 15.633 2.742 315 HG12 ILE 67 1HG1 ILE 67 4.578 14.801 -0.136 316 HG13 ILE 67 2HG1 ILE 67 5.712 15.679 0.887 317 HG21 ILE 67 1HG2 ILE 67 3.186 13.429 2.372 318 HG22 ILE 67 2HG2 ILE 67 2.374 14.009 0.919 319 HG23 ILE 67 3HG2 ILE 67 1.910 14.641 2.499 320 HD11 ILE 67 1HD1 ILE 67 5.902 13.717 2.333 321 HD12 ILE 67 2HD1 ILE 67 6.368 13.368 0.668 322 HD13 ILE 67 3HD1 ILE 67 4.797 12.842 1.276 323 HA PRO 68 HA PRO 68 -0.471 18.518 2.355 324 HB2 PRO 68 1HB PRO 68 -2.030 16.085 1.674 325 HB3 PRO 68 2HB PRO 68 -2.380 17.780 1.322 326 HG2 PRO 68 1HG PRO 68 -1.552 16.131 -0.599 327 HG3 PRO 68 2HG PRO 68 -1.000 17.821 -0.535 328 HD2 PRO 68 1HD PRO 68 0.437 15.319 0.267 329 HD3 PRO 68 2HD PRO 68 1.064 16.767 -0.558 330 H SER 69 H SER 69 -1.885 18.197 4.165 331 HA SER 69 HA SER 69 -0.641 16.611 6.209 332 HB2 SER 69 1HB SER 69 -2.540 17.661 7.592 333 HB3 SER 69 2HB SER 69 -1.355 18.764 6.893 334 HG SER 69 HG SER 69 -3.990 18.729 6.531 335 HA PRO 70 HA PRO 70 -3.054 12.980 5.742 336 HB2 PRO 70 1HB PRO 70 -3.283 12.226 8.389 337 HB3 PRO 70 2HB PRO 70 -1.878 11.902 7.368 338 HG2 PRO 70 1HG PRO 70 -2.302 14.068 9.379 339 HG3 PRO 70 2HG PRO 70 -0.843 13.122 9.041 340 HD2 PRO 70 1HD PRO 70 -1.127 15.643 8.147 341 HD3 PRO 70 2HD PRO 70 -0.287 14.404 7.190 342 H THR 71 H THR 71 -5.093 12.942 5.290 343 HA THR 71 HA THR 71 -7.098 13.758 7.239 344 HB THR 71 HB THR 71 -6.524 15.811 5.943 345 HG1 THR 71 HG1 THR 71 -8.849 16.054 5.132 346 HG21 THR 71 1HG2 THR 71 -5.943 14.744 3.819 347 HG22 THR 71 2HG2 THR 71 -7.194 15.966 3.592 348 HG23 THR 71 3HG2 THR 71 -7.624 14.256 3.599 349 H THR 72 H THR 72 -9.349 13.549 5.973 350 HA THR 72 HA THR 72 -9.270 11.012 4.505 351 HB THR 72 HB THR 72 -11.383 10.384 5.782 352 HG1 THR 72 HG1 THR 72 -12.043 12.009 7.004 353 HG21 THR 72 1HG2 THR 72 -8.803 10.568 7.341 354 HG22 THR 72 2HG2 THR 72 -9.208 9.312 6.171 355 HG23 THR 72 3HG2 THR 72 -10.135 9.458 7.665 356 H THR 73 H THR 73 -10.333 11.113 2.688 357 HA THR 73 HA THR 73 -12.172 13.250 2.091 358 HB THR 73 HB THR 73 -12.369 12.241 -0.124 359 HG1 THR 73 HG1 THR 73 -11.313 10.290 -0.586 360 HG21 THR 73 1HG2 THR 73 -10.410 13.649 0.325 361 HG22 THR 73 2HG2 THR 73 -10.033 12.375 -0.833 362 HG23 THR 73 3HG2 THR 73 -9.511 12.224 0.843 363 H ARG 74 H ARG 74 -14.308 12.298 0.849 364 HA ARG 74 HA ARG 74 -15.939 11.574 2.975 365 HB2 ARG 74 1HB ARG 74 -16.876 12.642 1.017 366 HB3 ARG 74 2HB ARG 74 -16.459 11.253 0.018 367 HG2 ARG 74 1HG ARG 74 -17.987 9.864 1.341 368 HG3 ARG 74 2HG ARG 74 -18.433 11.276 2.293 369 HD2 ARG 74 1HD ARG 74 -19.279 12.357 0.247 370 HD3 ARG 74 2HD ARG 74 -18.864 10.909 -0.671 371 HE ARG 74 HE ARG 74 -20.647 10.563 1.603 372 HH11 ARG 74 1HH1 ARG 74 -20.291 10.846 -1.868 373 HH12 ARG 74 2HH1 ARG 74 -21.843 10.154 -2.211 374 HH21 ARG 74 1HH2 ARG 74 -22.690 9.650 1.155 375 HH22 ARG 74 2HH2 ARG 74 -23.204 9.469 -0.491 376 H TYR 75 H TYR 75 -14.555 9.447 0.433 377 HA TYR 75 HA TYR 75 -15.846 7.180 1.668 378 HB2 TYR 75 1HB TYR 75 -13.929 7.290 -0.668 379 HB3 TYR 75 2HB TYR 75 -14.863 5.882 -0.158 380 HD1 TYR 75 HD1 TYR 75 -14.734 8.256 -2.585 381 HD2 TYR 75 HD2 TYR 75 -17.524 6.647 0.190 382 HE1 TYR 75 HE1 TYR 75 -16.580 8.977 -4.034 383 HE2 TYR 75 HE2 TYR 75 -19.382 7.360 -1.258 384 HH TYR 75 HH TYR 75 -18.880 8.455 -4.474 385 H VAL 76 H VAL 76 -12.821 8.779 1.985 386 HA VAL 76 HA VAL 76 -11.361 6.381 2.692 387 HB VAL 76 HB VAL 76 -10.587 9.299 2.837 388 HG11 VAL 76 1HG1 VAL 76 -8.848 6.901 3.428 389 HG12 VAL 76 2HG1 VAL 76 -9.505 7.989 4.647 390 HG13 VAL 76 3HG1 VAL 76 -8.354 8.594 3.457 391 HG21 VAL 76 1HG2 VAL 76 -9.049 8.705 1.037 392 HG22 VAL 76 2HG2 VAL 76 -10.715 8.338 0.589 393 HG23 VAL 76 3HG2 VAL 76 -9.629 7.039 1.085 394 H SER 77 H SER 77 -11.150 5.534 4.629 395 HA SER 77 HA SER 77 -12.710 6.692 6.784 396 HB2 SER 77 1HB SER 77 -12.922 4.278 6.243 397 HB3 SER 77 2HB SER 77 -11.224 4.050 6.674 398 HG SER 77 HG SER 77 -11.701 4.222 8.745 399 H ALA 78 H ALA 78 -9.345 5.778 6.137 400 HA ALA 78 HA ALA 78 -8.301 7.753 7.866 401 HB1 ALA 78 1HB ALA 78 -7.324 6.309 9.581 402 HB2 ALA 78 2HB ALA 78 -8.174 4.925 8.900 403 HB3 ALA 78 3HB ALA 78 -9.085 6.252 9.618 404 H MET 79 H MET 79 -6.138 8.026 7.573 405 HA MET 79 HA MET 79 -4.468 6.011 6.424 406 HB2 MET 79 1HB MET 79 -3.856 7.336 4.401 407 HB3 MET 79 2HB MET 79 -5.490 6.688 4.361 408 HG2 MET 79 1HG MET 79 -6.453 8.799 4.744 409 HG3 MET 79 2HG MET 79 -4.910 9.502 5.229 410 HE1 MET 79 1HE MET 79 -5.320 7.068 2.165 411 HE2 MET 79 2HE MET 79 -5.754 8.190 0.874 412 HE3 MET 79 3HE MET 79 -6.877 7.894 2.200 413 H SER 80 H SER 80 -2.349 6.408 6.770 414 HA SER 80 HA SER 80 -1.625 9.043 7.878 415 HB2 SER 80 1HB SER 80 -0.577 6.366 8.843 416 HB3 SER 80 2HB SER 80 -0.219 7.948 9.532 417 HG SER 80 HG SER 80 -2.029 6.424 10.390 418 H VAL 81 H VAL 81 0.533 9.740 7.447 419 HA VAL 81 HA VAL 81 1.900 8.196 5.342 420 HB VAL 81 HB VAL 81 1.848 11.212 5.540 421 HG11 VAL 81 1HG1 VAL 81 2.772 11.132 3.270 422 HG12 VAL 81 2HG1 VAL 81 2.806 9.370 3.353 423 HG13 VAL 81 3HG1 VAL 81 3.820 10.325 4.436 424 HG21 VAL 81 1HG2 VAL 81 0.353 11.177 3.587 425 HG22 VAL 81 2HG2 VAL 81 -0.388 10.470 5.024 426 HG23 VAL 81 3HG2 VAL 81 0.225 9.424 3.742 427 H ALA 82 H ALA 82 3.791 7.474 6.138 428 HA ALA 82 HA ALA 82 5.311 9.238 7.918 429 HB1 ALA 82 1HB ALA 82 4.092 7.639 9.327 430 HB2 ALA 82 2HB ALA 82 5.835 7.381 9.399 431 HB3 ALA 82 3HB ALA 82 4.823 6.306 8.431 432 H LYS 83 H LYS 83 7.032 9.628 6.867 433 HA LYS 83 HA LYS 83 8.947 9.447 5.576 434 HB2 LYS 83 1HB LYS 83 9.027 6.560 6.476 435 HB3 LYS 83 2HB LYS 83 10.386 7.603 6.081 436 HG2 LYS 83 1HG LYS 83 8.553 7.980 8.442 437 HG3 LYS 83 2HG LYS 83 10.141 7.214 8.503 438 HD2 LYS 83 1HD LYS 83 11.242 9.213 8.006 439 HD3 LYS 83 2HD LYS 83 9.773 9.995 7.432 440 HE2 LYS 83 1HE LYS 83 8.907 9.853 9.783 441 HE3 LYS 83 2HE LYS 83 10.509 9.301 10.269 442 HZ1 LYS 83 1HZ LYS 83 11.434 11.362 9.380 443 HZ2 LYS 83 2HZ LYS 83 10.291 11.670 10.594 444 HZ3 LYS 83 3HZ LYS 83 9.873 11.894 8.966 445 H GLY 84 H GLY 84 6.588 9.124 4.164 446 HA2 GLY 84 1HA GLY 84 6.029 8.626 1.972 447 HA3 GLY 84 2HA GLY 84 7.447 7.591 1.869 448 H VAL 85 H VAL 85 6.613 6.145 4.307 449 HA VAL 85 HA VAL 85 4.955 4.142 3.152 450 HB VAL 85 HB VAL 85 5.669 4.551 6.062 451 HG11 VAL 85 1HG1 VAL 85 3.800 3.034 5.812 452 HG12 VAL 85 2HG1 VAL 85 5.244 2.135 6.272 453 HG13 VAL 85 3HG1 VAL 85 4.683 2.106 4.600 454 HG21 VAL 85 1HG2 VAL 85 7.661 4.396 4.680 455 HG22 VAL 85 2HG2 VAL 85 7.051 2.917 3.939 456 HG23 VAL 85 3HG2 VAL 85 7.467 2.938 5.650 457 H VAL 86 H VAL 86 2.714 3.739 3.442 458 HA VAL 86 HA VAL 86 1.292 5.740 5.004 459 HB VAL 86 HB VAL 86 -0.392 6.057 3.233 460 HG11 VAL 86 1HG1 VAL 86 1.379 7.695 3.498 461 HG12 VAL 86 2HG1 VAL 86 0.928 7.538 1.801 462 HG13 VAL 86 3HG1 VAL 86 2.410 6.787 2.394 463 HG21 VAL 86 1HG2 VAL 86 0.007 5.384 0.956 464 HG22 VAL 86 2HG2 VAL 86 0.029 3.962 1.999 465 HG23 VAL 86 3HG2 VAL 86 1.544 4.649 1.408 466 H SER 87 H SER 87 0.090 4.716 6.360 467 HA SER 87 HA SER 87 -0.974 2.089 5.706 468 HB2 SER 87 1HB SER 87 -1.663 2.207 8.202 469 HB3 SER 87 2HB SER 87 0.051 2.062 7.810 470 HG SER 87 HG SER 87 -1.345 4.158 8.956 471 H LEU 88 H LEU 88 -2.954 1.695 5.161 472 HA LEU 88 HA LEU 88 -5.004 3.795 5.427 473 HB2 LEU 88 1HB LEU 88 -5.027 1.299 3.704 474 HB3 LEU 88 2HB LEU 88 -6.263 2.534 3.730 475 HG LEU 88 HG LEU 88 -5.033 2.836 1.734 476 HD11 LEU 88 1HD1 LEU 88 -3.986 4.868 3.683 477 HD12 LEU 88 2HD1 LEU 88 -5.573 4.902 2.917 478 HD13 LEU 88 3HD1 LEU 88 -4.118 5.054 1.936 479 HD21 LEU 88 1HD2 LEU 88 -3.051 1.534 2.299 480 HD22 LEU 88 2HD2 LEU 88 -2.495 2.834 3.356 481 HD23 LEU 88 3HD2 LEU 88 -2.620 3.103 1.618 482 H THR 89 H THR 89 -6.683 3.438 6.838 483 HA THR 89 HA THR 89 -6.781 0.748 8.039 484 HB THR 89 HB THR 89 -7.345 3.293 9.553 485 HG1 THR 89 HG1 THR 89 -5.258 3.578 9.684 486 HG21 THR 89 1HG2 THR 89 -6.986 1.883 11.511 487 HG22 THR 89 2HG2 THR 89 -6.634 0.503 10.469 488 HG23 THR 89 3HG2 THR 89 -8.254 1.203 10.490 489 H GLY 90 H GLY 90 -8.685 -0.198 8.281 490 HA2 GLY 90 1HA GLY 90 -10.930 -0.642 8.028 491 HA3 GLY 90 2HA GLY 90 -11.144 0.900 8.836 492 H GLN 91 H GLN 91 -9.836 0.243 5.624 493 HA GLN 91 HA GLN 91 -11.476 2.381 4.586 494 HB2 GLN 91 1HB GLN 91 -9.054 2.012 4.017 495 HB3 GLN 91 2HB GLN 91 -9.544 0.591 3.107 496 HG2 GLN 91 1HG GLN 91 -9.132 2.640 1.756 497 HG3 GLN 91 2HG GLN 91 -10.721 1.905 1.531 498 HE21 GLN 91 1HE2 GLN 91 -12.511 3.049 2.018 499 HE22 GLN 91 2HE2 GLN 91 -12.499 4.685 2.578 500 H GLU 92 H GLU 92 -13.361 2.137 3.550 501 HA GLU 92 HA GLU 92 -15.201 1.197 2.612 502 HB2 GLU 92 1HB GLU 92 -13.219 -0.841 1.579 503 HB3 GLU 92 2HB GLU 92 -14.870 -0.645 1.003 504 HG2 GLU 92 1HG GLU 92 -12.631 1.341 0.761 505 HG3 GLU 92 2HG GLU 92 -13.358 0.393 -0.529 506 H SER 93 H SER 93 -15.310 -1.820 2.179 507 HA SER 93 HA SER 93 -16.569 -2.582 4.566 508 HB2 SER 93 1HB SER 93 -15.372 -4.430 2.498 509 HB3 SER 93 2HB SER 93 -16.723 -4.768 3.581 510 HG SER 93 HG SER 93 -17.983 -3.328 2.448 511 H LEU 94 H LEU 94 -13.291 -2.230 3.962 512 HA LEU 94 HA LEU 94 -12.365 -4.622 5.284 513 HB2 LEU 94 1HB LEU 94 -10.756 -2.239 4.379 514 HB3 LEU 94 2HB LEU 94 -10.151 -3.845 4.761 515 HG LEU 94 HG LEU 94 -11.938 -3.154 2.422 516 HD11 LEU 94 1HD1 LEU 94 -9.002 -3.795 2.584 517 HD12 LEU 94 2HD1 LEU 94 -9.731 -2.264 2.100 518 HD13 LEU 94 3HD1 LEU 94 -9.930 -3.694 1.087 519 HD21 LEU 94 1HD2 LEU 94 -11.502 -5.439 1.682 520 HD22 LEU 94 2HD2 LEU 94 -12.334 -5.419 3.236 521 HD23 LEU 94 3HD2 LEU 94 -10.605 -5.755 3.165 522 H ASN 95 H ASN 95 -13.976 -2.898 6.880 523 HA ASN 95 HA ASN 95 -12.619 -1.342 8.723 524 HB2 ASN 95 1HB ASN 95 -15.058 -1.553 8.661 525 HB3 ASN 95 2HB ASN 95 -14.939 -3.224 9.195 526 HD21 ASN 95 1HD2 ASN 95 -16.153 -2.891 11.024 527 HD22 ASN 95 2HD2 ASN 95 -15.573 -1.989 12.382 528 H GLY 96 H GLY 96 -11.327 -1.734 10.434 529 HA2 GLY 96 1HA GLY 96 -10.149 -2.969 12.029 530 HA3 GLY 96 2HA GLY 96 -10.877 -4.438 11.391 531 H LEU 97 H LEU 97 -9.990 -3.408 8.634 532 HA LEU 97 HA LEU 97 -7.462 -4.825 8.714 533 HB2 LEU 97 1HB LEU 97 -9.165 -5.430 7.064 534 HB3 LEU 97 2HB LEU 97 -9.141 -3.799 6.426 535 HG LEU 97 HG LEU 97 -6.618 -5.408 6.352 536 HD11 LEU 97 1HD1 LEU 97 -8.296 -6.936 5.484 537 HD12 LEU 97 2HD1 LEU 97 -7.308 -6.311 4.164 538 HD13 LEU 97 3HD1 LEU 97 -8.931 -5.674 4.431 539 HD21 LEU 97 1HD2 LEU 97 -6.258 -4.122 4.318 540 HD22 LEU 97 2HD2 LEU 97 -6.609 -3.049 5.673 541 HD23 LEU 97 3HD2 LEU 97 -7.857 -3.396 4.477 542 H SER 98 H SER 98 -5.502 -3.979 8.145 543 HA SER 98 HA SER 98 -5.414 -1.114 7.485 544 HB2 SER 98 1HB SER 98 -3.484 -2.565 9.317 545 HB3 SER 98 2HB SER 98 -3.470 -0.844 8.925 546 HG SER 98 HG SER 98 -5.889 -1.409 9.808 547 H VAL 99 H VAL 99 -4.367 -0.731 5.646 548 HA VAL 99 HA VAL 99 -2.634 -2.833 4.532 549 HB VAL 99 HB VAL 99 -3.789 -0.388 3.167 550 HG11 VAL 99 1HG1 VAL 99 -1.703 -1.064 2.147 551 HG12 VAL 99 2HG1 VAL 99 -3.053 -1.461 1.087 552 HG13 VAL 99 3HG1 VAL 99 -2.272 -2.729 2.032 553 HG21 VAL 99 1HG2 VAL 99 -5.527 -1.991 3.738 554 HG22 VAL 99 2HG2 VAL 99 -4.607 -3.279 2.965 555 HG23 VAL 99 3HG2 VAL 99 -5.254 -1.955 1.998 556 H VAL 100 H VAL 100 -0.452 -2.512 4.340 557 HA VAL 100 HA VAL 100 0.520 0.137 5.170 558 HB VAL 100 HB VAL 100 1.958 -2.501 5.503 559 HG11 VAL 100 1HG1 VAL 100 3.466 -1.207 6.950 560 HG12 VAL 100 2HG1 VAL 100 2.581 0.263 6.542 561 HG13 VAL 100 3HG1 VAL 100 3.466 -0.610 5.291 562 HG21 VAL 100 1HG2 VAL 100 1.469 -2.274 7.896 563 HG22 VAL 100 2HG2 VAL 100 -0.007 -2.424 6.942 564 HG23 VAL 100 3HG2 VAL 100 0.488 -0.847 7.556 565 H MET 101 H MET 101 1.015 1.173 3.352 566 HA MET 101 HA MET 101 2.366 -0.221 1.165 567 HB2 MET 101 1HB MET 101 0.543 1.397 0.681 568 HB3 MET 101 2HB MET 101 1.505 2.669 1.413 569 HG2 MET 101 1HG MET 101 1.855 2.964 -0.847 570 HG3 MET 101 2HG MET 101 3.280 2.069 -0.328 571 HE1 MET 101 1HE MET 101 -0.169 1.932 -2.107 572 HE2 MET 101 2HE MET 101 -0.394 0.652 -0.916 573 HE3 MET 101 3HE MET 101 -0.281 0.252 -2.629 574 H THR 102 H THR 102 4.513 -0.445 1.336 575 HA THR 102 HA THR 102 6.031 1.678 2.712 576 HB THR 102 HB THR 102 6.796 -1.237 2.497 577 HG1 THR 102 HG1 THR 102 4.864 -0.558 3.854 578 HG21 THR 102 1HG2 THR 102 7.898 0.986 4.221 579 HG22 THR 102 2HG2 THR 102 8.688 0.305 2.800 580 HG23 THR 102 3HG2 THR 102 8.431 -0.695 4.229 581 HA PRO 103 HA PRO 103 7.759 1.883 -1.553 582 HB2 PRO 103 1HB PRO 103 8.569 4.474 -1.275 583 HB3 PRO 103 2HB PRO 103 6.946 4.006 -1.813 584 HG2 PRO 103 1HG PRO 103 7.871 4.844 0.915 585 HG3 PRO 103 2HG PRO 103 6.396 5.307 0.037 586 HD2 PRO 103 1HD PRO 103 6.392 3.433 1.977 587 HD3 PRO 103 2HD PRO 103 5.311 3.327 0.568 588 H GLY 104 H GLY 104 9.788 1.363 -2.021 589 HA2 GLY 104 1HA GLY 104 11.868 1.827 0.019 590 HA3 GLY 104 2HA GLY 104 11.915 0.563 -1.202 591 H TRP 105 H TRP 105 13.818 2.743 -0.523 592 HA TRP 105 HA TRP 105 14.159 3.738 -3.254 593 HB2 TRP 105 1HB TRP 105 13.041 5.470 -1.705 594 HB3 TRP 105 2HB TRP 105 14.594 5.553 -0.882 595 HD1 TRP 105 HD1 TRP 105 16.704 6.482 -2.404 596 HE1 TRP 105 HE1 TRP 105 16.701 8.187 -4.331 597 HE3 TRP 105 HE3 TRP 105 11.734 6.342 -3.609 598 HZ2 TRP 105 HZ2 TRP 105 14.841 9.329 -6.114 599 HZ3 TRP 105 HZ3 TRP 105 10.925 7.778 -5.434 600 HH2 TRP 105 HH2 TRP 105 12.449 9.240 -6.658 601 H ASP 106 H ASP 106 15.611 1.798 -2.920 602 HA ASP 106 HA ASP 106 18.153 2.658 -1.706 603 HB2 ASP 106 1HB ASP 106 16.950 -0.116 -1.705 604 HB3 ASP 106 2HB ASP 106 18.595 0.251 -1.198 605 H ASN 107 H ASN 107 19.114 3.331 -3.547 606 HA ASN 107 HA ASN 107 19.062 1.999 -6.029 607 HB2 ASN 107 1HB ASN 107 19.693 4.370 -5.752 608 HB3 ASN 107 2HB ASN 107 21.157 3.877 -4.911 609 HD21 ASN 107 1HD2 ASN 107 22.506 4.840 -6.374 610 HD22 ASN 107 2HD2 ASN 107 22.746 4.228 -7.975 611 H ALA 108 H ALA 108 21.005 1.588 -3.168 612 HA ALA 108 HA ALA 108 23.117 0.100 -4.336 613 HB1 ALA 108 1HB ALA 108 22.128 0.114 -1.486 614 HB2 ALA 108 2HB ALA 108 23.344 1.192 -2.168 615 HB3 ALA 108 3HB ALA 108 23.672 -0.535 -2.041 616 H ASN 109 H ASN 109 19.918 -0.690 -3.278 617 HA ASN 109 HA ASN 109 20.458 -3.564 -3.572 618 HB2 ASN 109 1HB ASN 109 18.075 -2.096 -2.417 619 HB3 ASN 109 2HB ASN 109 18.154 -3.844 -2.600 620 HD21 ASN 109 1HD2 ASN 109 17.827 -2.274 -0.202 621 HD22 ASN 109 2HD2 ASN 109 19.146 -2.675 0.840 622 H GLY 110 H GLY 110 19.798 -1.136 -5.491 623 HA2 GLY 110 1HA GLY 110 18.723 -0.785 -7.485 624 HA3 GLY 110 2HA GLY 110 18.768 -2.532 -7.653 625 H VAL 111 H VAL 111 17.016 -0.790 -5.128 626 HA VAL 111 HA VAL 111 14.533 -1.787 -6.353 627 HB VAL 111 HB VAL 111 13.604 -2.128 -4.095 628 HG11 VAL 111 1HG1 VAL 111 16.171 -3.622 -4.609 629 HG12 VAL 111 2HG1 VAL 111 14.589 -4.005 -5.288 630 HG13 VAL 111 3HG1 VAL 111 14.864 -4.153 -3.552 631 HG21 VAL 111 1HG2 VAL 111 14.919 -0.567 -2.818 632 HG22 VAL 111 2HG2 VAL 111 16.392 -1.463 -3.175 633 HG23 VAL 111 3HG2 VAL 111 15.147 -2.188 -2.161 634 H THR 112 H THR 112 12.927 -0.406 -6.624 635 HA THR 112 HA THR 112 12.581 1.904 -4.935 636 HB THR 112 HB THR 112 12.972 2.352 -7.909 637 HG1 THR 112 HG1 THR 112 14.785 2.190 -5.924 638 HG21 THR 112 1HG2 THR 112 12.847 4.730 -7.316 639 HG22 THR 112 2HG2 THR 112 12.568 4.297 -5.630 640 HG23 THR 112 3HG2 THR 112 11.369 3.883 -6.856 641 H GLY 113 H GLY 113 10.694 0.652 -4.479 642 HA2 GLY 113 1HA GLY 113 8.520 1.225 -6.319 643 HA3 GLY 113 2HA GLY 113 8.842 -0.480 -6.031 644 H TRP 114 H TRP 114 6.475 -0.088 -5.295 645 HA TRP 114 HA TRP 114 6.458 0.788 -2.488 646 HB2 TRP 114 1HB TRP 114 4.153 0.565 -4.438 647 HB3 TRP 114 2HB TRP 114 4.035 1.123 -2.770 648 HD1 TRP 114 HD1 TRP 114 4.865 3.586 -2.235 649 HE1 TRP 114 HE1 TRP 114 5.420 5.603 -3.737 650 HE3 TRP 114 HE3 TRP 114 5.135 1.197 -6.745 651 HZ2 TRP 114 HZ2 TRP 114 5.907 6.113 -6.470 652 HZ3 TRP 114 HZ3 TRP 114 5.648 2.520 -8.754 653 HH2 TRP 114 HH2 TRP 114 6.024 4.928 -8.619 654 H ALA 115 H ALA 115 6.318 -0.759 -1.008 655 HA ALA 115 HA ALA 115 5.502 -3.442 -1.802 656 HB1 ALA 115 1HB ALA 115 6.648 -2.448 0.808 657 HB2 ALA 115 2HB ALA 115 7.568 -3.177 -0.507 658 HB3 ALA 115 3HB ALA 115 6.375 -4.133 0.371 659 H ARG 116 H ARG 116 3.663 -4.398 -1.145 660 HA ARG 116 HA ARG 116 1.841 -2.727 0.463 661 HB2 ARG 116 1HB ARG 116 1.226 -4.578 -1.841 662 HB3 ARG 116 2HB ARG 116 0.001 -3.814 -0.832 663 HG2 ARG 116 1HG ARG 116 0.631 -1.647 -1.560 664 HG3 ARG 116 2HG ARG 116 2.074 -2.267 -2.358 665 HD2 ARG 116 1HD ARG 116 -0.746 -2.977 -3.145 666 HD3 ARG 116 2HD ARG 116 0.213 -1.713 -3.911 667 HE ARG 116 HE ARG 116 0.540 -4.584 -4.195 668 HH11 ARG 116 1HH1 ARG 116 1.918 -1.403 -4.712 669 HH12 ARG 116 2HH1 ARG 116 2.977 -1.928 -5.977 670 HH21 ARG 116 1HH2 ARG 116 1.941 -5.274 -5.854 671 HH22 ARG 116 2HH2 ARG 116 3.001 -4.133 -6.620 672 H ASN 117 H ASN 117 0.652 -3.646 2.067 673 HA ASN 117 HA ASN 117 0.699 -6.539 2.396 674 HB2 ASN 117 1HB ASN 117 2.666 -5.631 3.653 675 HB3 ASN 117 2HB ASN 117 1.547 -4.685 4.630 676 HD21 ASN 117 1HD2 ASN 117 2.745 -7.857 3.908 677 HD22 ASN 117 2HD2 ASN 117 2.050 -8.657 5.272 678 H CYS 118 H CYS 118 -1.124 -7.325 3.328 679 HA CYS 118 HA CYS 118 -3.094 -5.379 4.317 680 HB2 CYS 118 1HB CYS 118 -3.364 -8.087 3.041 681 HB3 CYS 118 2HB CYS 118 -4.655 -7.443 4.052 682 H ASN 119 H ASN 119 -3.163 -5.252 6.491 683 HA ASN 119 HA ASN 119 -2.699 -7.740 8.007 684 HB2 ASN 119 1HB ASN 119 -1.169 -5.795 8.477 685 HB3 ASN 119 2HB ASN 119 -2.574 -4.894 9.036 686 HD21 ASN 119 1HD2 ASN 119 -0.164 -5.661 10.467 687 HD22 ASN 119 2HD2 ASN 119 -0.684 -6.584 11.834 688 H ILE 120 H ILE 120 -4.663 -8.634 8.132 689 HA ILE 120 HA ILE 120 -6.578 -7.212 9.805 690 HB ILE 120 HB ILE 120 -7.531 -6.956 7.627 691 HG12 ILE 120 1HG1 ILE 120 -9.645 -8.229 7.830 692 HG13 ILE 120 2HG1 ILE 120 -8.907 -9.209 9.087 693 HG21 ILE 120 1HG2 ILE 120 -7.143 -9.916 7.265 694 HG22 ILE 120 2HG2 ILE 120 -6.317 -8.620 6.400 695 HG23 ILE 120 3HG2 ILE 120 -8.047 -8.875 6.166 696 HD11 ILE 120 1HD1 ILE 120 -8.722 -7.279 10.524 697 HD12 ILE 120 2HD1 ILE 120 -10.382 -7.455 9.964 698 HD13 ILE 120 3HD1 ILE 120 -9.335 -6.235 9.242 699 H GLN 121 H GLN 121 -6.443 -8.404 11.648 700 HA GLN 121 HA GLN 121 -5.436 -11.095 11.497 701 HB2 GLN 121 1HB GLN 121 -4.768 -9.380 13.228 702 HB3 GLN 121 2HB GLN 121 -6.340 -9.631 13.972 703 HG2 GLN 121 1HG GLN 121 -5.795 -12.009 14.265 704 HG3 GLN 121 2HG GLN 121 -4.198 -11.705 13.581 705 HE21 GLN 121 1HE2 GLN 121 -4.055 -9.064 14.881 706 HE22 GLN 121 2HE2 GLN 121 -3.720 -9.380 16.546 707 H SER 122 H SER 122 -8.553 -9.593 12.143 708 HA SER 122 HA SER 122 -9.602 -12.118 13.164 709 HB2 SER 122 1HB SER 122 -11.612 -10.734 13.730 710 HB3 SER 122 2HB SER 122 -10.117 -10.161 14.474 711 HG SER 122 HG SER 122 -11.489 -9.095 12.225 712 H ASP 123 H ASP 123 -9.406 -10.700 10.132 713 HA ASP 123 HA ASP 123 -11.802 -12.098 9.230 714 HB2 ASP 123 1HB ASP 123 -11.346 -9.149 8.781 715 HB3 ASP 123 2HB ASP 123 -12.531 -10.104 7.898 716 H SER 124 H SER 124 -10.297 -13.503 8.206 717 HA SER 124 HA SER 124 -8.397 -12.729 6.302 718 HB2 SER 124 1HB SER 124 -10.031 -15.279 6.332 719 HB3 SER 124 2HB SER 124 -8.474 -15.037 5.540 720 HG SER 124 HG SER 124 -8.883 -15.864 7.983 721 H ALA 125 H ALA 125 -11.866 -12.997 6.071 722 HA ALA 125 HA ALA 125 -12.133 -13.243 3.286 723 HB1 ALA 125 1HB ALA 125 -14.416 -12.490 3.603 724 HB2 ALA 125 2HB ALA 125 -14.019 -11.902 5.218 725 HB3 ALA 125 3HB ALA 125 -13.968 -13.632 4.871 726 H LEU 126 H LEU 126 -11.750 -10.419 5.354 727 HA LEU 126 HA LEU 126 -12.248 -8.504 3.319 728 HB2 LEU 126 1HB LEU 126 -10.712 -8.247 5.902 729 HB3 LEU 126 2HB LEU 126 -11.203 -6.902 4.888 730 HG LEU 126 HG LEU 126 -13.053 -8.791 6.351 731 HD11 LEU 126 1HD1 LEU 126 -13.620 -6.820 7.683 732 HD12 LEU 126 2HD1 LEU 126 -12.399 -5.887 6.818 733 HD13 LEU 126 3HD1 LEU 126 -11.915 -7.240 7.836 734 HD21 LEU 126 1HD2 LEU 126 -14.041 -8.074 4.253 735 HD22 LEU 126 2HD2 LEU 126 -13.669 -6.393 4.629 736 HD23 LEU 126 3HD2 LEU 126 -14.838 -7.278 5.610 737 H GLN 127 H GLN 127 -9.445 -10.249 4.427 738 HA GLN 127 HA GLN 127 -7.468 -8.730 3.125 739 HB2 GLN 127 1HB GLN 127 -6.883 -10.363 4.823 740 HB3 GLN 127 2HB GLN 127 -7.521 -11.665 3.832 741 HG2 GLN 127 1HG GLN 127 -5.790 -11.345 2.200 742 HG3 GLN 127 2HG GLN 127 -5.195 -9.922 3.052 743 HE21 GLN 127 1HE2 GLN 127 -5.636 -11.214 5.673 744 HE22 GLN 127 2HE2 GLN 127 -4.344 -12.341 5.858 745 H GLN 128 H GLN 128 -9.452 -11.451 2.091 746 HA GLN 128 HA GLN 128 -8.312 -12.001 -0.369 747 HB2 GLN 128 1HB GLN 128 -11.181 -12.108 0.542 748 HB3 GLN 128 2HB GLN 128 -10.672 -12.680 -1.041 749 HG2 GLN 128 1HG GLN 128 -9.656 -13.709 1.596 750 HG3 GLN 128 2HG GLN 128 -10.877 -14.486 0.593 751 HE21 GLN 128 1HE2 GLN 128 -9.512 -13.782 -1.898 752 HE22 GLN 128 2HE2 GLN 128 -8.145 -14.833 -2.005 753 H ALA 129 H ALA 129 -10.539 -9.439 0.524 754 HA ALA 129 HA ALA 129 -10.996 -8.562 -2.158 755 HB1 ALA 129 1HB ALA 129 -12.076 -6.621 -1.104 756 HB2 ALA 129 2HB ALA 129 -11.503 -7.176 0.469 757 HB3 ALA 129 3HB ALA 129 -12.655 -8.150 -0.443 758 H CYS 130 H CYS 130 -8.982 -7.400 0.535 759 HA CYS 130 HA CYS 130 -8.064 -5.125 -0.908 760 HB2 CYS 130 1HB CYS 130 -6.600 -4.718 0.959 761 HB3 CYS 130 2HB CYS 130 -8.154 -5.261 1.584 762 H GLU 131 H GLU 131 -6.682 -8.328 -0.251 763 HA GLU 131 HA GLU 131 -4.145 -7.807 -1.331 764 HB2 GLU 131 1HB GLU 131 -3.743 -10.146 -1.308 765 HB3 GLU 131 2HB GLU 131 -4.745 -9.792 0.092 766 HG2 GLU 131 1HG GLU 131 -6.666 -10.713 -0.933 767 HG3 GLU 131 2HG GLU 131 -5.865 -10.804 -2.504 768 H ASP 132 H ASP 132 -7.174 -8.402 -2.869 769 HA ASP 132 HA ASP 132 -6.173 -9.322 -5.353 770 HB2 ASP 132 1HB ASP 132 -8.594 -9.399 -4.539 771 HB3 ASP 132 2HB ASP 132 -8.695 -7.703 -4.994 772 H VAL 133 H VAL 133 -7.075 -6.069 -4.209 773 HA VAL 133 HA VAL 133 -6.128 -4.857 -6.661 774 HB VAL 133 HB VAL 133 -7.147 -3.617 -4.101 775 HG11 VAL 133 1HG1 VAL 133 -7.274 -1.522 -5.338 776 HG12 VAL 133 2HG1 VAL 133 -6.538 -2.294 -6.743 777 HG13 VAL 133 3HG1 VAL 133 -5.611 -2.102 -5.256 778 HG21 VAL 133 1HG2 VAL 133 -8.421 -4.079 -6.790 779 HG22 VAL 133 2HG2 VAL 133 -9.122 -3.093 -5.510 780 HG23 VAL 133 3HG2 VAL 133 -8.870 -4.819 -5.254 781 H PHE 134 H PHE 134 -5.160 -4.946 -3.281 782 HA PHE 134 HA PHE 134 -2.774 -3.384 -3.771 783 HB2 PHE 134 1HB PHE 134 -3.905 -4.588 -1.238 784 HB3 PHE 134 2HB PHE 134 -2.407 -3.669 -1.307 785 HD1 PHE 134 HD1 PHE 134 -6.027 -3.494 -1.283 786 HD2 PHE 134 HD2 PHE 134 -2.451 -1.267 -1.914 787 HE1 PHE 134 HE1 PHE 134 -7.291 -1.397 -1.057 788 HE2 PHE 134 HE2 PHE 134 -3.712 0.834 -1.681 789 HZ PHE 134 HZ PHE 134 -6.136 0.769 -1.256 790 H ARG 135 H ARG 135 -3.038 -5.957 -5.040 791 HA ARG 135 HA ARG 135 -2.036 -8.138 -3.659 792 HB2 ARG 135 1HB ARG 135 -1.532 -9.099 -5.892 793 HB3 ARG 135 2HB ARG 135 -3.142 -8.401 -5.790 794 HG2 ARG 135 1HG ARG 135 -2.309 -6.383 -6.932 795 HG3 ARG 135 2HG ARG 135 -0.731 -7.155 -7.094 796 HD2 ARG 135 1HD ARG 135 -1.983 -7.410 -9.153 797 HD3 ARG 135 2HD ARG 135 -1.780 -8.979 -8.377 798 HE ARG 135 HE ARG 135 -4.226 -7.894 -7.540 799 HH11 ARG 135 1HH1 ARG 135 -2.734 -9.159 -10.441 800 HH12 ARG 135 2HH1 ARG 135 -4.236 -9.662 -11.150 801 HH21 ARG 135 1HH2 ARG 135 -6.213 -8.562 -8.466 802 HH22 ARG 135 2HH2 ARG 135 -6.212 -9.331 -10.026 803 H PHE 136 H PHE 136 -0.049 -9.090 -3.495 804 HA PHE 136 HA PHE 136 2.237 -7.326 -3.912 805 HB2 PHE 136 1HB PHE 136 2.919 -7.914 -1.482 806 HB3 PHE 136 2HB PHE 136 1.733 -6.641 -1.749 807 HD1 PHE 136 HD1 PHE 136 2.282 -10.028 -0.471 808 HD2 PHE 136 HD2 PHE 136 -0.598 -6.959 -1.136 809 HE1 PHE 136 HE1 PHE 136 0.712 -11.173 1.039 810 HE2 PHE 136 HE2 PHE 136 -2.169 -8.107 0.369 811 HZ PHE 136 HZ PHE 136 -1.515 -10.213 1.459 812 H ASP 137 H ASP 137 3.957 -8.370 -4.597 813 HA ASP 137 HA ASP 137 3.998 -11.250 -4.684 814 HB2 ASP 137 1HB ASP 137 6.183 -9.314 -5.500 815 HB3 ASP 137 2HB ASP 137 6.035 -11.000 -5.974 816 H ASP 138 H ASP 138 5.856 -12.500 -3.810 817 HA ASP 138 HA ASP 138 6.137 -12.117 -1.080 818 HB2 ASP 138 1HB ASP 138 6.556 -14.260 -2.272 819 HB3 ASP 138 2HB ASP 138 8.072 -13.596 -2.874 820 H ALA 139 H ALA 139 8.193 -11.049 -3.699 821 HA ALA 139 HA ALA 139 10.287 -10.102 -1.975 822 HB1 ALA 139 1HB ALA 139 10.785 -10.930 -4.215 823 HB2 ALA 139 2HB ALA 139 11.308 -9.258 -4.024 824 HB3 ALA 139 3HB ALA 139 9.830 -9.624 -4.915 825 H ASN 140 H ASN 140 7.302 -8.824 -3.000 826 HA ASN 140 HA ASN 140 8.280 -6.083 -2.559 827 HB2 ASN 140 1HB ASN 140 7.494 -6.619 -4.909 828 HB3 ASN 140 2HB ASN 140 5.870 -6.788 -4.239 829 HD21 ASN 140 1HD2 ASN 140 5.078 -5.040 -5.421 830 HD22 ASN 140 2HD2 ASN 140 5.481 -3.406 -5.015 831 H LEU 141 H LEU 141 7.131 -8.124 -0.672 832 HA LEU 141 HA LEU 141 5.077 -6.316 0.394 833 HB2 LEU 141 1HB LEU 141 4.072 -8.176 1.588 834 HB3 LEU 141 2HB LEU 141 4.115 -8.499 -0.128 835 HG LEU 141 HG LEU 141 6.294 -9.844 0.472 836 HD11 LEU 141 1HD1 LEU 141 6.356 -9.154 2.828 837 HD12 LEU 141 2HD1 LEU 141 6.186 -10.901 2.657 838 HD13 LEU 141 3HD1 LEU 141 4.788 -9.918 3.085 839 HD21 LEU 141 1HD2 LEU 141 3.515 -10.830 1.091 840 HD22 LEU 141 2HD2 LEU 141 4.920 -11.845 0.768 841 HD23 LEU 141 3HD2 LEU 141 4.280 -10.797 -0.498 842 H VAL 142 H VAL 142 5.368 -5.499 2.407 843 HA VAL 142 HA VAL 142 7.882 -5.909 3.713 844 HB VAL 142 HB VAL 142 6.867 -3.700 3.793 845 HG11 VAL 142 1HG1 VAL 142 4.833 -3.262 5.112 846 HG12 VAL 142 2HG1 VAL 142 4.600 -5.002 5.291 847 HG13 VAL 142 3HG1 VAL 142 4.525 -4.259 3.693 848 HG21 VAL 142 1HG2 VAL 142 6.944 -5.016 6.502 849 HG22 VAL 142 2HG2 VAL 142 6.956 -3.277 6.221 850 HG23 VAL 142 3HG2 VAL 142 8.295 -4.268 5.649 851 HA PRO 143 HA PRO 143 6.559 -9.535 5.817 852 HB2 PRO 143 1HB PRO 143 8.586 -9.707 7.630 853 HB3 PRO 143 2HB PRO 143 8.757 -10.158 5.934 854 HG2 PRO 143 1HG PRO 143 9.583 -7.647 7.323 855 HG3 PRO 143 2HG PRO 143 10.435 -8.569 6.071 856 HD2 PRO 143 1HD PRO 143 9.045 -6.300 5.538 857 HD3 PRO 143 2HD PRO 143 9.213 -7.620 4.365 858 H ARG 144 H ARG 144 5.146 -9.885 7.388 859 HA ARG 144 HA ARG 144 5.175 -8.133 9.751 860 HB2 ARG 144 1HB ARG 144 2.685 -9.147 8.361 861 HB3 ARG 144 2HB ARG 144 2.746 -8.091 9.762 862 HG2 ARG 144 1HG ARG 144 3.703 -7.398 6.992 863 HG3 ARG 144 2HG ARG 144 2.196 -6.862 7.736 864 HD2 ARG 144 1HD ARG 144 4.996 -6.202 8.655 865 HD3 ARG 144 2HD ARG 144 3.864 -5.110 7.861 866 HE ARG 144 HE ARG 144 2.450 -5.309 9.854 867 HH11 ARG 144 1HH1 ARG 144 5.830 -6.188 10.128 868 HH12 ARG 144 2HH1 ARG 144 5.899 -5.885 11.842 869 HH21 ARG 144 1HH2 ARG 144 2.547 -4.901 12.101 870 HH22 ARG 144 2HH2 ARG 144 4.032 -5.165 12.954 871 H GLY 145 H GLY 145 4.855 -9.162 11.700 872 HA2 GLY 145 1HA GLY 145 4.067 -11.979 11.634 873 HA3 GLY 145 2HA GLY 145 5.636 -11.579 12.326 874 H SER 146 H SER 146 3.565 -12.836 13.746 875 HA SER 146 HA SER 146 2.475 -10.714 15.453 876 HB2 SER 146 1HB SER 146 1.907 -13.690 15.521 877 HB3 SER 146 2HB SER 146 1.019 -12.428 16.379 878 HG SER 146 HG SER 146 1.202 -12.772 13.557 879 H GLY 147 H GLY 147 3.637 -10.138 17.131 880 HA2 GLY 147 1HA GLY 147 4.762 -10.294 19.130 881 HA3 GLY 147 2HA GLY 147 4.611 -12.039 19.030 882 H LEU 148 H LEU 148 5.981 -12.270 16.459 883 HA LEU 148 HA LEU 148 8.701 -11.830 17.465 884 HB2 LEU 148 1HB LEU 148 7.740 -13.686 15.286 885 HB3 LEU 148 2HB LEU 148 9.386 -13.562 15.871 886 HG LEU 148 HG LEU 148 7.008 -14.569 17.436 887 HD11 LEU 148 1HD1 LEU 148 7.817 -16.128 15.742 888 HD12 LEU 148 2HD1 LEU 148 8.178 -16.706 17.367 889 HD13 LEU 148 3HD1 LEU 148 9.451 -15.986 16.385 890 HD21 LEU 148 1HD2 LEU 148 8.489 -13.426 18.949 891 HD22 LEU 148 2HD2 LEU 148 9.892 -14.228 18.247 892 HD23 LEU 148 3HD2 LEU 148 8.702 -15.164 19.150 893 H GLU 149 H GLU 149 8.765 -9.623 16.807 894 HA GLU 149 HA GLU 149 9.354 -9.382 13.932 895 HB2 GLU 149 1HB GLU 149 8.677 -7.217 15.936 896 HB3 GLU 149 2HB GLU 149 9.176 -6.917 14.278 897 HG2 GLU 149 1HG GLU 149 7.202 -8.149 13.482 898 HG3 GLU 149 2HG GLU 149 6.691 -8.374 15.155 899 H HIS 150 H HIS 150 10.521 -8.959 17.187 900 HA HIS 150 HA HIS 150 12.969 -7.705 16.506 901 HB2 HIS 150 1HB HIS 150 13.658 -8.110 18.777 902 HB3 HIS 150 2HB HIS 150 11.962 -7.654 18.792 903 HD1 HIS 150 HD1 HIS 150 14.185 -9.980 20.287 904 HD2 HIS 150 HD2 HIS 150 10.272 -10.194 18.894 905 HE1 HIS 150 HE1 HIS 150 13.162 -11.972 21.431 906 HE2 HIS 150 HE2 HIS 150 10.752 -11.982 20.699 907 H HIS 151 H HIS 151 14.937 -8.520 16.015 908 HA HIS 151 HA HIS 151 15.012 -11.392 15.393 909 HB2 HIS 151 1HB HIS 151 16.751 -9.135 14.368 910 HB3 HIS 151 2HB HIS 151 16.901 -10.823 13.899 911 HD1 HIS 151 HD1 HIS 151 15.177 -11.743 12.218 912 HD2 HIS 151 HD2 HIS 151 14.595 -7.754 13.220 913 HE1 HIS 151 HE1 HIS 151 13.555 -10.851 10.520 914 HE2 HIS 151 HE2 HIS 151 13.406 -8.384 11.015 915 H HIS 152 H HIS 152 15.945 -12.570 16.929 916 HA HIS 152 HA HIS 152 17.805 -11.412 18.793 917 HB2 HIS 152 1HB HIS 152 16.182 -13.109 19.529 918 HB3 HIS 152 2HB HIS 152 16.913 -14.285 18.441 919 HD1 HIS 152 HD1 HIS 152 18.805 -15.635 19.353 920 HD2 HIS 152 HD2 HIS 152 17.972 -12.296 21.687 921 HE1 HIS 152 HE1 HIS 152 20.262 -15.852 21.389 922 HE2 HIS 152 HE2 HIS 152 19.786 -13.795 22.762 923 H HIS 153 H HIS 153 19.476 -10.765 17.378 924 HA HIS 153 HA HIS 153 21.026 -12.918 16.125 925 HB2 HIS 153 1HB HIS 153 20.442 -10.922 14.760 926 HB3 HIS 153 2HB HIS 153 21.352 -9.916 15.881 927 HD1 HIS 153 HD1 HIS 153 21.779 -12.389 13.112 928 HD2 HIS 153 HD2 HIS 153 24.140 -10.045 15.607 929 HE1 HIS 153 HE1 HIS 153 24.089 -12.454 12.118 930 HE2 HIS 153 HE2 HIS 153 25.530 -11.199 13.759 931 H HIS 154 H HIS 154 21.221 -10.379 18.544 932 HA HIS 154 HA HIS 154 23.972 -10.966 19.183 933 HB2 HIS 154 1HB HIS 154 21.951 -9.252 20.649 934 HB3 HIS 154 2HB HIS 154 23.667 -9.343 21.020 935 HD1 HIS 154 HD1 HIS 154 21.412 -7.190 19.433 936 HD2 HIS 154 HD2 HIS 154 25.182 -8.627 18.420 937 HE1 HIS 154 HE1 HIS 154 22.318 -5.573 17.734 938 HE2 HIS 154 HE2 HIS 154 24.630 -6.417 17.187 939 H HIS 155 H HIS 155 24.389 -12.845 20.104 940 HA HIS 155 HA HIS 155 22.549 -13.830 22.174 941 HB2 HIS 155 1HB HIS 155 23.560 -16.098 21.667 942 HB3 HIS 155 2HB HIS 155 22.549 -15.411 20.406 943 HD1 HIS 155 HD1 HIS 155 23.782 -14.568 18.240 944 HD2 HIS 155 HD2 HIS 155 26.190 -16.584 20.961 945 HE1 HIS 155 HE1 HIS 155 25.872 -15.161 16.981 946 HE2 HIS 155 HE2 HIS 155 27.395 -16.175 18.711 Start of MODEL 2 1 H1 MET 24 1H MET 24 -14.951 -12.725 -3.064 2 H2 MET 24 2H MET 24 -14.812 -14.375 -2.738 3 H3 MET 24 3H MET 24 -15.312 -13.314 -1.522 4 HA MET 24 HA MET 24 -16.813 -13.897 -4.005 5 HB2 MET 24 1HB MET 24 -17.339 -14.727 -1.141 6 HB3 MET 24 2HB MET 24 -18.409 -15.030 -2.500 7 HG2 MET 24 1HG MET 24 -16.792 -16.486 -3.516 8 HG3 MET 24 2HG MET 24 -15.607 -16.096 -2.275 9 HE1 MET 24 1HE MET 24 -16.446 -19.812 -1.438 10 HE2 MET 24 2HE MET 24 -15.165 -18.641 -1.747 11 HE3 MET 24 3HE MET 24 -16.293 -19.075 -3.033 12 H GLU 25 H GLU 25 -18.532 -12.595 -4.394 13 HA GLU 25 HA GLU 25 -19.729 -10.664 -4.385 14 HB2 GLU 25 1HB GLU 25 -20.093 -11.799 -1.648 15 HB3 GLU 25 2HB GLU 25 -20.785 -10.225 -2.013 16 HG2 GLU 25 1HG GLU 25 -22.366 -12.091 -2.318 17 HG3 GLU 25 2HG GLU 25 -22.110 -11.145 -3.782 18 H ASN 26 H ASN 26 -17.076 -10.102 -4.280 19 HA ASN 26 HA ASN 26 -17.104 -7.580 -2.812 20 HB2 ASN 26 1HB ASN 26 -14.716 -7.920 -2.163 21 HB3 ASN 26 2HB ASN 26 -15.836 -9.005 -1.348 22 HD21 ASN 26 1HD2 ASN 26 -14.114 -10.411 -0.898 23 HD22 ASN 26 2HD2 ASN 26 -13.438 -11.441 -2.113 24 H TYR 27 H TYR 27 -17.377 -8.527 -5.632 25 HA TYR 27 HA TYR 27 -14.887 -8.001 -6.955 26 HB2 TYR 27 1HB TYR 27 -17.569 -8.111 -8.326 27 HB3 TYR 27 2HB TYR 27 -15.993 -8.578 -8.955 28 HD1 TYR 27 HD1 TYR 27 -19.008 -9.780 -7.616 29 HD2 TYR 27 HD2 TYR 27 -14.826 -10.575 -7.640 30 HE1 TYR 27 HE1 TYR 27 -19.450 -12.094 -6.922 31 HE2 TYR 27 HE2 TYR 27 -15.263 -12.897 -6.954 32 HH TYR 27 HH TYR 27 -18.367 -14.281 -7.024 33 H LEU 28 H LEU 28 -17.947 -6.274 -6.546 34 HA LEU 28 HA LEU 28 -17.148 -3.978 -8.005 35 HB2 LEU 28 1HB LEU 28 -19.195 -4.238 -5.797 36 HB3 LEU 28 2HB LEU 28 -19.027 -2.851 -6.855 37 HG LEU 28 HG LEU 28 -19.815 -5.639 -7.725 38 HD11 LEU 28 1HD1 LEU 28 -22.002 -4.653 -8.142 39 HD12 LEU 28 2HD1 LEU 28 -21.438 -3.109 -7.504 40 HD13 LEU 28 3HD1 LEU 28 -21.556 -4.510 -6.442 41 HD21 LEU 28 1HD2 LEU 28 -18.580 -4.484 -9.471 42 HD22 LEU 28 2HD2 LEU 28 -19.612 -3.066 -9.289 43 HD23 LEU 28 3HD2 LEU 28 -20.289 -4.580 -9.890 44 H ARG 29 H ARG 29 -16.848 -4.985 -4.668 45 HA ARG 29 HA ARG 29 -15.801 -2.562 -3.667 46 HB2 ARG 29 1HB ARG 29 -16.664 -4.159 -2.115 47 HB3 ARG 29 2HB ARG 29 -15.584 -5.413 -2.705 48 HG2 ARG 29 1HG ARG 29 -13.751 -4.534 -1.621 49 HG3 ARG 29 2HG ARG 29 -14.455 -2.920 -1.516 50 HD2 ARG 29 1HD ARG 29 -14.390 -4.021 0.665 51 HD3 ARG 29 2HD ARG 29 -16.042 -3.697 0.149 52 HE ARG 29 HE ARG 29 -14.898 -6.364 -0.274 53 HH11 ARG 29 1HH1 ARG 29 -17.263 -4.285 1.267 54 HH12 ARG 29 2HH1 ARG 29 -18.155 -5.601 1.957 55 HH21 ARG 29 1HH2 ARG 29 -16.094 -8.100 0.628 56 HH22 ARG 29 2HH2 ARG 29 -17.504 -7.763 1.579 57 H LYS 30 H LYS 30 -14.347 -5.338 -5.252 58 HA LYS 30 HA LYS 30 -11.652 -4.777 -4.822 59 HB2 LYS 30 1HB LYS 30 -13.057 -6.004 -7.194 60 HB3 LYS 30 2HB LYS 30 -11.311 -5.840 -7.124 61 HG2 LYS 30 1HG LYS 30 -11.231 -7.268 -5.163 62 HG3 LYS 30 2HG LYS 30 -12.992 -7.392 -5.162 63 HD2 LYS 30 1HD LYS 30 -12.853 -8.371 -7.455 64 HD3 LYS 30 2HD LYS 30 -11.099 -8.379 -7.289 65 HE2 LYS 30 1HE LYS 30 -12.939 -9.772 -5.357 66 HE3 LYS 30 2HE LYS 30 -12.274 -10.559 -6.786 67 HZ1 LYS 30 1HZ LYS 30 -10.708 -9.398 -4.550 68 HZ2 LYS 30 2HZ LYS 30 -10.043 -10.101 -5.940 69 HZ3 LYS 30 3HZ LYS 30 -10.942 -11.043 -4.857 70 H ALA 31 H ALA 31 -13.773 -3.645 -7.497 71 HA ALA 31 HA ALA 31 -11.846 -2.016 -8.704 72 HB1 ALA 31 1HB ALA 31 -13.885 -2.724 -9.828 73 HB2 ALA 31 2HB ALA 31 -13.722 -0.968 -9.856 74 HB3 ALA 31 3HB ALA 31 -14.841 -1.732 -8.730 75 H ALA 32 H ALA 32 -14.148 -1.368 -6.113 76 HA ALA 32 HA ALA 32 -13.799 1.422 -5.983 77 HB1 ALA 32 1HB ALA 32 -14.682 1.255 -3.712 78 HB2 ALA 32 2HB ALA 32 -14.438 -0.491 -3.735 79 HB3 ALA 32 3HB ALA 32 -15.614 0.248 -4.822 80 H LEU 33 H LEU 33 -12.157 -1.237 -4.333 81 HA LEU 33 HA LEU 33 -10.325 0.394 -2.907 82 HB2 LEU 33 1HB LEU 33 -10.072 -2.497 -3.760 83 HB3 LEU 33 2HB LEU 33 -9.091 -1.699 -2.540 84 HG LEU 33 HG LEU 33 -12.077 -2.136 -2.352 85 HD11 LEU 33 1HD1 LEU 33 -9.828 -3.564 -0.957 86 HD12 LEU 33 2HD1 LEU 33 -10.844 -4.234 -2.233 87 HD13 LEU 33 3HD1 LEU 33 -11.548 -3.810 -0.671 88 HD21 LEU 33 1HD2 LEU 33 -11.799 -1.449 -0.019 89 HD22 LEU 33 2HD2 LEU 33 -11.355 -0.160 -1.136 90 HD23 LEU 33 3HD2 LEU 33 -10.098 -1.097 -0.328 91 H THR 34 H THR 34 -10.330 -1.076 -6.081 92 HA THR 34 HA THR 34 -7.654 -0.526 -6.789 93 HB THR 34 HB THR 34 -10.065 -0.618 -8.617 94 HG1 THR 34 HG1 THR 34 -9.601 -2.531 -7.217 95 HG21 THR 34 1HG2 THR 34 -7.135 -1.083 -9.187 96 HG22 THR 34 2HG2 THR 34 -8.062 0.339 -9.659 97 HG23 THR 34 3HG2 THR 34 -8.453 -1.236 -10.350 98 H ASP 35 H ASP 35 -10.611 1.347 -6.855 99 HA ASP 35 HA ASP 35 -9.593 3.555 -8.327 100 HB2 ASP 35 1HB ASP 35 -12.004 3.136 -8.125 101 HB3 ASP 35 2HB ASP 35 -11.911 3.406 -6.385 102 H MET 36 H MET 36 -9.870 2.773 -4.906 103 HA MET 36 HA MET 36 -8.865 5.199 -3.893 104 HB2 MET 36 1HB MET 36 -8.560 2.435 -2.698 105 HB3 MET 36 2HB MET 36 -8.362 3.959 -1.844 106 HG2 MET 36 1HG MET 36 -10.895 2.876 -3.045 107 HG3 MET 36 2HG MET 36 -10.506 3.014 -1.329 108 HE1 MET 36 1HE MET 36 -10.218 5.329 -0.075 109 HE2 MET 36 2HE MET 36 -10.450 6.902 -0.837 110 HE3 MET 36 3HE MET 36 -9.069 5.902 -1.286 111 H LEU 37 H LEU 37 -7.268 2.234 -4.946 112 HA LEU 37 HA LEU 37 -4.627 3.018 -4.340 113 HB2 LEU 37 1HB LEU 37 -5.256 0.706 -4.860 114 HB3 LEU 37 2HB LEU 37 -5.653 1.179 -6.508 115 HG LEU 37 HG LEU 37 -3.191 1.882 -6.719 116 HD11 LEU 37 1HD1 LEU 37 -2.647 1.852 -4.337 117 HD12 LEU 37 2HD1 LEU 37 -1.629 0.736 -5.243 118 HD13 LEU 37 3HD1 LEU 37 -2.972 0.118 -4.282 119 HD21 LEU 37 1HD2 LEU 37 -3.897 -1.028 -6.366 120 HD22 LEU 37 2HD2 LEU 37 -2.507 -0.402 -7.253 121 HD23 LEU 37 3HD2 LEU 37 -4.142 -0.066 -7.824 122 H GLN 38 H GLN 38 -6.623 3.405 -7.237 123 HA GLN 38 HA GLN 38 -4.608 4.621 -8.810 124 HB2 GLN 38 1HB GLN 38 -7.608 4.554 -9.043 125 HB3 GLN 38 2HB GLN 38 -6.589 5.390 -10.209 126 HG2 GLN 38 1HG GLN 38 -6.438 2.460 -9.539 127 HG3 GLN 38 2HG GLN 38 -7.210 3.155 -10.965 128 HE21 GLN 38 1HE2 GLN 38 -4.951 1.277 -10.716 129 HE22 GLN 38 2HE2 GLN 38 -3.643 2.012 -11.582 130 H THR 39 H THR 39 -6.905 5.871 -6.495 131 HA THR 39 HA THR 39 -6.409 8.630 -7.101 132 HB THR 39 HB THR 39 -7.440 7.421 -4.521 133 HG1 THR 39 HG1 THR 39 -8.616 7.076 -6.669 134 HG21 THR 39 1HG2 THR 39 -8.438 9.626 -4.149 135 HG22 THR 39 2HG2 THR 39 -7.713 10.214 -5.645 136 HG23 THR 39 3HG2 THR 39 -6.684 9.746 -4.291 137 H PHE 40 H PHE 40 -4.943 6.187 -5.094 138 HA PHE 40 HA PHE 40 -3.311 7.934 -3.558 139 HB2 PHE 40 1HB PHE 40 -3.838 5.637 -2.828 140 HB3 PHE 40 2HB PHE 40 -2.899 5.005 -4.178 141 HD1 PHE 40 HD1 PHE 40 -0.905 4.118 -3.542 142 HD2 PHE 40 HD2 PHE 40 -2.325 7.601 -1.548 143 HE1 PHE 40 HE1 PHE 40 1.148 4.182 -2.199 144 HE2 PHE 40 HE2 PHE 40 -0.274 7.668 -0.197 145 HZ PHE 40 HZ PHE 40 1.470 5.956 -0.518 146 H VAL 41 H VAL 41 -2.932 6.339 -6.657 147 HA VAL 41 HA VAL 41 -0.225 6.511 -7.066 148 HB VAL 41 HB VAL 41 -2.437 6.839 -9.081 149 HG11 VAL 41 1HG1 VAL 41 0.500 6.397 -9.582 150 HG12 VAL 41 2HG1 VAL 41 -0.403 7.863 -9.956 151 HG13 VAL 41 3HG1 VAL 41 -0.772 6.360 -10.803 152 HG21 VAL 41 1HG2 VAL 41 -2.385 4.692 -7.939 153 HG22 VAL 41 2HG2 VAL 41 -0.682 4.502 -8.353 154 HG23 VAL 41 3HG2 VAL 41 -1.902 4.514 -9.626 155 HA PRO 42 HA PRO 42 -0.711 11.127 -8.707 156 HB2 PRO 42 1HB PRO 42 -3.032 11.887 -7.017 157 HB3 PRO 42 2HB PRO 42 -2.591 12.437 -8.638 158 HG2 PRO 42 1HG PRO 42 -4.582 10.705 -8.285 159 HG3 PRO 42 2HG PRO 42 -3.474 10.559 -9.663 160 HD2 PRO 42 1HD PRO 42 -3.579 8.972 -7.133 161 HD3 PRO 42 2HD PRO 42 -3.199 8.448 -8.784 162 H TYR 43 H TYR 43 -1.496 10.005 -5.414 163 HA TYR 43 HA TYR 43 -0.270 12.308 -4.174 164 HB2 TYR 43 1HB TYR 43 -1.294 9.668 -3.108 165 HB3 TYR 43 2HB TYR 43 -0.435 10.824 -2.086 166 HD1 TYR 43 HD1 TYR 43 -1.583 12.580 -1.070 167 HD2 TYR 43 HD2 TYR 43 -3.430 10.498 -4.288 168 HE1 TYR 43 HE1 TYR 43 -3.680 13.788 -0.643 169 HE2 TYR 43 HE2 TYR 43 -5.531 11.699 -3.867 170 HH TYR 43 HH TYR 43 -6.654 12.878 -2.029 171 H ARG 44 H ARG 44 0.587 9.098 -5.171 172 HA ARG 44 HA ARG 44 3.049 8.796 -3.907 173 HB2 ARG 44 1HB ARG 44 2.107 7.816 -6.597 174 HB3 ARG 44 2HB ARG 44 3.639 7.344 -5.878 175 HG2 ARG 44 1HG ARG 44 2.438 6.376 -3.976 176 HG3 ARG 44 2HG ARG 44 0.906 6.823 -4.738 177 HD2 ARG 44 1HD ARG 44 1.347 5.382 -6.605 178 HD3 ARG 44 2HD ARG 44 2.986 5.071 -6.042 179 HE ARG 44 HE ARG 44 1.304 4.219 -4.032 180 HH11 ARG 44 1HH1 ARG 44 1.847 3.476 -7.405 181 HH12 ARG 44 2HH1 ARG 44 1.399 1.806 -7.246 182 HH21 ARG 44 1HH2 ARG 44 0.735 2.005 -3.806 183 HH22 ARG 44 2HH2 ARG 44 0.785 0.967 -5.193 184 H THR 45 H THR 45 2.217 10.434 -6.937 185 HA THR 45 HA THR 45 4.668 11.210 -7.825 186 HB THR 45 HB THR 45 2.291 13.068 -7.667 187 HG1 THR 45 HG1 THR 45 2.858 11.182 -9.727 188 HG21 THR 45 1HG2 THR 45 3.159 13.941 -9.787 189 HG22 THR 45 2HG2 THR 45 4.520 12.825 -9.691 190 HG23 THR 45 3HG2 THR 45 4.347 14.107 -8.494 191 H ALA 46 H ALA 46 2.827 12.734 -5.190 192 HA ALA 46 HA ALA 46 4.690 14.790 -4.639 193 HB1 ALA 46 1HB ALA 46 2.400 14.874 -3.805 194 HB2 ALA 46 2HB ALA 46 3.546 14.966 -2.467 195 HB3 ALA 46 3HB ALA 46 2.699 13.454 -2.802 196 H VAL 47 H VAL 47 4.327 11.503 -3.576 197 HA VAL 47 HA VAL 47 6.387 11.476 -1.617 198 HB VAL 47 HB VAL 47 5.274 9.189 -3.259 199 HG11 VAL 47 1HG1 VAL 47 6.220 7.716 -1.550 200 HG12 VAL 47 2HG1 VAL 47 6.946 9.108 -0.746 201 HG13 VAL 47 3HG1 VAL 47 7.483 8.644 -2.361 202 HG21 VAL 47 1HG2 VAL 47 3.577 10.265 -1.894 203 HG22 VAL 47 2HG2 VAL 47 4.610 10.134 -0.471 204 HG23 VAL 47 3HG2 VAL 47 3.975 8.678 -1.235 205 H GLU 48 H GLU 48 6.306 10.717 -5.073 206 HA GLU 48 HA GLU 48 8.996 9.883 -5.290 207 HB2 GLU 48 1HB GLU 48 7.240 11.102 -7.436 208 HB3 GLU 48 2HB GLU 48 8.730 10.217 -7.710 209 HG2 GLU 48 1HG GLU 48 7.678 8.208 -6.731 210 HG3 GLU 48 2HG GLU 48 6.170 9.112 -6.578 211 H LEU 49 H LEU 49 7.433 13.036 -5.669 212 HA LEU 49 HA LEU 49 9.670 14.492 -6.507 213 HB2 LEU 49 1HB LEU 49 7.097 15.128 -5.200 214 HB3 LEU 49 2HB LEU 49 8.366 16.322 -4.991 215 HG LEU 49 HG LEU 49 6.895 16.856 -6.884 216 HD11 LEU 49 1HD1 LEU 49 9.249 17.561 -6.889 217 HD12 LEU 49 2HD1 LEU 49 8.610 17.310 -8.512 218 HD13 LEU 49 3HD1 LEU 49 9.667 16.102 -7.785 219 HD21 LEU 49 1HD2 LEU 49 7.946 14.311 -8.108 220 HD22 LEU 49 2HD2 LEU 49 6.924 15.505 -8.908 221 HD23 LEU 49 3HD2 LEU 49 6.297 14.577 -7.543 222 H CYS 50 H CYS 50 8.506 13.756 -3.253 223 HA CYS 50 HA CYS 50 10.575 15.045 -1.842 224 HB2 CYS 50 1HB CYS 50 8.543 14.371 -0.719 225 HB3 CYS 50 2HB CYS 50 8.824 12.684 -1.122 226 H ALA 51 H ALA 51 10.168 11.609 -2.667 227 HA ALA 51 HA ALA 51 12.634 10.639 -1.919 228 HB1 ALA 51 1HB ALA 51 12.257 8.799 -3.445 229 HB2 ALA 51 2HB ALA 51 11.046 9.739 -4.318 230 HB3 ALA 51 3HB ALA 51 10.747 9.245 -2.651 231 H LEU 52 H LEU 52 11.898 12.545 -4.761 232 HA LEU 52 HA LEU 52 14.429 11.935 -6.017 233 HB2 LEU 52 1HB LEU 52 12.237 13.889 -6.686 234 HB3 LEU 52 2HB LEU 52 13.738 13.822 -7.585 235 HG LEU 52 HG LEU 52 11.811 11.510 -7.303 236 HD11 LEU 52 1HD1 LEU 52 11.227 11.964 -9.634 237 HD12 LEU 52 2HD1 LEU 52 12.244 13.405 -9.606 238 HD13 LEU 52 3HD1 LEU 52 10.809 13.317 -8.583 239 HD21 LEU 52 1HD2 LEU 52 13.131 10.556 -9.161 240 HD22 LEU 52 2HD2 LEU 52 14.069 10.752 -7.683 241 HD23 LEU 52 3HD2 LEU 52 14.267 11.898 -9.010 242 H GLU 53 H GLU 53 13.069 14.549 -4.116 243 HA GLU 53 HA GLU 53 15.184 16.382 -4.644 244 HB2 GLU 53 1HB GLU 53 12.893 17.076 -4.019 245 HB3 GLU 53 2HB GLU 53 13.150 16.415 -2.412 246 HG2 GLU 53 1HG GLU 53 14.903 18.022 -1.989 247 HG3 GLU 53 2HG GLU 53 14.759 18.646 -3.631 248 H HIS 54 H HIS 54 14.448 14.216 -1.934 249 HA HIS 54 HA HIS 54 17.027 15.000 -0.715 250 HB2 HIS 54 1HB HIS 54 15.099 15.401 0.722 251 HB3 HIS 54 2HB HIS 54 14.570 13.737 0.528 252 HD1 HIS 54 HD1 HIS 54 15.116 12.323 2.450 253 HD2 HIS 54 HD2 HIS 54 17.855 15.420 2.006 254 HE1 HIS 54 HE1 HIS 54 16.723 12.090 4.375 255 HE2 HIS 54 HE2 HIS 54 18.411 13.930 4.048 256 H GLY 55 H GLY 55 15.446 12.538 -2.351 257 HA2 GLY 55 1HA GLY 55 16.040 10.455 -3.037 258 HA3 GLY 55 2HA GLY 55 17.646 10.777 -2.410 259 H GLY 56 H GLY 56 16.726 11.076 0.428 260 HA2 GLY 56 1HA GLY 56 15.631 8.423 0.880 261 HA3 GLY 56 2HA GLY 56 16.300 9.492 2.101 262 H LEU 57 H LEU 57 13.799 7.960 2.007 263 HA LEU 57 HA LEU 57 11.608 9.761 1.638 264 HB2 LEU 57 1HB LEU 57 11.761 7.097 3.051 265 HB3 LEU 57 2HB LEU 57 10.279 7.956 2.670 266 HG LEU 57 HG LEU 57 12.206 7.100 0.523 267 HD11 LEU 57 1HD1 LEU 57 11.565 5.117 1.809 268 HD12 LEU 57 2HD1 LEU 57 10.848 5.113 0.200 269 HD13 LEU 57 3HD1 LEU 57 9.865 5.536 1.600 270 HD21 LEU 57 1HD2 LEU 57 9.265 7.766 0.522 271 HD22 LEU 57 2HD2 LEU 57 10.191 7.222 -0.877 272 HD23 LEU 57 3HD2 LEU 57 10.565 8.770 -0.120 273 H ASP 58 H ASP 58 13.919 9.613 3.941 274 HA ASP 58 HA ASP 58 12.794 9.757 6.418 275 HB2 ASP 58 1HB ASP 58 15.029 11.498 5.383 276 HB3 ASP 58 2HB ASP 58 14.693 11.148 7.077 277 H THR 59 H THR 59 12.857 12.278 3.977 278 HA THR 59 HA THR 59 11.670 14.187 5.823 279 HB THR 59 HB THR 59 11.956 15.760 3.864 280 HG1 THR 59 HG1 THR 59 12.293 14.705 2.043 281 HG21 THR 59 1HG2 THR 59 13.573 15.641 5.703 282 HG22 THR 59 2HG2 THR 59 14.375 15.956 4.166 283 HG23 THR 59 3HG2 THR 59 14.425 14.341 4.870 284 H CYS 60 H CYS 60 10.440 11.770 4.095 285 HA CYS 60 HA CYS 60 8.290 13.282 2.820 286 HB2 CYS 60 1HB CYS 60 8.756 10.295 2.790 287 HB3 CYS 60 2HB CYS 60 7.695 11.213 1.728 288 H ASP 61 H ASP 61 7.980 13.782 5.291 289 HA ASP 61 HA ASP 61 6.259 11.752 6.541 290 HB2 ASP 61 1HB ASP 61 8.097 12.469 7.950 291 HB3 ASP 61 2HB ASP 61 7.682 14.161 7.698 292 H GLY 62 H GLY 62 4.157 12.156 6.996 293 HA2 GLY 62 1HA GLY 62 2.872 14.326 5.646 294 HA3 GLY 62 2HA GLY 62 2.095 13.146 6.695 295 H GLY 63 H GLY 63 3.261 16.330 6.408 296 HA2 GLY 63 1HA GLY 63 2.198 17.825 8.121 297 HA3 GLY 63 2HA GLY 63 2.909 16.742 9.310 298 H SER 64 H SER 64 5.107 16.912 6.867 299 HA SER 64 HA SER 64 6.280 19.447 7.657 300 HB2 SER 64 1HB SER 64 8.475 18.319 8.161 301 HB3 SER 64 2HB SER 64 7.203 17.996 9.337 302 HG SER 64 HG SER 64 6.914 15.972 8.471 303 H ASN 65 H ASN 65 8.356 19.833 6.368 304 HA ASN 65 HA ASN 65 9.413 20.069 4.383 305 HB2 ASN 65 1HB ASN 65 8.630 17.172 4.031 306 HB3 ASN 65 2HB ASN 65 9.826 18.025 3.061 307 HD21 ASN 65 1HD2 ASN 65 9.127 16.613 6.165 308 HD22 ASN 65 2HD2 ASN 65 10.748 16.663 6.778 309 H GLY 66 H GLY 66 6.636 20.808 4.456 310 HA2 GLY 66 1HA GLY 66 5.350 21.850 2.805 311 HA3 GLY 66 2HA GLY 66 6.212 20.928 1.581 312 H ILE 67 H ILE 67 5.620 18.487 3.370 313 HA ILE 67 HA ILE 67 3.192 17.767 1.995 314 HB ILE 67 HB ILE 67 4.828 16.173 3.984 315 HG12 ILE 67 1HG1 ILE 67 4.860 16.170 0.958 316 HG13 ILE 67 2HG1 ILE 67 6.145 16.766 2.004 317 HG21 ILE 67 1HG2 ILE 67 2.502 15.396 3.736 318 HG22 ILE 67 2HG2 ILE 67 3.667 14.227 3.113 319 HG23 ILE 67 3HG2 ILE 67 2.755 15.243 1.997 320 HD11 ILE 67 1HD1 ILE 67 5.204 13.914 1.818 321 HD12 ILE 67 2HD1 ILE 67 6.494 14.513 2.861 322 HD13 ILE 67 3HD1 ILE 67 6.678 14.575 1.108 323 HA PRO 68 HA PRO 68 0.722 19.163 5.403 324 HB2 PRO 68 1HB PRO 68 -1.674 18.255 4.534 325 HB3 PRO 68 2HB PRO 68 -0.876 19.666 3.827 326 HG2 PRO 68 1HG PRO 68 -0.982 16.848 2.829 327 HG3 PRO 68 2HG PRO 68 -1.138 18.369 1.919 328 HD2 PRO 68 1HD PRO 68 1.166 16.906 2.016 329 HD3 PRO 68 2HD PRO 68 1.147 18.672 1.809 330 H SER 69 H SER 69 -0.018 18.349 7.284 331 HA SER 69 HA SER 69 0.347 15.840 8.248 332 HB2 SER 69 1HB SER 69 -1.985 17.652 8.923 333 HB3 SER 69 2HB SER 69 -1.350 16.360 9.943 334 HG SER 69 HG SER 69 0.476 17.522 10.306 335 HA PRO 70 HA PRO 70 -2.069 13.063 5.911 336 HB2 PRO 70 1HB PRO 70 -2.791 11.322 7.970 337 HB3 PRO 70 2HB PRO 70 -1.310 11.233 7.009 338 HG2 PRO 70 1HG PRO 70 -1.749 12.394 9.718 339 HG3 PRO 70 2HG PRO 70 -0.344 11.518 9.084 340 HD2 PRO 70 1HD PRO 70 -0.309 14.181 9.378 341 HD3 PRO 70 2HD PRO 70 0.492 13.395 8.001 342 H THR 71 H THR 71 -4.125 12.892 5.285 343 HA THR 71 HA THR 71 -6.232 13.751 7.119 344 HB THR 71 HB THR 71 -5.538 15.728 5.778 345 HG1 THR 71 HG1 THR 71 -7.575 16.249 5.879 346 HG21 THR 71 1HG2 THR 71 -6.009 15.782 3.370 347 HG22 THR 71 2HG2 THR 71 -6.438 14.072 3.418 348 HG23 THR 71 3HG2 THR 71 -4.783 14.577 3.759 349 H THR 72 H THR 72 -8.414 13.429 5.830 350 HA THR 72 HA THR 72 -8.223 10.868 4.416 351 HB THR 72 HB THR 72 -10.325 10.161 5.610 352 HG1 THR 72 HG1 THR 72 -10.836 11.252 7.531 353 HG21 THR 72 1HG2 THR 72 -7.909 10.606 7.363 354 HG22 THR 72 2HG2 THR 72 -8.117 9.274 6.227 355 HG23 THR 72 3HG2 THR 72 -9.180 9.412 7.626 356 H THR 73 H THR 73 -9.242 10.908 2.543 357 HA THR 73 HA THR 73 -10.927 13.051 1.741 358 HB THR 73 HB THR 73 -11.209 11.804 -0.331 359 HG1 THR 73 HG1 THR 73 -10.697 9.683 -0.499 360 HG21 THR 73 1HG2 THR 73 -8.875 11.509 -0.999 361 HG22 THR 73 2HG2 THR 73 -8.384 11.514 0.694 362 HG23 THR 73 3HG2 THR 73 -9.071 12.969 -0.029 363 H ARG 74 H ARG 74 -13.138 12.228 0.614 364 HA ARG 74 HA ARG 74 -14.873 11.716 2.719 365 HB2 ARG 74 1HB ARG 74 -15.706 12.744 0.720 366 HB3 ARG 74 2HB ARG 74 -15.258 11.350 -0.251 367 HG2 ARG 74 1HG ARG 74 -17.673 11.475 0.162 368 HG3 ARG 74 2HG ARG 74 -16.947 10.007 0.818 369 HD2 ARG 74 1HD ARG 74 -16.901 11.016 3.043 370 HD3 ARG 74 2HD ARG 74 -17.616 12.492 2.395 371 HE ARG 74 HE ARG 74 -19.497 10.829 1.713 372 HH11 ARG 74 1HH1 ARG 74 -17.619 10.759 4.668 373 HH12 ARG 74 2HH1 ARG 74 -18.900 10.076 5.619 374 HH21 ARG 74 1HH2 ARG 74 -21.194 9.935 2.965 375 HH22 ARG 74 2HH2 ARG 74 -20.939 9.623 4.652 376 H TYR 75 H TYR 75 -13.518 9.403 0.342 377 HA TYR 75 HA TYR 75 -14.943 7.238 1.590 378 HB2 TYR 75 1HB TYR 75 -12.929 7.273 -0.660 379 HB3 TYR 75 2HB TYR 75 -13.806 5.839 -0.119 380 HD1 TYR 75 HD1 TYR 75 -16.300 5.783 -0.341 381 HD2 TYR 75 HD2 TYR 75 -13.945 8.836 -2.130 382 HE1 TYR 75 HE1 TYR 75 -18.172 6.347 -1.827 383 HE2 TYR 75 HE2 TYR 75 -15.810 9.410 -3.621 384 HH TYR 75 HH TYR 75 -17.839 8.248 -4.565 385 H VAL 76 H VAL 76 -11.850 8.691 2.077 386 HA VAL 76 HA VAL 76 -10.611 6.234 2.985 387 HB VAL 76 HB VAL 76 -9.634 9.093 3.101 388 HG11 VAL 76 1HG1 VAL 76 -8.769 7.808 5.012 389 HG12 VAL 76 2HG1 VAL 76 -7.494 8.203 3.857 390 HG13 VAL 76 3HG1 VAL 76 -8.170 6.576 3.900 391 HG21 VAL 76 1HG2 VAL 76 -7.996 8.302 1.449 392 HG22 VAL 76 2HG2 VAL 76 -9.655 8.124 0.871 393 HG23 VAL 76 3HG2 VAL 76 -8.768 6.717 1.460 394 H SER 77 H SER 77 -10.527 5.484 4.982 395 HA SER 77 HA SER 77 -12.216 6.815 6.942 396 HB2 SER 77 1HB SER 77 -12.496 4.382 6.394 397 HB3 SER 77 2HB SER 77 -10.905 4.088 7.104 398 HG SER 77 HG SER 77 -11.999 3.881 8.887 399 H ALA 78 H ALA 78 -8.872 5.730 6.589 400 HA ALA 78 HA ALA 78 -7.888 7.637 8.443 401 HB1 ALA 78 1HB ALA 78 -7.024 6.071 10.136 402 HB2 ALA 78 2HB ALA 78 -7.908 4.759 9.354 403 HB3 ALA 78 3HB ALA 78 -8.787 6.093 10.098 404 H MET 79 H MET 79 -5.717 7.923 8.168 405 HA MET 79 HA MET 79 -3.982 5.944 7.107 406 HB2 MET 79 1HB MET 79 -3.498 6.979 4.939 407 HB3 MET 79 2HB MET 79 -5.164 6.425 5.024 408 HG2 MET 79 1HG MET 79 -5.928 8.697 5.398 409 HG3 MET 79 2HG MET 79 -4.264 9.276 5.396 410 HE1 MET 79 1HE MET 79 -2.694 9.249 3.262 411 HE2 MET 79 2HE MET 79 -3.193 8.656 1.678 412 HE3 MET 79 3HE MET 79 -2.986 7.527 3.016 413 H SER 80 H SER 80 -1.862 6.518 7.324 414 HA SER 80 HA SER 80 -1.244 9.330 7.903 415 HB2 SER 80 1HB SER 80 -1.532 7.998 10.043 416 HB3 SER 80 2HB SER 80 -0.133 7.046 9.546 417 HG SER 80 HG SER 80 -0.264 9.594 10.572 418 H VAL 81 H VAL 81 0.995 9.880 7.589 419 HA VAL 81 HA VAL 81 2.328 8.091 5.662 420 HB VAL 81 HB VAL 81 2.440 11.114 5.703 421 HG11 VAL 81 1HG1 VAL 81 3.456 9.111 3.692 422 HG12 VAL 81 2HG1 VAL 81 4.433 10.128 4.753 423 HG13 VAL 81 3HG1 VAL 81 3.461 10.861 3.478 424 HG21 VAL 81 1HG2 VAL 81 0.208 10.419 5.108 425 HG22 VAL 81 2HG2 VAL 81 0.849 9.285 3.919 426 HG23 VAL 81 3HG2 VAL 81 1.046 11.021 3.676 427 H ALA 82 H ALA 82 4.208 7.329 6.413 428 HA ALA 82 HA ALA 82 5.802 9.014 8.205 429 HB1 ALA 82 1HB ALA 82 6.231 7.149 9.685 430 HB2 ALA 82 2HB ALA 82 5.226 6.095 8.691 431 HB3 ALA 82 3HB ALA 82 4.493 7.433 9.576 432 H LYS 83 H LYS 83 7.571 9.312 7.206 433 HA LYS 83 HA LYS 83 9.436 9.090 5.823 434 HB2 LYS 83 1HB LYS 83 9.268 6.198 6.725 435 HB3 LYS 83 2HB LYS 83 10.673 6.967 6.003 436 HG2 LYS 83 1HG LYS 83 9.461 7.873 8.599 437 HG3 LYS 83 2HG LYS 83 10.742 6.663 8.497 438 HD2 LYS 83 1HD LYS 83 12.132 8.307 7.292 439 HD3 LYS 83 2HD LYS 83 10.871 9.519 7.536 440 HE2 LYS 83 1HE LYS 83 12.549 9.824 9.221 441 HE3 LYS 83 2HE LYS 83 11.106 9.167 9.990 442 HZ1 LYS 83 1HZ LYS 83 13.129 8.091 10.777 443 HZ2 LYS 83 2HZ LYS 83 13.502 7.592 9.205 444 HZ3 LYS 83 3HZ LYS 83 12.127 6.986 9.981 445 H GLY 84 H GLY 84 7.033 9.016 4.453 446 HA2 GLY 84 1HA GLY 84 6.314 8.587 2.294 447 HA3 GLY 84 2HA GLY 84 7.709 7.537 2.077 448 H VAL 85 H VAL 85 6.974 5.998 4.490 449 HA VAL 85 HA VAL 85 5.250 4.044 3.392 450 HB VAL 85 HB VAL 85 5.904 4.471 6.319 451 HG11 VAL 85 1HG1 VAL 85 4.015 2.980 6.018 452 HG12 VAL 85 2HG1 VAL 85 5.431 2.067 6.540 453 HG13 VAL 85 3HG1 VAL 85 4.929 2.026 4.848 454 HG21 VAL 85 1HG2 VAL 85 7.695 2.853 5.996 455 HG22 VAL 85 2HG2 VAL 85 7.927 4.258 4.956 456 HG23 VAL 85 3HG2 VAL 85 7.310 2.752 4.280 457 H VAL 86 H VAL 86 3.009 3.644 3.751 458 HA VAL 86 HA VAL 86 1.563 5.786 5.116 459 HB VAL 86 HB VAL 86 0.941 4.893 2.290 460 HG11 VAL 86 1HG1 VAL 86 -1.068 5.348 3.617 461 HG12 VAL 86 2HG1 VAL 86 -0.836 6.559 2.356 462 HG13 VAL 86 3HG1 VAL 86 -0.429 6.941 4.029 463 HG21 VAL 86 1HG2 VAL 86 1.923 7.552 3.322 464 HG22 VAL 86 2HG2 VAL 86 1.455 7.205 1.659 465 HG23 VAL 86 3HG2 VAL 86 2.857 6.403 2.366 466 H SER 87 H SER 87 0.555 4.651 6.626 467 HA SER 87 HA SER 87 -0.687 2.113 5.861 468 HB2 SER 87 1HB SER 87 0.869 2.215 7.850 469 HB3 SER 87 2HB SER 87 -0.366 3.174 8.668 470 HG SER 87 HG SER 87 -1.140 0.756 7.493 471 H LEU 88 H LEU 88 -2.769 1.801 5.784 472 HA LEU 88 HA LEU 88 -4.558 3.982 6.631 473 HB2 LEU 88 1HB LEU 88 -5.013 1.912 4.473 474 HB3 LEU 88 2HB LEU 88 -6.146 3.167 4.944 475 HG LEU 88 HG LEU 88 -4.175 4.778 4.279 476 HD11 LEU 88 1HD1 LEU 88 -2.887 3.913 2.371 477 HD12 LEU 88 2HD1 LEU 88 -3.532 2.302 2.687 478 HD13 LEU 88 3HD1 LEU 88 -2.499 3.090 3.879 479 HD21 LEU 88 1HD2 LEU 88 -6.356 4.748 3.217 480 HD22 LEU 88 2HD2 LEU 88 -5.894 3.341 2.261 481 HD23 LEU 88 3HD2 LEU 88 -5.084 4.885 2.003 482 H THR 89 H THR 89 -6.406 3.437 7.802 483 HA THR 89 HA THR 89 -6.406 0.676 8.823 484 HB THR 89 HB THR 89 -7.007 3.139 10.467 485 HG1 THR 89 HG1 THR 89 -4.650 1.533 10.535 486 HG21 THR 89 1HG2 THR 89 -6.480 0.268 11.257 487 HG22 THR 89 2HG2 THR 89 -8.054 1.063 11.266 488 HG23 THR 89 3HG2 THR 89 -6.785 1.607 12.363 489 H GLY 90 H GLY 90 -8.252 -0.349 8.857 490 HA2 GLY 90 1HA GLY 90 -10.456 -0.853 8.370 491 HA3 GLY 90 2HA GLY 90 -10.784 0.527 9.402 492 H GLN 91 H GLN 91 -9.408 0.294 6.137 493 HA GLN 91 HA GLN 91 -10.782 2.636 5.312 494 HB2 GLN 91 1HB GLN 91 -8.651 2.117 4.358 495 HB3 GLN 91 2HB GLN 91 -9.206 0.540 3.819 496 HG2 GLN 91 1HG GLN 91 -8.985 2.143 1.987 497 HG3 GLN 91 2HG GLN 91 -10.641 1.567 2.177 498 HE21 GLN 91 1HE2 GLN 91 -11.478 3.337 1.125 499 HE22 GLN 91 2HE2 GLN 91 -11.569 4.891 1.878 500 H GLU 92 H GLU 92 -12.769 2.844 4.555 501 HA GLU 92 HA GLU 92 -14.927 2.322 4.091 502 HB2 GLU 92 1HB GLU 92 -13.432 0.710 2.038 503 HB3 GLU 92 2HB GLU 92 -15.183 0.861 2.032 504 HG2 GLU 92 1HG GLU 92 -14.969 3.286 1.825 505 HG3 GLU 92 2HG GLU 92 -13.217 3.121 1.802 506 H SER 93 H SER 93 -14.790 -0.704 2.759 507 HA SER 93 HA SER 93 -16.308 -1.884 4.863 508 HB2 SER 93 1HB SER 93 -15.090 -3.263 2.471 509 HB3 SER 93 2HB SER 93 -16.514 -3.759 3.389 510 HG SER 93 HG SER 93 -17.457 -1.707 2.674 511 H LEU 94 H LEU 94 -13.007 -1.568 4.363 512 HA LEU 94 HA LEU 94 -12.235 -4.202 5.298 513 HB2 LEU 94 1HB LEU 94 -10.504 -1.811 4.670 514 HB3 LEU 94 2HB LEU 94 -9.965 -3.472 4.876 515 HG LEU 94 HG LEU 94 -11.743 -2.481 2.638 516 HD11 LEU 94 1HD1 LEU 94 -9.527 -1.598 2.384 517 HD12 LEU 94 2HD1 LEU 94 -9.754 -2.915 1.231 518 HD13 LEU 94 3HD1 LEU 94 -8.813 -3.178 2.699 519 HD21 LEU 94 1HD2 LEU 94 -10.459 -5.175 3.084 520 HD22 LEU 94 2HD2 LEU 94 -11.362 -4.683 1.653 521 HD23 LEU 94 3HD2 LEU 94 -12.179 -4.810 3.208 522 H ASN 95 H ASN 95 -13.746 -2.702 7.099 523 HA ASN 95 HA ASN 95 -12.336 -1.327 9.062 524 HB2 ASN 95 1HB ASN 95 -14.835 -1.547 8.867 525 HB3 ASN 95 2HB ASN 95 -14.685 -3.171 9.533 526 HD21 ASN 95 1HD2 ASN 95 -14.190 -3.434 11.697 527 HD22 ASN 95 2HD2 ASN 95 -14.266 -2.130 12.832 528 H GLY 96 H GLY 96 -11.167 -1.927 10.838 529 HA2 GLY 96 1HA GLY 96 -9.998 -3.328 12.276 530 HA3 GLY 96 2HA GLY 96 -10.816 -4.703 11.546 531 H LEU 97 H LEU 97 -9.877 -3.495 8.866 532 HA LEU 97 HA LEU 97 -7.449 -5.080 8.788 533 HB2 LEU 97 1HB LEU 97 -9.242 -5.385 7.127 534 HB3 LEU 97 2HB LEU 97 -9.045 -3.723 6.614 535 HG LEU 97 HG LEU 97 -6.733 -5.621 6.384 536 HD11 LEU 97 1HD1 LEU 97 -7.510 -6.214 4.140 537 HD12 LEU 97 2HD1 LEU 97 -9.010 -5.336 4.423 538 HD13 LEU 97 3HD1 LEU 97 -8.638 -6.774 5.370 539 HD21 LEU 97 1HD2 LEU 97 -6.375 -3.236 5.963 540 HD22 LEU 97 2HD2 LEU 97 -7.665 -3.252 4.763 541 HD23 LEU 97 3HD2 LEU 97 -6.192 -4.181 4.486 542 H SER 98 H SER 98 -5.443 -4.306 8.443 543 HA SER 98 HA SER 98 -5.152 -1.385 8.183 544 HB2 SER 98 1HB SER 98 -3.233 -3.349 9.465 545 HB3 SER 98 2HB SER 98 -3.046 -1.595 9.403 546 HG SER 98 HG SER 98 -5.261 -2.891 10.616 547 H VAL 99 H VAL 99 -4.235 -0.682 6.374 548 HA VAL 99 HA VAL 99 -2.788 -2.606 4.674 549 HB VAL 99 HB VAL 99 -3.766 0.159 3.929 550 HG11 VAL 99 1HG1 VAL 99 -3.440 -0.591 1.630 551 HG12 VAL 99 2HG1 VAL 99 -2.837 -2.140 2.218 552 HG13 VAL 99 3HG1 VAL 99 -1.938 -0.660 2.550 553 HG21 VAL 99 1HG2 VAL 99 -5.676 -1.251 4.480 554 HG22 VAL 99 2HG2 VAL 99 -5.083 -2.495 3.378 555 HG23 VAL 99 3HG2 VAL 99 -5.602 -0.931 2.747 556 H VAL 100 H VAL 100 -0.586 -2.324 4.306 557 HA VAL 100 HA VAL 100 0.566 0.166 5.360 558 HB VAL 100 HB VAL 100 1.868 -2.561 5.429 559 HG11 VAL 100 1HG1 VAL 100 3.466 -0.743 5.152 560 HG12 VAL 100 2HG1 VAL 100 3.591 -1.436 6.769 561 HG13 VAL 100 3HG1 VAL 100 2.765 0.103 6.532 562 HG21 VAL 100 1HG2 VAL 100 1.613 -2.403 7.871 563 HG22 VAL 100 2HG2 VAL 100 0.052 -2.427 7.048 564 HG23 VAL 100 3HG2 VAL 100 0.697 -0.907 7.670 565 H MET 101 H MET 101 1.014 1.317 3.594 566 HA MET 101 HA MET 101 2.071 0.041 1.195 567 HB2 MET 101 1HB MET 101 0.344 1.878 1.143 568 HB3 MET 101 2HB MET 101 1.561 2.971 1.777 569 HG2 MET 101 1HG MET 101 1.562 3.392 -0.489 570 HG3 MET 101 2HG MET 101 2.943 2.329 -0.263 571 HE1 MET 101 1HE MET 101 -1.115 0.920 -1.961 572 HE2 MET 101 2HE MET 101 -0.812 2.536 -1.319 573 HE3 MET 101 3HE MET 101 -0.851 1.146 -0.234 574 H THR 102 H THR 102 4.213 -0.386 1.180 575 HA THR 102 HA THR 102 6.006 1.481 2.603 576 HB THR 102 HB THR 102 6.592 -1.426 2.057 577 HG1 THR 102 HG1 THR 102 4.664 -0.838 3.482 578 HG21 THR 102 1HG2 THR 102 7.734 0.550 4.037 579 HG22 THR 102 2HG2 THR 102 8.521 0.002 2.556 580 HG23 THR 102 3HG2 THR 102 8.217 -1.138 3.869 581 HA PRO 103 HA PRO 103 7.474 2.138 -1.662 582 HB2 PRO 103 1HB PRO 103 9.144 4.143 -0.290 583 HB3 PRO 103 2HB PRO 103 8.011 4.353 -1.632 584 HG2 PRO 103 1HG PRO 103 7.449 5.251 0.844 585 HG3 PRO 103 2HG PRO 103 6.191 4.612 -0.232 586 HD2 PRO 103 1HD PRO 103 7.547 3.300 2.091 587 HD3 PRO 103 2HD PRO 103 5.839 3.231 1.593 588 H GLY 104 H GLY 104 9.246 1.320 -2.667 589 HA2 GLY 104 1HA GLY 104 11.418 0.324 -0.950 590 HA3 GLY 104 2HA GLY 104 11.009 -0.294 -2.544 591 H TRP 105 H TRP 105 13.595 0.249 -1.988 592 HA TRP 105 HA TRP 105 14.138 2.833 -3.286 593 HB2 TRP 105 1HB TRP 105 16.009 1.103 -1.651 594 HB3 TRP 105 2HB TRP 105 16.397 2.673 -2.344 595 HD1 TRP 105 HD1 TRP 105 14.858 4.792 -1.309 596 HE1 TRP 105 HE1 TRP 105 14.112 5.158 1.127 597 HE3 TRP 105 HE3 TRP 105 15.390 0.014 0.433 598 HZ2 TRP 105 HZ2 TRP 105 13.790 3.625 3.476 599 HZ3 TRP 105 HZ3 TRP 105 14.844 -0.451 2.786 600 HH2 TRP 105 HH2 TRP 105 14.062 1.318 4.274 601 H ASP 106 H ASP 106 14.491 2.655 -5.386 602 HA ASP 106 HA ASP 106 16.339 0.634 -6.366 603 HB2 ASP 106 1HB ASP 106 14.838 -0.104 -8.161 604 HB3 ASP 106 2HB ASP 106 14.151 -0.457 -6.584 605 H ASN 107 H ASN 107 17.160 3.052 -6.166 606 HA ASN 107 HA ASN 107 16.322 5.020 -7.950 607 HB2 ASN 107 1HB ASN 107 17.864 5.321 -5.977 608 HB3 ASN 107 2HB ASN 107 19.158 4.668 -6.977 609 HD21 ASN 107 1HD2 ASN 107 16.570 6.754 -8.122 610 HD22 ASN 107 2HD2 ASN 107 17.578 8.111 -8.485 611 H ALA 108 H ALA 108 18.511 2.331 -8.449 612 HA ALA 108 HA ALA 108 19.520 3.337 -10.948 613 HB1 ALA 108 1HB ALA 108 19.755 0.585 -9.742 614 HB2 ALA 108 2HB ALA 108 20.890 1.914 -9.506 615 HB3 ALA 108 3HB ALA 108 20.682 1.205 -11.108 616 H ASN 109 H ASN 109 16.775 1.507 -9.962 617 HA ASN 109 HA ASN 109 16.440 0.282 -12.588 618 HB2 ASN 109 1HB ASN 109 14.846 0.041 -10.037 619 HB3 ASN 109 2HB ASN 109 14.379 -0.740 -11.541 620 HD21 ASN 109 1HD2 ASN 109 15.074 -1.930 -8.992 621 HD22 ASN 109 2HD2 ASN 109 16.406 -2.988 -9.299 622 H GLY 110 H GLY 110 15.550 3.085 -10.969 623 HA2 GLY 110 1HA GLY 110 14.154 4.830 -11.450 624 HA3 GLY 110 2HA GLY 110 14.309 4.296 -13.109 625 H VAL 111 H VAL 111 12.780 2.242 -10.701 626 HA VAL 111 HA VAL 111 10.155 3.006 -11.777 627 HB VAL 111 HB VAL 111 9.528 0.542 -11.784 628 HG11 VAL 111 1HG1 VAL 111 10.396 0.183 -14.041 629 HG12 VAL 111 2HG1 VAL 111 11.554 1.493 -13.807 630 HG13 VAL 111 3HG1 VAL 111 9.824 1.838 -13.829 631 HG21 VAL 111 1HG2 VAL 111 12.525 0.207 -11.845 632 HG22 VAL 111 2HG2 VAL 111 11.338 -1.068 -12.120 633 HG23 VAL 111 3HG2 VAL 111 11.458 -0.299 -10.537 634 H THR 112 H THR 112 10.692 4.034 -9.521 635 HA THR 112 HA THR 112 10.713 2.782 -7.126 636 HB THR 112 HB THR 112 9.062 5.227 -7.791 637 HG1 THR 112 HG1 THR 112 11.731 5.037 -6.795 638 HG21 THR 112 1HG2 THR 112 9.368 5.817 -5.424 639 HG22 THR 112 2HG2 THR 112 10.182 4.277 -5.149 640 HG23 THR 112 3HG2 THR 112 8.479 4.304 -5.602 641 H GLY 113 H GLY 113 9.555 1.224 -6.290 642 HA2 GLY 113 1HA GLY 113 6.696 1.052 -6.993 643 HA3 GLY 113 2HA GLY 113 7.715 -0.341 -6.654 644 H TRP 114 H TRP 114 5.263 0.225 -5.393 645 HA TRP 114 HA TRP 114 6.160 0.765 -2.647 646 HB2 TRP 114 1HB TRP 114 3.518 1.302 -4.001 647 HB3 TRP 114 2HB TRP 114 3.666 1.233 -2.248 648 HD1 TRP 114 HD1 TRP 114 4.507 3.355 -1.043 649 HE1 TRP 114 HE1 TRP 114 5.267 5.693 -1.798 650 HE3 TRP 114 HE3 TRP 114 4.821 2.520 -6.076 651 HZ2 TRP 114 HZ2 TRP 114 5.917 7.007 -4.202 652 HZ3 TRP 114 HZ3 TRP 114 5.518 4.377 -7.531 653 HH2 TRP 114 HH2 TRP 114 6.053 6.573 -6.616 654 H ALA 115 H ALA 115 6.008 -0.877 -1.251 655 HA ALA 115 HA ALA 115 4.840 -3.373 -2.162 656 HB1 ALA 115 1HB ALA 115 5.880 -4.352 -0.193 657 HB2 ALA 115 2HB ALA 115 6.323 -2.749 0.391 658 HB3 ALA 115 3HB ALA 115 7.052 -3.381 -1.085 659 H ARG 116 H ARG 116 2.940 -4.068 -1.589 660 HA ARG 116 HA ARG 116 1.424 -2.456 0.355 661 HB2 ARG 116 1HB ARG 116 0.426 -4.080 -1.991 662 HB3 ARG 116 2HB ARG 116 -0.569 -3.101 -0.917 663 HG2 ARG 116 1HG ARG 116 0.255 -1.104 -1.767 664 HG3 ARG 116 2HG ARG 116 1.686 -1.874 -2.452 665 HD2 ARG 116 1HD ARG 116 -1.145 -2.248 -3.414 666 HD3 ARG 116 2HD ARG 116 0.074 -1.242 -4.185 667 HE ARG 116 HE ARG 116 1.025 -3.893 -3.881 668 HH11 ARG 116 1HH1 ARG 116 -1.229 -2.036 -5.814 669 HH12 ARG 116 2HH1 ARG 116 -1.063 -3.050 -7.205 670 HH21 ARG 116 1HH2 ARG 116 1.264 -5.203 -5.705 671 HH22 ARG 116 2HH2 ARG 116 0.390 -4.837 -7.160 672 H ASN 117 H ASN 117 0.251 -3.432 1.946 673 HA ASN 117 HA ASN 117 0.147 -6.349 2.069 674 HB2 ASN 117 1HB ASN 117 2.225 -5.679 3.257 675 HB3 ASN 117 2HB ASN 117 1.270 -4.638 4.305 676 HD21 ASN 117 1HD2 ASN 117 0.344 -7.857 3.187 677 HD22 ASN 117 2HD2 ASN 117 0.365 -8.591 4.752 678 H CYS 118 H CYS 118 -1.798 -6.998 2.781 679 HA CYS 118 HA CYS 118 -3.468 -5.040 4.210 680 HB2 CYS 118 1HB CYS 118 -4.282 -7.497 2.632 681 HB3 CYS 118 2HB CYS 118 -5.391 -6.400 3.455 682 H ASN 119 H ASN 119 -3.545 -5.371 6.346 683 HA ASN 119 HA ASN 119 -3.258 -8.139 7.313 684 HB2 ASN 119 1HB ASN 119 -1.471 -6.635 8.070 685 HB3 ASN 119 2HB ASN 119 -2.672 -5.538 8.744 686 HD21 ASN 119 1HD2 ASN 119 -1.812 -5.724 10.814 687 HD22 ASN 119 2HD2 ASN 119 -2.017 -7.154 11.768 688 H ILE 120 H ILE 120 -5.239 -8.919 7.559 689 HA ILE 120 HA ILE 120 -6.962 -7.561 9.488 690 HB ILE 120 HB ILE 120 -8.005 -7.069 7.395 691 HG12 ILE 120 1HG1 ILE 120 -10.163 -8.300 7.572 692 HG13 ILE 120 2HG1 ILE 120 -9.411 -9.374 8.741 693 HG21 ILE 120 1HG2 ILE 120 -6.937 -8.649 5.958 694 HG22 ILE 120 2HG2 ILE 120 -8.684 -8.840 5.805 695 HG23 ILE 120 3HG2 ILE 120 -7.751 -9.994 6.756 696 HD11 ILE 120 1HD1 ILE 120 -10.802 -7.623 9.764 697 HD12 ILE 120 2HD1 ILE 120 -9.725 -6.402 9.087 698 HD13 ILE 120 3HD1 ILE 120 -9.121 -7.547 10.284 699 H GLN 121 H GLN 121 -6.915 -8.900 11.204 700 HA GLN 121 HA GLN 121 -5.970 -11.582 10.862 701 HB2 GLN 121 1HB GLN 121 -6.801 -10.040 13.315 702 HB3 GLN 121 2HB GLN 121 -6.130 -11.666 13.356 703 HG2 GLN 121 1HG GLN 121 -4.737 -9.262 12.200 704 HG3 GLN 121 2HG GLN 121 -4.470 -9.905 13.819 705 HE21 GLN 121 1HE2 GLN 121 -3.987 -10.411 10.418 706 HE22 GLN 121 2HE2 GLN 121 -2.825 -11.683 10.567 707 H SER 122 H SER 122 -9.117 -10.157 11.640 708 HA SER 122 HA SER 122 -10.122 -12.789 12.398 709 HB2 SER 122 1HB SER 122 -12.136 -11.505 13.140 710 HB3 SER 122 2HB SER 122 -10.637 -10.972 13.907 711 HG SER 122 HG SER 122 -12.083 -9.729 11.798 712 H ASP 123 H ASP 123 -9.960 -11.062 9.544 713 HA ASP 123 HA ASP 123 -12.398 -12.314 8.523 714 HB2 ASP 123 1HB ASP 123 -11.807 -9.357 8.384 715 HB3 ASP 123 2HB ASP 123 -12.969 -10.152 7.334 716 H SER 124 H SER 124 -11.027 -13.705 7.343 717 HA SER 124 HA SER 124 -9.023 -12.866 5.567 718 HB2 SER 124 1HB SER 124 -10.831 -15.286 5.341 719 HB3 SER 124 2HB SER 124 -9.291 -15.063 4.512 720 HG SER 124 HG SER 124 -8.697 -14.648 6.977 721 H ALA 125 H ALA 125 -12.487 -12.801 5.286 722 HA ALA 125 HA ALA 125 -12.743 -12.713 2.495 723 HB1 ALA 125 1HB ALA 125 -14.640 -13.088 3.981 724 HB2 ALA 125 2HB ALA 125 -14.939 -11.725 2.902 725 HB3 ALA 125 3HB ALA 125 -14.501 -11.437 4.585 726 H LEU 126 H LEU 126 -12.242 -10.141 4.875 727 HA LEU 126 HA LEU 126 -12.440 -8.009 3.023 728 HB2 LEU 126 1HB LEU 126 -11.008 -8.127 5.676 729 HB3 LEU 126 2HB LEU 126 -11.342 -6.660 4.778 730 HG LEU 126 HG LEU 126 -13.393 -8.503 6.010 731 HD11 LEU 126 1HD1 LEU 126 -13.866 -6.596 7.466 732 HD12 LEU 126 2HD1 LEU 126 -12.542 -5.702 6.719 733 HD13 LEU 126 3HD1 LEU 126 -12.205 -7.161 7.648 734 HD21 LEU 126 1HD2 LEU 126 -14.246 -7.563 3.942 735 HD22 LEU 126 2HD2 LEU 126 -13.758 -5.948 4.452 736 HD23 LEU 126 3HD2 LEU 126 -15.030 -6.802 5.327 737 H GLN 127 H GLN 127 -9.837 -10.062 4.131 738 HA GLN 127 HA GLN 127 -7.703 -8.700 2.902 739 HB2 GLN 127 1HB GLN 127 -7.173 -10.400 4.483 740 HB3 GLN 127 2HB GLN 127 -8.109 -11.602 3.606 741 HG2 GLN 127 1HG GLN 127 -6.509 -11.587 1.798 742 HG3 GLN 127 2HG GLN 127 -5.592 -10.297 2.581 743 HE21 GLN 127 1HE2 GLN 127 -3.738 -11.606 2.624 744 HE22 GLN 127 2HE2 GLN 127 -3.577 -12.898 3.768 745 H GLN 128 H GLN 128 -9.988 -11.108 1.716 746 HA GLN 128 HA GLN 128 -8.735 -11.662 -0.723 747 HB2 GLN 128 1HB GLN 128 -11.679 -11.666 -0.058 748 HB3 GLN 128 2HB GLN 128 -10.977 -12.382 -1.501 749 HG2 GLN 128 1HG GLN 128 -10.667 -13.249 1.351 750 HG3 GLN 128 2HG GLN 128 -11.327 -14.156 -0.008 751 HE21 GLN 128 1HE2 GLN 128 -8.475 -13.171 1.657 752 HE22 GLN 128 2HE2 GLN 128 -7.350 -14.127 0.753 753 H ALA 129 H ALA 129 -10.977 -9.110 0.188 754 HA ALA 129 HA ALA 129 -11.163 -8.011 -2.443 755 HB1 ALA 129 1HB ALA 129 -12.298 -6.146 -1.369 756 HB2 ALA 129 2HB ALA 129 -11.800 -6.740 0.216 757 HB3 ALA 129 3HB ALA 129 -12.921 -7.682 -0.764 758 H CYS 130 H CYS 130 -9.365 -7.172 0.491 759 HA CYS 130 HA CYS 130 -8.194 -4.821 -0.575 760 HB2 CYS 130 1HB CYS 130 -8.469 -5.244 1.843 761 HB3 CYS 130 2HB CYS 130 -7.276 -6.538 1.740 762 H GLU 131 H GLU 131 -6.901 -8.076 -0.033 763 HA GLU 131 HA GLU 131 -4.296 -7.476 -0.907 764 HB2 GLU 131 1HB GLU 131 -5.011 -9.412 0.561 765 HB3 GLU 131 2HB GLU 131 -5.570 -10.205 -0.905 766 HG2 GLU 131 1HG GLU 131 -3.357 -10.254 -1.806 767 HG3 GLU 131 2HG GLU 131 -2.742 -9.274 -0.470 768 H ASP 132 H ASP 132 -7.187 -8.269 -2.630 769 HA ASP 132 HA ASP 132 -6.056 -9.184 -5.038 770 HB2 ASP 132 1HB ASP 132 -8.535 -9.102 -4.413 771 HB3 ASP 132 2HB ASP 132 -8.490 -7.399 -4.855 772 H VAL 133 H VAL 133 -6.878 -5.907 -3.957 773 HA VAL 133 HA VAL 133 -5.622 -4.685 -6.258 774 HB VAL 133 HB VAL 133 -6.805 -3.444 -3.771 775 HG11 VAL 133 1HG1 VAL 133 -6.022 -2.158 -6.383 776 HG12 VAL 133 2HG1 VAL 133 -5.169 -1.980 -4.850 777 HG13 VAL 133 3HG1 VAL 133 -6.809 -1.357 -5.022 778 HG21 VAL 133 1HG2 VAL 133 -8.698 -2.900 -5.266 779 HG22 VAL 133 2HG2 VAL 133 -8.480 -4.633 -5.021 780 HG23 VAL 133 3HG2 VAL 133 -7.945 -3.879 -6.524 781 H PHE 134 H PHE 134 -5.055 -4.871 -2.792 782 HA PHE 134 HA PHE 134 -2.577 -3.380 -3.012 783 HB2 PHE 134 1HB PHE 134 -4.145 -4.310 -0.608 784 HB3 PHE 134 2HB PHE 134 -2.604 -3.465 -0.507 785 HD1 PHE 134 HD1 PHE 134 -2.427 -1.146 -1.472 786 HD2 PHE 134 HD2 PHE 134 -6.159 -3.122 -0.920 787 HE1 PHE 134 HE1 PHE 134 -3.593 1.018 -1.628 788 HE2 PHE 134 HE2 PHE 134 -7.327 -0.963 -1.079 789 HZ PHE 134 HZ PHE 134 -6.045 1.108 -1.438 790 H ARG 135 H ARG 135 -2.866 -6.074 -4.044 791 HA ARG 135 HA ARG 135 -1.757 -8.093 -2.529 792 HB2 ARG 135 1HB ARG 135 -0.970 -9.017 -4.733 793 HB3 ARG 135 2HB ARG 135 -2.671 -8.569 -4.682 794 HG2 ARG 135 1HG ARG 135 -2.148 -6.470 -5.833 795 HG3 ARG 135 2HG ARG 135 -0.448 -6.941 -5.900 796 HD2 ARG 135 1HD ARG 135 -1.018 -8.868 -7.271 797 HD3 ARG 135 2HD ARG 135 -2.732 -8.466 -7.158 798 HE ARG 135 HE ARG 135 -1.687 -6.222 -8.200 799 HH11 ARG 135 1HH1 ARG 135 -1.345 -9.586 -9.089 800 HH12 ARG 135 2HH1 ARG 135 -1.102 -9.247 -10.772 801 HH21 ARG 135 1HH2 ARG 135 -1.361 -5.769 -10.411 802 HH22 ARG 135 2HH2 ARG 135 -1.107 -7.072 -11.528 803 H PHE 136 H PHE 136 0.289 -8.899 -2.261 804 HA PHE 136 HA PHE 136 2.337 -6.853 -2.082 805 HB2 PHE 136 1HB PHE 136 3.601 -8.586 -0.788 806 HB3 PHE 136 2HB PHE 136 2.044 -8.160 -0.089 807 HD1 PHE 136 HD1 PHE 136 4.113 -10.808 -1.365 808 HD2 PHE 136 HD2 PHE 136 0.097 -9.743 -0.414 809 HE1 PHE 136 HE1 PHE 136 3.496 -13.186 -1.306 810 HE2 PHE 136 HE2 PHE 136 -0.521 -12.123 -0.362 811 HZ PHE 136 HZ PHE 136 1.178 -13.846 -0.807 812 H ASP 137 H ASP 137 3.938 -6.650 -3.483 813 HA ASP 137 HA ASP 137 4.080 -8.497 -5.702 814 HB2 ASP 137 1HB ASP 137 5.580 -6.889 -6.726 815 HB3 ASP 137 2HB ASP 137 4.189 -6.041 -6.070 816 H ASP 138 H ASP 138 5.845 -9.690 -6.312 817 HA ASP 138 HA ASP 138 7.523 -10.557 -4.113 818 HB2 ASP 138 1HB ASP 138 6.338 -12.127 -5.737 819 HB3 ASP 138 2HB ASP 138 7.503 -11.611 -6.951 820 H ALA 139 H ALA 139 7.724 -8.043 -6.053 821 HA ALA 139 HA ALA 139 10.391 -8.370 -7.115 822 HB1 ALA 139 1HB ALA 139 10.100 -6.136 -8.020 823 HB2 ALA 139 2HB ALA 139 8.628 -5.923 -7.074 824 HB3 ALA 139 3HB ALA 139 8.678 -7.120 -8.367 825 H ASN 140 H ASN 140 8.799 -6.294 -4.700 826 HA ASN 140 HA ASN 140 11.342 -5.299 -3.755 827 HB2 ASN 140 1HB ASN 140 9.190 -3.963 -3.730 828 HB3 ASN 140 2HB ASN 140 8.646 -4.996 -2.413 829 HD21 ASN 140 1HD2 ASN 140 10.883 -2.535 -3.397 830 HD22 ASN 140 2HD2 ASN 140 11.401 -2.082 -1.809 831 H LEU 141 H LEU 141 9.126 -7.829 -2.966 832 HA LEU 141 HA LEU 141 10.398 -8.391 -0.420 833 HB2 LEU 141 1HB LEU 141 8.320 -9.981 -1.929 834 HB3 LEU 141 2HB LEU 141 8.825 -10.256 -0.274 835 HG LEU 141 HG LEU 141 7.368 -7.805 -1.274 836 HD11 LEU 141 1HD1 LEU 141 6.421 -10.141 0.377 837 HD12 LEU 141 2HD1 LEU 141 5.951 -9.772 -1.282 838 HD13 LEU 141 3HD1 LEU 141 5.490 -8.685 0.028 839 HD21 LEU 141 1HD2 LEU 141 8.824 -7.265 0.592 840 HD22 LEU 141 2HD2 LEU 141 8.181 -8.625 1.514 841 HD23 LEU 141 3HD2 LEU 141 7.139 -7.260 1.112 842 H VAL 142 H VAL 142 12.502 -8.924 -0.956 843 HA VAL 142 HA VAL 142 13.214 -10.760 -2.982 844 HB VAL 142 HB VAL 142 14.750 -9.964 -0.504 845 HG11 VAL 142 1HG1 VAL 142 15.697 -11.304 -3.036 846 HG12 VAL 142 2HG1 VAL 142 15.617 -12.033 -1.431 847 HG13 VAL 142 3HG1 VAL 142 16.739 -10.708 -1.744 848 HG21 VAL 142 1HG2 VAL 142 14.191 -8.056 -1.915 849 HG22 VAL 142 2HG2 VAL 142 14.865 -8.884 -3.318 850 HG23 VAL 142 3HG2 VAL 142 15.917 -8.404 -1.987 851 HA PRO 143 HA PRO 143 11.828 -14.551 -1.051 852 HB2 PRO 143 1HB PRO 143 13.883 -15.680 -2.879 853 HB3 PRO 143 2HB PRO 143 12.190 -16.129 -2.681 854 HG2 PRO 143 1HG PRO 143 12.993 -14.733 -4.806 855 HG3 PRO 143 2HG PRO 143 11.430 -14.414 -4.029 856 HD2 PRO 143 1HD PRO 143 13.973 -12.850 -3.886 857 HD3 PRO 143 2HD PRO 143 12.289 -12.283 -3.890 858 H ARG 144 H ARG 144 12.629 -15.905 0.525 859 HA ARG 144 HA ARG 144 15.033 -14.983 1.787 860 HB2 ARG 144 1HB ARG 144 13.267 -17.307 2.567 861 HB3 ARG 144 2HB ARG 144 14.489 -16.546 3.571 862 HG2 ARG 144 1HG ARG 144 12.011 -15.182 2.542 863 HG3 ARG 144 2HG ARG 144 12.208 -15.855 4.159 864 HD2 ARG 144 1HD ARG 144 13.817 -13.605 2.947 865 HD3 ARG 144 2HD ARG 144 12.569 -13.451 4.180 866 HE ARG 144 HE ARG 144 14.350 -15.174 5.285 867 HH11 ARG 144 1HH1 ARG 144 14.617 -11.977 3.886 868 HH12 ARG 144 2HH1 ARG 144 15.964 -11.515 4.879 869 HH21 ARG 144 1HH2 ARG 144 16.107 -14.579 6.598 870 HH22 ARG 144 2HH2 ARG 144 16.805 -12.998 6.434 871 H GLY 145 H GLY 145 16.825 -15.511 0.671 872 HA2 GLY 145 1HA GLY 145 17.450 -18.388 0.565 873 HA3 GLY 145 2HA GLY 145 17.815 -17.345 -0.806 874 H SER 146 H SER 146 20.044 -17.975 -0.536 875 HA SER 146 HA SER 146 21.400 -17.303 1.916 876 HB2 SER 146 1HB SER 146 22.527 -18.112 -0.777 877 HB3 SER 146 2HB SER 146 23.420 -18.055 0.743 878 HG SER 146 HG SER 146 22.557 -20.170 0.070 879 H GLY 147 H GLY 147 23.031 -15.728 2.158 880 HA2 GLY 147 1HA GLY 147 24.396 -13.959 1.122 881 HA3 GLY 147 2HA GLY 147 22.994 -13.569 0.139 882 H LEU 148 H LEU 148 21.193 -13.955 2.464 883 HA LEU 148 HA LEU 148 21.728 -11.408 3.806 884 HB2 LEU 148 1HB LEU 148 19.221 -12.992 3.344 885 HB3 LEU 148 2HB LEU 148 19.292 -11.803 4.624 886 HG LEU 148 HG LEU 148 18.234 -10.830 2.700 887 HD11 LEU 148 1HD1 LEU 148 21.033 -9.743 2.935 888 HD12 LEU 148 2HD1 LEU 148 19.703 -9.390 4.038 889 HD13 LEU 148 3HD1 LEU 148 19.610 -8.880 2.353 890 HD21 LEU 148 1HD2 LEU 148 19.144 -12.285 0.974 891 HD22 LEU 148 2HD2 LEU 148 20.727 -11.531 1.161 892 HD23 LEU 148 3HD2 LEU 148 19.366 -10.587 0.553 893 H GLU 149 H GLU 149 23.122 -11.966 5.422 894 HA GLU 149 HA GLU 149 22.543 -14.277 7.081 895 HB2 GLU 149 1HB GLU 149 24.833 -12.308 7.162 896 HB3 GLU 149 2HB GLU 149 24.673 -13.693 8.234 897 HG2 GLU 149 1HG GLU 149 24.576 -15.093 6.095 898 HG3 GLU 149 2HG GLU 149 25.192 -13.652 5.286 899 H HIS 150 H HIS 150 22.518 -10.761 7.326 900 HA HIS 150 HA HIS 150 21.758 -10.945 10.129 901 HB2 HIS 150 1HB HIS 150 21.702 -8.432 10.037 902 HB3 HIS 150 2HB HIS 150 23.266 -9.152 9.699 903 HD1 HIS 150 HD1 HIS 150 24.435 -8.124 7.800 904 HD2 HIS 150 HD2 HIS 150 20.315 -7.746 7.429 905 HE1 HIS 150 HE1 HIS 150 24.066 -6.739 5.737 906 HE2 HIS 150 HE2 HIS 150 21.578 -6.374 5.639 907 H HIS 151 H HIS 151 19.744 -10.773 10.909 908 HA HIS 151 HA HIS 151 17.589 -10.855 8.987 909 HB2 HIS 151 1HB HIS 151 17.781 -12.386 10.999 910 HB3 HIS 151 2HB HIS 151 17.403 -10.992 12.001 911 HD1 HIS 151 HD1 HIS 151 14.955 -10.111 11.928 912 HD2 HIS 151 HD2 HIS 151 15.635 -13.501 9.626 913 HE1 HIS 151 HE1 HIS 151 12.677 -10.995 11.340 914 HE2 HIS 151 HE2 HIS 151 13.118 -12.949 9.818 915 H HIS 152 H HIS 152 16.404 -9.163 8.423 916 HA HIS 152 HA HIS 152 16.879 -6.588 9.563 917 HB2 HIS 152 1HB HIS 152 14.874 -7.536 7.512 918 HB3 HIS 152 2HB HIS 152 15.046 -5.854 8.000 919 HD1 HIS 152 HD1 HIS 152 15.992 -7.921 5.346 920 HD2 HIS 152 HD2 HIS 152 18.047 -5.162 7.683 921 HE1 HIS 152 HE1 HIS 152 18.012 -7.266 4.003 922 HE2 HIS 152 HE2 HIS 152 19.181 -5.517 5.386 923 H HIS 153 H HIS 153 15.622 -5.381 10.876 924 HA HIS 153 HA HIS 153 13.092 -6.503 11.799 925 HB2 HIS 153 1HB HIS 153 13.767 -5.809 14.174 926 HB3 HIS 153 2HB HIS 153 14.462 -7.289 13.532 927 HD1 HIS 153 HD1 HIS 153 17.007 -7.302 13.056 928 HD2 HIS 153 HD2 HIS 153 15.586 -3.741 14.665 929 HE1 HIS 153 HE1 HIS 153 19.046 -6.025 13.778 930 HE2 HIS 153 HE2 HIS 153 18.168 -3.828 14.648 931 H HIS 154 H HIS 154 11.817 -5.009 10.961 932 HA HIS 154 HA HIS 154 12.285 -2.215 11.759 933 HB2 HIS 154 1HB HIS 154 11.201 -1.504 9.649 934 HB3 HIS 154 2HB HIS 154 12.689 -2.395 9.368 935 HD1 HIS 154 HD1 HIS 154 8.948 -2.736 9.039 936 HD2 HIS 154 HD2 HIS 154 12.419 -4.717 7.892 937 HE1 HIS 154 HE1 HIS 154 8.212 -4.496 7.408 938 HE2 HIS 154 HE2 HIS 154 10.338 -5.612 6.640 939 H HIS 155 H HIS 155 10.468 -1.008 12.322 940 HA HIS 155 HA HIS 155 7.958 -2.512 12.579 941 HB2 HIS 155 1HB HIS 155 9.158 -2.510 14.754 942 HB3 HIS 155 2HB HIS 155 9.163 -0.752 14.727 943 HD1 HIS 155 HD1 HIS 155 7.253 0.340 15.873 944 HD2 HIS 155 HD2 HIS 155 6.391 -3.583 14.791 945 HE1 HIS 155 HE1 HIS 155 4.975 -0.140 16.824 946 HE2 HIS 155 HE2 HIS 155 4.408 -2.454 16.011 Start of MODEL 3 1 H1 MET 24 1H MET 24 -21.963 -10.888 -9.346 2 H2 MET 24 2H MET 24 -22.638 -10.595 -7.824 3 H3 MET 24 3H MET 24 -21.638 -11.940 -8.061 4 HA MET 24 HA MET 24 -19.753 -10.541 -8.457 5 HB2 MET 24 1HB MET 24 -21.769 -8.330 -8.061 6 HB3 MET 24 2HB MET 24 -20.038 -8.067 -7.915 7 HG2 MET 24 1HG MET 24 -19.744 -8.833 -10.228 8 HG3 MET 24 2HG MET 24 -21.487 -9.038 -10.366 9 HE1 MET 24 1HE MET 24 -19.637 -7.261 -12.350 10 HE2 MET 24 2HE MET 24 -20.730 -5.902 -12.605 11 HE3 MET 24 3HE MET 24 -21.363 -7.546 -12.560 12 H GLU 25 H GLU 25 -18.965 -11.589 -6.726 13 HA GLU 25 HA GLU 25 -20.096 -11.333 -4.117 14 HB2 GLU 25 1HB GLU 25 -19.048 -13.405 -4.865 15 HB3 GLU 25 2HB GLU 25 -17.507 -12.584 -5.036 16 HG2 GLU 25 1HG GLU 25 -17.380 -12.228 -2.659 17 HG3 GLU 25 2HG GLU 25 -18.992 -12.913 -2.442 18 H ASN 26 H ASN 26 -16.775 -10.541 -5.261 19 HA ASN 26 HA ASN 26 -16.808 -8.331 -3.300 20 HB2 ASN 26 1HB ASN 26 -14.641 -10.292 -3.969 21 HB3 ASN 26 2HB ASN 26 -14.207 -8.682 -3.408 22 HD21 ASN 26 1HD2 ASN 26 -17.101 -10.248 -2.277 23 HD22 ASN 26 2HD2 ASN 26 -16.531 -10.577 -0.679 24 H TYR 27 H TYR 27 -17.241 -8.647 -6.370 25 HA TYR 27 HA TYR 27 -15.075 -7.420 -7.685 26 HB2 TYR 27 1HB TYR 27 -17.989 -7.578 -8.469 27 HB3 TYR 27 2HB TYR 27 -16.714 -6.986 -9.525 28 HD1 TYR 27 HD1 TYR 27 -17.853 -9.978 -7.645 29 HD2 TYR 27 HD2 TYR 27 -15.430 -8.487 -10.809 30 HE1 TYR 27 HE1 TYR 27 -17.446 -12.276 -8.411 31 HE2 TYR 27 HE2 TYR 27 -15.013 -10.787 -11.577 32 HH TYR 27 HH TYR 27 -15.051 -13.083 -10.661 33 H LEU 28 H LEU 28 -17.993 -6.092 -6.225 34 HA LEU 28 HA LEU 28 -17.601 -3.435 -7.188 35 HB2 LEU 28 1HB LEU 28 -19.221 -4.429 -4.836 36 HB3 LEU 28 2HB LEU 28 -19.319 -2.820 -5.521 37 HG LEU 28 HG LEU 28 -20.062 -5.371 -6.962 38 HD11 LEU 28 1HD1 LEU 28 -22.362 -4.563 -6.726 39 HD12 LEU 28 2HD1 LEU 28 -21.784 -3.213 -5.748 40 HD13 LEU 28 3HD1 LEU 28 -21.612 -4.868 -5.160 41 HD21 LEU 28 1HD2 LEU 28 -21.004 -3.866 -8.649 42 HD22 LEU 28 2HD2 LEU 28 -19.263 -3.644 -8.486 43 HD23 LEU 28 3HD2 LEU 28 -20.372 -2.478 -7.762 44 H ARG 29 H ARG 29 -16.888 -5.127 -4.178 45 HA ARG 29 HA ARG 29 -15.801 -2.947 -2.786 46 HB2 ARG 29 1HB ARG 29 -16.383 -4.915 -1.556 47 HB3 ARG 29 2HB ARG 29 -15.342 -5.922 -2.551 48 HG2 ARG 29 1HG ARG 29 -13.434 -5.246 -1.492 49 HG3 ARG 29 2HG ARG 29 -14.118 -3.699 -1.001 50 HD2 ARG 29 1HD ARG 29 -13.875 -5.039 0.957 51 HD3 ARG 29 2HD ARG 29 -15.595 -4.937 0.586 52 HE ARG 29 HE ARG 29 -14.239 -7.273 -0.456 53 HH11 ARG 29 1HH1 ARG 29 -16.160 -5.894 2.136 54 HH12 ARG 29 2HH1 ARG 29 -16.600 -7.443 2.792 55 HH21 ARG 29 1HH2 ARG 29 -14.815 -9.311 0.421 56 HH22 ARG 29 2HH2 ARG 29 -15.837 -9.373 1.830 57 H LYS 30 H LYS 30 -14.373 -5.304 -4.977 58 HA LYS 30 HA LYS 30 -11.713 -4.441 -4.670 59 HB2 LYS 30 1HB LYS 30 -13.107 -5.904 -6.899 60 HB3 LYS 30 2HB LYS 30 -11.396 -5.507 -6.965 61 HG2 LYS 30 1HG LYS 30 -11.071 -6.775 -4.858 62 HG3 LYS 30 2HG LYS 30 -12.768 -7.256 -4.932 63 HD2 LYS 30 1HD LYS 30 -12.352 -8.297 -7.121 64 HD3 LYS 30 2HD LYS 30 -10.651 -7.852 -6.994 65 HE2 LYS 30 1HE LYS 30 -10.477 -9.212 -4.944 66 HE3 LYS 30 2HE LYS 30 -12.160 -9.696 -5.143 67 HZ1 LYS 30 1HZ LYS 30 -9.954 -10.253 -7.052 68 HZ2 LYS 30 2HZ LYS 30 -11.571 -10.695 -7.272 69 HZ3 LYS 30 3HZ LYS 30 -10.675 -11.377 -6.009 70 H ALA 31 H ALA 31 -14.169 -3.552 -7.175 71 HA ALA 31 HA ALA 31 -12.635 -1.733 -8.545 72 HB1 ALA 31 1HB ALA 31 -14.724 -0.736 -9.277 73 HB2 ALA 31 2HB ALA 31 -15.585 -1.541 -7.967 74 HB3 ALA 31 3HB ALA 31 -14.849 -2.495 -9.255 75 H ALA 32 H ALA 32 -14.521 -1.194 -5.587 76 HA ALA 32 HA ALA 32 -14.162 1.594 -5.449 77 HB1 ALA 32 1HB ALA 32 -14.472 -0.365 -3.170 78 HB2 ALA 32 2HB ALA 32 -15.790 0.391 -4.065 79 HB3 ALA 32 3HB ALA 32 -14.715 1.381 -3.078 80 H LEU 33 H LEU 33 -12.270 -1.086 -4.155 81 HA LEU 33 HA LEU 33 -10.254 0.520 -2.965 82 HB2 LEU 33 1HB LEU 33 -10.147 -2.346 -3.924 83 HB3 LEU 33 2HB LEU 33 -8.955 -1.579 -2.886 84 HG LEU 33 HG LEU 33 -11.855 -2.028 -2.168 85 HD11 LEU 33 1HD1 LEU 33 -9.383 -3.474 -1.236 86 HD12 LEU 33 2HD1 LEU 33 -10.613 -4.123 -2.319 87 HD13 LEU 33 3HD1 LEU 33 -11.026 -3.736 -0.648 88 HD21 LEU 33 1HD2 LEU 33 -11.138 -1.388 0.094 89 HD22 LEU 33 2HD2 LEU 33 -10.942 -0.074 -1.064 90 HD23 LEU 33 3HD2 LEU 33 -9.538 -1.000 -0.536 91 H THR 34 H THR 34 -10.749 -0.810 -6.158 92 HA THR 34 HA THR 34 -8.188 -0.305 -7.219 93 HB THR 34 HB THR 34 -10.858 -0.353 -8.644 94 HG1 THR 34 HG1 THR 34 -10.206 -2.306 -7.479 95 HG21 THR 34 1HG2 THR 34 -9.540 -0.852 -10.658 96 HG22 THR 34 2HG2 THR 34 -8.053 -0.644 -9.734 97 HG23 THR 34 3HG2 THR 34 -9.128 0.729 -9.995 98 H ASP 35 H ASP 35 -11.112 1.662 -6.972 99 HA ASP 35 HA ASP 35 -10.111 3.915 -8.362 100 HB2 ASP 35 1HB ASP 35 -12.490 3.710 -7.972 101 HB3 ASP 35 2HB ASP 35 -12.245 3.694 -6.227 102 H MET 36 H MET 36 -10.044 2.930 -4.977 103 HA MET 36 HA MET 36 -8.769 5.233 -3.966 104 HB2 MET 36 1HB MET 36 -9.740 3.644 -2.425 105 HB3 MET 36 2HB MET 36 -8.668 2.369 -2.993 106 HG2 MET 36 1HG MET 36 -7.969 3.293 -0.832 107 HG3 MET 36 2HG MET 36 -6.751 3.511 -2.094 108 HE1 MET 36 1HE MET 36 -6.146 6.741 -0.055 109 HE2 MET 36 2HE MET 36 -5.413 5.344 -0.846 110 HE3 MET 36 3HE MET 36 -6.470 5.115 0.549 111 H LEU 37 H LEU 37 -7.479 2.209 -5.284 112 HA LEU 37 HA LEU 37 -4.755 2.769 -5.003 113 HB2 LEU 37 1HB LEU 37 -5.679 0.577 -5.648 114 HB3 LEU 37 2HB LEU 37 -6.148 1.244 -7.208 115 HG LEU 37 HG LEU 37 -3.659 1.721 -7.573 116 HD11 LEU 37 1HD1 LEU 37 -2.939 1.448 -5.253 117 HD12 LEU 37 2HD1 LEU 37 -2.107 0.320 -6.320 118 HD13 LEU 37 3HD1 LEU 37 -3.428 -0.244 -5.298 119 HD21 LEU 37 1HD2 LEU 37 -3.255 -0.535 -8.369 120 HD22 LEU 37 2HD2 LEU 37 -4.921 -0.057 -8.702 121 HD23 LEU 37 3HD2 LEU 37 -4.566 -1.146 -7.362 122 H GLN 38 H GLN 38 -7.028 3.593 -7.591 123 HA GLN 38 HA GLN 38 -5.153 4.815 -9.311 124 HB2 GLN 38 1HB GLN 38 -8.122 5.302 -9.002 125 HB3 GLN 38 2HB GLN 38 -7.141 5.949 -10.308 126 HG2 GLN 38 1HG GLN 38 -7.686 3.044 -9.739 127 HG3 GLN 38 2HG GLN 38 -8.359 4.008 -11.051 128 HE21 GLN 38 1HE2 GLN 38 -5.569 2.338 -9.865 129 HE22 GLN 38 2HE2 GLN 38 -4.654 2.395 -11.332 130 H THR 39 H THR 39 -7.070 6.024 -6.628 131 HA THR 39 HA THR 39 -6.297 8.765 -6.972 132 HB THR 39 HB THR 39 -7.351 7.477 -4.448 133 HG1 THR 39 HG1 THR 39 -8.715 6.974 -6.253 134 HG21 THR 39 1HG2 THR 39 -7.631 10.281 -5.544 135 HG22 THR 39 2HG2 THR 39 -6.549 9.797 -4.238 136 HG23 THR 39 3HG2 THR 39 -8.296 9.690 -4.022 137 H PHE 40 H PHE 40 -4.942 5.979 -5.494 138 HA PHE 40 HA PHE 40 -3.231 7.262 -3.628 139 HB2 PHE 40 1HB PHE 40 -3.864 4.900 -3.418 140 HB3 PHE 40 2HB PHE 40 -3.005 4.532 -4.908 141 HD1 PHE 40 HD1 PHE 40 -1.126 3.293 -4.474 142 HD2 PHE 40 HD2 PHE 40 -2.135 6.493 -1.852 143 HE1 PHE 40 HE1 PHE 40 0.920 2.874 -3.183 144 HE2 PHE 40 HE2 PHE 40 -0.091 6.084 -0.562 145 HZ PHE 40 HZ PHE 40 1.443 4.270 -1.218 146 H VAL 41 H VAL 41 -2.935 6.388 -7.013 147 HA VAL 41 HA VAL 41 -0.195 6.638 -7.352 148 HB VAL 41 HB VAL 41 -2.353 7.372 -9.334 149 HG11 VAL 41 1HG1 VAL 41 -0.215 8.369 -9.945 150 HG12 VAL 41 2HG1 VAL 41 -0.643 7.057 -11.044 151 HG13 VAL 41 3HG1 VAL 41 0.567 6.797 -9.787 152 HG21 VAL 41 1HG2 VAL 41 -1.896 5.122 -10.243 153 HG22 VAL 41 2HG2 VAL 41 -2.549 5.084 -8.606 154 HG23 VAL 41 3HG2 VAL 41 -0.826 4.817 -8.875 155 HA PRO 42 HA PRO 42 -0.835 11.498 -8.064 156 HB2 PRO 42 1HB PRO 42 -3.208 11.793 -6.296 157 HB3 PRO 42 2HB PRO 42 -2.769 12.690 -7.754 158 HG2 PRO 42 1HG PRO 42 -4.689 10.850 -7.818 159 HG3 PRO 42 2HG PRO 42 -3.558 11.040 -9.170 160 HD2 PRO 42 1HD PRO 42 -3.636 8.949 -7.042 161 HD3 PRO 42 2HD PRO 42 -3.205 8.807 -8.755 162 H TYR 43 H TYR 43 -1.356 9.549 -5.201 163 HA TYR 43 HA TYR 43 -0.383 11.600 -3.372 164 HB2 TYR 43 1HB TYR 43 -1.243 8.730 -3.050 165 HB3 TYR 43 2HB TYR 43 -0.241 9.490 -1.814 166 HD1 TYR 43 HD1 TYR 43 -3.531 9.658 -3.517 167 HD2 TYR 43 HD2 TYR 43 -1.156 11.019 -0.259 168 HE1 TYR 43 HE1 TYR 43 -5.534 10.611 -2.458 169 HE2 TYR 43 HE2 TYR 43 -3.154 11.979 0.803 170 HH TYR 43 HH TYR 43 -6.303 11.248 -0.204 171 H ARG 44 H ARG 44 0.624 8.701 -5.012 172 HA ARG 44 HA ARG 44 3.191 8.383 -3.979 173 HB2 ARG 44 1HB ARG 44 2.042 7.729 -6.683 174 HB3 ARG 44 2HB ARG 44 3.676 7.293 -6.213 175 HG2 ARG 44 1HG ARG 44 1.228 6.442 -4.695 176 HG3 ARG 44 2HG ARG 44 1.975 5.483 -5.975 177 HD2 ARG 44 1HD ARG 44 3.045 4.575 -4.169 178 HD3 ARG 44 2HD ARG 44 4.146 5.902 -4.523 179 HE ARG 44 HE ARG 44 2.042 6.446 -2.593 180 HH11 ARG 44 1HH1 ARG 44 5.418 5.805 -3.212 181 HH12 ARG 44 2HH1 ARG 44 5.905 6.016 -1.562 182 HH21 ARG 44 1HH2 ARG 44 2.675 6.730 -0.389 183 HH22 ARG 44 2HH2 ARG 44 4.341 6.534 0.052 184 H THR 45 H THR 45 2.095 10.211 -6.839 185 HA THR 45 HA THR 45 4.430 11.232 -7.730 186 HB THR 45 HB THR 45 1.954 12.921 -7.394 187 HG1 THR 45 HG1 THR 45 2.485 11.206 -9.590 188 HG21 THR 45 1HG2 THR 45 2.663 13.919 -9.516 189 HG22 THR 45 2HG2 THR 45 4.084 12.875 -9.535 190 HG23 THR 45 3HG2 THR 45 3.909 14.102 -8.280 191 H ALA 46 H ALA 46 2.622 12.434 -4.921 192 HA ALA 46 HA ALA 46 4.360 14.619 -4.390 193 HB1 ALA 46 1HB ALA 46 3.278 14.663 -2.181 194 HB2 ALA 46 2HB ALA 46 2.510 13.115 -2.540 195 HB3 ALA 46 3HB ALA 46 2.102 14.544 -3.490 196 H VAL 47 H VAL 47 4.225 11.293 -3.339 197 HA VAL 47 HA VAL 47 6.297 11.552 -1.370 198 HB VAL 47 HB VAL 47 5.064 9.065 -2.559 199 HG11 VAL 47 1HG1 VAL 47 7.296 8.590 -1.708 200 HG12 VAL 47 2HG1 VAL 47 6.071 7.891 -0.649 201 HG13 VAL 47 3HG1 VAL 47 6.897 9.378 -0.182 202 HG21 VAL 47 1HG2 VAL 47 4.599 10.464 0.075 203 HG22 VAL 47 2HG2 VAL 47 3.854 8.948 -0.433 204 HG23 VAL 47 3HG2 VAL 47 3.489 10.443 -1.296 205 H GLU 48 H GLU 48 6.169 10.134 -4.635 206 HA GLU 48 HA GLU 48 8.810 9.124 -4.598 207 HB2 GLU 48 1HB GLU 48 7.188 9.900 -7.034 208 HB3 GLU 48 2HB GLU 48 8.565 8.812 -6.996 209 HG2 GLU 48 1HG GLU 48 5.885 8.328 -5.706 210 HG3 GLU 48 2HG GLU 48 6.471 7.600 -7.199 211 H LEU 49 H LEU 49 7.415 12.181 -5.675 212 HA LEU 49 HA LEU 49 9.788 13.224 -6.813 213 HB2 LEU 49 1HB LEU 49 7.177 14.334 -5.947 214 HB3 LEU 49 2HB LEU 49 8.505 15.467 -6.097 215 HG LEU 49 HG LEU 49 7.115 15.382 -8.125 216 HD11 LEU 49 1HD1 LEU 49 9.887 14.286 -8.561 217 HD12 LEU 49 2HD1 LEU 49 9.486 15.978 -8.277 218 HD13 LEU 49 3HD1 LEU 49 8.912 15.170 -9.735 219 HD21 LEU 49 1HD2 LEU 49 7.182 13.416 -9.581 220 HD22 LEU 49 2HD2 LEU 49 6.410 13.056 -8.037 221 HD23 LEU 49 3HD2 LEU 49 8.065 12.529 -8.339 222 H CYS 50 H CYS 50 8.435 13.300 -3.567 223 HA CYS 50 HA CYS 50 10.441 14.920 -2.403 224 HB2 CYS 50 1HB CYS 50 8.497 14.619 -1.109 225 HB3 CYS 50 2HB CYS 50 8.515 12.872 -1.323 226 H ALA 51 H ALA 51 10.061 11.393 -2.614 227 HA ALA 51 HA ALA 51 12.493 10.596 -1.556 228 HB1 ALA 51 1HB ALA 51 10.627 9.083 -2.162 229 HB2 ALA 51 2HB ALA 51 12.198 8.520 -2.733 230 HB3 ALA 51 3HB ALA 51 11.070 9.275 -3.859 231 H LEU 52 H LEU 52 11.835 12.049 -4.628 232 HA LEU 52 HA LEU 52 14.424 11.397 -5.726 233 HB2 LEU 52 1HB LEU 52 12.419 11.698 -7.155 234 HB3 LEU 52 2HB LEU 52 12.354 13.383 -6.680 235 HG LEU 52 HG LEU 52 14.533 13.771 -7.756 236 HD11 LEU 52 1HD1 LEU 52 15.528 11.584 -7.537 237 HD12 LEU 52 2HD1 LEU 52 15.456 12.026 -9.240 238 HD13 LEU 52 3HD1 LEU 52 14.291 10.881 -8.579 239 HD21 LEU 52 1HD2 LEU 52 12.480 14.152 -9.009 240 HD22 LEU 52 2HD2 LEU 52 12.483 12.471 -9.543 241 HD23 LEU 52 3HD2 LEU 52 13.764 13.565 -10.066 242 H GLU 53 H GLU 53 12.878 14.140 -4.181 243 HA GLU 53 HA GLU 53 14.873 16.060 -4.728 244 HB2 GLU 53 1HB GLU 53 12.598 16.684 -4.121 245 HB3 GLU 53 2HB GLU 53 12.799 15.962 -2.534 246 HG2 GLU 53 1HG GLU 53 14.521 17.615 -2.005 247 HG3 GLU 53 2HG GLU 53 14.295 18.348 -3.591 248 H HIS 54 H HIS 54 14.348 13.920 -1.975 249 HA HIS 54 HA HIS 54 16.842 14.953 -0.763 250 HB2 HIS 54 1HB HIS 54 14.736 15.132 0.588 251 HB3 HIS 54 2HB HIS 54 14.636 13.378 0.591 252 HD1 HIS 54 HD1 HIS 54 16.674 16.220 1.983 253 HD2 HIS 54 HD2 HIS 54 16.250 12.111 2.451 254 HE1 HIS 54 HE1 HIS 54 17.996 15.634 4.036 255 HE2 HIS 54 HE2 HIS 54 17.846 13.129 4.218 256 H GLY 55 H GLY 55 15.485 12.371 -2.389 257 HA2 GLY 55 1HA GLY 55 16.310 10.377 -3.115 258 HA3 GLY 55 2HA GLY 55 17.829 10.767 -2.324 259 H GLY 56 H GLY 56 16.644 10.992 0.379 260 HA2 GLY 56 1HA GLY 56 15.546 8.318 0.718 261 HA3 GLY 56 2HA GLY 56 16.150 9.355 2.000 262 H LEU 57 H LEU 57 13.699 7.883 1.910 263 HA LEU 57 HA LEU 57 11.507 9.645 1.411 264 HB2 LEU 57 1HB LEU 57 11.687 7.072 2.980 265 HB3 LEU 57 2HB LEU 57 10.192 7.906 2.601 266 HG LEU 57 HG LEU 57 12.064 6.940 0.453 267 HD11 LEU 57 1HD1 LEU 57 9.696 5.466 1.597 268 HD12 LEU 57 2HD1 LEU 57 11.386 5.039 1.870 269 HD13 LEU 57 3HD1 LEU 57 10.708 4.954 0.245 270 HD21 LEU 57 1HD2 LEU 57 10.081 7.083 -0.939 271 HD22 LEU 57 2HD2 LEU 57 10.405 8.634 -0.169 272 HD23 LEU 57 3HD2 LEU 57 9.124 7.593 0.448 273 H ASP 58 H ASP 58 13.801 9.727 3.727 274 HA ASP 58 HA ASP 58 12.635 9.925 6.189 275 HB2 ASP 58 1HB ASP 58 14.874 11.629 5.102 276 HB3 ASP 58 2HB ASP 58 14.489 11.423 6.808 277 H THR 59 H THR 59 12.785 12.413 3.705 278 HA THR 59 HA THR 59 11.550 14.372 5.443 279 HB THR 59 HB THR 59 11.645 15.775 3.294 280 HG1 THR 59 HG1 THR 59 11.894 14.149 1.770 281 HG21 THR 59 1HG2 THR 59 13.254 16.028 5.114 282 HG22 THR 59 2HG2 THR 59 14.058 16.174 3.551 283 HG23 THR 59 3HG2 THR 59 14.200 14.681 4.479 284 H CYS 60 H CYS 60 10.393 11.847 3.683 285 HA CYS 60 HA CYS 60 8.148 13.256 2.473 286 HB2 CYS 60 1HB CYS 60 8.808 10.309 2.369 287 HB3 CYS 60 2HB CYS 60 7.702 11.189 1.317 288 H ASP 61 H ASP 61 7.747 13.663 4.951 289 HA ASP 61 HA ASP 61 6.096 11.470 6.030 290 HB2 ASP 61 1HB ASP 61 8.195 12.279 7.304 291 HB3 ASP 61 2HB ASP 61 7.251 13.725 7.663 292 H GLY 62 H GLY 62 4.120 12.042 7.068 293 HA2 GLY 62 1HA GLY 62 2.691 14.065 5.652 294 HA3 GLY 62 2HA GLY 62 2.063 13.072 6.960 295 H GLY 63 H GLY 63 3.558 16.071 6.093 296 HA2 GLY 63 1HA GLY 63 2.686 17.900 7.627 297 HA3 GLY 63 2HA GLY 63 3.427 16.947 8.904 298 H SER 64 H SER 64 5.359 16.683 6.180 299 HA SER 64 HA SER 64 6.835 19.129 6.692 300 HB2 SER 64 1HB SER 64 7.639 17.494 8.381 301 HB3 SER 64 2HB SER 64 8.112 16.414 7.071 302 HG SER 64 HG SER 64 9.171 18.960 7.725 303 H ASN 65 H ASN 65 8.496 19.545 5.171 304 HA ASN 65 HA ASN 65 9.451 19.683 3.127 305 HB2 ASN 65 1HB ASN 65 10.208 17.348 3.980 306 HB3 ASN 65 2HB ASN 65 9.096 16.723 2.765 307 HD21 ASN 65 1HD2 ASN 65 9.584 16.993 0.585 308 HD22 ASN 65 2HD2 ASN 65 11.157 17.485 0.037 309 H GLY 66 H GLY 66 6.806 20.330 3.047 310 HA2 GLY 66 1HA GLY 66 5.512 20.990 1.213 311 HA3 GLY 66 2HA GLY 66 6.292 19.748 0.243 312 H ILE 67 H ILE 67 5.636 17.837 2.579 313 HA ILE 67 HA ILE 67 3.004 17.143 1.552 314 HB ILE 67 HB ILE 67 4.777 15.581 3.437 315 HG12 ILE 67 1HG1 ILE 67 4.371 15.331 0.447 316 HG13 ILE 67 2HG1 ILE 67 5.847 15.858 1.254 317 HG21 ILE 67 1HG2 ILE 67 2.351 14.722 1.858 318 HG22 ILE 67 2HG2 ILE 67 2.391 15.021 3.594 319 HG23 ILE 67 3HG2 ILE 67 3.329 13.694 2.906 320 HD11 ILE 67 1HD1 ILE 67 6.085 13.651 2.255 321 HD12 ILE 67 2HD1 ILE 67 6.024 13.561 0.495 322 HD13 ILE 67 3HD1 ILE 67 4.607 13.123 1.451 323 HA PRO 68 HA PRO 68 1.376 19.116 5.225 324 HB2 PRO 68 1HB PRO 68 -1.257 18.291 4.290 325 HB3 PRO 68 2HB PRO 68 -0.587 19.918 4.427 326 HG2 PRO 68 1HG PRO 68 -1.085 18.726 2.043 327 HG3 PRO 68 2HG PRO 68 0.211 19.918 2.283 328 HD2 PRO 68 1HD PRO 68 0.381 16.924 2.145 329 HD3 PRO 68 2HD PRO 68 1.469 18.152 1.451 330 H SER 69 H SER 69 0.101 18.519 7.084 331 HA SER 69 HA SER 69 0.405 16.089 8.233 332 HB2 SER 69 1HB SER 69 -2.055 17.823 8.535 333 HB3 SER 69 2HB SER 69 -1.424 16.681 9.722 334 HG SER 69 HG SER 69 0.369 17.985 9.998 335 HA PRO 70 HA PRO 70 -1.861 13.035 6.028 336 HB2 PRO 70 1HB PRO 70 -2.742 11.531 8.198 337 HB3 PRO 70 2HB PRO 70 -1.175 11.359 7.403 338 HG2 PRO 70 1HG PRO 70 -1.887 12.827 9.898 339 HG3 PRO 70 2HG PRO 70 -0.434 11.882 9.524 340 HD2 PRO 70 1HD PRO 70 -0.396 14.563 9.492 341 HD3 PRO 70 2HD PRO 70 0.532 13.614 8.311 342 H THR 71 H THR 71 -3.872 12.836 5.270 343 HA THR 71 HA THR 71 -6.121 13.841 6.839 344 HB THR 71 HB THR 71 -5.228 15.765 5.534 345 HG1 THR 71 HG1 THR 71 -7.241 16.316 4.569 346 HG21 THR 71 1HG2 THR 71 -5.439 15.768 3.087 347 HG22 THR 71 2HG2 THR 71 -5.915 14.071 3.131 348 HG23 THR 71 3HG2 THR 71 -4.295 14.545 3.638 349 H THR 72 H THR 72 -8.144 13.604 5.214 350 HA THR 72 HA THR 72 -7.884 11.036 3.831 351 HB THR 72 HB THR 72 -10.158 10.406 4.709 352 HG1 THR 72 HG1 THR 72 -9.712 12.766 6.154 353 HG21 THR 72 1HG2 THR 72 -9.333 9.562 6.844 354 HG22 THR 72 2HG2 THR 72 -7.977 10.690 6.777 355 HG23 THR 72 3HG2 THR 72 -8.105 9.393 5.588 356 H THR 73 H THR 73 -8.614 11.164 1.842 357 HA THR 73 HA THR 73 -10.289 13.313 0.964 358 HB THR 73 HB THR 73 -10.339 11.765 -1.175 359 HG1 THR 73 HG1 THR 73 -9.298 9.963 -0.801 360 HG21 THR 73 1HG2 THR 73 -8.193 12.724 -1.889 361 HG22 THR 73 2HG2 THR 73 -7.833 13.149 -0.216 362 HG23 THR 73 3HG2 THR 73 -9.186 13.914 -1.048 363 H ARG 74 H ARG 74 -12.238 12.373 -0.580 364 HA ARG 74 HA ARG 74 -14.216 12.060 1.322 365 HB2 ARG 74 1HB ARG 74 -14.736 13.012 -0.798 366 HB3 ARG 74 2HB ARG 74 -14.258 11.548 -1.644 367 HG2 ARG 74 1HG ARG 74 -16.144 10.357 -0.693 368 HG3 ARG 74 2HG ARG 74 -16.616 11.796 0.212 369 HD2 ARG 74 1HD ARG 74 -16.896 12.999 -1.932 370 HD3 ARG 74 2HD ARG 74 -16.512 11.510 -2.790 371 HE ARG 74 HE ARG 74 -18.682 11.178 -0.961 372 HH11 ARG 74 1HH1 ARG 74 -17.808 12.315 -4.146 373 HH12 ARG 74 2HH1 ARG 74 -19.402 12.118 -4.799 374 HH21 ARG 74 1HH2 ARG 74 -20.793 10.907 -1.815 375 HH22 ARG 74 2HH2 ARG 74 -21.096 11.311 -3.476 376 H TYR 75 H TYR 75 -12.833 9.475 -0.767 377 HA TYR 75 HA TYR 75 -14.543 7.581 0.628 378 HB2 TYR 75 1HB TYR 75 -12.749 7.223 -1.778 379 HB3 TYR 75 2HB TYR 75 -13.798 5.978 -1.098 380 HD1 TYR 75 HD1 TYR 75 -16.291 6.365 -1.108 381 HD2 TYR 75 HD2 TYR 75 -13.599 8.812 -3.312 382 HE1 TYR 75 HE1 TYR 75 -18.156 7.147 -2.503 383 HE2 TYR 75 HE2 TYR 75 -15.459 9.604 -4.711 384 HH TYR 75 HH TYR 75 -18.766 8.927 -3.936 385 H VAL 76 H VAL 76 -11.775 8.874 1.497 386 HA VAL 76 HA VAL 76 -10.443 6.355 2.196 387 HB VAL 76 HB VAL 76 -9.490 9.213 2.447 388 HG11 VAL 76 1HG1 VAL 76 -7.366 8.306 3.211 389 HG12 VAL 76 2HG1 VAL 76 -8.011 6.667 3.125 390 HG13 VAL 76 3HG1 VAL 76 -8.658 7.807 4.305 391 HG21 VAL 76 1HG2 VAL 76 -9.500 8.341 0.174 392 HG22 VAL 76 2HG2 VAL 76 -8.594 6.923 0.702 393 HG23 VAL 76 3HG2 VAL 76 -7.847 8.521 0.764 394 H SER 77 H SER 77 -10.406 5.578 4.208 395 HA SER 77 HA SER 77 -12.203 6.823 6.109 396 HB2 SER 77 1HB SER 77 -10.728 4.191 6.354 397 HB3 SER 77 2HB SER 77 -12.134 4.717 7.286 398 HG SER 77 HG SER 77 -13.304 4.751 5.282 399 H ALA 78 H ALA 78 -8.812 5.800 5.957 400 HA ALA 78 HA ALA 78 -7.932 7.827 7.723 401 HB1 ALA 78 1HB ALA 78 -8.003 5.034 8.864 402 HB2 ALA 78 2HB ALA 78 -8.967 6.404 9.418 403 HB3 ALA 78 3HB ALA 78 -7.211 6.430 9.596 404 H MET 79 H MET 79 -5.804 8.144 7.417 405 HA MET 79 HA MET 79 -4.039 6.030 6.623 406 HB2 MET 79 1HB MET 79 -3.390 6.990 4.461 407 HB3 MET 79 2HB MET 79 -5.071 6.479 4.460 408 HG2 MET 79 1HG MET 79 -5.800 8.779 4.722 409 HG3 MET 79 2HG MET 79 -4.125 9.318 4.803 410 HE1 MET 79 1HE MET 79 -2.857 8.542 1.174 411 HE2 MET 79 2HE MET 79 -2.777 7.435 2.543 412 HE3 MET 79 3HE MET 79 -2.428 9.148 2.773 413 H SER 80 H SER 80 -1.931 6.535 6.977 414 HA SER 80 HA SER 80 -1.311 9.317 7.700 415 HB2 SER 80 1HB SER 80 -1.674 7.817 9.729 416 HB3 SER 80 2HB SER 80 -0.250 6.915 9.209 417 HG SER 80 HG SER 80 0.581 8.389 10.548 418 H VAL 81 H VAL 81 0.834 9.949 7.286 419 HA VAL 81 HA VAL 81 2.258 8.168 5.426 420 HB VAL 81 HB VAL 81 2.437 11.185 5.542 421 HG11 VAL 81 1HG1 VAL 81 4.395 10.134 4.579 422 HG12 VAL 81 2HG1 VAL 81 3.470 10.959 3.325 423 HG13 VAL 81 3HG1 VAL 81 3.382 9.205 3.474 424 HG21 VAL 81 1HG2 VAL 81 0.182 10.583 4.914 425 HG22 VAL 81 2HG2 VAL 81 0.792 9.475 3.687 426 HG23 VAL 81 3HG2 VAL 81 1.051 11.211 3.514 427 H ALA 82 H ALA 82 4.149 7.415 6.197 428 HA ALA 82 HA ALA 82 5.633 9.088 8.090 429 HB1 ALA 82 1HB ALA 82 6.119 7.159 9.492 430 HB2 ALA 82 2HB ALA 82 5.119 6.139 8.456 431 HB3 ALA 82 3HB ALA 82 4.380 7.432 9.401 432 H LYS 83 H LYS 83 7.347 9.530 7.032 433 HA LYS 83 HA LYS 83 9.188 9.425 5.639 434 HB2 LYS 83 1HB LYS 83 9.474 6.615 6.720 435 HB3 LYS 83 2HB LYS 83 10.754 7.672 6.145 436 HG2 LYS 83 1HG LYS 83 9.095 8.073 8.628 437 HG3 LYS 83 2HG LYS 83 10.772 7.530 8.567 438 HD2 LYS 83 1HD LYS 83 11.402 9.680 7.549 439 HD3 LYS 83 2HD LYS 83 9.731 10.220 7.675 440 HE2 LYS 83 1HE LYS 83 10.953 11.135 9.516 441 HE3 LYS 83 2HE LYS 83 9.879 9.884 10.139 442 HZ1 LYS 83 1HZ LYS 83 12.787 9.586 9.611 443 HZ2 LYS 83 2HZ LYS 83 11.766 8.357 10.157 444 HZ3 LYS 83 3HZ LYS 83 12.055 9.706 11.131 445 H GLY 84 H GLY 84 7.001 9.054 4.167 446 HA2 GLY 84 1HA GLY 84 6.510 8.462 1.989 447 HA3 GLY 84 2HA GLY 84 7.906 7.393 1.991 448 H VAL 85 H VAL 85 6.946 6.071 4.422 449 HA VAL 85 HA VAL 85 5.267 4.058 3.309 450 HB VAL 85 HB VAL 85 5.783 4.583 6.244 451 HG11 VAL 85 1HG1 VAL 85 4.940 2.092 4.774 452 HG12 VAL 85 2HG1 VAL 85 3.960 3.040 5.894 453 HG13 VAL 85 3HG1 VAL 85 5.372 2.163 6.482 454 HG21 VAL 85 1HG2 VAL 85 7.614 2.954 6.036 455 HG22 VAL 85 2HG2 VAL 85 7.894 4.405 5.074 456 HG23 VAL 85 3HG2 VAL 85 7.363 2.917 4.291 457 H VAL 86 H VAL 86 3.008 3.686 3.623 458 HA VAL 86 HA VAL 86 1.594 5.822 5.029 459 HB VAL 86 HB VAL 86 -0.144 5.890 3.248 460 HG11 VAL 86 1HG1 VAL 86 2.626 6.692 2.361 461 HG12 VAL 86 2HG1 VAL 86 1.564 7.628 3.410 462 HG13 VAL 86 3HG1 VAL 86 1.110 7.337 1.732 463 HG21 VAL 86 1HG2 VAL 86 1.900 4.430 1.586 464 HG22 VAL 86 2HG2 VAL 86 0.353 5.067 1.032 465 HG23 VAL 86 3HG2 VAL 86 0.392 3.739 2.190 466 H SER 87 H SER 87 0.483 4.916 6.544 467 HA SER 87 HA SER 87 -0.582 2.220 6.158 468 HB2 SER 87 1HB SER 87 -0.886 2.347 8.690 469 HB3 SER 87 2HB SER 87 0.775 2.359 8.098 470 HG SER 87 HG SER 87 1.029 4.240 8.968 471 H LEU 88 H LEU 88 -2.648 1.813 5.961 472 HA LEU 88 HA LEU 88 -4.597 3.941 6.570 473 HB2 LEU 88 1HB LEU 88 -4.811 1.742 4.504 474 HB3 LEU 88 2HB LEU 88 -6.031 2.956 4.840 475 HG LEU 88 HG LEU 88 -4.128 4.638 4.184 476 HD11 LEU 88 1HD1 LEU 88 -2.325 3.039 3.994 477 HD12 LEU 88 2HD1 LEU 88 -2.668 3.753 2.417 478 HD13 LEU 88 3HD1 LEU 88 -3.231 2.122 2.789 479 HD21 LEU 88 1HD2 LEU 88 -6.221 4.412 2.998 480 HD22 LEU 88 2HD2 LEU 88 -5.629 2.967 2.179 481 HD23 LEU 88 3HD2 LEU 88 -4.887 4.532 1.851 482 H THR 89 H THR 89 -6.587 3.261 7.538 483 HA THR 89 HA THR 89 -6.637 0.485 8.481 484 HB THR 89 HB THR 89 -7.149 2.825 10.327 485 HG1 THR 89 HG1 THR 89 -4.895 2.558 9.622 486 HG21 THR 89 1HG2 THR 89 -6.768 -0.126 10.870 487 HG22 THR 89 2HG2 THR 89 -8.301 0.744 10.935 488 HG23 THR 89 3HG2 THR 89 -7.021 1.125 12.087 489 H GLY 90 H GLY 90 -8.624 -0.366 8.816 490 HA2 GLY 90 1HA GLY 90 -10.844 -0.729 8.258 491 HA3 GLY 90 2HA GLY 90 -11.064 0.758 9.163 492 H GLN 91 H GLN 91 -9.587 0.235 5.979 493 HA GLN 91 HA GLN 91 -10.885 2.583 4.989 494 HB2 GLN 91 1HB GLN 91 -8.624 1.938 4.304 495 HB3 GLN 91 2HB GLN 91 -9.247 0.461 3.583 496 HG2 GLN 91 1HG GLN 91 -8.714 2.163 1.922 497 HG3 GLN 91 2HG GLN 91 -10.425 1.731 1.909 498 HE21 GLN 91 1HE2 GLN 91 -11.931 3.234 2.490 499 HE22 GLN 91 2HE2 GLN 91 -11.571 4.909 2.670 500 H GLU 92 H GLU 92 -12.838 2.719 4.131 501 HA GLU 92 HA GLU 92 -14.917 2.138 3.437 502 HB2 GLU 92 1HB GLU 92 -13.169 0.547 1.580 503 HB3 GLU 92 2HB GLU 92 -14.918 0.578 1.409 504 HG2 GLU 92 1HG GLU 92 -13.092 2.960 1.290 505 HG3 GLU 92 2HG GLU 92 -13.879 2.176 -0.072 506 H SER 93 H SER 93 -14.704 -0.915 2.223 507 HA SER 93 HA SER 93 -16.298 -2.010 4.327 508 HB2 SER 93 1HB SER 93 -16.602 -2.519 1.898 509 HB3 SER 93 2HB SER 93 -15.086 -3.417 1.942 510 HG SER 93 HG SER 93 -17.320 -3.987 3.601 511 H LEU 94 H LEU 94 -12.992 -1.735 3.894 512 HA LEU 94 HA LEU 94 -12.221 -4.322 4.924 513 HB2 LEU 94 1HB LEU 94 -10.518 -1.888 4.388 514 HB3 LEU 94 2HB LEU 94 -9.939 -3.519 4.687 515 HG LEU 94 HG LEU 94 -11.529 -2.625 2.276 516 HD11 LEU 94 1HD1 LEU 94 -9.264 -1.773 2.245 517 HD12 LEU 94 2HD1 LEU 94 -9.442 -3.066 1.059 518 HD13 LEU 94 3HD1 LEU 94 -8.629 -3.382 2.591 519 HD21 LEU 94 1HD2 LEU 94 -12.032 -4.937 2.870 520 HD22 LEU 94 2HD2 LEU 94 -10.308 -5.309 2.924 521 HD23 LEU 94 3HD2 LEU 94 -11.066 -4.862 1.396 522 H ASN 95 H ASN 95 -13.884 -2.890 6.629 523 HA ASN 95 HA ASN 95 -12.648 -1.465 8.680 524 HB2 ASN 95 1HB ASN 95 -15.097 -1.668 8.392 525 HB3 ASN 95 2HB ASN 95 -15.001 -3.354 8.888 526 HD21 ASN 95 1HD2 ASN 95 -16.367 -3.011 10.629 527 HD22 ASN 95 2HD2 ASN 95 -15.857 -2.165 12.052 528 H GLY 96 H GLY 96 -11.539 -2.027 10.487 529 HA2 GLY 96 1HA GLY 96 -10.424 -3.391 12.005 530 HA3 GLY 96 2HA GLY 96 -11.176 -4.789 11.249 531 H LEU 97 H LEU 97 -10.084 -3.513 8.617 532 HA LEU 97 HA LEU 97 -7.578 -5.003 8.750 533 HB2 LEU 97 1HB LEU 97 -9.226 -5.617 7.039 534 HB3 LEU 97 2HB LEU 97 -9.192 -3.983 6.410 535 HG LEU 97 HG LEU 97 -6.669 -5.605 6.417 536 HD11 LEU 97 1HD1 LEU 97 -8.312 -7.076 5.407 537 HD12 LEU 97 2HD1 LEU 97 -7.267 -6.402 4.158 538 HD13 LEU 97 3HD1 LEU 97 -8.894 -5.764 4.384 539 HD21 LEU 97 1HD2 LEU 97 -6.196 -4.255 4.445 540 HD22 LEU 97 2HD2 LEU 97 -6.583 -3.230 5.826 541 HD23 LEU 97 3HD2 LEU 97 -7.786 -3.502 4.568 542 H SER 98 H SER 98 -5.636 -4.074 8.529 543 HA SER 98 HA SER 98 -5.551 -1.211 7.842 544 HB2 SER 98 1HB SER 98 -4.817 -1.782 10.173 545 HB3 SER 98 2HB SER 98 -3.526 -2.761 9.481 546 HG SER 98 HG SER 98 -3.797 -0.081 8.679 547 H VAL 99 H VAL 99 -4.302 -0.582 6.175 548 HA VAL 99 HA VAL 99 -2.723 -2.657 4.789 549 HB VAL 99 HB VAL 99 -3.881 -0.130 3.587 550 HG11 VAL 99 1HG1 VAL 99 -2.549 -2.505 2.300 551 HG12 VAL 99 2HG1 VAL 99 -1.877 -0.881 2.458 552 HG13 VAL 99 3HG1 VAL 99 -3.292 -1.155 1.441 553 HG21 VAL 99 1HG2 VAL 99 -5.673 -1.671 4.190 554 HG22 VAL 99 2HG2 VAL 99 -4.866 -2.962 3.299 555 HG23 VAL 99 3HG2 VAL 99 -5.488 -1.554 2.440 556 H VAL 100 H VAL 100 -0.545 -2.329 4.792 557 HA VAL 100 HA VAL 100 0.370 0.414 5.341 558 HB VAL 100 HB VAL 100 1.814 -2.145 6.052 559 HG11 VAL 100 1HG1 VAL 100 2.415 0.718 6.787 560 HG12 VAL 100 2HG1 VAL 100 3.290 -0.242 5.596 561 HG13 VAL 100 3HG1 VAL 100 3.326 -0.702 7.297 562 HG21 VAL 100 1HG2 VAL 100 -0.175 -1.890 7.433 563 HG22 VAL 100 2HG2 VAL 100 0.305 -0.244 7.842 564 HG23 VAL 100 3HG2 VAL 100 1.282 -1.606 8.383 565 H MET 101 H MET 101 1.011 1.237 3.473 566 HA MET 101 HA MET 101 2.388 -0.477 1.529 567 HB2 MET 101 1HB MET 101 0.604 1.035 0.704 568 HB3 MET 101 2HB MET 101 1.529 2.415 1.274 569 HG2 MET 101 1HG MET 101 1.842 2.182 -1.086 570 HG3 MET 101 2HG MET 101 3.350 1.802 -0.264 571 HE1 MET 101 1HE MET 101 0.532 -1.357 -2.111 572 HE2 MET 101 2HE MET 101 0.235 0.380 -2.152 573 HE3 MET 101 3HE MET 101 0.135 -0.496 -0.626 574 H THR 102 H THR 102 4.479 -0.705 1.804 575 HA THR 102 HA THR 102 6.030 1.541 2.920 576 HB THR 102 HB THR 102 6.700 -1.403 3.077 577 HG1 THR 102 HG1 THR 102 5.945 0.086 5.335 578 HG21 THR 102 1HG2 THR 102 8.638 0.108 3.208 579 HG22 THR 102 2HG2 THR 102 8.341 -0.707 4.742 580 HG23 THR 102 3HG2 THR 102 7.862 0.975 4.532 581 HA PRO 103 HA PRO 103 7.999 1.263 -1.190 582 HB2 PRO 103 1HB PRO 103 9.194 3.794 -0.308 583 HB3 PRO 103 2HB PRO 103 8.222 3.456 -1.748 584 HG2 PRO 103 1HG PRO 103 7.269 4.917 0.320 585 HG3 PRO 103 2HG PRO 103 6.231 3.870 -0.667 586 HD2 PRO 103 1HD PRO 103 7.378 3.386 2.057 587 HD3 PRO 103 2HD PRO 103 5.764 2.981 1.420 588 H GLY 104 H GLY 104 9.898 0.270 -1.505 589 HA2 GLY 104 1HA GLY 104 12.369 0.470 -1.036 590 HA3 GLY 104 2HA GLY 104 11.906 0.411 0.660 591 H TRP 105 H TRP 105 10.227 -1.471 -1.698 592 HA TRP 105 HA TRP 105 10.960 -3.928 -0.367 593 HB2 TRP 105 1HB TRP 105 8.656 -3.580 -1.050 594 HB3 TRP 105 2HB TRP 105 9.149 -3.316 -2.714 595 HD1 TRP 105 HD1 TRP 105 9.442 -5.402 -4.237 596 HE1 TRP 105 HE1 TRP 105 9.015 -7.919 -3.923 597 HE3 TRP 105 HE3 TRP 105 8.787 -5.482 0.831 598 HZ2 TRP 105 HZ2 TRP 105 8.471 -9.700 -1.805 599 HZ3 TRP 105 HZ3 TRP 105 8.316 -7.635 1.925 600 HH2 TRP 105 HH2 TRP 105 8.161 -9.699 0.631 601 H ASP 106 H ASP 106 11.703 -2.236 -3.318 602 HA ASP 106 HA ASP 106 12.899 -4.468 -4.658 603 HB2 ASP 106 1HB ASP 106 12.019 -2.706 -6.019 604 HB3 ASP 106 2HB ASP 106 12.970 -1.493 -5.171 605 H ASN 107 H ASN 107 14.683 -5.374 -3.947 606 HA ASN 107 HA ASN 107 16.428 -4.143 -2.075 607 HB2 ASN 107 1HB ASN 107 15.946 -6.613 -2.255 608 HB3 ASN 107 2HB ASN 107 16.947 -6.639 -3.700 609 HD21 ASN 107 1HD2 ASN 107 17.521 -4.790 -0.750 610 HD22 ASN 107 2HD2 ASN 107 18.986 -5.603 -0.321 611 H ALA 108 H ALA 108 16.379 -4.351 -5.517 612 HA ALA 108 HA ALA 108 19.115 -4.119 -6.076 613 HB1 ALA 108 1HB ALA 108 17.461 -4.803 -7.743 614 HB2 ALA 108 2HB ALA 108 18.435 -3.449 -8.315 615 HB3 ALA 108 3HB ALA 108 16.788 -3.174 -7.747 616 H ASN 109 H ASN 109 16.606 -1.584 -5.858 617 HA ASN 109 HA ASN 109 18.768 0.410 -5.858 618 HB2 ASN 109 1HB ASN 109 15.775 0.769 -6.135 619 HB3 ASN 109 2HB ASN 109 16.953 2.075 -6.178 620 HD21 ASN 109 1HD2 ASN 109 15.671 -0.694 -7.851 621 HD22 ASN 109 2HD2 ASN 109 16.337 -0.302 -9.405 622 H GLY 110 H GLY 110 16.209 -0.917 -3.852 623 HA2 GLY 110 1HA GLY 110 16.389 -1.003 -1.504 624 HA3 GLY 110 2HA GLY 110 17.504 0.353 -1.558 625 H VAL 111 H VAL 111 15.867 2.024 -3.222 626 HA VAL 111 HA VAL 111 13.982 2.888 -1.151 627 HB VAL 111 HB VAL 111 14.004 5.076 -2.337 628 HG11 VAL 111 1HG1 VAL 111 16.694 4.002 -1.504 629 HG12 VAL 111 2HG1 VAL 111 15.470 4.699 -0.441 630 HG13 VAL 111 3HG1 VAL 111 16.273 5.709 -1.643 631 HG21 VAL 111 1HG2 VAL 111 14.567 4.291 -4.574 632 HG22 VAL 111 2HG2 VAL 111 16.158 3.781 -4.010 633 HG23 VAL 111 3HG2 VAL 111 15.735 5.494 -4.024 634 H THR 112 H THR 112 13.904 1.248 -4.035 635 HA THR 112 HA THR 112 11.375 2.424 -4.917 636 HB THR 112 HB THR 112 11.886 0.726 -6.878 637 HG1 THR 112 HG1 THR 112 13.770 -0.210 -6.574 638 HG21 THR 112 1HG2 THR 112 11.764 3.155 -7.128 639 HG22 THR 112 2HG2 THR 112 13.135 2.505 -8.027 640 HG23 THR 112 3HG2 THR 112 13.397 3.312 -6.481 641 H GLY 113 H GLY 113 9.803 0.770 -5.865 642 HA2 GLY 113 1HA GLY 113 8.621 -1.226 -5.756 643 HA3 GLY 113 2HA GLY 113 9.861 -1.873 -4.693 644 H TRP 114 H TRP 114 6.717 -0.734 -4.856 645 HA TRP 114 HA TRP 114 6.578 0.092 -2.075 646 HB2 TRP 114 1HB TRP 114 4.319 -0.246 -4.060 647 HB3 TRP 114 2HB TRP 114 4.267 0.628 -2.530 648 HD1 TRP 114 HD1 TRP 114 5.919 2.897 -2.451 649 HE1 TRP 114 HE1 TRP 114 6.383 4.610 -4.330 650 HE3 TRP 114 HE3 TRP 114 4.463 0.092 -6.463 651 HZ2 TRP 114 HZ2 TRP 114 6.130 4.741 -7.133 652 HZ3 TRP 114 HZ3 TRP 114 4.599 1.085 -8.710 653 HH2 TRP 114 HH2 TRP 114 5.415 3.363 -9.037 654 H ALA 115 H ALA 115 6.191 -1.304 -0.462 655 HA ALA 115 HA ALA 115 5.306 -4.011 -1.131 656 HB1 ALA 115 1HB ALA 115 7.321 -3.768 0.253 657 HB2 ALA 115 2HB ALA 115 6.037 -4.618 1.109 658 HB3 ALA 115 3HB ALA 115 6.372 -2.926 1.476 659 H ARG 116 H ARG 116 3.418 -4.839 -0.494 660 HA ARG 116 HA ARG 116 1.603 -3.039 0.954 661 HB2 ARG 116 1HB ARG 116 -0.248 -4.078 -0.134 662 HB3 ARG 116 2HB ARG 116 0.939 -3.706 -1.377 663 HG2 ARG 116 1HG ARG 116 0.941 -6.427 -0.165 664 HG3 ARG 116 2HG ARG 116 -0.321 -6.011 -1.322 665 HD2 ARG 116 1HD ARG 116 1.274 -6.888 -2.714 666 HD3 ARG 116 2HD ARG 116 1.690 -5.184 -2.764 667 HE ARG 116 HE ARG 116 3.101 -6.920 -0.871 668 HH11 ARG 116 1HH1 ARG 116 3.104 -4.933 -3.743 669 HH12 ARG 116 2HH1 ARG 116 4.825 -4.968 -3.941 670 HH21 ARG 116 1HH2 ARG 116 5.393 -6.971 -1.113 671 HH22 ARG 116 2HH2 ARG 116 6.128 -6.133 -2.442 672 H ASN 117 H ASN 117 0.479 -3.735 2.698 673 HA ASN 117 HA ASN 117 0.763 -6.513 3.561 674 HB2 ASN 117 1HB ASN 117 2.585 -5.078 4.613 675 HB3 ASN 117 2HB ASN 117 1.302 -4.200 5.432 676 HD21 ASN 117 1HD2 ASN 117 3.472 -5.750 6.548 677 HD22 ASN 117 2HD2 ASN 117 2.746 -6.976 7.527 678 H CYS 118 H CYS 118 -1.223 -7.212 3.973 679 HA CYS 118 HA CYS 118 -3.239 -5.284 4.900 680 HB2 CYS 118 1HB CYS 118 -3.481 -7.944 3.493 681 HB3 CYS 118 2HB CYS 118 -4.852 -7.181 4.295 682 H ASN 119 H ASN 119 -3.523 -5.278 7.028 683 HA ASN 119 HA ASN 119 -3.179 -7.822 8.476 684 HB2 ASN 119 1HB ASN 119 -3.194 -4.998 9.573 685 HB3 ASN 119 2HB ASN 119 -2.892 -6.462 10.498 686 HD21 ASN 119 1HD2 ASN 119 -0.920 -7.538 10.241 687 HD22 ASN 119 2HD2 ASN 119 0.451 -6.769 9.520 688 H ILE 120 H ILE 120 -5.121 -8.770 8.405 689 HA ILE 120 HA ILE 120 -7.287 -7.396 9.800 690 HB ILE 120 HB ILE 120 -7.907 -7.187 7.500 691 HG12 ILE 120 1HG1 ILE 120 -9.996 -8.522 7.411 692 HG13 ILE 120 2HG1 ILE 120 -9.425 -9.453 8.790 693 HG21 ILE 120 1HG2 ILE 120 -6.501 -8.829 6.472 694 HG22 ILE 120 2HG2 ILE 120 -8.175 -9.153 6.017 695 HG23 ILE 120 3HG2 ILE 120 -7.389 -10.141 7.250 696 HD11 ILE 120 1HD1 ILE 120 -11.026 -7.768 9.472 697 HD12 ILE 120 2HD1 ILE 120 -10.022 -6.504 8.762 698 HD13 ILE 120 3HD1 ILE 120 -9.436 -7.418 10.150 699 H GLN 121 H GLN 121 -7.473 -8.548 11.627 700 HA GLN 121 HA GLN 121 -6.484 -11.219 11.797 701 HB2 GLN 121 1HB GLN 121 -6.276 -9.571 13.626 702 HB3 GLN 121 2HB GLN 121 -8.017 -9.615 13.847 703 HG2 GLN 121 1HG GLN 121 -7.856 -12.017 14.387 704 HG3 GLN 121 2HG GLN 121 -6.101 -11.897 14.260 705 HE21 GLN 121 1HE2 GLN 121 -4.962 -10.736 15.817 706 HE22 GLN 121 2HE2 GLN 121 -5.655 -10.333 17.349 707 H SER 122 H SER 122 -9.758 -9.838 11.654 708 HA SER 122 HA SER 122 -10.847 -12.434 12.422 709 HB2 SER 122 1HB SER 122 -13.011 -11.158 12.573 710 HB3 SER 122 2HB SER 122 -11.735 -10.586 13.648 711 HG SER 122 HG SER 122 -12.687 -9.427 11.241 712 H ASP 123 H ASP 123 -10.455 -10.622 9.499 713 HA ASP 123 HA ASP 123 -12.568 -12.241 8.250 714 HB2 ASP 123 1HB ASP 123 -12.121 -9.285 7.836 715 HB3 ASP 123 2HB ASP 123 -13.209 -10.277 6.869 716 H SER 124 H SER 124 -11.222 -13.625 7.208 717 HA SER 124 HA SER 124 -8.949 -12.953 5.712 718 HB2 SER 124 1HB SER 124 -9.476 -15.254 6.411 719 HB3 SER 124 2HB SER 124 -10.864 -15.272 5.327 720 HG SER 124 HG SER 124 -8.388 -14.631 4.218 721 H ALA 125 H ALA 125 -12.346 -12.757 4.930 722 HA ALA 125 HA ALA 125 -12.165 -12.746 2.123 723 HB1 ALA 125 1HB ALA 125 -14.234 -11.420 3.866 724 HB2 ALA 125 2HB ALA 125 -14.260 -13.104 3.339 725 HB3 ALA 125 3HB ALA 125 -14.402 -11.807 2.153 726 H LEU 126 H LEU 126 -11.858 -10.179 4.504 727 HA LEU 126 HA LEU 126 -12.003 -8.027 2.671 728 HB2 LEU 126 1HB LEU 126 -10.679 -8.154 5.380 729 HB3 LEU 126 2HB LEU 126 -11.002 -6.684 4.484 730 HG LEU 126 HG LEU 126 -13.067 -8.571 5.619 731 HD11 LEU 126 1HD1 LEU 126 -11.941 -7.207 7.298 732 HD12 LEU 126 2HD1 LEU 126 -13.619 -6.708 7.085 733 HD13 LEU 126 3HD1 LEU 126 -12.318 -5.753 6.375 734 HD21 LEU 126 1HD2 LEU 126 -13.842 -7.622 3.521 735 HD22 LEU 126 2HD2 LEU 126 -13.422 -6.003 4.080 736 HD23 LEU 126 3HD2 LEU 126 -14.706 -6.908 4.881 737 H GLN 127 H GLN 127 -9.397 -10.018 3.897 738 HA GLN 127 HA GLN 127 -7.244 -8.508 2.907 739 HB2 GLN 127 1HB GLN 127 -6.795 -10.234 4.499 740 HB3 GLN 127 2HB GLN 127 -7.529 -11.458 3.469 741 HG2 GLN 127 1HG GLN 127 -5.749 -11.161 1.835 742 HG3 GLN 127 2HG GLN 127 -5.014 -9.925 2.853 743 HE21 GLN 127 1HE2 GLN 127 -3.966 -12.465 1.881 744 HE22 GLN 127 2HE2 GLN 127 -3.491 -13.349 3.301 745 H GLN 128 H GLN 128 -9.150 -11.112 1.481 746 HA GLN 128 HA GLN 128 -7.648 -11.507 -0.833 747 HB2 GLN 128 1HB GLN 128 -10.593 -11.849 -0.291 748 HB3 GLN 128 2HB GLN 128 -9.840 -12.342 -1.803 749 HG2 GLN 128 1HG GLN 128 -8.398 -13.886 -0.599 750 HG3 GLN 128 2HG GLN 128 -9.101 -13.362 0.932 751 HE21 GLN 128 1HE2 GLN 128 -11.146 -14.036 1.484 752 HE22 GLN 128 2HE2 GLN 128 -11.976 -15.300 0.650 753 H ALA 129 H ALA 129 -10.027 -9.077 -0.053 754 HA ALA 129 HA ALA 129 -10.293 -8.081 -2.716 755 HB1 ALA 129 1HB ALA 129 -12.072 -7.781 -1.090 756 HB2 ALA 129 2HB ALA 129 -11.489 -6.218 -1.669 757 HB3 ALA 129 3HB ALA 129 -11.001 -6.807 -0.080 758 H CYS 130 H CYS 130 -8.454 -7.049 0.156 759 HA CYS 130 HA CYS 130 -7.487 -4.690 -1.108 760 HB2 CYS 130 1HB CYS 130 -6.048 -4.435 0.848 761 HB3 CYS 130 2HB CYS 130 -7.690 -4.847 1.329 762 H GLU 131 H GLU 131 -5.966 -7.845 -0.406 763 HA GLU 131 HA GLU 131 -3.471 -7.196 -1.536 764 HB2 GLU 131 1HB GLU 131 -2.992 -9.571 -1.550 765 HB3 GLU 131 2HB GLU 131 -3.819 -9.146 -0.056 766 HG2 GLU 131 1HG GLU 131 -5.860 -10.093 -0.826 767 HG3 GLU 131 2HG GLU 131 -5.202 -10.324 -2.449 768 H ASP 132 H ASP 132 -6.476 -8.073 -2.972 769 HA ASP 132 HA ASP 132 -5.475 -8.967 -5.479 770 HB2 ASP 132 1HB ASP 132 -7.777 -9.437 -4.607 771 HB3 ASP 132 2HB ASP 132 -8.181 -7.749 -4.886 772 H VAL 133 H VAL 133 -6.617 -5.828 -4.282 773 HA VAL 133 HA VAL 133 -6.124 -4.550 -6.827 774 HB VAL 133 HB VAL 133 -6.914 -3.398 -4.149 775 HG11 VAL 133 1HG1 VAL 133 -6.755 -2.047 -6.841 776 HG12 VAL 133 2HG1 VAL 133 -5.698 -1.741 -5.463 777 HG13 VAL 133 3HG1 VAL 133 -7.411 -1.338 -5.366 778 HG21 VAL 133 1HG2 VAL 133 -9.092 -3.071 -5.319 779 HG22 VAL 133 2HG2 VAL 133 -8.653 -4.759 -5.067 780 HG23 VAL 133 3HG2 VAL 133 -8.458 -4.024 -6.658 781 H PHE 134 H PHE 134 -4.670 -4.545 -3.619 782 HA PHE 134 HA PHE 134 -2.472 -2.861 -4.439 783 HB2 PHE 134 1HB PHE 134 -3.031 -4.315 -1.847 784 HB3 PHE 134 2HB PHE 134 -1.631 -3.284 -2.116 785 HD1 PHE 134 HD1 PHE 134 -5.171 -3.384 -1.379 786 HD2 PHE 134 HD2 PHE 134 -1.948 -0.855 -2.542 787 HE1 PHE 134 HE1 PHE 134 -6.505 -1.408 -0.777 788 HE2 PHE 134 HE2 PHE 134 -3.278 1.125 -1.934 789 HZ PHE 134 HZ PHE 134 -5.561 0.851 -1.054 790 H ARG 135 H ARG 135 -3.000 -5.382 -5.720 791 HA ARG 135 HA ARG 135 -1.513 -7.563 -4.928 792 HB2 ARG 135 1HB ARG 135 -1.579 -8.251 -7.327 793 HB3 ARG 135 2HB ARG 135 -3.141 -7.751 -6.687 794 HG2 ARG 135 1HG ARG 135 -3.083 -5.708 -7.846 795 HG3 ARG 135 2HG ARG 135 -1.363 -5.870 -8.207 796 HD2 ARG 135 1HD ARG 135 -3.542 -7.659 -9.283 797 HD3 ARG 135 2HD ARG 135 -2.797 -6.326 -10.166 798 HE ARG 135 HE ARG 135 -1.581 -8.898 -9.512 799 HH11 ARG 135 1HH1 ARG 135 -1.223 -5.691 -10.864 800 HH12 ARG 135 2HH1 ARG 135 0.249 -6.066 -11.705 801 HH21 ARG 135 1HH2 ARG 135 0.334 -9.411 -10.636 802 HH22 ARG 135 2HH2 ARG 135 1.109 -8.202 -11.612 803 H PHE 136 H PHE 136 0.440 -8.448 -5.610 804 HA PHE 136 HA PHE 136 2.505 -6.421 -5.984 805 HB2 PHE 136 1HB PHE 136 3.985 -8.530 -5.402 806 HB3 PHE 136 2HB PHE 136 3.174 -7.609 -4.140 807 HD1 PHE 136 HD1 PHE 136 2.662 -10.589 -6.334 808 HD2 PHE 136 HD2 PHE 136 1.863 -8.723 -2.595 809 HE1 PHE 136 HE1 PHE 136 1.556 -12.639 -5.550 810 HE2 PHE 136 HE2 PHE 136 0.751 -10.770 -1.808 811 HZ PHE 136 HZ PHE 136 0.598 -12.730 -3.286 812 H ASP 137 H ASP 137 3.160 -6.095 -7.972 813 HA ASP 137 HA ASP 137 2.837 -7.923 -10.110 814 HB2 ASP 137 1HB ASP 137 4.677 -5.522 -9.897 815 HB3 ASP 137 2HB ASP 137 4.280 -6.374 -11.385 816 H ASP 138 H ASP 138 4.198 -9.420 -10.953 817 HA ASP 138 HA ASP 138 6.103 -10.551 -9.209 818 HB2 ASP 138 1HB ASP 138 6.426 -12.252 -10.839 819 HB3 ASP 138 2HB ASP 138 4.730 -11.799 -10.939 820 H ALA 139 H ALA 139 6.386 -7.965 -11.322 821 HA ALA 139 HA ALA 139 9.065 -8.211 -12.166 822 HB1 ALA 139 1HB ALA 139 7.519 -6.564 -13.115 823 HB2 ALA 139 2HB ALA 139 8.987 -5.795 -12.512 824 HB3 ALA 139 3HB ALA 139 7.493 -5.702 -11.577 825 H ASN 140 H ASN 140 7.587 -7.245 -9.166 826 HA ASN 140 HA ASN 140 10.172 -6.431 -8.062 827 HB2 ASN 140 1HB ASN 140 7.330 -6.103 -7.113 828 HB3 ASN 140 2HB ASN 140 8.695 -5.832 -6.037 829 HD21 ASN 140 1HD2 ASN 140 10.375 -4.724 -8.161 830 HD22 ASN 140 2HD2 ASN 140 9.762 -3.137 -8.470 831 H LEU 141 H LEU 141 8.864 -9.243 -8.588 832 HA LEU 141 HA LEU 141 9.594 -10.344 -5.958 833 HB2 LEU 141 1HB LEU 141 7.544 -11.470 -7.863 834 HB3 LEU 141 2HB LEU 141 7.992 -12.148 -6.312 835 HG LEU 141 HG LEU 141 6.552 -9.529 -6.756 836 HD11 LEU 141 1HD1 LEU 141 4.681 -10.709 -5.673 837 HD12 LEU 141 2HD1 LEU 141 5.632 -12.191 -5.678 838 HD13 LEU 141 3HD1 LEU 141 5.149 -11.446 -7.202 839 HD21 LEU 141 1HD2 LEU 141 7.984 -9.396 -4.793 840 HD22 LEU 141 2HD2 LEU 141 7.334 -10.923 -4.195 841 HD23 LEU 141 3HD2 LEU 141 6.290 -9.508 -4.313 842 H VAL 142 H VAL 142 11.607 -11.148 -6.313 843 HA VAL 142 HA VAL 142 12.457 -12.345 -8.707 844 HB VAL 142 HB VAL 142 14.109 -11.617 -7.108 845 HG11 VAL 142 1HG1 VAL 142 14.484 -12.814 -4.983 846 HG12 VAL 142 2HG1 VAL 142 12.993 -13.715 -5.258 847 HG13 VAL 142 3HG1 VAL 142 12.940 -11.968 -5.032 848 HG21 VAL 142 1HG2 VAL 142 14.746 -13.442 -8.583 849 HG22 VAL 142 2HG2 VAL 142 14.176 -14.617 -7.395 850 HG23 VAL 142 3HG2 VAL 142 15.556 -13.584 -7.022 851 HA PRO 143 HA PRO 143 10.026 -16.027 -8.378 852 HB2 PRO 143 1HB PRO 143 10.855 -17.207 -10.662 853 HB3 PRO 143 2HB PRO 143 9.750 -15.832 -10.651 854 HG2 PRO 143 1HG PRO 143 12.683 -15.902 -11.188 855 HG3 PRO 143 2HG PRO 143 11.417 -14.956 -11.990 856 HD2 PRO 143 1HD PRO 143 13.100 -13.946 -10.073 857 HD3 PRO 143 2HD PRO 143 11.479 -13.305 -10.401 858 H ARG 144 H ARG 144 10.329 -17.954 -7.447 859 HA ARG 144 HA ARG 144 13.073 -19.028 -7.342 860 HB2 ARG 144 1HB ARG 144 10.885 -19.273 -5.260 861 HB3 ARG 144 2HB ARG 144 12.478 -19.998 -5.157 862 HG2 ARG 144 1HG ARG 144 11.996 -17.033 -5.307 863 HG3 ARG 144 2HG ARG 144 12.174 -17.933 -3.801 864 HD2 ARG 144 1HD ARG 144 14.230 -17.652 -5.994 865 HD3 ARG 144 2HD ARG 144 14.280 -16.916 -4.394 866 HE ARG 144 HE ARG 144 14.106 -19.785 -4.344 867 HH11 ARG 144 1HH1 ARG 144 16.259 -17.025 -4.429 868 HH12 ARG 144 2HH1 ARG 144 17.641 -17.928 -3.890 869 HH21 ARG 144 1HH2 ARG 144 15.913 -20.965 -3.616 870 HH22 ARG 144 2HH2 ARG 144 17.439 -20.167 -3.418 871 H GLY 145 H GLY 145 12.935 -20.512 -9.019 872 HA2 GLY 145 1HA GLY 145 12.491 -22.608 -9.877 873 HA3 GLY 145 2HA GLY 145 11.535 -22.941 -8.438 874 H SER 146 H SER 146 10.344 -24.017 -10.391 875 HA SER 146 HA SER 146 8.490 -22.107 -11.623 876 HB2 SER 146 1HB SER 146 8.846 -25.064 -12.179 877 HB3 SER 146 2HB SER 146 7.905 -23.917 -13.137 878 HG SER 146 HG SER 146 10.080 -22.767 -13.243 879 H GLY 147 H GLY 147 6.537 -21.825 -10.756 880 HA2 GLY 147 1HA GLY 147 4.457 -22.459 -9.931 881 HA3 GLY 147 2HA GLY 147 5.080 -24.077 -9.665 882 H LEU 148 H LEU 148 7.277 -22.028 -8.340 883 HA LEU 148 HA LEU 148 6.109 -22.412 -5.675 884 HB2 LEU 148 1HB LEU 148 8.971 -21.779 -6.408 885 HB3 LEU 148 2HB LEU 148 8.373 -22.194 -4.815 886 HG LEU 148 HG LEU 148 8.397 -24.062 -7.191 887 HD11 LEU 148 1HD1 LEU 148 10.194 -23.960 -4.770 888 HD12 LEU 148 2HD1 LEU 148 10.656 -23.548 -6.421 889 HD13 LEU 148 3HD1 LEU 148 10.209 -25.205 -6.019 890 HD21 LEU 148 1HD2 LEU 148 7.934 -25.783 -5.466 891 HD22 LEU 148 2HD2 LEU 148 6.619 -24.632 -5.679 892 HD23 LEU 148 3HD2 LEU 148 7.698 -24.492 -4.289 893 H GLU 149 H GLU 149 4.771 -20.590 -5.631 894 HA GLU 149 HA GLU 149 6.140 -17.993 -5.776 895 HB2 GLU 149 1HB GLU 149 3.179 -18.630 -5.800 896 HB3 GLU 149 2HB GLU 149 3.862 -17.013 -5.882 897 HG2 GLU 149 1HG GLU 149 4.903 -17.527 -8.006 898 HG3 GLU 149 2HG GLU 149 4.315 -19.186 -7.917 899 H HIS 150 H HIS 150 3.727 -19.709 -3.791 900 HA HIS 150 HA HIS 150 4.994 -18.557 -1.417 901 HB2 HIS 150 1HB HIS 150 2.020 -18.488 -1.968 902 HB3 HIS 150 2HB HIS 150 2.735 -18.180 -0.391 903 HD1 HIS 150 HD1 HIS 150 1.724 -16.516 -3.437 904 HD2 HIS 150 HD2 HIS 150 4.509 -15.825 -0.431 905 HE1 HIS 150 HE1 HIS 150 2.348 -14.088 -3.640 906 HE2 HIS 150 HE2 HIS 150 4.127 -13.726 -1.893 907 H HIS 151 H HIS 151 5.874 -20.744 -1.469 908 HA HIS 151 HA HIS 151 3.962 -22.772 -0.547 909 HB2 HIS 151 1HB HIS 151 6.742 -23.021 -1.693 910 HB3 HIS 151 2HB HIS 151 5.908 -24.364 -0.920 911 HD1 HIS 151 HD1 HIS 151 4.855 -25.849 -2.583 912 HD2 HIS 151 HD2 HIS 151 4.851 -21.884 -3.828 913 HE1 HIS 151 HE1 HIS 151 3.764 -25.850 -4.848 914 HE2 HIS 151 HE2 HIS 151 3.882 -23.459 -5.636 915 H HIS 152 H HIS 152 3.734 -22.803 1.534 916 HA HIS 152 HA HIS 152 5.777 -23.384 3.354 917 HB2 HIS 152 1HB HIS 152 6.416 -21.005 2.970 918 HB3 HIS 152 2HB HIS 152 4.815 -20.512 3.508 919 HD1 HIS 152 HD1 HIS 152 4.797 -19.760 5.860 920 HD2 HIS 152 HD2 HIS 152 7.704 -22.655 5.192 921 HE1 HIS 152 HE1 HIS 152 5.981 -20.058 8.059 922 HE2 HIS 152 HE2 HIS 152 7.634 -21.911 7.664 923 H HIS 153 H HIS 153 2.633 -21.984 2.733 924 HA HIS 153 HA HIS 153 1.623 -22.923 5.301 925 HB2 HIS 153 1HB HIS 153 0.964 -20.672 4.583 926 HB3 HIS 153 2HB HIS 153 0.259 -21.334 3.113 927 HD1 HIS 153 HD1 HIS 153 -0.358 -20.963 6.775 928 HD2 HIS 153 HD2 HIS 153 -2.245 -22.578 3.447 929 HE1 HIS 153 HE1 HIS 153 -2.710 -21.451 7.506 930 HE2 HIS 153 HE2 HIS 153 -3.878 -22.263 5.430 931 H HIS 154 H HIS 154 0.588 -24.768 5.526 932 HA HIS 154 HA HIS 154 -1.122 -25.759 3.418 933 HB2 HIS 154 1HB HIS 154 -0.183 -28.088 3.599 934 HB3 HIS 154 2HB HIS 154 0.863 -26.936 2.786 935 HD1 HIS 154 HD1 HIS 154 3.211 -26.868 3.565 936 HD2 HIS 154 HD2 HIS 154 0.690 -28.588 6.391 937 HE1 HIS 154 HE1 HIS 154 4.720 -27.742 5.374 938 HE2 HIS 154 HE2 HIS 154 3.187 -28.897 7.004 939 H HIS 155 H HIS 155 -2.553 -27.497 4.221 940 HA HIS 155 HA HIS 155 -3.378 -26.806 6.902 941 HB2 HIS 155 1HB HIS 155 -5.044 -27.021 5.103 942 HB3 HIS 155 2HB HIS 155 -4.614 -28.716 4.905 943 HD1 HIS 155 HD1 HIS 155 -6.094 -30.285 6.104 944 HD2 HIS 155 HD2 HIS 155 -6.050 -26.534 7.896 945 HE1 HIS 155 HE1 HIS 155 -7.748 -30.418 7.991 946 HE2 HIS 155 HE2 HIS 155 -7.609 -28.183 9.140 Start of MODEL 4 1 H1 MET 24 1H MET 24 -21.351 -13.581 -2.373 2 H2 MET 24 2H MET 24 -20.715 -12.786 -1.026 3 H3 MET 24 3H MET 24 -21.575 -14.230 -0.827 4 HA MET 24 HA MET 24 -19.222 -14.601 -0.593 5 HB2 MET 24 1HB MET 24 -18.977 -16.412 -2.246 6 HB3 MET 24 2HB MET 24 -20.558 -16.425 -1.482 7 HG2 MET 24 1HG MET 24 -21.514 -15.350 -3.461 8 HG3 MET 24 2HG MET 24 -19.927 -15.358 -4.225 9 HE1 MET 24 1HE MET 24 -18.806 -18.221 -3.273 10 HE2 MET 24 2HE MET 24 -18.629 -17.572 -4.902 11 HE3 MET 24 3HE MET 24 -19.268 -19.198 -4.665 12 H GLU 25 H GLU 25 -20.082 -13.056 -3.651 13 HA GLU 25 HA GLU 25 -17.284 -12.807 -4.385 14 HB2 GLU 25 1HB GLU 25 -19.785 -11.803 -5.759 15 HB3 GLU 25 2HB GLU 25 -18.156 -11.669 -6.406 16 HG2 GLU 25 1HG GLU 25 -19.684 -14.207 -5.883 17 HG3 GLU 25 2HG GLU 25 -19.306 -13.500 -7.451 18 H ASN 26 H ASN 26 -16.113 -10.960 -4.302 19 HA ASN 26 HA ASN 26 -17.440 -8.585 -3.179 20 HB2 ASN 26 1HB ASN 26 -15.343 -8.125 -1.909 21 HB3 ASN 26 2HB ASN 26 -16.156 -9.598 -1.398 22 HD21 ASN 26 1HD2 ASN 26 -15.228 -11.591 -1.873 23 HD22 ASN 26 2HD2 ASN 26 -13.569 -11.743 -2.336 24 H TYR 27 H TYR 27 -17.044 -9.085 -5.913 25 HA TYR 27 HA TYR 27 -14.627 -8.031 -6.921 26 HB2 TYR 27 1HB TYR 27 -16.117 -9.485 -8.247 27 HB3 TYR 27 2HB TYR 27 -17.317 -8.198 -8.293 28 HD1 TYR 27 HD1 TYR 27 -17.309 -6.704 -10.090 29 HD2 TYR 27 HD2 TYR 27 -13.760 -8.872 -9.186 30 HE1 TYR 27 HE1 TYR 27 -16.233 -5.767 -12.091 31 HE2 TYR 27 HE2 TYR 27 -12.679 -7.942 -11.188 32 HH TYR 27 HH TYR 27 -13.949 -5.318 -12.909 33 H LEU 28 H LEU 28 -17.710 -6.565 -6.104 34 HA LEU 28 HA LEU 28 -17.134 -4.037 -7.295 35 HB2 LEU 28 1HB LEU 28 -19.096 -4.812 -5.130 36 HB3 LEU 28 2HB LEU 28 -19.014 -3.220 -5.855 37 HG LEU 28 HG LEU 28 -19.650 -5.759 -7.365 38 HD11 LEU 28 1HD1 LEU 28 -21.938 -4.914 -7.433 39 HD12 LEU 28 2HD1 LEU 28 -21.471 -3.551 -6.416 40 HD13 LEU 28 3HD1 LEU 28 -21.412 -5.192 -5.771 41 HD21 LEU 28 1HD2 LEU 28 -20.316 -4.226 -9.157 42 HD22 LEU 28 2HD2 LEU 28 -18.609 -4.045 -8.759 43 HD23 LEU 28 3HD2 LEU 28 -19.778 -2.857 -8.186 44 H ARG 29 H ARG 29 -16.759 -5.411 -4.072 45 HA ARG 29 HA ARG 29 -15.753 -3.065 -2.857 46 HB2 ARG 29 1HB ARG 29 -16.633 -4.940 -1.548 47 HB3 ARG 29 2HB ARG 29 -15.317 -5.963 -2.109 48 HG2 ARG 29 1HG ARG 29 -13.712 -4.710 -0.905 49 HG3 ARG 29 2HG ARG 29 -14.874 -3.434 -0.546 50 HD2 ARG 29 1HD ARG 29 -14.590 -4.759 1.426 51 HD3 ARG 29 2HD ARG 29 -16.190 -5.088 0.767 52 HE ARG 29 HE ARG 29 -13.975 -6.909 0.155 53 HH11 ARG 29 1HH1 ARG 29 -17.100 -6.324 1.608 54 HH12 ARG 29 2HH1 ARG 29 -17.353 -7.983 2.047 55 HH21 ARG 29 1HH2 ARG 29 -14.304 -9.110 0.741 56 HH22 ARG 29 2HH2 ARG 29 -15.778 -9.570 1.524 57 H LYS 30 H LYS 30 -14.252 -5.690 -4.655 58 HA LYS 30 HA LYS 30 -11.565 -5.077 -4.215 59 HB2 LYS 30 1HB LYS 30 -12.974 -6.217 -6.623 60 HB3 LYS 30 2HB LYS 30 -11.232 -6.007 -6.575 61 HG2 LYS 30 1HG LYS 30 -11.056 -7.532 -4.720 62 HG3 LYS 30 2HG LYS 30 -12.813 -7.678 -4.632 63 HD2 LYS 30 1HD LYS 30 -12.807 -8.592 -6.932 64 HD3 LYS 30 2HD LYS 30 -11.047 -8.520 -6.926 65 HE2 LYS 30 1HE LYS 30 -12.618 -10.049 -4.870 66 HE3 LYS 30 2HE LYS 30 -12.094 -10.766 -6.392 67 HZ1 LYS 30 1HZ LYS 30 -10.509 -11.270 -4.708 68 HZ2 LYS 30 2HZ LYS 30 -10.353 -9.647 -4.267 69 HZ3 LYS 30 3HZ LYS 30 -9.797 -10.170 -5.781 70 H ALA 31 H ALA 31 -13.768 -3.872 -6.764 71 HA ALA 31 HA ALA 31 -11.971 -2.145 -7.987 72 HB1 ALA 31 1HB ALA 31 -14.093 -2.833 -8.970 73 HB2 ALA 31 2HB ALA 31 -13.934 -1.077 -8.947 74 HB3 ALA 31 3HB ALA 31 -14.962 -1.884 -7.763 75 H ALA 32 H ALA 32 -13.785 -1.773 -5.044 76 HA ALA 32 HA ALA 32 -13.670 1.025 -4.790 77 HB1 ALA 32 1HB ALA 32 -15.064 -0.379 -3.346 78 HB2 ALA 32 2HB ALA 32 -13.997 0.659 -2.399 79 HB3 ALA 32 3HB ALA 32 -13.614 -1.051 -2.599 80 H LEU 33 H LEU 33 -11.436 -1.526 -3.756 81 HA LEU 33 HA LEU 33 -9.478 0.258 -2.732 82 HB2 LEU 33 1HB LEU 33 -9.252 -2.594 -3.696 83 HB3 LEU 33 2HB LEU 33 -7.904 -1.699 -3.019 84 HG LEU 33 HG LEU 33 -8.592 -2.875 -1.187 85 HD11 LEU 33 1HD1 LEU 33 -9.755 -1.433 0.342 86 HD12 LEU 33 2HD1 LEU 33 -10.405 -0.485 -0.993 87 HD13 LEU 33 3HD1 LEU 33 -8.673 -0.471 -0.665 88 HD21 LEU 33 1HD2 LEU 33 -10.447 -4.009 -2.220 89 HD22 LEU 33 2HD2 LEU 33 -11.437 -2.553 -2.103 90 HD23 LEU 33 3HD2 LEU 33 -10.929 -3.392 -0.641 91 H THR 34 H THR 34 -10.155 -1.073 -5.901 92 HA THR 34 HA THR 34 -7.840 -0.286 -7.249 93 HB THR 34 HB THR 34 -10.677 -0.268 -8.317 94 HG1 THR 34 HG1 THR 34 -8.695 -2.322 -8.236 95 HG21 THR 34 1HG2 THR 34 -8.035 -0.468 -9.767 96 HG22 THR 34 2HG2 THR 34 -9.097 0.941 -9.750 97 HG23 THR 34 3HG2 THR 34 -9.632 -0.560 -10.509 98 H ASP 35 H ASP 35 -10.833 1.494 -6.560 99 HA ASP 35 HA ASP 35 -10.047 3.881 -7.866 100 HB2 ASP 35 1HB ASP 35 -12.129 3.305 -5.763 101 HB3 ASP 35 2HB ASP 35 -11.864 4.925 -6.400 102 H MET 36 H MET 36 -9.735 2.730 -4.545 103 HA MET 36 HA MET 36 -8.716 5.167 -3.510 104 HB2 MET 36 1HB MET 36 -9.588 3.401 -2.038 105 HB3 MET 36 2HB MET 36 -8.246 2.357 -2.492 106 HG2 MET 36 1HG MET 36 -7.863 3.397 -0.330 107 HG3 MET 36 2HG MET 36 -6.670 3.922 -1.521 108 HE1 MET 36 1HE MET 36 -5.844 6.043 -0.310 109 HE2 MET 36 2HE MET 36 -6.807 5.545 1.082 110 HE3 MET 36 3HE MET 36 -6.904 7.204 0.491 111 H LEU 37 H LEU 37 -7.161 2.302 -4.889 112 HA LEU 37 HA LEU 37 -4.492 3.127 -4.532 113 HB2 LEU 37 1HB LEU 37 -5.147 0.842 -5.151 114 HB3 LEU 37 2HB LEU 37 -5.707 1.424 -6.715 115 HG LEU 37 HG LEU 37 -3.275 2.196 -7.082 116 HD11 LEU 37 1HD1 LEU 37 -2.833 0.205 -4.858 117 HD12 LEU 37 2HD1 LEU 37 -2.529 1.940 -4.765 118 HD13 LEU 37 3HD1 LEU 37 -1.583 0.939 -5.865 119 HD21 LEU 37 1HD2 LEU 37 -3.901 -0.748 -6.942 120 HD22 LEU 37 2HD2 LEU 37 -2.647 0.009 -7.926 121 HD23 LEU 37 3HD2 LEU 37 -4.348 0.338 -8.258 122 H GLN 38 H GLN 38 -6.821 3.684 -7.133 123 HA GLN 38 HA GLN 38 -5.076 5.138 -8.817 124 HB2 GLN 38 1HB GLN 38 -8.084 5.099 -8.613 125 HB3 GLN 38 2HB GLN 38 -7.210 5.993 -9.849 126 HG2 GLN 38 1HG GLN 38 -7.153 3.016 -9.416 127 HG3 GLN 38 2HG GLN 38 -7.969 3.875 -10.722 128 HE21 GLN 38 1HE2 GLN 38 -5.850 1.835 -10.785 129 HE22 GLN 38 2HE2 GLN 38 -4.552 2.536 -11.687 130 H THR 39 H THR 39 -6.870 5.996 -5.992 131 HA THR 39 HA THR 39 -6.610 8.833 -6.318 132 HB THR 39 HB THR 39 -7.054 7.234 -3.785 133 HG1 THR 39 HG1 THR 39 -8.657 6.938 -5.488 134 HG21 THR 39 1HG2 THR 39 -8.026 9.315 -2.914 135 HG22 THR 39 2HG2 THR 39 -7.602 10.140 -4.414 136 HG23 THR 39 3HG2 THR 39 -6.331 9.536 -3.351 137 H PHE 40 H PHE 40 -4.714 6.262 -4.867 138 HA PHE 40 HA PHE 40 -2.809 7.943 -3.590 139 HB2 PHE 40 1HB PHE 40 -3.080 5.655 -2.843 140 HB3 PHE 40 2HB PHE 40 -2.653 5.046 -4.438 141 HD1 PHE 40 HD1 PHE 40 -1.191 7.329 -1.856 142 HD2 PHE 40 HD2 PHE 40 -0.546 4.191 -4.662 143 HE1 PHE 40 HE1 PHE 40 1.174 7.226 -1.192 144 HE2 PHE 40 HE2 PHE 40 1.819 4.085 -4.005 145 HZ PHE 40 HZ PHE 40 2.687 5.606 -2.270 146 H VAL 41 H VAL 41 -3.090 6.549 -6.786 147 HA VAL 41 HA VAL 41 -0.553 6.691 -7.769 148 HB VAL 41 HB VAL 41 -3.134 7.247 -9.212 149 HG11 VAL 41 1HG1 VAL 41 -1.317 8.325 -10.433 150 HG12 VAL 41 2HG1 VAL 41 -1.903 6.904 -11.297 151 HG13 VAL 41 3HG1 VAL 41 -0.392 6.826 -10.391 152 HG21 VAL 41 1HG2 VAL 41 -2.878 5.004 -8.299 153 HG22 VAL 41 2HG2 VAL 41 -1.321 4.842 -9.112 154 HG23 VAL 41 3HG2 VAL 41 -2.801 4.979 -10.061 155 HA PRO 42 HA PRO 42 -1.066 11.381 -9.076 156 HB2 PRO 42 1HB PRO 42 -2.935 12.293 -6.970 157 HB3 PRO 42 2HB PRO 42 -2.832 12.768 -8.669 158 HG2 PRO 42 1HG PRO 42 -4.789 11.175 -7.780 159 HG3 PRO 42 2HG PRO 42 -4.077 10.965 -9.388 160 HD2 PRO 42 1HD PRO 42 -3.653 9.378 -6.899 161 HD3 PRO 42 2HD PRO 42 -3.715 8.841 -8.587 162 H TYR 43 H TYR 43 -1.380 10.322 -5.682 163 HA TYR 43 HA TYR 43 0.220 12.460 -4.672 164 HB2 TYR 43 1HB TYR 43 -0.645 9.824 -3.472 165 HB3 TYR 43 2HB TYR 43 0.335 11.003 -2.601 166 HD1 TYR 43 HD1 TYR 43 -0.639 13.317 -2.193 167 HD2 TYR 43 HD2 TYR 43 -2.993 10.048 -3.575 168 HE1 TYR 43 HE1 TYR 43 -2.679 14.484 -1.473 169 HE2 TYR 43 HE2 TYR 43 -5.033 11.210 -2.859 170 HH TYR 43 HH TYR 43 -5.109 14.475 -2.063 171 H ARG 44 H ARG 44 0.873 9.325 -6.019 172 HA ARG 44 HA ARG 44 3.392 8.785 -4.962 173 HB2 ARG 44 1HB ARG 44 2.512 8.278 -7.802 174 HB3 ARG 44 2HB ARG 44 3.849 7.497 -6.980 175 HG2 ARG 44 1HG ARG 44 2.279 6.470 -5.415 176 HG3 ARG 44 2HG ARG 44 0.940 7.234 -6.281 177 HD2 ARG 44 1HD ARG 44 2.863 5.148 -7.304 178 HD3 ARG 44 2HD ARG 44 1.110 5.011 -7.139 179 HE ARG 44 HE ARG 44 1.597 7.134 -8.867 180 HH11 ARG 44 1HH1 ARG 44 2.093 3.666 -8.805 181 HH12 ARG 44 2HH1 ARG 44 2.118 3.513 -10.532 182 HH21 ARG 44 1HH2 ARG 44 1.634 6.938 -11.133 183 HH22 ARG 44 2HH2 ARG 44 1.849 5.375 -11.860 184 H THR 45 H THR 45 2.554 10.596 -7.895 185 HA THR 45 HA THR 45 5.030 11.375 -8.736 186 HB THR 45 HB THR 45 2.629 13.201 -8.708 187 HG1 THR 45 HG1 THR 45 2.500 11.965 -10.922 188 HG21 THR 45 1HG2 THR 45 4.718 14.185 -9.554 189 HG22 THR 45 2HG2 THR 45 3.522 13.995 -10.834 190 HG23 THR 45 3HG2 THR 45 4.866 12.861 -10.710 191 H ALA 46 H ALA 46 3.066 12.918 -6.219 192 HA ALA 46 HA ALA 46 4.871 15.042 -5.669 193 HB1 ALA 46 1HB ALA 46 3.588 15.315 -3.594 194 HB2 ALA 46 2HB ALA 46 2.790 13.768 -3.888 195 HB3 ALA 46 3HB ALA 46 2.526 15.119 -4.989 196 H VAL 47 H VAL 47 4.396 11.835 -4.405 197 HA VAL 47 HA VAL 47 6.295 11.906 -2.318 198 HB VAL 47 HB VAL 47 5.239 9.559 -3.907 199 HG11 VAL 47 1HG1 VAL 47 7.408 9.002 -2.920 200 HG12 VAL 47 2HG1 VAL 47 6.094 8.126 -2.131 201 HG13 VAL 47 3HG1 VAL 47 6.822 9.526 -1.340 202 HG21 VAL 47 1HG2 VAL 47 4.523 10.628 -1.179 203 HG22 VAL 47 2HG2 VAL 47 3.873 9.156 -1.901 204 HG23 VAL 47 3HG2 VAL 47 3.531 10.723 -2.633 205 H GLU 48 H GLU 48 6.549 11.093 -5.746 206 HA GLU 48 HA GLU 48 9.157 10.058 -5.719 207 HB2 GLU 48 1HB GLU 48 7.739 11.551 -7.937 208 HB3 GLU 48 2HB GLU 48 9.216 10.625 -8.132 209 HG2 GLU 48 1HG GLU 48 8.014 8.592 -7.472 210 HG3 GLU 48 2HG GLU 48 6.529 9.537 -7.333 211 H LEU 49 H LEU 49 7.981 13.370 -6.147 212 HA LEU 49 HA LEU 49 10.470 14.560 -6.677 213 HB2 LEU 49 1HB LEU 49 7.841 15.543 -5.686 214 HB3 LEU 49 2HB LEU 49 9.229 16.599 -5.505 215 HG LEU 49 HG LEU 49 7.987 17.146 -7.526 216 HD11 LEU 49 1HD1 LEU 49 10.436 17.423 -7.499 217 HD12 LEU 49 2HD1 LEU 49 9.790 17.130 -9.114 218 HD13 LEU 49 3HD1 LEU 49 10.599 15.830 -8.240 219 HD21 LEU 49 1HD2 LEU 49 7.001 14.962 -7.984 220 HD22 LEU 49 2HD2 LEU 49 8.590 14.335 -8.425 221 HD23 LEU 49 3HD2 LEU 49 7.837 15.596 -9.401 222 H CYS 50 H CYS 50 8.744 14.055 -3.636 223 HA CYS 50 HA CYS 50 10.744 15.208 -1.984 224 HB2 CYS 50 1HB CYS 50 8.543 15.009 -1.099 225 HB3 CYS 50 2HB CYS 50 8.482 13.285 -1.447 226 H ALA 51 H ALA 51 10.246 12.019 -3.313 227 HA ALA 51 HA ALA 51 11.994 10.631 -1.514 228 HB1 ALA 51 1HB ALA 51 10.180 9.473 -2.695 229 HB2 ALA 51 2HB ALA 51 11.751 8.742 -3.021 230 HB3 ALA 51 3HB ALA 51 10.994 9.778 -4.230 231 H LEU 52 H LEU 52 12.294 12.103 -4.682 232 HA LEU 52 HA LEU 52 14.942 11.037 -5.110 233 HB2 LEU 52 1HB LEU 52 13.315 11.387 -6.958 234 HB3 LEU 52 2HB LEU 52 13.412 13.115 -6.681 235 HG LEU 52 HG LEU 52 15.796 13.074 -7.303 236 HD11 LEU 52 1HD1 LEU 52 15.267 10.165 -7.897 237 HD12 LEU 52 2HD1 LEU 52 16.365 10.807 -6.676 238 HD13 LEU 52 3HD1 LEU 52 16.707 11.054 -8.387 239 HD21 LEU 52 1HD2 LEU 52 15.452 12.710 -9.688 240 HD22 LEU 52 2HD2 LEU 52 14.078 13.557 -8.975 241 HD23 LEU 52 3HD2 LEU 52 13.959 11.837 -9.349 242 H GLU 53 H GLU 53 13.530 13.901 -3.806 243 HA GLU 53 HA GLU 53 15.599 15.739 -4.227 244 HB2 GLU 53 1HB GLU 53 13.327 16.340 -3.463 245 HB3 GLU 53 2HB GLU 53 13.664 15.601 -1.906 246 HG2 GLU 53 1HG GLU 53 13.863 18.033 -1.835 247 HG3 GLU 53 2HG GLU 53 15.393 17.236 -1.467 248 H HIS 54 H HIS 54 15.031 13.467 -1.586 249 HA HIS 54 HA HIS 54 17.714 14.122 -0.539 250 HB2 HIS 54 1HB HIS 54 15.319 12.951 0.891 251 HB3 HIS 54 2HB HIS 54 16.923 13.086 1.605 252 HD1 HIS 54 HD1 HIS 54 17.486 15.258 2.711 253 HD2 HIS 54 HD2 HIS 54 14.117 15.535 0.292 254 HE1 HIS 54 HE1 HIS 54 16.539 17.546 3.131 255 HE2 HIS 54 HE2 HIS 54 14.466 17.673 1.707 256 H GLY 55 H GLY 55 15.875 11.781 -2.127 257 HA2 GLY 55 1HA GLY 55 16.597 9.822 -3.099 258 HA3 GLY 55 2HA GLY 55 18.069 9.901 -2.140 259 H GLY 56 H GLY 56 16.565 10.233 0.389 260 HA2 GLY 56 1HA GLY 56 15.067 7.720 0.468 261 HA3 GLY 56 2HA GLY 56 15.766 8.528 1.862 262 H LEU 57 H LEU 57 13.083 7.538 1.450 263 HA LEU 57 HA LEU 57 11.283 9.730 1.142 264 HB2 LEU 57 1HB LEU 57 10.963 6.957 2.267 265 HB3 LEU 57 2HB LEU 57 9.643 8.106 2.166 266 HG LEU 57 HG LEU 57 11.208 7.278 -0.265 267 HD11 LEU 57 1HD1 LEU 57 9.483 5.639 -0.725 268 HD12 LEU 57 2HD1 LEU 57 8.688 6.014 0.803 269 HD13 LEU 57 3HD1 LEU 57 10.286 5.266 0.801 270 HD21 LEU 57 1HD2 LEU 57 8.469 8.458 0.155 271 HD22 LEU 57 2HD2 LEU 57 9.140 7.976 -1.401 272 HD23 LEU 57 3HD2 LEU 57 9.882 9.290 -0.491 273 H ASP 58 H ASP 58 13.435 9.145 3.519 274 HA ASP 58 HA ASP 58 12.106 9.221 5.931 275 HB2 ASP 58 1HB ASP 58 14.495 8.846 5.792 276 HB3 ASP 58 2HB ASP 58 14.750 10.488 5.213 277 H THR 59 H THR 59 12.692 11.883 3.710 278 HA THR 59 HA THR 59 11.766 13.824 5.654 279 HB THR 59 HB THR 59 12.093 15.436 3.733 280 HG1 THR 59 HG1 THR 59 11.907 13.776 2.069 281 HG21 THR 59 1HG2 THR 59 13.807 15.084 5.441 282 HG22 THR 59 2HG2 THR 59 14.544 15.337 3.859 283 HG23 THR 59 3HG2 THR 59 14.438 13.710 4.534 284 H CYS 60 H CYS 60 10.223 11.663 3.724 285 HA CYS 60 HA CYS 60 8.194 13.469 2.691 286 HB2 CYS 60 1HB CYS 60 8.480 10.471 2.414 287 HB3 CYS 60 2HB CYS 60 7.328 11.481 1.542 288 H ASP 61 H ASP 61 7.706 13.985 5.012 289 HA ASP 61 HA ASP 61 5.943 11.990 6.255 290 HB2 ASP 61 1HB ASP 61 7.752 12.906 7.657 291 HB3 ASP 61 2HB ASP 61 7.127 14.532 7.399 292 H GLY 62 H GLY 62 3.814 12.394 6.632 293 HA2 GLY 62 1HA GLY 62 2.501 14.124 4.824 294 HA3 GLY 62 2HA GLY 62 1.736 13.226 6.127 295 H GLY 63 H GLY 63 2.532 16.259 4.971 296 HA2 GLY 63 1HA GLY 63 1.449 18.139 6.128 297 HA3 GLY 63 2HA GLY 63 2.076 17.464 7.628 298 H SER 64 H SER 64 4.474 16.943 5.488 299 HA SER 64 HA SER 64 5.636 19.614 5.800 300 HB2 SER 64 1HB SER 64 7.755 18.623 6.558 301 HB3 SER 64 2HB SER 64 6.442 18.237 7.666 302 HG SER 64 HG SER 64 6.289 16.235 6.244 303 H ASN 65 H ASN 65 7.681 19.837 4.475 304 HA ASN 65 HA ASN 65 8.701 19.865 2.450 305 HB2 ASN 65 1HB ASN 65 8.188 16.917 2.790 306 HB3 ASN 65 2HB ASN 65 9.041 17.552 1.388 307 HD21 ASN 65 1HD2 ASN 65 9.163 17.105 4.855 308 HD22 ASN 65 2HD2 ASN 65 10.860 17.407 5.026 309 H GLY 66 H GLY 66 5.950 20.522 2.381 310 HA2 GLY 66 1HA GLY 66 4.522 21.162 0.679 311 HA3 GLY 66 2HA GLY 66 5.547 20.291 -0.456 312 H ILE 67 H ILE 67 4.932 18.117 1.881 313 HA ILE 67 HA ILE 67 2.892 16.823 0.289 314 HB ILE 67 HB ILE 67 4.393 15.863 2.735 315 HG12 ILE 67 1HG1 ILE 67 4.742 15.257 -0.207 316 HG13 ILE 67 2HG1 ILE 67 5.847 16.192 0.798 317 HG21 ILE 67 1HG2 ILE 67 2.612 14.327 0.842 318 HG22 ILE 67 2HG2 ILE 67 2.223 14.752 2.510 319 HG23 ILE 67 3HG2 ILE 67 3.549 13.640 2.168 320 HD11 ILE 67 1HD1 ILE 67 5.210 13.269 1.098 321 HD12 ILE 67 2HD1 ILE 67 6.291 14.197 2.138 322 HD13 ILE 67 3HD1 ILE 67 6.693 13.959 0.437 323 HA PRO 68 HA PRO 68 -0.417 18.405 2.815 324 HB2 PRO 68 1HB PRO 68 -1.854 16.002 1.838 325 HB3 PRO 68 2HB PRO 68 -2.300 17.707 1.713 326 HG2 PRO 68 1HG PRO 68 -1.436 16.357 -0.416 327 HG3 PRO 68 2HG PRO 68 -0.980 18.057 -0.154 328 HD2 PRO 68 1HD PRO 68 0.617 15.562 0.312 329 HD3 PRO 68 2HD PRO 68 1.140 17.129 -0.354 330 H SER 69 H SER 69 -1.880 17.625 4.533 331 HA SER 69 HA SER 69 -0.405 15.855 6.292 332 HB2 SER 69 1HB SER 69 -2.065 16.629 7.986 333 HB3 SER 69 2HB SER 69 -1.223 17.965 7.202 334 HG SER 69 HG SER 69 -3.093 18.667 6.606 335 HA PRO 70 HA PRO 70 -2.906 12.313 5.519 336 HB2 PRO 70 1HB PRO 70 -2.999 11.203 8.027 337 HB3 PRO 70 2HB PRO 70 -1.624 11.060 6.929 338 HG2 PRO 70 1HG PRO 70 -2.022 12.918 9.232 339 HG3 PRO 70 2HG PRO 70 -0.562 12.041 8.738 340 HD2 PRO 70 1HD PRO 70 -0.909 14.663 8.196 341 HD3 PRO 70 2HD PRO 70 -0.049 13.578 7.084 342 H THR 71 H THR 71 -4.985 12.285 5.214 343 HA THR 71 HA THR 71 -6.806 13.149 7.345 344 HB THR 71 HB THR 71 -6.473 15.061 5.785 345 HG1 THR 71 HG1 THR 71 -8.493 14.834 6.828 346 HG21 THR 71 1HG2 THR 71 -7.683 13.201 3.739 347 HG22 THR 71 2HG2 THR 71 -6.037 13.836 3.729 348 HG23 THR 71 3HG2 THR 71 -7.406 14.928 3.512 349 H THR 72 H THR 72 -9.126 12.611 6.646 350 HA THR 72 HA THR 72 -9.069 9.953 5.388 351 HB THR 72 HB THR 72 -11.056 9.443 6.913 352 HG1 THR 72 HG1 THR 72 -10.072 11.171 8.824 353 HG21 THR 72 1HG2 THR 72 -8.331 9.837 8.152 354 HG22 THR 72 2HG2 THR 72 -8.854 8.435 7.216 355 HG23 THR 72 3HG2 THR 72 -9.601 8.784 8.773 356 H THR 73 H THR 73 -10.250 9.821 3.635 357 HA THR 73 HA THR 73 -12.185 11.821 2.958 358 HB THR 73 HB THR 73 -12.466 10.391 0.894 359 HG1 THR 73 HG1 THR 73 -11.111 8.641 0.637 360 HG21 THR 73 1HG2 THR 73 -10.905 12.269 0.903 361 HG22 THR 73 2HG2 THR 73 -10.251 10.929 -0.036 362 HG23 THR 73 3HG2 THR 73 -9.650 11.238 1.593 363 H ARG 74 H ARG 74 -14.293 10.701 1.869 364 HA ARG 74 HA ARG 74 -15.906 10.089 4.026 365 HB2 ARG 74 1HB ARG 74 -16.816 10.924 1.937 366 HB3 ARG 74 2HB ARG 74 -16.333 9.455 1.101 367 HG2 ARG 74 1HG ARG 74 -18.730 9.490 1.565 368 HG3 ARG 74 2HG ARG 74 -17.921 8.164 2.403 369 HD2 ARG 74 1HD ARG 74 -19.592 9.350 3.817 370 HD3 ARG 74 2HD ARG 74 -17.957 9.381 4.482 371 HE ARG 74 HE ARG 74 -18.553 11.683 2.881 372 HH11 ARG 74 1HH1 ARG 74 -18.922 10.284 6.066 373 HH12 ARG 74 2HH1 ARG 74 -19.025 11.817 6.868 374 HH21 ARG 74 1HH2 ARG 74 -18.683 13.706 3.931 375 HH22 ARG 74 2HH2 ARG 74 -18.912 13.768 5.652 376 H TYR 75 H TYR 75 -14.371 7.808 1.736 377 HA TYR 75 HA TYR 75 -15.584 5.592 3.157 378 HB2 TYR 75 1HB TYR 75 -13.782 5.639 0.734 379 HB3 TYR 75 2HB TYR 75 -14.607 4.219 1.375 380 HD1 TYR 75 HD1 TYR 75 -17.274 4.973 1.900 381 HD2 TYR 75 HD2 TYR 75 -14.750 6.331 -1.241 382 HE1 TYR 75 HE1 TYR 75 -19.253 5.488 0.541 383 HE2 TYR 75 HE2 TYR 75 -16.723 6.853 -2.608 384 HH TYR 75 HH TYR 75 -19.897 6.884 -1.313 385 H VAL 76 H VAL 76 -12.622 7.286 3.310 386 HA VAL 76 HA VAL 76 -11.154 4.952 4.269 387 HB VAL 76 HB VAL 76 -10.257 7.803 3.835 388 HG11 VAL 76 1HG1 VAL 76 -8.628 5.412 4.698 389 HG12 VAL 76 2HG1 VAL 76 -9.043 6.794 5.711 390 HG13 VAL 76 3HG1 VAL 76 -7.993 7.012 4.310 391 HG21 VAL 76 1HG2 VAL 76 -9.623 5.243 2.373 392 HG22 VAL 76 2HG2 VAL 76 -8.927 6.825 2.021 393 HG23 VAL 76 3HG2 VAL 76 -10.654 6.546 1.785 394 H SER 77 H SER 77 -11.046 4.438 6.337 395 HA SER 77 HA SER 77 -12.352 6.172 8.253 396 HB2 SER 77 1HB SER 77 -12.828 3.711 8.134 397 HB3 SER 77 2HB SER 77 -11.179 3.414 8.691 398 HG SER 77 HG SER 77 -12.059 3.544 10.596 399 H ALA 78 H ALA 78 -9.122 5.045 7.510 400 HA ALA 78 HA ALA 78 -7.977 7.067 9.184 401 HB1 ALA 78 1HB ALA 78 -7.481 4.187 9.912 402 HB2 ALA 78 2HB ALA 78 -8.418 5.338 10.860 403 HB3 ALA 78 3HB ALA 78 -6.689 5.590 10.627 404 H MET 79 H MET 79 -5.877 7.529 8.643 405 HA MET 79 HA MET 79 -4.142 5.751 7.302 406 HB2 MET 79 1HB MET 79 -4.036 6.687 5.110 407 HB3 MET 79 2HB MET 79 -5.718 6.286 5.423 408 HG2 MET 79 1HG MET 79 -5.976 8.334 4.477 409 HG3 MET 79 2HG MET 79 -5.829 8.808 6.166 410 HE1 MET 79 1HE MET 79 -2.444 9.173 3.048 411 HE2 MET 79 2HE MET 79 -4.056 8.545 2.705 412 HE3 MET 79 3HE MET 79 -2.940 7.614 3.703 413 H SER 80 H SER 80 -2.076 6.481 7.370 414 HA SER 80 HA SER 80 -1.598 9.336 7.772 415 HB2 SER 80 1HB SER 80 -1.755 8.252 10.029 416 HB3 SER 80 2HB SER 80 -0.375 7.248 9.586 417 HG SER 80 HG SER 80 0.845 8.844 10.155 418 H VAL 81 H VAL 81 0.600 9.974 7.388 419 HA VAL 81 HA VAL 81 1.999 8.137 5.558 420 HB VAL 81 HB VAL 81 2.101 11.156 5.499 421 HG11 VAL 81 1HG1 VAL 81 4.043 10.117 4.516 422 HG12 VAL 81 2HG1 VAL 81 3.040 10.820 3.247 423 HG13 VAL 81 3HG1 VAL 81 3.023 9.077 3.521 424 HG21 VAL 81 1HG2 VAL 81 0.632 11.052 3.540 425 HG22 VAL 81 2HG2 VAL 81 -0.164 10.460 4.999 426 HG23 VAL 81 3HG2 VAL 81 0.430 9.318 3.795 427 H ALA 82 H ALA 82 3.898 7.446 6.358 428 HA ALA 82 HA ALA 82 5.435 9.261 8.081 429 HB1 ALA 82 1HB ALA 82 6.050 7.383 9.523 430 HB2 ALA 82 2HB ALA 82 4.974 6.327 8.605 431 HB3 ALA 82 3HB ALA 82 4.310 7.668 9.539 432 H LYS 83 H LYS 83 7.140 9.668 7.022 433 HA LYS 83 HA LYS 83 8.968 9.554 5.612 434 HB2 LYS 83 1HB LYS 83 9.192 6.674 6.505 435 HB3 LYS 83 2HB LYS 83 10.488 7.748 6.004 436 HG2 LYS 83 1HG LYS 83 8.876 7.941 8.541 437 HG3 LYS 83 2HG LYS 83 10.554 7.416 8.396 438 HD2 LYS 83 1HD LYS 83 11.090 9.683 7.483 439 HD3 LYS 83 2HD LYS 83 9.441 10.166 7.870 440 HE2 LYS 83 1HE LYS 83 10.900 10.874 9.644 441 HE3 LYS 83 2HE LYS 83 9.865 9.572 10.234 442 HZ1 LYS 83 1HZ LYS 83 12.669 9.229 9.295 443 HZ2 LYS 83 2HZ LYS 83 11.676 8.026 9.966 444 HZ3 LYS 83 3HZ LYS 83 12.188 9.323 10.919 445 H GLY 84 H GLY 84 6.616 9.235 4.293 446 HA2 GLY 84 1HA GLY 84 5.947 8.730 2.135 447 HA3 GLY 84 2HA GLY 84 7.361 7.698 1.969 448 H VAL 85 H VAL 85 6.651 6.217 4.415 449 HA VAL 85 HA VAL 85 4.975 4.211 3.325 450 HB VAL 85 HB VAL 85 5.725 4.633 6.222 451 HG11 VAL 85 1HG1 VAL 85 4.765 2.166 4.780 452 HG12 VAL 85 2HG1 VAL 85 3.879 3.078 6.002 453 HG13 VAL 85 3HG1 VAL 85 5.351 2.212 6.443 454 HG21 VAL 85 1HG2 VAL 85 7.508 2.973 5.725 455 HG22 VAL 85 2HG2 VAL 85 7.714 4.516 4.900 456 HG23 VAL 85 3HG2 VAL 85 7.103 3.117 4.016 457 H VAL 86 H VAL 86 2.770 3.655 3.810 458 HA VAL 86 HA VAL 86 1.299 5.744 5.209 459 HB VAL 86 HB VAL 86 -0.461 5.733 3.442 460 HG11 VAL 86 1HG1 VAL 86 2.260 6.660 2.535 461 HG12 VAL 86 2HG1 VAL 86 1.176 7.540 3.609 462 HG13 VAL 86 3HG1 VAL 86 0.709 7.246 1.934 463 HG21 VAL 86 1HG2 VAL 86 1.638 4.360 1.771 464 HG22 VAL 86 2HG2 VAL 86 0.080 4.961 1.203 465 HG23 VAL 86 3HG2 VAL 86 0.144 3.622 2.352 466 H SER 87 H SER 87 0.376 4.714 6.793 467 HA SER 87 HA SER 87 -0.743 2.054 6.324 468 HB2 SER 87 1HB SER 87 0.801 2.402 8.261 469 HB3 SER 87 2HB SER 87 -0.395 3.493 8.964 470 HG SER 87 HG SER 87 -0.906 0.789 8.271 471 H LEU 88 H LEU 88 -2.790 1.744 6.040 472 HA LEU 88 HA LEU 88 -4.700 3.846 6.832 473 HB2 LEU 88 1HB LEU 88 -4.954 1.850 4.574 474 HB3 LEU 88 2HB LEU 88 -6.133 3.075 5.002 475 HG LEU 88 HG LEU 88 -4.163 4.735 4.510 476 HD11 LEU 88 1HD1 LEU 88 -2.704 3.950 2.701 477 HD12 LEU 88 2HD1 LEU 88 -3.347 2.319 2.902 478 HD13 LEU 88 3HD1 LEU 88 -2.426 3.072 4.206 479 HD21 LEU 88 1HD2 LEU 88 -4.901 4.868 2.178 480 HD22 LEU 88 2HD2 LEU 88 -6.255 4.668 3.289 481 HD23 LEU 88 3HD2 LEU 88 -5.681 3.295 2.342 482 H THR 89 H THR 89 -6.830 3.047 7.500 483 HA THR 89 HA THR 89 -6.936 0.211 8.181 484 HB THR 89 HB THR 89 -7.467 2.325 10.279 485 HG1 THR 89 HG1 THR 89 -5.116 1.192 9.437 486 HG21 THR 89 1HG2 THR 89 -7.413 0.422 11.828 487 HG22 THR 89 2HG2 THR 89 -7.171 -0.678 10.471 488 HG23 THR 89 3HG2 THR 89 -8.679 0.228 10.616 489 H GLY 90 H GLY 90 -8.963 -0.603 8.399 490 HA2 GLY 90 1HA GLY 90 -11.211 -0.822 7.956 491 HA3 GLY 90 2HA GLY 90 -11.344 0.667 8.869 492 H GLN 91 H GLN 91 -10.055 0.006 5.600 493 HA GLN 91 HA GLN 91 -11.387 2.307 4.540 494 HB2 GLN 91 1HB GLN 91 -9.270 0.826 3.732 495 HB3 GLN 91 2HB GLN 91 -10.517 0.134 2.707 496 HG2 GLN 91 1HG GLN 91 -9.960 3.081 2.847 497 HG3 GLN 91 2HG GLN 91 -9.141 1.999 1.725 498 HE21 GLN 91 1HE2 GLN 91 -12.118 3.593 2.517 499 HE22 GLN 91 2HE2 GLN 91 -12.924 3.247 1.026 500 H GLU 92 H GLU 92 -13.458 2.440 3.921 501 HA GLU 92 HA GLU 92 -15.656 1.863 3.839 502 HB2 GLU 92 1HB GLU 92 -14.391 0.128 1.741 503 HB3 GLU 92 2HB GLU 92 -16.132 0.146 1.985 504 HG2 GLU 92 1HG GLU 92 -16.015 2.644 1.680 505 HG3 GLU 92 2HG GLU 92 -14.361 2.396 1.140 506 H SER 93 H SER 93 -15.564 -1.296 2.799 507 HA SER 93 HA SER 93 -16.950 -2.235 5.102 508 HB2 SER 93 1HB SER 93 -15.875 -3.900 2.827 509 HB3 SER 93 2HB SER 93 -17.280 -4.232 3.842 510 HG SER 93 HG SER 93 -18.279 -2.384 2.910 511 H LEU 94 H LEU 94 -13.689 -1.957 4.406 512 HA LEU 94 HA LEU 94 -12.846 -4.507 5.494 513 HB2 LEU 94 1HB LEU 94 -11.158 -2.179 4.585 514 HB3 LEU 94 2HB LEU 94 -10.616 -3.824 4.874 515 HG LEU 94 HG LEU 94 -12.495 -2.950 2.677 516 HD11 LEU 94 1HD1 LEU 94 -10.591 -3.603 1.218 517 HD12 LEU 94 2HD1 LEU 94 -9.592 -3.731 2.665 518 HD13 LEU 94 3HD1 LEU 94 -10.292 -2.178 2.212 519 HD21 LEU 94 1HD2 LEU 94 -11.284 -5.653 3.242 520 HD22 LEU 94 2HD2 LEU 94 -12.251 -5.226 1.832 521 HD23 LEU 94 3HD2 LEU 94 -12.980 -5.215 3.437 522 H ASN 95 H ASN 95 -14.226 -2.837 7.312 523 HA ASN 95 HA ASN 95 -12.611 -1.399 9.059 524 HB2 ASN 95 1HB ASN 95 -14.329 -1.650 10.689 525 HB3 ASN 95 2HB ASN 95 -15.136 -1.603 9.131 526 HD21 ASN 95 1HD2 ASN 95 -16.064 -3.511 8.317 527 HD22 ASN 95 2HD2 ASN 95 -16.405 -4.861 9.345 528 H GLY 96 H GLY 96 -11.347 -1.947 10.809 529 HA2 GLY 96 1HA GLY 96 -10.037 -3.312 12.159 530 HA3 GLY 96 2HA GLY 96 -10.890 -4.707 11.513 531 H LEU 97 H LEU 97 -10.227 -3.718 8.722 532 HA LEU 97 HA LEU 97 -7.747 -5.166 8.515 533 HB2 LEU 97 1HB LEU 97 -9.589 -5.468 6.896 534 HB3 LEU 97 2HB LEU 97 -9.415 -3.796 6.403 535 HG LEU 97 HG LEU 97 -7.081 -5.657 6.119 536 HD11 LEU 97 1HD1 LEU 97 -9.362 -5.407 4.157 537 HD12 LEU 97 2HD1 LEU 97 -9.007 -6.830 5.134 538 HD13 LEU 97 3HD1 LEU 97 -7.860 -6.297 3.907 539 HD21 LEU 97 1HD2 LEU 97 -6.780 -3.262 5.695 540 HD22 LEU 97 2HD2 LEU 97 -8.073 -3.313 4.500 541 HD23 LEU 97 3HD2 LEU 97 -6.581 -4.211 4.221 542 H SER 98 H SER 98 -5.780 -4.346 8.257 543 HA SER 98 HA SER 98 -5.549 -1.426 7.960 544 HB2 SER 98 1HB SER 98 -3.539 -3.278 9.256 545 HB3 SER 98 2HB SER 98 -3.559 -1.512 9.299 546 HG SER 98 HG SER 98 -5.830 -2.816 10.231 547 H VAL 99 H VAL 99 -4.420 -0.670 6.282 548 HA VAL 99 HA VAL 99 -2.946 -2.610 4.622 549 HB VAL 99 HB VAL 99 -3.907 0.133 3.786 550 HG11 VAL 99 1HG1 VAL 99 -2.027 -0.740 2.501 551 HG12 VAL 99 2HG1 VAL 99 -3.492 -0.660 1.523 552 HG13 VAL 99 3HG1 VAL 99 -2.940 -2.211 2.159 553 HG21 VAL 99 1HG2 VAL 99 -5.218 -2.532 3.274 554 HG22 VAL 99 2HG2 VAL 99 -5.701 -0.993 2.560 555 HG23 VAL 99 3HG2 VAL 99 -5.846 -1.240 4.301 556 H VAL 100 H VAL 100 -0.748 -2.390 4.544 557 HA VAL 100 HA VAL 100 0.339 0.178 5.466 558 HB VAL 100 HB VAL 100 1.548 -2.548 5.965 559 HG11 VAL 100 1HG1 VAL 100 3.212 -1.339 7.289 560 HG12 VAL 100 2HG1 VAL 100 2.470 0.192 6.823 561 HG13 VAL 100 3HG1 VAL 100 3.236 -0.825 5.603 562 HG21 VAL 100 1HG2 VAL 100 0.283 -0.598 7.884 563 HG22 VAL 100 2HG2 VAL 100 1.105 -2.090 8.332 564 HG23 VAL 100 3HG2 VAL 100 -0.385 -2.155 7.393 565 H MET 101 H MET 101 0.975 1.116 3.675 566 HA MET 101 HA MET 101 2.356 -0.518 1.655 567 HB2 MET 101 1HB MET 101 0.435 0.889 0.887 568 HB3 MET 101 2HB MET 101 1.358 2.317 1.341 569 HG2 MET 101 1HG MET 101 3.113 1.673 -0.231 570 HG3 MET 101 2HG MET 101 2.159 0.274 -0.710 571 HE1 MET 101 1HE MET 101 -1.001 2.033 -2.296 572 HE2 MET 101 2HE MET 101 -0.819 1.652 -0.584 573 HE3 MET 101 3HE MET 101 -0.292 0.496 -1.806 574 H THR 102 H THR 102 4.447 -0.585 1.815 575 HA THR 102 HA THR 102 5.903 1.751 2.856 576 HB THR 102 HB THR 102 6.957 -1.069 2.561 577 HG1 THR 102 HG1 THR 102 5.182 -0.072 4.351 578 HG21 THR 102 1HG2 THR 102 7.890 1.247 4.257 579 HG22 THR 102 2HG2 THR 102 8.644 0.714 2.757 580 HG23 THR 102 3HG2 THR 102 8.640 -0.347 4.166 581 HA PRO 103 HA PRO 103 6.959 1.970 -1.616 582 HB2 PRO 103 1HB PRO 103 7.642 4.723 -0.839 583 HB3 PRO 103 2HB PRO 103 6.563 4.155 -2.120 584 HG2 PRO 103 1HG PRO 103 5.634 5.326 0.130 585 HG3 PRO 103 2HG PRO 103 4.740 4.050 -0.720 586 HD2 PRO 103 1HD PRO 103 6.391 3.881 1.769 587 HD3 PRO 103 2HD PRO 103 4.862 3.060 1.367 588 H GLY 104 H GLY 104 8.968 1.851 -2.501 589 HA2 GLY 104 1HA GLY 104 11.263 2.297 -2.691 590 HA3 GLY 104 2HA GLY 104 11.257 2.918 -1.048 591 H TRP 105 H TRP 105 11.255 -0.012 -3.001 592 HA TRP 105 HA TRP 105 11.806 -1.717 -0.755 593 HB2 TRP 105 1HB TRP 105 10.720 -2.401 -2.990 594 HB3 TRP 105 2HB TRP 105 12.355 -2.393 -3.644 595 HD1 TRP 105 HD1 TRP 105 10.243 -4.208 -0.972 596 HE1 TRP 105 HE1 TRP 105 11.256 -6.540 -0.584 597 HE3 TRP 105 HE3 TRP 105 14.413 -3.773 -3.900 598 HZ2 TRP 105 HZ2 TRP 105 13.521 -8.001 -1.414 599 HZ3 TRP 105 HZ3 TRP 105 15.952 -5.688 -4.046 600 HH2 TRP 105 HH2 TRP 105 15.514 -7.756 -2.828 601 H ASP 106 H ASP 106 13.590 0.099 -3.120 602 HA ASP 106 HA ASP 106 16.123 -0.707 -1.856 603 HB2 ASP 106 1HB ASP 106 15.635 0.776 -4.456 604 HB3 ASP 106 2HB ASP 106 17.215 0.362 -3.806 605 H ASN 107 H ASN 107 16.331 0.553 -0.105 606 HA ASN 107 HA ASN 107 15.058 2.984 0.330 607 HB2 ASN 107 1HB ASN 107 15.739 1.771 2.226 608 HB3 ASN 107 2HB ASN 107 17.400 1.645 1.656 609 HD21 ASN 107 1HD2 ASN 107 15.004 3.802 3.038 610 HD22 ASN 107 2HD2 ASN 107 16.140 4.953 3.659 611 H ALA 108 H ALA 108 18.233 2.384 -1.049 612 HA ALA 108 HA ALA 108 19.116 5.092 -0.723 613 HB1 ALA 108 1HB ALA 108 20.678 3.201 -0.740 614 HB2 ALA 108 2HB ALA 108 21.078 4.408 -1.962 615 HB3 ALA 108 3HB ALA 108 20.284 2.906 -2.433 616 H ASN 109 H ASN 109 17.252 3.428 -3.092 617 HA ASN 109 HA ASN 109 17.626 5.670 -4.966 618 HB2 ASN 109 1HB ASN 109 18.150 3.284 -5.757 619 HB3 ASN 109 2HB ASN 109 16.409 3.018 -5.723 620 HD21 ASN 109 1HD2 ASN 109 17.931 6.058 -6.584 621 HD22 ASN 109 2HD2 ASN 109 17.460 6.037 -8.246 622 H GLY 110 H GLY 110 15.926 5.475 -2.591 623 HA2 GLY 110 1HA GLY 110 13.801 5.975 -1.874 624 HA3 GLY 110 2HA GLY 110 13.674 6.835 -3.397 625 H VAL 111 H VAL 111 11.884 6.328 -4.437 626 HA VAL 111 HA VAL 111 10.432 3.951 -3.676 627 HB VAL 111 HB VAL 111 8.637 4.912 -5.202 628 HG11 VAL 111 1HG1 VAL 111 8.598 5.157 -2.783 629 HG12 VAL 111 2HG1 VAL 111 8.004 6.620 -3.568 630 HG13 VAL 111 3HG1 VAL 111 9.635 6.579 -2.897 631 HG21 VAL 111 1HG2 VAL 111 10.467 7.315 -5.155 632 HG22 VAL 111 2HG2 VAL 111 8.835 7.252 -5.822 633 HG23 VAL 111 3HG2 VAL 111 10.132 6.317 -6.570 634 H THR 112 H THR 112 12.151 2.567 -4.744 635 HA THR 112 HA THR 112 11.968 2.262 -7.589 636 HB THR 112 HB THR 112 13.193 0.116 -7.181 637 HG1 THR 112 HG1 THR 112 13.794 -0.412 -5.109 638 HG21 THR 112 1HG2 THR 112 14.359 2.557 -5.845 639 HG22 THR 112 2HG2 THR 112 14.382 2.225 -7.577 640 HG23 THR 112 3HG2 THR 112 15.269 1.181 -6.468 641 H GLY 113 H GLY 113 10.037 1.333 -4.968 642 HA2 GLY 113 1HA GLY 113 8.138 0.004 -6.599 643 HA3 GLY 113 2HA GLY 113 9.056 -1.160 -5.649 644 H TRP 114 H TRP 114 6.621 -1.373 -4.969 645 HA TRP 114 HA TRP 114 6.317 0.208 -2.510 646 HB2 TRP 114 1HB TRP 114 4.154 -0.423 -4.529 647 HB3 TRP 114 2HB TRP 114 3.826 0.157 -2.900 648 HD1 TRP 114 HD1 TRP 114 4.149 2.725 -2.430 649 HE1 TRP 114 HE1 TRP 114 4.585 4.759 -3.949 650 HE3 TRP 114 HE3 TRP 114 5.414 0.269 -6.732 651 HZ2 TRP 114 HZ2 TRP 114 5.362 5.253 -6.614 652 HZ3 TRP 114 HZ3 TRP 114 5.988 1.595 -8.721 653 HH2 TRP 114 HH2 TRP 114 5.961 4.036 -8.663 654 H ALA 115 H ALA 115 6.285 -1.118 -0.805 655 HA ALA 115 HA ALA 115 5.440 -3.887 -1.141 656 HB1 ALA 115 1HB ALA 115 6.456 -2.460 1.315 657 HB2 ALA 115 2HB ALA 115 7.442 -3.410 0.207 658 HB3 ALA 115 3HB ALA 115 6.181 -4.192 1.160 659 H ARG 116 H ARG 116 3.359 -4.321 -1.008 660 HA ARG 116 HA ARG 116 1.660 -2.518 0.577 661 HB2 ARG 116 1HB ARG 116 0.889 -4.259 -1.772 662 HB3 ARG 116 2HB ARG 116 -0.167 -3.139 -0.919 663 HG2 ARG 116 1HG ARG 116 1.149 -1.261 -1.662 664 HG3 ARG 116 2HG ARG 116 2.320 -2.340 -2.416 665 HD2 ARG 116 1HD ARG 116 -0.578 -2.076 -3.198 666 HD3 ARG 116 2HD ARG 116 0.778 -1.339 -4.044 667 HE ARG 116 HE ARG 116 0.683 -4.259 -3.751 668 HH11 ARG 116 1HH1 ARG 116 0.609 -1.411 -5.802 669 HH12 ARG 116 2HH1 ARG 116 0.717 -2.320 -7.277 670 HH21 ARG 116 1HH2 ARG 116 0.842 -5.446 -5.692 671 HH22 ARG 116 2HH2 ARG 116 0.852 -4.610 -7.217 672 H ASN 117 H ASN 117 0.800 -3.304 2.348 673 HA ASN 117 HA ASN 117 0.588 -6.230 2.659 674 HB2 ASN 117 1HB ASN 117 1.174 -4.129 4.759 675 HB3 ASN 117 2HB ASN 117 0.897 -5.822 5.103 676 HD21 ASN 117 1HD2 ASN 117 2.905 -5.988 6.081 677 HD22 ASN 117 2HD2 ASN 117 4.371 -6.036 5.165 678 H CYS 118 H CYS 118 -1.499 -6.863 2.731 679 HA CYS 118 HA CYS 118 -3.446 -5.081 4.021 680 HB2 CYS 118 1HB CYS 118 -3.881 -7.567 2.341 681 HB3 CYS 118 2HB CYS 118 -5.165 -6.597 3.068 682 H ASN 119 H ASN 119 -3.824 -5.435 6.112 683 HA ASN 119 HA ASN 119 -3.364 -8.158 7.153 684 HB2 ASN 119 1HB ASN 119 -1.679 -6.418 7.829 685 HB3 ASN 119 2HB ASN 119 -2.977 -5.548 8.632 686 HD21 ASN 119 1HD2 ASN 119 -0.521 -6.720 9.680 687 HD22 ASN 119 2HD2 ASN 119 -1.002 -7.807 10.934 688 H ILE 120 H ILE 120 -5.374 -8.964 7.304 689 HA ILE 120 HA ILE 120 -7.108 -7.675 9.272 690 HB ILE 120 HB ILE 120 -8.170 -7.177 7.182 691 HG12 ILE 120 1HG1 ILE 120 -10.299 -8.539 7.366 692 HG13 ILE 120 2HG1 ILE 120 -9.500 -9.450 8.637 693 HG21 ILE 120 1HG2 ILE 120 -7.086 -8.770 5.748 694 HG22 ILE 120 2HG2 ILE 120 -8.836 -8.916 5.578 695 HG23 ILE 120 3HG2 ILE 120 -7.940 -10.102 6.526 696 HD11 ILE 120 1HD1 ILE 120 -9.277 -7.418 9.957 697 HD12 ILE 120 2HD1 ILE 120 -10.960 -7.723 9.532 698 HD13 ILE 120 3HD1 ILE 120 -10.041 -6.493 8.668 699 H GLN 121 H GLN 121 -6.924 -9.050 10.973 700 HA GLN 121 HA GLN 121 -5.889 -11.678 10.498 701 HB2 GLN 121 1HB GLN 121 -5.845 -11.875 12.967 702 HB3 GLN 121 2HB GLN 121 -5.026 -10.440 12.367 703 HG2 GLN 121 1HG GLN 121 -6.921 -9.066 12.981 704 HG3 GLN 121 2HG GLN 121 -7.812 -10.495 13.505 705 HE21 GLN 121 1HE2 GLN 121 -5.182 -8.335 14.210 706 HE22 GLN 121 2HE2 GLN 121 -4.957 -8.821 15.854 707 H SER 122 H SER 122 -9.034 -10.417 11.499 708 HA SER 122 HA SER 122 -9.908 -13.083 12.244 709 HB2 SER 122 1HB SER 122 -10.475 -11.091 13.629 710 HB3 SER 122 2HB SER 122 -11.464 -10.491 12.300 711 HG SER 122 HG SER 122 -11.859 -12.765 13.924 712 H ASP 123 H ASP 123 -10.139 -11.059 9.454 713 HA ASP 123 HA ASP 123 -12.255 -12.797 8.401 714 HB2 ASP 123 1HB ASP 123 -12.233 -9.786 8.341 715 HB3 ASP 123 2HB ASP 123 -13.223 -10.748 7.248 716 H SER 124 H SER 124 -10.847 -13.915 7.100 717 HA SER 124 HA SER 124 -8.943 -12.789 5.373 718 HB2 SER 124 1HB SER 124 -10.469 -15.379 5.017 719 HB3 SER 124 2HB SER 124 -8.924 -14.964 4.277 720 HG SER 124 HG SER 124 -8.526 -14.583 6.800 721 H ALA 125 H ALA 125 -12.403 -13.127 5.047 722 HA ALA 125 HA ALA 125 -12.624 -12.955 2.251 723 HB1 ALA 125 1HB ALA 125 -14.927 -12.257 2.643 724 HB2 ALA 125 2HB ALA 125 -14.555 -11.973 4.344 725 HB3 ALA 125 3HB ALA 125 -14.485 -13.609 3.687 726 H LEU 126 H LEU 126 -12.267 -10.483 4.720 727 HA LEU 126 HA LEU 126 -12.724 -8.275 2.993 728 HB2 LEU 126 1HB LEU 126 -11.203 -8.426 5.594 729 HB3 LEU 126 2HB LEU 126 -11.672 -6.939 4.795 730 HG LEU 126 HG LEU 126 -13.535 -8.994 5.992 731 HD11 LEU 126 1HD1 LEU 126 -12.412 -7.634 7.652 732 HD12 LEU 126 2HD1 LEU 126 -14.114 -7.188 7.538 733 HD13 LEU 126 3HD1 LEU 126 -12.882 -6.166 6.797 734 HD21 LEU 126 1HD2 LEU 126 -14.178 -6.405 4.585 735 HD22 LEU 126 2HD2 LEU 126 -15.332 -7.431 5.435 736 HD23 LEU 126 3HD2 LEU 126 -14.522 -8.027 3.988 737 H GLN 127 H GLN 127 -9.950 -10.200 3.877 738 HA GLN 127 HA GLN 127 -7.940 -8.556 2.793 739 HB2 GLN 127 1HB GLN 127 -7.380 -10.412 4.260 740 HB3 GLN 127 2HB GLN 127 -8.033 -11.559 3.098 741 HG2 GLN 127 1HG GLN 127 -6.299 -11.028 1.520 742 HG3 GLN 127 2HG GLN 127 -5.679 -9.753 2.568 743 HE21 GLN 127 1HE2 GLN 127 -6.814 -12.888 3.652 744 HE22 GLN 127 2HE2 GLN 127 -5.274 -13.466 4.191 745 H GLN 128 H GLN 128 -10.059 -10.963 1.382 746 HA GLN 128 HA GLN 128 -8.776 -11.420 -1.032 747 HB2 GLN 128 1HB GLN 128 -11.754 -11.257 -0.540 748 HB3 GLN 128 2HB GLN 128 -10.988 -12.035 -1.919 749 HG2 GLN 128 1HG GLN 128 -9.910 -13.630 -0.400 750 HG3 GLN 128 2HG GLN 128 -10.716 -12.858 0.963 751 HE21 GLN 128 1HE2 GLN 128 -12.160 -13.401 -2.188 752 HE22 GLN 128 2HE2 GLN 128 -13.331 -14.555 -1.654 753 H ALA 129 H ALA 129 -10.859 -8.743 -0.095 754 HA ALA 129 HA ALA 129 -10.954 -7.593 -2.709 755 HB1 ALA 129 1HB ALA 129 -11.949 -5.656 -1.590 756 HB2 ALA 129 2HB ALA 129 -11.576 -6.380 -0.024 757 HB3 ALA 129 3HB ALA 129 -12.723 -7.167 -1.110 758 H CYS 130 H CYS 130 -9.112 -6.939 0.239 759 HA CYS 130 HA CYS 130 -7.786 -4.649 -0.811 760 HB2 CYS 130 1HB CYS 130 -8.117 -5.011 1.608 761 HB3 CYS 130 2HB CYS 130 -7.035 -6.401 1.543 762 H GLU 131 H GLU 131 -6.741 -7.984 -0.204 763 HA GLU 131 HA GLU 131 -4.098 -7.689 -1.093 764 HB2 GLU 131 1HB GLU 131 -4.944 -9.581 0.296 765 HB3 GLU 131 2HB GLU 131 -5.795 -10.194 -1.116 766 HG2 GLU 131 1HG GLU 131 -3.542 -10.294 -2.266 767 HG3 GLU 131 2HG GLU 131 -2.831 -10.006 -0.675 768 H ASP 132 H ASP 132 -7.082 -8.142 -2.788 769 HA ASP 132 HA ASP 132 -6.094 -9.135 -5.221 770 HB2 ASP 132 1HB ASP 132 -8.518 -8.948 -4.616 771 HB3 ASP 132 2HB ASP 132 -8.402 -7.210 -4.863 772 H VAL 133 H VAL 133 -6.680 -5.787 -4.188 773 HA VAL 133 HA VAL 133 -5.441 -4.742 -6.586 774 HB VAL 133 HB VAL 133 -6.536 -3.324 -4.153 775 HG11 VAL 133 1HG1 VAL 133 -4.841 -1.970 -5.270 776 HG12 VAL 133 2HG1 VAL 133 -6.451 -1.296 -5.519 777 HG13 VAL 133 3HG1 VAL 133 -5.663 -2.199 -6.813 778 HG21 VAL 133 1HG2 VAL 133 -8.260 -4.488 -5.380 779 HG22 VAL 133 2HG2 VAL 133 -7.689 -3.798 -6.897 780 HG23 VAL 133 3HG2 VAL 133 -8.402 -2.754 -5.668 781 H PHE 134 H PHE 134 -4.757 -4.807 -3.133 782 HA PHE 134 HA PHE 134 -2.229 -3.438 -3.489 783 HB2 PHE 134 1HB PHE 134 -3.638 -4.416 -1.003 784 HB3 PHE 134 2HB PHE 134 -2.097 -3.571 -1.002 785 HD1 PHE 134 HD1 PHE 134 -5.670 -3.230 -1.131 786 HD2 PHE 134 HD2 PHE 134 -1.998 -1.220 -1.904 787 HE1 PHE 134 HE1 PHE 134 -6.851 -1.078 -1.139 788 HE2 PHE 134 HE2 PHE 134 -3.180 0.940 -1.907 789 HZ PHE 134 HZ PHE 134 -5.611 1.011 -1.529 790 H ARG 135 H ARG 135 -2.701 -6.131 -4.550 791 HA ARG 135 HA ARG 135 -1.691 -8.228 -3.074 792 HB2 ARG 135 1HB ARG 135 -1.214 -9.311 -5.223 793 HB3 ARG 135 2HB ARG 135 -2.763 -8.480 -5.273 794 HG2 ARG 135 1HG ARG 135 -1.715 -6.614 -6.463 795 HG3 ARG 135 2HG ARG 135 -0.173 -7.473 -6.433 796 HD2 ARG 135 1HD ARG 135 -1.163 -7.834 -8.576 797 HD3 ARG 135 2HD ARG 135 -1.288 -9.339 -7.671 798 HE ARG 135 HE ARG 135 -3.647 -7.933 -7.243 799 HH11 ARG 135 1HH1 ARG 135 -1.939 -9.399 -9.923 800 HH12 ARG 135 2HH1 ARG 135 -3.382 -9.725 -10.829 801 HH21 ARG 135 1HH2 ARG 135 -5.545 -8.346 -8.433 802 HH22 ARG 135 2HH2 ARG 135 -5.440 -9.135 -9.975 803 H PHE 136 H PHE 136 0.338 -9.227 -2.948 804 HA PHE 136 HA PHE 136 2.557 -7.330 -3.231 805 HB2 PHE 136 1HB PHE 136 3.493 -8.833 -1.257 806 HB3 PHE 136 2HB PHE 136 2.450 -7.447 -0.959 807 HD1 PHE 136 HD1 PHE 136 2.490 -11.143 -1.243 808 HD2 PHE 136 HD2 PHE 136 0.353 -7.707 0.084 809 HE1 PHE 136 HE1 PHE 136 0.925 -12.591 -0.021 810 HE2 PHE 136 HE2 PHE 136 -1.220 -9.153 1.302 811 HZ PHE 136 HZ PHE 136 -0.933 -11.596 1.252 812 H ASP 137 H ASP 137 3.883 -7.895 -4.746 813 HA ASP 137 HA ASP 137 4.114 -10.403 -5.949 814 HB2 ASP 137 1HB ASP 137 6.301 -8.314 -5.814 815 HB3 ASP 137 2HB ASP 137 6.052 -9.522 -7.069 816 H ASP 138 H ASP 138 5.442 -12.112 -5.631 817 HA ASP 138 HA ASP 138 6.279 -12.599 -2.976 818 HB2 ASP 138 1HB ASP 138 6.883 -14.175 -5.488 819 HB3 ASP 138 2HB ASP 138 7.096 -14.756 -3.840 820 H ALA 139 H ALA 139 7.825 -11.266 -5.715 821 HA ALA 139 HA ALA 139 10.521 -11.714 -4.815 822 HB1 ALA 139 1HB ALA 139 10.005 -11.463 -7.194 823 HB2 ALA 139 2HB ALA 139 11.156 -10.243 -6.653 824 HB3 ALA 139 3HB ALA 139 9.465 -9.811 -6.903 825 H ASN 140 H ASN 140 8.034 -9.507 -4.115 826 HA ASN 140 HA ASN 140 9.824 -7.438 -3.113 827 HB2 ASN 140 1HB ASN 140 7.809 -6.700 -4.273 828 HB3 ASN 140 2HB ASN 140 6.795 -7.644 -3.189 829 HD21 ASN 140 1HD2 ASN 140 8.736 -4.786 -3.546 830 HD22 ASN 140 2HD2 ASN 140 8.182 -3.990 -2.114 831 H LEU 141 H LEU 141 8.241 -10.235 -2.081 832 HA LEU 141 HA LEU 141 7.975 -9.525 0.698 833 HB2 LEU 141 1HB LEU 141 7.731 -12.184 -0.718 834 HB3 LEU 141 2HB LEU 141 7.367 -11.921 0.976 835 HG LEU 141 HG LEU 141 5.895 -10.712 -1.368 836 HD11 LEU 141 1HD1 LEU 141 5.037 -12.773 0.660 837 HD12 LEU 141 2HD1 LEU 141 5.458 -13.103 -1.019 838 HD13 LEU 141 3HD1 LEU 141 4.050 -12.115 -0.641 839 HD21 LEU 141 1HD2 LEU 141 4.321 -9.897 0.364 840 HD22 LEU 141 2HD2 LEU 141 5.910 -9.143 0.459 841 HD23 LEU 141 3HD2 LEU 141 5.468 -10.410 1.602 842 H VAL 142 H VAL 142 8.822 -11.937 1.849 843 HA VAL 142 HA VAL 142 11.718 -11.512 1.784 844 HB VAL 142 HB VAL 142 10.847 -11.073 3.967 845 HG11 VAL 142 1HG1 VAL 142 9.615 -12.780 5.269 846 HG12 VAL 142 2HG1 VAL 142 9.515 -13.772 3.813 847 HG13 VAL 142 3HG1 VAL 142 8.724 -12.197 3.864 848 HG21 VAL 142 1HG2 VAL 142 12.059 -12.684 5.328 849 HG22 VAL 142 2HG2 VAL 142 12.974 -12.280 3.875 850 HG23 VAL 142 3HG2 VAL 142 12.107 -13.812 3.973 851 HA PRO 143 HA PRO 143 11.793 -15.501 -0.188 852 HB2 PRO 143 1HB PRO 143 14.449 -15.569 -0.678 853 HB3 PRO 143 2HB PRO 143 13.338 -14.569 -1.618 854 HG2 PRO 143 1HG PRO 143 15.186 -13.788 0.590 855 HG3 PRO 143 2HG PRO 143 14.792 -12.921 -0.905 856 HD2 PRO 143 1HD PRO 143 13.703 -12.338 1.552 857 HD3 PRO 143 2HD PRO 143 12.922 -11.969 0.003 858 H ARG 144 H ARG 144 12.050 -17.517 0.569 859 HA ARG 144 HA ARG 144 13.476 -17.844 3.119 860 HB2 ARG 144 1HB ARG 144 11.521 -19.770 1.846 861 HB3 ARG 144 2HB ARG 144 12.150 -19.825 3.482 862 HG2 ARG 144 1HG ARG 144 10.334 -17.685 2.389 863 HG3 ARG 144 2HG ARG 144 9.837 -19.038 3.402 864 HD2 ARG 144 1HD ARG 144 11.356 -18.206 5.174 865 HD3 ARG 144 2HD ARG 144 11.716 -16.810 4.161 866 HE ARG 144 HE ARG 144 8.924 -17.053 4.504 867 HH11 ARG 144 1HH1 ARG 144 11.826 -16.122 6.230 868 HH12 ARG 144 2HH1 ARG 144 10.991 -15.057 7.312 869 HH21 ARG 144 1HH2 ARG 144 7.819 -15.649 5.926 870 HH22 ARG 144 2HH2 ARG 144 8.712 -14.778 7.133 871 H GLY 145 H GLY 145 15.555 -18.485 2.778 872 HA2 GLY 145 1HA GLY 145 17.063 -20.246 2.199 873 HA3 GLY 145 2HA GLY 145 15.984 -20.687 0.880 874 H SER 146 H SER 146 18.373 -18.432 1.995 875 HA SER 146 HA SER 146 18.425 -16.601 -0.083 876 HB2 SER 146 1HB SER 146 20.839 -17.607 1.431 877 HB3 SER 146 2HB SER 146 20.643 -16.028 0.669 878 HG SER 146 HG SER 146 19.595 -15.362 2.366 879 H GLY 147 H GLY 147 18.768 -16.844 -2.184 880 HA2 GLY 147 1HA GLY 147 20.156 -17.337 -4.031 881 HA3 GLY 147 2HA GLY 147 20.959 -18.569 -3.070 882 H LEU 148 H LEU 148 17.823 -19.093 -2.471 883 HA LEU 148 HA LEU 148 17.674 -21.136 -4.571 884 HB2 LEU 148 1HB LEU 148 16.106 -20.913 -1.999 885 HB3 LEU 148 2HB LEU 148 16.048 -22.253 -3.128 886 HG LEU 148 HG LEU 148 18.440 -21.444 -1.469 887 HD11 LEU 148 1HD1 LEU 148 16.589 -23.812 -1.259 888 HD12 LEU 148 2HD1 LEU 148 16.649 -22.440 -0.152 889 HD13 LEU 148 3HD1 LEU 148 18.029 -23.531 -0.279 890 HD21 LEU 148 1HD2 LEU 148 19.176 -22.391 -3.564 891 HD22 LEU 148 2HD2 LEU 148 18.046 -23.733 -3.394 892 HD23 LEU 148 3HD2 LEU 148 19.401 -23.576 -2.279 893 H GLU 149 H GLU 149 16.871 -19.853 -6.242 894 HA GLU 149 HA GLU 149 14.470 -18.322 -5.949 895 HB2 GLU 149 1HB GLU 149 16.307 -18.032 -7.729 896 HB3 GLU 149 2HB GLU 149 15.567 -19.400 -8.545 897 HG2 GLU 149 1HG GLU 149 14.804 -17.304 -9.486 898 HG3 GLU 149 2HG GLU 149 13.472 -18.172 -8.724 899 H HIS 150 H HIS 150 15.309 -21.595 -6.732 900 HA HIS 150 HA HIS 150 12.604 -22.344 -7.416 901 HB2 HIS 150 1HB HIS 150 14.426 -23.563 -8.459 902 HB3 HIS 150 2HB HIS 150 15.088 -23.989 -6.886 903 HD1 HIS 150 HD1 HIS 150 14.871 -26.482 -6.968 904 HD2 HIS 150 HD2 HIS 150 11.322 -24.545 -7.934 905 HE1 HIS 150 HE1 HIS 150 13.127 -28.288 -7.095 906 HE2 HIS 150 HE2 HIS 150 11.027 -27.115 -7.845 907 H HIS 151 H HIS 151 11.325 -21.852 -5.683 908 HA HIS 151 HA HIS 151 12.065 -22.672 -3.017 909 HB2 HIS 151 1HB HIS 151 10.821 -20.582 -3.327 910 HB3 HIS 151 2HB HIS 151 9.493 -21.467 -4.068 911 HD1 HIS 151 HD1 HIS 151 7.748 -22.409 -2.533 912 HD2 HIS 151 HD2 HIS 151 11.127 -21.118 -0.488 913 HE1 HIS 151 HE1 HIS 151 7.164 -22.562 -0.095 914 HE2 HIS 151 HE2 HIS 151 9.178 -21.666 1.118 915 H HIS 152 H HIS 152 11.876 -24.721 -2.408 916 HA HIS 152 HA HIS 152 9.392 -26.134 -2.879 917 HB2 HIS 152 1HB HIS 152 10.891 -26.592 -4.882 918 HB3 HIS 152 2HB HIS 152 11.975 -27.421 -3.773 919 HD1 HIS 152 HD1 HIS 152 8.615 -27.732 -5.401 920 HD2 HIS 152 HD2 HIS 152 11.144 -29.952 -2.964 921 HE1 HIS 152 HE1 HIS 152 7.663 -30.057 -5.381 922 HE2 HIS 152 HE2 HIS 152 9.145 -31.353 -3.811 923 H HIS 153 H HIS 153 12.750 -26.908 -1.951 924 HA HIS 153 HA HIS 153 13.658 -27.792 -0.075 925 HB2 HIS 153 1HB HIS 153 11.732 -25.800 0.823 926 HB3 HIS 153 2HB HIS 153 12.057 -27.027 2.043 927 HD1 HIS 153 HD1 HIS 153 13.453 -25.610 3.589 928 HD2 HIS 153 HD2 HIS 153 14.858 -25.603 -0.319 929 HE1 HIS 153 HE1 HIS 153 15.689 -24.478 3.681 930 HE2 HIS 153 HE2 HIS 153 16.608 -24.683 1.350 931 H HIS 154 H HIS 154 12.591 -29.801 -1.189 932 HA HIS 154 HA HIS 154 11.708 -31.450 0.977 933 HB2 HIS 154 1HB HIS 154 9.550 -30.434 0.278 934 HB3 HIS 154 2HB HIS 154 9.801 -31.065 -1.344 935 HD1 HIS 154 HD1 HIS 154 8.717 -32.063 2.075 936 HD2 HIS 154 HD2 HIS 154 9.420 -33.857 -1.610 937 HE1 HIS 154 HE1 HIS 154 7.682 -34.350 2.224 938 HE2 HIS 154 HE2 HIS 154 7.990 -35.356 -0.066 939 H HIS 155 H HIS 155 13.267 -32.910 0.631 940 HA HIS 155 HA HIS 155 13.914 -33.769 -2.052 941 HB2 HIS 155 1HB HIS 155 15.697 -35.072 -1.056 942 HB3 HIS 155 2HB HIS 155 15.708 -33.457 -0.368 943 HD1 HIS 155 HD1 HIS 155 15.712 -36.966 0.542 944 HD2 HIS 155 HD2 HIS 155 14.578 -33.406 2.355 945 HE1 HIS 155 HE1 HIS 155 15.538 -37.483 2.991 946 HE2 HIS 155 HE2 HIS 155 14.685 -35.362 4.041 Start of MODEL 5 1 H1 MET 24 1H MET 24 -16.467 -11.979 -1.002 2 H2 MET 24 2H MET 24 -16.467 -13.249 0.113 3 H3 MET 24 3H MET 24 -15.969 -13.524 -1.475 4 HA MET 24 HA MET 24 -14.614 -11.808 0.515 5 HB2 MET 24 1HB MET 24 -12.819 -13.451 0.466 6 HB3 MET 24 2HB MET 24 -14.327 -14.217 0.941 7 HG2 MET 24 1HG MET 24 -14.585 -15.174 -1.245 8 HG3 MET 24 2HG MET 24 -13.166 -14.309 -1.833 9 HE1 MET 24 1HE MET 24 -11.908 -17.990 -1.838 10 HE2 MET 24 2HE MET 24 -12.104 -16.509 -2.775 11 HE3 MET 24 3HE MET 24 -13.522 -17.417 -2.252 12 H GLU 25 H GLU 25 -14.920 -12.846 -2.821 13 HA GLU 25 HA GLU 25 -12.621 -11.406 -3.738 14 HB2 GLU 25 1HB GLU 25 -15.051 -12.446 -5.211 15 HB3 GLU 25 2HB GLU 25 -13.661 -11.711 -5.995 16 HG2 GLU 25 1HG GLU 25 -12.229 -13.485 -5.176 17 HG3 GLU 25 2HG GLU 25 -13.591 -14.211 -4.323 18 H ASN 26 H ASN 26 -16.098 -10.898 -4.240 19 HA ASN 26 HA ASN 26 -17.372 -9.038 -4.439 20 HB2 ASN 26 1HB ASN 26 -15.286 -8.024 -2.496 21 HB3 ASN 26 2HB ASN 26 -16.756 -7.140 -2.892 22 HD21 ASN 26 1HD2 ASN 26 -18.723 -7.883 -2.157 23 HD22 ASN 26 2HD2 ASN 26 -18.858 -9.084 -0.920 24 H TYR 27 H TYR 27 -16.762 -8.895 -6.683 25 HA TYR 27 HA TYR 27 -14.491 -7.506 -7.590 26 HB2 TYR 27 1HB TYR 27 -17.092 -7.932 -9.073 27 HB3 TYR 27 2HB TYR 27 -15.529 -7.563 -9.790 28 HD1 TYR 27 HD1 TYR 27 -13.655 -9.281 -9.541 29 HD2 TYR 27 HD2 TYR 27 -17.725 -10.149 -8.650 30 HE1 TYR 27 HE1 TYR 27 -13.177 -11.689 -9.711 31 HE2 TYR 27 HE2 TYR 27 -17.256 -12.554 -8.818 32 HH TYR 27 HH TYR 27 -14.161 -13.830 -8.800 33 H LEU 28 H LEU 28 -17.743 -6.463 -6.823 34 HA LEU 28 HA LEU 28 -17.552 -3.853 -7.910 35 HB2 LEU 28 1HB LEU 28 -19.236 -4.832 -5.598 36 HB3 LEU 28 2HB LEU 28 -19.472 -3.326 -6.459 37 HG LEU 28 HG LEU 28 -19.803 -6.093 -7.631 38 HD11 LEU 28 1HD1 LEU 28 -21.838 -3.991 -6.903 39 HD12 LEU 28 2HD1 LEU 28 -21.566 -5.510 -6.052 40 HD13 LEU 28 3HD1 LEU 28 -22.175 -5.523 -7.707 41 HD21 LEU 28 1HD2 LEU 28 -20.741 -4.883 -9.568 42 HD22 LEU 28 2HD2 LEU 28 -19.027 -4.549 -9.322 43 HD23 LEU 28 3HD2 LEU 28 -20.236 -3.361 -8.834 44 H ARG 29 H ARG 29 -16.894 -5.210 -4.725 45 HA ARG 29 HA ARG 29 -16.126 -2.791 -3.473 46 HB2 ARG 29 1HB ARG 29 -16.706 -4.768 -2.166 47 HB3 ARG 29 2HB ARG 29 -15.359 -5.655 -2.868 48 HG2 ARG 29 1HG ARG 29 -13.817 -4.004 -1.827 49 HG3 ARG 29 2HG ARG 29 -15.209 -3.300 -1.003 50 HD2 ARG 29 1HD ARG 29 -14.231 -6.144 -0.742 51 HD3 ARG 29 2HD ARG 29 -14.021 -4.862 0.451 52 HE ARG 29 HE ARG 29 -16.699 -4.949 0.166 53 HH11 ARG 29 1HH1 ARG 29 -14.330 -7.477 0.684 54 HH12 ARG 29 2HH1 ARG 29 -15.406 -8.482 1.598 55 HH21 ARG 29 1HH2 ARG 29 -18.121 -6.271 1.376 56 HH22 ARG 29 2HH2 ARG 29 -17.560 -7.789 2.005 57 H LYS 30 H LYS 30 -14.387 -5.255 -5.286 58 HA LYS 30 HA LYS 30 -11.785 -4.381 -4.822 59 HB2 LYS 30 1HB LYS 30 -12.998 -5.774 -7.195 60 HB3 LYS 30 2HB LYS 30 -11.285 -5.396 -7.105 61 HG2 LYS 30 1HG LYS 30 -11.204 -6.706 -4.969 62 HG3 LYS 30 2HG LYS 30 -12.859 -7.222 -5.306 63 HD2 LYS 30 1HD LYS 30 -12.133 -8.190 -7.426 64 HD3 LYS 30 2HD LYS 30 -10.481 -7.653 -7.112 65 HE2 LYS 30 1HE LYS 30 -10.499 -9.046 -5.045 66 HE3 LYS 30 2HE LYS 30 -12.073 -9.673 -5.541 67 HZ1 LYS 30 1HZ LYS 30 -10.247 -11.138 -6.179 68 HZ2 LYS 30 2HZ LYS 30 -9.563 -9.902 -7.116 69 HZ3 LYS 30 3HZ LYS 30 -11.068 -10.555 -7.537 70 H ALA 31 H ALA 31 -14.044 -3.385 -7.440 71 HA ALA 31 HA ALA 31 -12.367 -1.536 -8.628 72 HB1 ALA 31 1HB ALA 31 -14.492 -2.312 -9.570 73 HB2 ALA 31 2HB ALA 31 -14.378 -0.553 -9.550 74 HB3 ALA 31 3HB ALA 31 -15.360 -1.387 -8.345 75 H ALA 32 H ALA 32 -14.374 -1.225 -5.753 76 HA ALA 32 HA ALA 32 -14.076 1.592 -5.488 77 HB1 ALA 32 1HB ALA 32 -14.869 1.278 -3.201 78 HB2 ALA 32 2HB ALA 32 -14.640 -0.464 -3.349 79 HB3 ALA 32 3HB ALA 32 -15.854 0.354 -4.335 80 H LEU 33 H LEU 33 -12.342 -1.210 -4.276 81 HA LEU 33 HA LEU 33 -10.410 0.193 -2.751 82 HB2 LEU 33 1HB LEU 33 -10.158 -2.498 -4.114 83 HB3 LEU 33 2HB LEU 33 -9.139 -1.899 -2.815 84 HG LEU 33 HG LEU 33 -12.090 -2.518 -2.587 85 HD11 LEU 33 1HD1 LEU 33 -10.738 -4.529 -2.832 86 HD12 LEU 33 2HD1 LEU 33 -11.382 -4.391 -1.197 87 HD13 LEU 33 3HD1 LEU 33 -9.695 -3.995 -1.516 88 HD21 LEU 33 1HD2 LEU 33 -11.754 -2.187 -0.184 89 HD22 LEU 33 2HD2 LEU 33 -11.439 -0.712 -1.100 90 HD23 LEU 33 3HD2 LEU 33 -10.094 -1.677 -0.491 91 H THR 34 H THR 34 -10.658 -0.731 -6.111 92 HA THR 34 HA THR 34 -8.027 0.006 -6.869 93 HB THR 34 HB THR 34 -10.536 -0.129 -8.559 94 HG1 THR 34 HG1 THR 34 -9.899 -2.119 -7.483 95 HG21 THR 34 1HG2 THR 34 -8.780 1.147 -9.660 96 HG22 THR 34 2HG2 THR 34 -8.975 -0.422 -10.444 97 HG23 THR 34 3HG2 THR 34 -7.621 -0.144 -9.349 98 H ASP 35 H ASP 35 -11.093 1.701 -6.649 99 HA ASP 35 HA ASP 35 -10.351 4.059 -7.996 100 HB2 ASP 35 1HB ASP 35 -12.671 3.643 -7.661 101 HB3 ASP 35 2HB ASP 35 -12.459 3.470 -5.922 102 H MET 36 H MET 36 -10.340 3.247 -4.533 103 HA MET 36 HA MET 36 -9.283 5.758 -3.725 104 HB2 MET 36 1HB MET 36 -8.736 4.644 -1.587 105 HB3 MET 36 2HB MET 36 -10.396 4.360 -2.091 106 HG2 MET 36 1HG MET 36 -9.906 2.146 -2.759 107 HG3 MET 36 2HG MET 36 -8.170 2.411 -2.597 108 HE1 MET 36 1HE MET 36 -6.935 2.743 -0.344 109 HE2 MET 36 2HE MET 36 -7.684 2.635 1.246 110 HE3 MET 36 3HE MET 36 -8.025 4.016 0.205 111 H LEU 37 H LEU 37 -7.816 2.702 -4.679 112 HA LEU 37 HA LEU 37 -5.139 3.360 -4.114 113 HB2 LEU 37 1HB LEU 37 -5.874 1.086 -4.646 114 HB3 LEU 37 2HB LEU 37 -6.292 1.596 -6.278 115 HG LEU 37 HG LEU 37 -3.813 2.190 -6.548 116 HD11 LEU 37 1HD1 LEU 37 -3.240 2.102 -4.162 117 HD12 LEU 37 2HD1 LEU 37 -2.261 0.996 -5.120 118 HD13 LEU 37 3HD1 LEU 37 -3.595 0.374 -4.150 119 HD21 LEU 37 1HD2 LEU 37 -4.659 -0.682 -6.206 120 HD22 LEU 37 2HD2 LEU 37 -3.253 -0.126 -7.110 121 HD23 LEU 37 3HD2 LEU 37 -4.874 0.307 -7.650 122 H GLN 38 H GLN 38 -7.155 3.865 -6.974 123 HA GLN 38 HA GLN 38 -5.163 5.025 -8.594 124 HB2 GLN 38 1HB GLN 38 -8.166 5.129 -8.655 125 HB3 GLN 38 2HB GLN 38 -7.183 6.003 -9.827 126 HG2 GLN 38 1HG GLN 38 -7.087 3.034 -9.339 127 HG3 GLN 38 2HG GLN 38 -7.931 3.829 -10.668 128 HE21 GLN 38 1HE2 GLN 38 -5.683 1.899 -10.639 129 HE22 GLN 38 2HE2 GLN 38 -4.429 2.652 -11.561 130 H THR 39 H THR 39 -7.096 6.298 -6.030 131 HA THR 39 HA THR 39 -6.559 9.055 -6.586 132 HB THR 39 HB THR 39 -7.202 7.783 -3.915 133 HG1 THR 39 HG1 THR 39 -8.696 7.464 -5.855 134 HG21 THR 39 1HG2 THR 39 -6.401 10.119 -3.806 135 HG22 THR 39 2HG2 THR 39 -8.096 9.977 -3.339 136 HG23 THR 39 3HG2 THR 39 -7.672 10.592 -4.936 137 H PHE 40 H PHE 40 -5.014 6.495 -4.737 138 HA PHE 40 HA PHE 40 -3.026 8.141 -3.537 139 HB2 PHE 40 1HB PHE 40 -3.667 5.976 -2.568 140 HB3 PHE 40 2HB PHE 40 -3.035 5.150 -3.989 141 HD1 PHE 40 HD1 PHE 40 -1.733 7.810 -1.698 142 HD2 PHE 40 HD2 PHE 40 -1.098 4.034 -3.563 143 HE1 PHE 40 HE1 PHE 40 0.495 7.676 -0.662 144 HE2 PHE 40 HE2 PHE 40 1.129 3.896 -2.533 145 HZ PHE 40 HZ PHE 40 1.930 5.719 -1.079 146 H VAL 41 H VAL 41 -3.231 6.350 -6.543 147 HA VAL 41 HA VAL 41 -0.621 6.090 -7.291 148 HB VAL 41 HB VAL 41 -2.997 6.705 -9.032 149 HG11 VAL 41 1HG1 VAL 41 -1.645 5.970 -10.933 150 HG12 VAL 41 2HG1 VAL 41 -0.231 5.856 -9.884 151 HG13 VAL 41 3HG1 VAL 41 -0.972 7.424 -10.198 152 HG21 VAL 41 1HG2 VAL 41 -3.067 4.590 -7.826 153 HG22 VAL 41 2HG2 VAL 41 -1.474 4.169 -8.453 154 HG23 VAL 41 3HG2 VAL 41 -2.843 4.317 -9.554 155 HA PRO 42 HA PRO 42 -0.472 10.623 -9.152 156 HB2 PRO 42 1HB PRO 42 -2.456 11.930 -7.370 157 HB3 PRO 42 2HB PRO 42 -2.100 12.232 -9.076 158 HG2 PRO 42 1HG PRO 42 -4.313 10.938 -8.358 159 HG3 PRO 42 2HG PRO 42 -3.401 10.463 -9.801 160 HD2 PRO 42 1HD PRO 42 -3.483 9.177 -7.102 161 HD3 PRO 42 2HD PRO 42 -3.427 8.428 -8.709 162 H TYR 43 H TYR 43 -1.325 10.078 -5.723 163 HA TYR 43 HA TYR 43 0.463 12.036 -4.723 164 HB2 TYR 43 1HB TYR 43 -0.870 9.640 -3.459 165 HB3 TYR 43 2HB TYR 43 0.224 10.691 -2.559 166 HD1 TYR 43 HD1 TYR 43 -0.551 12.680 -1.600 167 HD2 TYR 43 HD2 TYR 43 -2.956 10.700 -4.499 168 HE1 TYR 43 HE1 TYR 43 -2.411 14.208 -1.095 169 HE2 TYR 43 HE2 TYR 43 -4.819 12.224 -4.002 170 HH TYR 43 HH TYR 43 -4.423 15.046 -2.072 171 H ARG 44 H ARG 44 0.845 8.717 -5.710 172 HA ARG 44 HA ARG 44 3.231 8.086 -4.414 173 HB2 ARG 44 1HB ARG 44 2.379 7.239 -7.183 174 HB3 ARG 44 2HB ARG 44 3.641 6.482 -6.228 175 HG2 ARG 44 1HG ARG 44 1.896 5.982 -4.502 176 HG3 ARG 44 2HG ARG 44 0.694 6.520 -5.679 177 HD2 ARG 44 1HD ARG 44 2.599 4.193 -5.892 178 HD3 ARG 44 2HD ARG 44 0.836 4.146 -5.886 179 HE ARG 44 HE ARG 44 1.739 5.679 -8.081 180 HH11 ARG 44 1HH1 ARG 44 1.581 2.372 -6.958 181 HH12 ARG 44 2HH1 ARG 44 1.593 1.691 -8.551 182 HH21 ARG 44 1HH2 ARG 44 1.764 4.783 -10.187 183 HH22 ARG 44 2HH2 ARG 44 1.693 3.061 -10.391 184 H THR 45 H THR 45 2.756 9.529 -7.630 185 HA THR 45 HA THR 45 5.334 10.126 -8.282 186 HB THR 45 HB THR 45 2.969 11.962 -8.686 187 HG1 THR 45 HG1 THR 45 3.872 9.652 -10.095 188 HG21 THR 45 1HG2 THR 45 5.514 11.612 -10.277 189 HG22 THR 45 2HG2 THR 45 5.095 13.003 -9.278 190 HG23 THR 45 3HG2 THR 45 4.158 12.643 -10.728 191 H ALA 46 H ALA 46 3.208 12.059 -6.170 192 HA ALA 46 HA ALA 46 5.057 14.123 -5.643 193 HB1 ALA 46 1HB ALA 46 3.665 14.639 -3.700 194 HB2 ALA 46 2HB ALA 46 2.846 13.086 -3.866 195 HB3 ALA 46 3HB ALA 46 2.669 14.314 -5.121 196 H VAL 47 H VAL 47 4.482 11.018 -4.192 197 HA VAL 47 HA VAL 47 6.279 11.248 -2.003 198 HB VAL 47 HB VAL 47 5.290 8.781 -3.450 199 HG11 VAL 47 1HG1 VAL 47 7.394 8.315 -2.294 200 HG12 VAL 47 2HG1 VAL 47 6.037 7.507 -1.509 201 HG13 VAL 47 3HG1 VAL 47 6.719 8.970 -0.801 202 HG21 VAL 47 1HG2 VAL 47 4.409 10.087 -0.879 203 HG22 VAL 47 2HG2 VAL 47 3.823 8.538 -1.483 204 HG23 VAL 47 3HG2 VAL 47 3.501 10.015 -2.391 205 H GLU 48 H GLU 48 6.608 9.927 -5.265 206 HA GLU 48 HA GLU 48 9.293 9.128 -5.102 207 HB2 GLU 48 1HB GLU 48 7.475 9.863 -7.376 208 HB3 GLU 48 2HB GLU 48 9.177 9.548 -7.675 209 HG2 GLU 48 1HG GLU 48 7.431 7.593 -6.220 210 HG3 GLU 48 2HG GLU 48 7.556 7.622 -7.981 211 H LEU 49 H LEU 49 7.843 12.215 -6.055 212 HA LEU 49 HA LEU 49 10.255 13.468 -6.817 213 HB2 LEU 49 1HB LEU 49 7.510 14.362 -6.152 214 HB3 LEU 49 2HB LEU 49 8.775 15.574 -6.040 215 HG LEU 49 HG LEU 49 7.618 15.595 -8.221 216 HD11 LEU 49 1HD1 LEU 49 10.497 14.737 -8.429 217 HD12 LEU 49 2HD1 LEU 49 9.944 16.358 -8.016 218 HD13 LEU 49 3HD1 LEU 49 9.592 15.686 -9.607 219 HD21 LEU 49 1HD2 LEU 49 7.987 13.792 -9.818 220 HD22 LEU 49 2HD2 LEU 49 7.112 13.214 -8.399 221 HD23 LEU 49 3HD2 LEU 49 8.831 12.861 -8.582 222 H CYS 50 H CYS 50 8.505 13.355 -3.751 223 HA CYS 50 HA CYS 50 10.303 14.956 -2.285 224 HB2 CYS 50 1HB CYS 50 8.135 14.470 -1.365 225 HB3 CYS 50 2HB CYS 50 8.432 12.738 -1.428 226 H ALA 51 H ALA 51 10.054 11.403 -2.489 227 HA ALA 51 HA ALA 51 12.396 10.683 -1.269 228 HB1 ALA 51 1HB ALA 51 10.733 9.083 -2.081 229 HB2 ALA 51 2HB ALA 51 12.360 8.650 -2.604 230 HB3 ALA 51 3HB ALA 51 11.239 9.401 -3.740 231 H LEU 52 H LEU 52 12.034 12.079 -4.457 232 HA LEU 52 HA LEU 52 14.696 11.484 -5.326 233 HB2 LEU 52 1HB LEU 52 12.855 11.896 -6.910 234 HB3 LEU 52 2HB LEU 52 12.719 13.543 -6.322 235 HG LEU 52 HG LEU 52 15.044 13.959 -7.138 236 HD11 LEU 52 1HD1 LEU 52 15.890 11.705 -7.175 237 HD12 LEU 52 2HD1 LEU 52 15.951 12.379 -8.802 238 HD13 LEU 52 3HD1 LEU 52 14.681 11.237 -8.368 239 HD21 LEU 52 1HD2 LEU 52 13.102 14.658 -8.427 240 HD22 LEU 52 2HD2 LEU 52 13.025 13.071 -9.193 241 HD23 LEU 52 3HD2 LEU 52 14.404 14.128 -9.492 242 H GLU 53 H GLU 53 13.234 13.962 -3.426 243 HA GLU 53 HA GLU 53 15.122 16.029 -3.869 244 HB2 GLU 53 1HB GLU 53 12.791 16.300 -2.960 245 HB3 GLU 53 2HB GLU 53 13.369 15.628 -1.441 246 HG2 GLU 53 1HG GLU 53 13.302 18.010 -1.275 247 HG3 GLU 53 2HG GLU 53 14.985 17.483 -1.277 248 H HIS 54 H HIS 54 14.810 13.530 -1.395 249 HA HIS 54 HA HIS 54 17.415 14.394 -0.297 250 HB2 HIS 54 1HB HIS 54 15.442 14.570 1.258 251 HB3 HIS 54 2HB HIS 54 15.323 12.816 1.205 252 HD1 HIS 54 HD1 HIS 54 16.644 11.606 2.941 253 HD2 HIS 54 HD2 HIS 54 18.077 15.449 2.278 254 HE1 HIS 54 HE1 HIS 54 18.423 11.971 4.673 255 HE2 HIS 54 HE2 HIS 54 19.378 14.243 4.158 256 H GLY 55 H GLY 55 15.834 11.959 -1.973 257 HA2 GLY 55 1HA GLY 55 16.705 10.047 -2.916 258 HA3 GLY 55 2HA GLY 55 18.119 10.194 -1.880 259 H GLY 56 H GLY 56 16.510 10.382 0.594 260 HA2 GLY 56 1HA GLY 56 14.999 7.860 0.480 261 HA3 GLY 56 2HA GLY 56 15.775 8.490 1.923 262 H LEU 57 H LEU 57 13.167 7.635 1.875 263 HA LEU 57 HA LEU 57 11.289 9.749 1.454 264 HB2 LEU 57 1HB LEU 57 11.048 7.105 2.882 265 HB3 LEU 57 2HB LEU 57 9.708 8.190 2.566 266 HG LEU 57 HG LEU 57 11.391 7.067 0.343 267 HD11 LEU 57 1HD1 LEU 57 10.441 5.227 1.697 268 HD12 LEU 57 2HD1 LEU 57 9.779 5.309 0.066 269 HD13 LEU 57 3HD1 LEU 57 8.834 5.905 1.432 270 HD21 LEU 57 1HD2 LEU 57 9.418 7.567 -0.994 271 HD22 LEU 57 2HD2 LEU 57 10.004 9.012 -0.175 272 HD23 LEU 57 3HD2 LEU 57 8.587 8.165 0.440 273 H ASP 58 H ASP 58 13.535 9.372 3.808 274 HA ASP 58 HA ASP 58 12.311 9.634 6.246 275 HB2 ASP 58 1HB ASP 58 14.848 10.958 5.287 276 HB3 ASP 58 2HB ASP 58 14.357 10.856 6.974 277 H THR 59 H THR 59 12.904 12.175 3.866 278 HA THR 59 HA THR 59 11.922 14.251 5.591 279 HB THR 59 HB THR 59 13.683 14.730 3.963 280 HG1 THR 59 HG1 THR 59 11.234 16.072 3.918 281 HG21 THR 59 1HG2 THR 59 13.056 13.225 2.170 282 HG22 THR 59 2HG2 THR 59 13.133 14.875 1.555 283 HG23 THR 59 3HG2 THR 59 11.571 14.131 1.891 284 H CYS 60 H CYS 60 10.334 11.869 3.982 285 HA CYS 60 HA CYS 60 8.195 13.559 2.925 286 HB2 CYS 60 1HB CYS 60 8.567 10.572 2.654 287 HB3 CYS 60 2HB CYS 60 7.443 11.581 1.749 288 H ASP 61 H ASP 61 7.893 13.922 5.406 289 HA ASP 61 HA ASP 61 6.131 11.818 6.480 290 HB2 ASP 61 1HB ASP 61 8.320 12.663 7.702 291 HB3 ASP 61 2HB ASP 61 7.265 13.984 8.206 292 H GLY 62 H GLY 62 4.108 12.394 7.279 293 HA2 GLY 62 1HA GLY 62 2.856 14.553 5.940 294 HA3 GLY 62 2HA GLY 62 2.118 13.535 7.169 295 H GLY 63 H GLY 63 2.910 16.624 6.446 296 HA2 GLY 63 1HA GLY 63 2.480 18.461 7.858 297 HA3 GLY 63 2HA GLY 63 2.703 17.412 9.252 298 H SER 64 H SER 64 5.092 17.154 6.815 299 HA SER 64 HA SER 64 6.877 18.966 8.273 300 HB2 SER 64 1HB SER 64 7.194 16.665 9.128 301 HB3 SER 64 2HB SER 64 7.537 16.115 7.490 302 HG SER 64 HG SER 64 9.301 16.870 9.143 303 H ASN 65 H ASN 65 8.541 19.863 7.032 304 HA ASN 65 HA ASN 65 9.479 20.778 5.185 305 HB2 ASN 65 1HB ASN 65 9.172 17.937 4.213 306 HB3 ASN 65 2HB ASN 65 10.080 19.172 3.348 307 HD21 ASN 65 1HD2 ASN 65 10.045 17.015 6.055 308 HD22 ASN 65 2HD2 ASN 65 11.677 17.304 6.567 309 H GLY 66 H GLY 66 6.689 21.192 5.337 310 HA2 GLY 66 1HA GLY 66 5.252 22.386 3.955 311 HA3 GLY 66 2HA GLY 66 6.260 21.956 2.580 312 H ILE 67 H ILE 67 5.866 19.084 3.864 313 HA ILE 67 HA ILE 67 3.867 18.282 2.012 314 HB ILE 67 HB ILE 67 5.243 16.762 4.233 315 HG12 ILE 67 1HG1 ILE 67 5.670 16.810 1.238 316 HG13 ILE 67 2HG1 ILE 67 6.732 17.539 2.439 317 HG21 ILE 67 1HG2 ILE 67 3.531 15.678 1.995 318 HG22 ILE 67 2HG2 ILE 67 3.081 15.737 3.700 319 HG23 ILE 67 3HG2 ILE 67 4.426 14.723 3.177 320 HD11 ILE 67 1HD1 ILE 67 7.603 15.424 1.610 321 HD12 ILE 67 2HD1 ILE 67 6.147 14.602 2.175 322 HD13 ILE 67 3HD1 ILE 67 7.244 15.351 3.334 323 HA PRO 68 HA PRO 68 0.283 19.196 4.427 324 HB2 PRO 68 1HB PRO 68 -0.897 16.900 2.957 325 HB3 PRO 68 2HB PRO 68 -1.468 18.566 3.087 326 HG2 PRO 68 1HG PRO 68 -0.343 17.689 0.846 327 HG3 PRO 68 2HG PRO 68 -0.023 19.333 1.452 328 HD2 PRO 68 1HD PRO 68 1.693 16.879 1.593 329 HD3 PRO 68 2HD PRO 68 2.160 18.569 1.283 330 H SER 69 H SER 69 -1.387 18.022 5.736 331 HA SER 69 HA SER 69 0.013 16.079 7.405 332 HB2 SER 69 1HB SER 69 -1.986 16.609 8.950 333 HB3 SER 69 2HB SER 69 -0.812 17.896 8.676 334 HG SER 69 HG SER 69 -3.414 17.952 8.222 335 HA PRO 70 HA PRO 70 -2.205 12.514 6.075 336 HB2 PRO 70 1HB PRO 70 -3.213 11.664 8.569 337 HB3 PRO 70 2HB PRO 70 -1.708 11.147 7.808 338 HG2 PRO 70 1HG PRO 70 -2.163 13.181 9.919 339 HG3 PRO 70 2HG PRO 70 -0.765 12.127 9.648 340 HD2 PRO 70 1HD PRO 70 -0.684 14.749 9.059 341 HD3 PRO 70 2HD PRO 70 0.158 13.544 8.061 342 H THR 71 H THR 71 -4.095 12.433 5.116 343 HA THR 71 HA THR 71 -6.465 13.559 6.387 344 HB THR 71 HB THR 71 -5.319 15.398 5.128 345 HG1 THR 71 HG1 THR 71 -7.554 15.526 5.378 346 HG21 THR 71 1HG2 THR 71 -5.955 13.682 2.727 347 HG22 THR 71 2HG2 THR 71 -4.345 14.076 3.329 348 HG23 THR 71 3HG2 THR 71 -5.376 15.345 2.671 349 H THR 72 H THR 72 -8.391 13.247 4.807 350 HA THR 72 HA THR 72 -8.094 10.762 3.291 351 HB THR 72 HB THR 72 -10.252 9.945 4.321 352 HG1 THR 72 HG1 THR 72 -9.625 12.016 6.185 353 HG21 THR 72 1HG2 THR 72 -9.190 9.019 6.301 354 HG22 THR 72 2HG2 THR 72 -7.921 10.242 6.212 355 HG23 THR 72 3HG2 THR 72 -8.058 9.022 4.947 356 H THR 73 H THR 73 -9.452 10.570 1.578 357 HA THR 73 HA THR 73 -11.108 12.845 0.886 358 HB THR 73 HB THR 73 -11.458 11.586 -1.265 359 HG1 THR 73 HG1 THR 73 -10.865 9.569 -1.316 360 HG21 THR 73 1HG2 THR 73 -8.593 12.074 -0.448 361 HG22 THR 73 2HG2 THR 73 -9.709 13.277 -1.092 362 HG23 THR 73 3HG2 THR 73 -9.175 11.937 -2.107 363 H ARG 74 H ARG 74 -13.272 11.928 -0.338 364 HA ARG 74 HA ARG 74 -14.992 11.534 1.787 365 HB2 ARG 74 1HB ARG 74 -15.784 12.478 -0.266 366 HB3 ARG 74 2HB ARG 74 -15.404 11.010 -1.151 367 HG2 ARG 74 1HG ARG 74 -17.134 9.809 0.056 368 HG3 ARG 74 2HG ARG 74 -17.503 11.256 0.995 369 HD2 ARG 74 1HD ARG 74 -18.106 12.421 -1.100 370 HD3 ARG 74 2HD ARG 74 -17.795 10.937 -1.996 371 HE ARG 74 HE ARG 74 -19.694 10.596 0.124 372 HH11 ARG 74 1HH1 ARG 74 -19.307 11.629 -3.202 373 HH12 ARG 74 2HH1 ARG 74 -20.949 11.277 -3.634 374 HH21 ARG 74 1HH2 ARG 74 -21.865 10.149 -0.450 375 HH22 ARG 74 2HH2 ARG 74 -22.401 10.446 -2.073 376 H TYR 75 H TYR 75 -13.683 9.039 -0.403 377 HA TYR 75 HA TYR 75 -15.153 7.041 1.157 378 HB2 TYR 75 1HB TYR 75 -13.848 6.853 -1.559 379 HB3 TYR 75 2HB TYR 75 -14.595 5.492 -0.723 380 HD1 TYR 75 HD1 TYR 75 -15.165 8.392 -2.783 381 HD2 TYR 75 HD2 TYR 75 -17.049 5.584 -0.209 382 HE1 TYR 75 HE1 TYR 75 -17.351 9.019 -3.710 383 HE2 TYR 75 HE2 TYR 75 -19.240 6.198 -1.132 384 HH TYR 75 HH TYR 75 -19.573 8.140 -3.946 385 H VAL 76 H VAL 76 -12.579 8.400 1.928 386 HA VAL 76 HA VAL 76 -11.073 5.912 2.405 387 HB VAL 76 HB VAL 76 -10.027 8.749 2.335 388 HG11 VAL 76 1HG1 VAL 76 -7.841 7.818 2.816 389 HG12 VAL 76 2HG1 VAL 76 -8.522 6.194 2.892 390 HG13 VAL 76 3HG1 VAL 76 -8.963 7.388 4.109 391 HG21 VAL 76 1HG2 VAL 76 -8.660 7.906 0.463 392 HG22 VAL 76 2HG2 VAL 76 -10.389 7.803 0.127 393 HG23 VAL 76 3HG2 VAL 76 -9.490 6.354 0.578 394 H SER 77 H SER 77 -10.734 5.297 4.449 395 HA SER 77 HA SER 77 -12.413 6.568 6.421 396 HB2 SER 77 1HB SER 77 -10.724 4.061 6.654 397 HB3 SER 77 2HB SER 77 -12.018 4.563 7.749 398 HG SER 77 HG SER 77 -13.323 4.551 5.676 399 H ALA 78 H ALA 78 -8.953 5.686 6.218 400 HA ALA 78 HA ALA 78 -8.210 7.894 7.889 401 HB1 ALA 78 1HB ALA 78 -7.939 5.108 9.010 402 HB2 ALA 78 2HB ALA 78 -9.015 6.368 9.609 403 HB3 ALA 78 3HB ALA 78 -7.269 6.575 9.720 404 H MET 79 H MET 79 -6.083 8.397 7.660 405 HA MET 79 HA MET 79 -4.274 6.427 6.479 406 HB2 MET 79 1HB MET 79 -4.680 9.211 5.354 407 HB3 MET 79 2HB MET 79 -3.420 8.091 4.858 408 HG2 MET 79 1HG MET 79 -5.131 6.544 4.037 409 HG3 MET 79 2HG MET 79 -6.385 7.679 4.529 410 HE1 MET 79 1HE MET 79 -3.454 6.925 2.063 411 HE2 MET 79 2HE MET 79 -2.869 8.399 2.838 412 HE3 MET 79 3HE MET 79 -3.341 8.424 1.139 413 H SER 80 H SER 80 -2.224 6.612 7.191 414 HA SER 80 HA SER 80 -1.448 9.073 8.608 415 HB2 SER 80 1HB SER 80 -0.838 6.223 9.470 416 HB3 SER 80 2HB SER 80 -0.202 7.677 10.242 417 HG SER 80 HG SER 80 -2.410 8.275 10.654 418 H VAL 81 H VAL 81 0.652 9.777 8.188 419 HA VAL 81 HA VAL 81 2.016 8.289 6.038 420 HB VAL 81 HB VAL 81 1.987 11.291 6.400 421 HG11 VAL 81 1HG1 VAL 81 2.992 9.565 4.139 422 HG12 VAL 81 2HG1 VAL 81 3.978 10.489 5.276 423 HG13 VAL 81 3HG1 VAL 81 2.932 11.328 4.129 424 HG21 VAL 81 1HG2 VAL 81 -0.241 10.521 5.808 425 HG22 VAL 81 2HG2 VAL 81 0.420 9.625 4.441 426 HG23 VAL 81 3HG2 VAL 81 0.504 11.386 4.464 427 H ALA 82 H ALA 82 3.990 7.591 6.635 428 HA ALA 82 HA ALA 82 5.539 9.232 8.490 429 HB1 ALA 82 1HB ALA 82 6.132 7.281 9.832 430 HB2 ALA 82 2HB ALA 82 5.060 6.277 8.856 431 HB3 ALA 82 3HB ALA 82 4.391 7.562 9.862 432 H LYS 83 H LYS 83 7.177 9.700 7.347 433 HA LYS 83 HA LYS 83 8.962 9.637 5.868 434 HB2 LYS 83 1HB LYS 83 9.314 6.765 6.729 435 HB3 LYS 83 2HB LYS 83 10.555 7.913 6.249 436 HG2 LYS 83 1HG LYS 83 8.905 8.093 8.760 437 HG3 LYS 83 2HG LYS 83 10.553 7.474 8.664 438 HD2 LYS 83 1HD LYS 83 11.367 9.635 7.977 439 HD3 LYS 83 2HD LYS 83 9.724 10.266 7.882 440 HE2 LYS 83 1HE LYS 83 11.137 9.321 10.370 441 HE3 LYS 83 2HE LYS 83 10.803 10.994 9.935 442 HZ1 LYS 83 1HZ LYS 83 9.165 10.297 11.485 443 HZ2 LYS 83 2HZ LYS 83 8.829 8.888 10.617 444 HZ3 LYS 83 3HZ LYS 83 8.394 10.396 9.976 445 H GLY 84 H GLY 84 6.665 9.326 4.547 446 HA2 GLY 84 1HA GLY 84 5.999 8.808 2.397 447 HA3 GLY 84 2HA GLY 84 7.401 7.758 2.248 448 H VAL 85 H VAL 85 6.600 6.327 4.735 449 HA VAL 85 HA VAL 85 4.929 4.338 3.533 450 HB VAL 85 HB VAL 85 5.675 4.593 6.451 451 HG11 VAL 85 1HG1 VAL 85 5.315 2.167 6.507 452 HG12 VAL 85 2HG1 VAL 85 4.792 2.215 4.824 453 HG13 VAL 85 3HG1 VAL 85 3.849 3.041 6.066 454 HG21 VAL 85 1HG2 VAL 85 7.684 4.592 5.127 455 HG22 VAL 85 2HG2 VAL 85 7.114 3.206 4.200 456 HG23 VAL 85 3HG2 VAL 85 7.505 3.022 5.909 457 H VAL 86 H VAL 86 2.692 4.044 3.731 458 HA VAL 86 HA VAL 86 1.346 5.935 5.498 459 HB VAL 86 HB VAL 86 -0.382 6.366 3.800 460 HG11 VAL 86 1HG1 VAL 86 0.918 7.890 2.403 461 HG12 VAL 86 2HG1 VAL 86 2.404 7.073 2.891 462 HG13 VAL 86 3HG1 VAL 86 1.446 7.947 4.084 463 HG21 VAL 86 1HG2 VAL 86 -0.028 5.805 1.467 464 HG22 VAL 86 2HG2 VAL 86 -0.087 4.343 2.450 465 HG23 VAL 86 3HG2 VAL 86 1.464 4.961 1.876 466 H SER 87 H SER 87 0.173 4.876 6.848 467 HA SER 87 HA SER 87 -0.917 2.264 6.109 468 HB2 SER 87 1HB SER 87 0.457 2.374 8.152 469 HB3 SER 87 2HB SER 87 -0.660 3.556 8.836 470 HG SER 87 HG SER 87 -1.241 0.862 8.140 471 H LEU 88 H LEU 88 -2.987 1.905 5.848 472 HA LEU 88 HA LEU 88 -4.904 4.022 6.575 473 HB2 LEU 88 1HB LEU 88 -5.158 1.962 4.375 474 HB3 LEU 88 2HB LEU 88 -6.319 3.222 4.754 475 HG LEU 88 HG LEU 88 -4.272 4.811 4.256 476 HD11 LEU 88 1HD1 LEU 88 -2.889 3.940 2.420 477 HD12 LEU 88 2HD1 LEU 88 -3.583 2.340 2.677 478 HD13 LEU 88 3HD1 LEU 88 -2.610 3.094 3.940 479 HD21 LEU 88 1HD2 LEU 88 -5.888 3.437 2.118 480 HD22 LEU 88 2HD2 LEU 88 -5.031 4.967 1.931 481 HD23 LEU 88 3HD2 LEU 88 -6.380 4.843 3.062 482 H THR 89 H THR 89 -6.672 3.405 7.800 483 HA THR 89 HA THR 89 -6.626 0.589 8.661 484 HB THR 89 HB THR 89 -7.328 2.910 10.456 485 HG1 THR 89 HG1 THR 89 -4.906 2.157 9.519 486 HG21 THR 89 1HG2 THR 89 -6.474 0.072 11.058 487 HG22 THR 89 2HG2 THR 89 -8.132 0.668 11.123 488 HG23 THR 89 3HG2 THR 89 -6.924 1.302 12.238 489 H GLY 90 H GLY 90 -8.489 -0.454 8.933 490 HA2 GLY 90 1HA GLY 90 -10.705 -1.002 8.546 491 HA3 GLY 90 2HA GLY 90 -10.996 0.440 9.501 492 H GLN 91 H GLN 91 -9.780 -0.009 6.193 493 HA GLN 91 HA GLN 91 -11.299 2.262 5.317 494 HB2 GLN 91 1HB GLN 91 -9.070 1.779 4.442 495 HB3 GLN 91 2HB GLN 91 -9.644 0.253 3.782 496 HG2 GLN 91 1HG GLN 91 -9.425 1.919 2.052 497 HG3 GLN 91 2HG GLN 91 -11.114 1.456 2.266 498 HE21 GLN 91 1HE2 GLN 91 -12.571 2.959 2.969 499 HE22 GLN 91 2HE2 GLN 91 -12.204 4.633 3.119 500 H GLU 92 H GLU 92 -13.324 2.249 4.575 501 HA GLU 92 HA GLU 92 -15.369 1.526 3.894 502 HB2 GLU 92 1HB GLU 92 -13.604 -0.134 2.095 503 HB3 GLU 92 2HB GLU 92 -15.347 -0.007 1.902 504 HG2 GLU 92 1HG GLU 92 -13.345 2.222 1.681 505 HG3 GLU 92 2HG GLU 92 -14.267 1.485 0.379 506 H SER 93 H SER 93 -15.148 -1.488 2.753 507 HA SER 93 HA SER 93 -16.511 -2.695 4.925 508 HB2 SER 93 1HB SER 93 -15.219 -4.143 2.615 509 HB3 SER 93 2HB SER 93 -16.669 -4.599 3.513 510 HG SER 93 HG SER 93 -17.794 -2.989 2.525 511 H LEU 94 H LEU 94 -13.251 -2.153 4.389 512 HA LEU 94 HA LEU 94 -12.269 -4.690 5.375 513 HB2 LEU 94 1HB LEU 94 -10.716 -2.204 4.658 514 HB3 LEU 94 2HB LEU 94 -10.070 -3.823 4.877 515 HG LEU 94 HG LEU 94 -11.947 -2.977 2.662 516 HD11 LEU 94 1HD1 LEU 94 -9.971 -3.320 1.218 517 HD12 LEU 94 2HD1 LEU 94 -8.983 -3.515 2.667 518 HD13 LEU 94 3HD1 LEU 94 -9.788 -1.978 2.348 519 HD21 LEU 94 1HD2 LEU 94 -12.242 -5.317 3.264 520 HD22 LEU 94 2HD2 LEU 94 -10.505 -5.586 3.128 521 HD23 LEU 94 3HD2 LEU 94 -11.448 -5.169 1.697 522 H ASN 95 H ASN 95 -13.862 -3.212 7.175 523 HA ASN 95 HA ASN 95 -12.535 -1.758 9.121 524 HB2 ASN 95 1HB ASN 95 -14.965 -2.128 9.108 525 HB3 ASN 95 2HB ASN 95 -14.713 -3.825 9.504 526 HD21 ASN 95 1HD2 ASN 95 -15.912 -3.675 11.387 527 HD22 ASN 95 2HD2 ASN 95 -15.332 -2.857 12.796 528 H GLY 96 H GLY 96 -11.135 -2.216 10.733 529 HA2 GLY 96 1HA GLY 96 -9.842 -3.507 12.190 530 HA3 GLY 96 2HA GLY 96 -10.537 -4.960 11.476 531 H LEU 97 H LEU 97 -9.829 -3.728 8.772 532 HA LEU 97 HA LEU 97 -7.263 -5.061 8.623 533 HB2 LEU 97 1HB LEU 97 -9.100 -5.515 7.018 534 HB3 LEU 97 2HB LEU 97 -9.001 -3.854 6.471 535 HG LEU 97 HG LEU 97 -6.601 -5.645 6.245 536 HD11 LEU 97 1HD1 LEU 97 -7.362 -6.297 4.017 537 HD12 LEU 97 2HD1 LEU 97 -8.889 -5.461 4.286 538 HD13 LEU 97 3HD1 LEU 97 -8.478 -6.876 5.252 539 HD21 LEU 97 1HD2 LEU 97 -6.115 -4.198 4.346 540 HD22 LEU 97 2HD2 LEU 97 -6.354 -3.243 5.810 541 HD23 LEU 97 3HD2 LEU 97 -7.632 -3.337 4.599 542 H SER 98 H SER 98 -5.371 -4.078 8.454 543 HA SER 98 HA SER 98 -5.348 -1.181 7.946 544 HB2 SER 98 1HB SER 98 -3.265 -2.822 9.412 545 HB3 SER 98 2HB SER 98 -3.306 -1.065 9.254 546 HG SER 98 HG SER 98 -4.479 -1.068 10.984 547 H VAL 99 H VAL 99 -4.560 -0.619 6.040 548 HA VAL 99 HA VAL 99 -2.903 -2.501 4.530 549 HB VAL 99 HB VAL 99 -3.911 0.212 3.646 550 HG11 VAL 99 1HG1 VAL 99 -3.496 -0.615 1.396 551 HG12 VAL 99 2HG1 VAL 99 -2.905 -2.140 2.056 552 HG13 VAL 99 3HG1 VAL 99 -2.025 -0.643 2.367 553 HG21 VAL 99 1HG2 VAL 99 -5.689 -0.968 2.444 554 HG22 VAL 99 2HG2 VAL 99 -5.824 -1.189 4.188 555 HG23 VAL 99 3HG2 VAL 99 -5.175 -2.486 3.183 556 H VAL 100 H VAL 100 -0.691 -2.211 4.320 557 HA VAL 100 HA VAL 100 0.354 0.337 5.349 558 HB VAL 100 HB VAL 100 1.680 -2.377 5.533 559 HG11 VAL 100 1HG1 VAL 100 2.520 0.312 6.624 560 HG12 VAL 100 2HG1 VAL 100 3.285 -0.558 5.292 561 HG13 VAL 100 3HG1 VAL 100 3.339 -1.223 6.925 562 HG21 VAL 100 1HG2 VAL 100 0.415 -0.684 7.691 563 HG22 VAL 100 2HG2 VAL 100 1.315 -2.179 7.952 564 HG23 VAL 100 3HG2 VAL 100 -0.209 -2.211 7.064 565 H MET 101 H MET 101 0.853 1.459 3.578 566 HA MET 101 HA MET 101 2.093 0.099 1.303 567 HB2 MET 101 1HB MET 101 0.261 1.656 0.839 568 HB3 MET 101 2HB MET 101 1.116 2.940 1.675 569 HG2 MET 101 1HG MET 101 1.480 3.395 -0.558 570 HG3 MET 101 2HG MET 101 2.960 2.590 -0.049 571 HE1 MET 101 1HE MET 101 -0.415 2.279 -1.951 572 HE2 MET 101 2HE MET 101 -0.564 0.913 -0.845 573 HE3 MET 101 3HE MET 101 -0.367 0.630 -2.572 574 H THR 102 H THR 102 4.236 -0.135 1.449 575 HA THR 102 HA THR 102 5.789 2.034 2.703 576 HB THR 102 HB THR 102 6.591 -0.860 2.368 577 HG1 THR 102 HG1 THR 102 4.838 -0.063 3.984 578 HG21 THR 102 1HG2 THR 102 8.412 -0.304 3.899 579 HG22 THR 102 2HG2 THR 102 7.870 1.372 3.944 580 HG23 THR 102 3HG2 THR 102 8.493 0.687 2.443 581 HA PRO 103 HA PRO 103 7.083 2.461 -1.665 582 HB2 PRO 103 1HB PRO 103 7.931 5.099 -0.689 583 HB3 PRO 103 2HB PRO 103 6.838 4.694 -2.019 584 HG2 PRO 103 1HG PRO 103 5.957 5.781 0.294 585 HG3 PRO 103 2HG PRO 103 4.985 4.642 -0.660 586 HD2 PRO 103 1HD PRO 103 6.567 4.163 1.838 587 HD3 PRO 103 2HD PRO 103 4.982 3.506 1.358 588 H GLY 104 H GLY 104 9.160 2.734 -2.563 589 HA2 GLY 104 1HA GLY 104 11.477 3.120 -2.551 590 HA3 GLY 104 2HA GLY 104 11.413 3.285 -0.803 591 H TRP 105 H TRP 105 9.836 0.586 -2.227 592 HA TRP 105 HA TRP 105 12.071 -1.126 -1.384 593 HB2 TRP 105 1HB TRP 105 10.015 -1.406 -0.012 594 HB3 TRP 105 2HB TRP 105 9.143 -1.881 -1.469 595 HD1 TRP 105 HD1 TRP 105 9.823 -4.266 -2.572 596 HE1 TRP 105 HE1 TRP 105 10.878 -6.370 -1.539 597 HE3 TRP 105 HE3 TRP 105 11.639 -2.220 1.743 598 HZ2 TRP 105 HZ2 TRP 105 12.284 -7.072 0.801 599 HZ3 TRP 105 HZ3 TRP 105 12.828 -3.680 3.328 600 HH2 TRP 105 HH2 TRP 105 13.142 -6.056 2.865 601 H ASP 106 H ASP 106 13.132 -1.351 -3.233 602 HA ASP 106 HA ASP 106 11.906 -3.101 -5.198 603 HB2 ASP 106 1HB ASP 106 11.593 -0.963 -6.271 604 HB3 ASP 106 2HB ASP 106 13.246 -0.482 -5.904 605 H ASN 107 H ASN 107 13.292 -4.644 -5.835 606 HA ASN 107 HA ASN 107 15.618 -4.962 -4.232 607 HB2 ASN 107 1HB ASN 107 14.398 -6.603 -6.437 608 HB3 ASN 107 2HB ASN 107 15.932 -7.049 -5.699 609 HD21 ASN 107 1HD2 ASN 107 13.284 -5.558 -3.946 610 HD22 ASN 107 2HD2 ASN 107 12.894 -6.942 -2.986 611 H ALA 108 H ALA 108 15.099 -3.762 -7.458 612 HA ALA 108 HA ALA 108 17.832 -4.291 -8.254 613 HB1 ALA 108 1HB ALA 108 16.029 -4.551 -9.876 614 HB2 ALA 108 2HB ALA 108 17.187 -3.329 -10.396 615 HB3 ALA 108 3HB ALA 108 15.637 -2.840 -9.718 616 H ASN 109 H ASN 109 15.820 -1.339 -7.989 617 HA ASN 109 HA ASN 109 18.349 0.161 -7.702 618 HB2 ASN 109 1HB ASN 109 15.717 0.944 -8.937 619 HB3 ASN 109 2HB ASN 109 16.868 2.164 -8.406 620 HD21 ASN 109 1HD2 ASN 109 17.211 2.922 -10.481 621 HD22 ASN 109 2HD2 ASN 109 18.088 2.026 -11.674 622 H GLY 110 H GLY 110 15.180 -0.384 -6.307 623 HA2 GLY 110 1HA GLY 110 14.974 -0.146 -3.901 624 HA3 GLY 110 2HA GLY 110 16.045 1.244 -4.005 625 H VAL 111 H VAL 111 15.166 3.027 -5.503 626 HA VAL 111 HA VAL 111 12.607 3.812 -4.503 627 HB VAL 111 HB VAL 111 12.884 5.806 -5.964 628 HG11 VAL 111 1HG1 VAL 111 15.273 5.093 -4.267 629 HG12 VAL 111 2HG1 VAL 111 13.771 5.828 -3.706 630 HG13 VAL 111 3HG1 VAL 111 14.840 6.721 -4.789 631 HG21 VAL 111 1HG2 VAL 111 14.076 4.782 -7.815 632 HG22 VAL 111 2HG2 VAL 111 15.458 4.451 -6.772 633 HG23 VAL 111 3HG2 VAL 111 15.019 6.117 -7.152 634 H THR 112 H THR 112 10.937 4.744 -6.136 635 HA THR 112 HA THR 112 9.260 4.211 -7.571 636 HB THR 112 HB THR 112 11.371 2.946 -9.322 637 HG1 THR 112 HG1 THR 112 10.847 5.662 -8.704 638 HG21 THR 112 1HG2 THR 112 8.837 4.463 -9.970 639 HG22 THR 112 2HG2 THR 112 9.043 2.715 -10.076 640 HG23 THR 112 3HG2 THR 112 9.960 3.776 -11.144 641 H GLY 113 H GLY 113 9.194 2.582 -5.570 642 HA2 GLY 113 1HA GLY 113 8.122 0.150 -6.645 643 HA3 GLY 113 2HA GLY 113 9.598 -0.110 -5.719 644 H TRP 114 H TRP 114 6.516 -0.566 -5.321 645 HA TRP 114 HA TRP 114 6.421 0.646 -2.643 646 HB2 TRP 114 1HB TRP 114 4.252 0.345 -4.704 647 HB3 TRP 114 2HB TRP 114 3.869 0.535 -2.994 648 HD1 TRP 114 HD1 TRP 114 3.956 2.928 -2.005 649 HE1 TRP 114 HE1 TRP 114 4.477 5.260 -2.958 650 HE3 TRP 114 HE3 TRP 114 5.804 1.552 -6.568 651 HZ2 TRP 114 HZ2 TRP 114 5.536 6.368 -5.323 652 HZ3 TRP 114 HZ3 TRP 114 6.548 3.312 -8.117 653 HH2 TRP 114 HH2 TRP 114 6.414 5.670 -7.507 654 H ALA 115 H ALA 115 6.413 -0.762 -1.050 655 HA ALA 115 HA ALA 115 5.611 -3.518 -1.526 656 HB1 ALA 115 1HB ALA 115 7.629 -3.107 -0.204 657 HB2 ALA 115 2HB ALA 115 6.398 -3.928 0.754 658 HB3 ALA 115 3HB ALA 115 6.679 -2.204 0.972 659 H ARG 116 H ARG 116 3.583 -4.037 -1.356 660 HA ARG 116 HA ARG 116 1.794 -2.380 0.284 661 HB2 ARG 116 1HB ARG 116 1.252 -4.042 -2.182 662 HB3 ARG 116 2HB ARG 116 0.015 -3.197 -1.259 663 HG2 ARG 116 1HG ARG 116 0.817 -1.095 -1.888 664 HG3 ARG 116 2HG ARG 116 2.363 -1.749 -2.421 665 HD2 ARG 116 1HD ARG 116 -0.236 -2.474 -3.741 666 HD3 ARG 116 2HD ARG 116 0.716 -1.075 -4.234 667 HE ARG 116 HE ARG 116 2.368 -3.346 -4.187 668 HH11 ARG 116 1HH1 ARG 116 -0.274 -1.986 -6.028 669 HH12 ARG 116 2HH1 ARG 116 0.193 -2.761 -7.505 670 HH21 ARG 116 1HH2 ARG 116 3.012 -4.343 -6.151 671 HH22 ARG 116 2HH2 ARG 116 2.048 -4.093 -7.574 672 H ASN 117 H ASN 117 0.673 -3.312 1.908 673 HA ASN 117 HA ASN 117 0.368 -6.214 1.950 674 HB2 ASN 117 1HB ASN 117 2.508 -5.575 3.164 675 HB3 ASN 117 2HB ASN 117 1.493 -4.745 4.337 676 HD21 ASN 117 1HD2 ASN 117 0.636 -7.750 2.736 677 HD22 ASN 117 2HD2 ASN 117 0.682 -8.733 4.155 678 H CYS 118 H CYS 118 -1.580 -6.792 2.694 679 HA CYS 118 HA CYS 118 -3.187 -4.796 4.131 680 HB2 CYS 118 1HB CYS 118 -4.033 -7.318 2.675 681 HB3 CYS 118 2HB CYS 118 -5.127 -6.209 3.502 682 H ASN 119 H ASN 119 -3.252 -5.044 6.290 683 HA ASN 119 HA ASN 119 -2.786 -7.741 7.372 684 HB2 ASN 119 1HB ASN 119 -2.480 -5.014 8.652 685 HB3 ASN 119 2HB ASN 119 -2.264 -6.537 9.507 686 HD21 ASN 119 1HD2 ASN 119 -0.452 -7.796 9.080 687 HD22 ASN 119 2HD2 ASN 119 0.921 -7.172 8.237 688 H ILE 120 H ILE 120 -4.712 -8.695 7.544 689 HA ILE 120 HA ILE 120 -6.587 -7.490 9.428 690 HB ILE 120 HB ILE 120 -7.598 -7.104 7.289 691 HG12 ILE 120 1HG1 ILE 120 -9.664 -8.522 7.459 692 HG13 ILE 120 2HG1 ILE 120 -8.860 -9.425 8.733 693 HG21 ILE 120 1HG2 ILE 120 -8.128 -8.922 5.722 694 HG22 ILE 120 2HG2 ILE 120 -7.194 -10.030 6.727 695 HG23 ILE 120 3HG2 ILE 120 -6.393 -8.675 5.932 696 HD11 ILE 120 1HD1 ILE 120 -8.720 -7.383 10.072 697 HD12 ILE 120 2HD1 ILE 120 -10.382 -7.771 9.644 698 HD13 ILE 120 3HD1 ILE 120 -9.528 -6.493 8.788 699 H GLN 121 H GLN 121 -6.452 -8.807 11.158 700 HA GLN 121 HA GLN 121 -5.294 -11.412 10.897 701 HB2 GLN 121 1HB GLN 121 -4.749 -9.962 12.774 702 HB3 GLN 121 2HB GLN 121 -6.428 -9.971 13.296 703 HG2 GLN 121 1HG GLN 121 -6.260 -12.403 13.684 704 HG3 GLN 121 2HG GLN 121 -4.551 -12.323 13.255 705 HE21 GLN 121 1HE2 GLN 121 -3.895 -13.027 15.279 706 HE22 GLN 121 2HE2 GLN 121 -3.994 -12.026 16.683 707 H SER 122 H SER 122 -8.554 -10.236 11.611 708 HA SER 122 HA SER 122 -9.377 -13.021 12.078 709 HB2 SER 122 1HB SER 122 -9.658 -11.386 13.948 710 HB3 SER 122 2HB SER 122 -10.810 -10.504 12.947 711 HG SER 122 HG SER 122 -11.959 -12.605 12.823 712 H ASP 123 H ASP 123 -9.283 -11.375 9.434 713 HA ASP 123 HA ASP 123 -11.867 -12.327 8.501 714 HB2 ASP 123 1HB ASP 123 -11.103 -9.426 8.480 715 HB3 ASP 123 2HB ASP 123 -12.151 -10.074 7.232 716 H SER 124 H SER 124 -10.468 -13.823 7.403 717 HA SER 124 HA SER 124 -8.473 -13.085 5.574 718 HB2 SER 124 1HB SER 124 -8.830 -15.398 6.437 719 HB3 SER 124 2HB SER 124 -10.268 -15.522 5.426 720 HG SER 124 HG SER 124 -7.772 -16.034 4.757 721 H ALA 125 H ALA 125 -11.959 -13.197 5.252 722 HA ALA 125 HA ALA 125 -12.150 -13.194 2.453 723 HB1 ALA 125 1HB ALA 125 -14.415 -12.400 2.764 724 HB2 ALA 125 2HB ALA 125 -14.051 -11.946 4.429 725 HB3 ALA 125 3HB ALA 125 -14.043 -13.645 3.956 726 H LEU 126 H LEU 126 -11.854 -10.559 4.777 727 HA LEU 126 HA LEU 126 -12.132 -8.463 2.895 728 HB2 LEU 126 1HB LEU 126 -10.736 -8.491 5.568 729 HB3 LEU 126 2HB LEU 126 -11.114 -7.049 4.649 730 HG LEU 126 HG LEU 126 -13.118 -8.961 5.854 731 HD11 LEU 126 1HD1 LEU 126 -12.345 -6.146 6.601 732 HD12 LEU 126 2HD1 LEU 126 -11.998 -7.605 7.522 733 HD13 LEU 126 3HD1 LEU 126 -13.662 -7.070 7.314 734 HD21 LEU 126 1HD2 LEU 126 -13.568 -6.385 4.354 735 HD22 LEU 126 2HD2 LEU 126 -14.807 -7.354 5.148 736 HD23 LEU 126 3HD2 LEU 126 -13.935 -8.001 3.759 737 H GLN 127 H GLN 127 -9.457 -10.404 4.022 738 HA GLN 127 HA GLN 127 -7.379 -8.846 2.916 739 HB2 GLN 127 1HB GLN 127 -6.893 -10.567 4.567 740 HB3 GLN 127 2HB GLN 127 -7.488 -11.814 3.477 741 HG2 GLN 127 1HG GLN 127 -5.683 -11.416 1.945 742 HG3 GLN 127 2HG GLN 127 -5.128 -10.036 2.893 743 HE21 GLN 127 1HE2 GLN 127 -6.263 -13.026 4.312 744 HE22 GLN 127 2HE2 GLN 127 -4.734 -13.531 4.936 745 H GLN 128 H GLN 128 -9.271 -11.563 1.662 746 HA GLN 128 HA GLN 128 -7.911 -12.026 -0.700 747 HB2 GLN 128 1HB GLN 128 -10.834 -12.267 -0.024 748 HB3 GLN 128 2HB GLN 128 -10.194 -12.760 -1.588 749 HG2 GLN 128 1HG GLN 128 -9.304 -13.839 1.076 750 HG3 GLN 128 2HG GLN 128 -10.430 -14.630 -0.021 751 HE21 GLN 128 1HE2 GLN 128 -8.950 -13.795 -2.402 752 HE22 GLN 128 2HE2 GLN 128 -7.545 -14.794 -2.462 753 H ALA 129 H ALA 129 -10.438 -9.631 -0.074 754 HA ALA 129 HA ALA 129 -10.454 -8.643 -2.752 755 HB1 ALA 129 1HB ALA 129 -11.823 -6.823 -1.852 756 HB2 ALA 129 2HB ALA 129 -11.476 -7.377 -0.215 757 HB3 ALA 129 3HB ALA 129 -12.402 -8.400 -1.314 758 H CYS 130 H CYS 130 -8.999 -7.547 0.288 759 HA CYS 130 HA CYS 130 -7.969 -5.123 -0.735 760 HB2 CYS 130 1HB CYS 130 -8.308 -5.588 1.680 761 HB3 CYS 130 2HB CYS 130 -6.967 -6.733 1.624 762 H GLU 131 H GLU 131 -6.407 -8.267 -0.132 763 HA GLU 131 HA GLU 131 -3.844 -7.406 -0.951 764 HB2 GLU 131 1HB GLU 131 -3.136 -9.661 -0.793 765 HB3 GLU 131 2HB GLU 131 -4.320 -9.428 0.485 766 HG2 GLU 131 1HG GLU 131 -5.894 -10.748 -0.539 767 HG3 GLU 131 2HG GLU 131 -5.204 -10.509 -2.146 768 H ASP 132 H ASP 132 -6.614 -8.460 -2.719 769 HA ASP 132 HA ASP 132 -5.219 -9.308 -5.044 770 HB2 ASP 132 1HB ASP 132 -7.640 -9.825 -4.470 771 HB3 ASP 132 2HB ASP 132 -8.021 -8.188 -4.993 772 H VAL 133 H VAL 133 -6.652 -6.209 -4.079 773 HA VAL 133 HA VAL 133 -5.734 -4.897 -6.492 774 HB VAL 133 HB VAL 133 -7.000 -3.768 -3.986 775 HG11 VAL 133 1HG1 VAL 133 -6.478 -2.438 -6.643 776 HG12 VAL 133 2HG1 VAL 133 -5.656 -2.077 -5.125 777 HG13 VAL 133 3HG1 VAL 133 -7.378 -1.737 -5.299 778 HG21 VAL 133 1HG2 VAL 133 -9.001 -3.557 -5.411 779 HG22 VAL 133 2HG2 VAL 133 -8.502 -5.233 -5.188 780 HG23 VAL 133 3HG2 VAL 133 -8.147 -4.400 -6.702 781 H PHE 134 H PHE 134 -4.942 -4.827 -3.058 782 HA PHE 134 HA PHE 134 -2.659 -3.086 -3.458 783 HB2 PHE 134 1HB PHE 134 -3.879 -4.287 -0.968 784 HB3 PHE 134 2HB PHE 134 -2.422 -3.301 -0.957 785 HD1 PHE 134 HD1 PHE 134 -2.531 -0.921 -1.611 786 HD2 PHE 134 HD2 PHE 134 -6.039 -3.298 -1.209 787 HE1 PHE 134 HE1 PHE 134 -3.899 1.123 -1.519 788 HE2 PHE 134 HE2 PHE 134 -7.411 -1.260 -1.122 789 HZ PHE 134 HZ PHE 134 -6.343 0.952 -1.279 790 H ARG 135 H ARG 135 -2.619 -5.672 -4.666 791 HA ARG 135 HA ARG 135 -1.603 -7.770 -3.224 792 HB2 ARG 135 1HB ARG 135 -0.816 -8.673 -5.388 793 HB3 ARG 135 2HB ARG 135 -2.452 -8.034 -5.471 794 HG2 ARG 135 1HG ARG 135 -1.561 -5.966 -6.479 795 HG3 ARG 135 2HG ARG 135 0.049 -6.688 -6.467 796 HD2 ARG 135 1HD ARG 135 -0.987 -6.923 -8.661 797 HD3 ARG 135 2HD ARG 135 -0.758 -8.500 -7.905 798 HE ARG 135 HE ARG 135 -3.346 -7.489 -7.335 799 HH11 ARG 135 1HH1 ARG 135 -1.472 -8.922 -9.927 800 HH12 ARG 135 2HH1 ARG 135 -2.856 -9.616 -10.708 801 HH21 ARG 135 1HH2 ARG 135 -5.159 -8.395 -8.362 802 HH22 ARG 135 2HH2 ARG 135 -4.957 -9.314 -9.820 803 H PHE 136 H PHE 136 0.321 -8.609 -2.770 804 HA PHE 136 HA PHE 136 2.536 -6.721 -2.647 805 HB2 PHE 136 1HB PHE 136 3.408 -8.781 -1.162 806 HB3 PHE 136 2HB PHE 136 2.382 -7.506 -0.515 807 HD1 PHE 136 HD1 PHE 136 0.379 -8.051 0.526 808 HD2 PHE 136 HD2 PHE 136 2.196 -10.889 -2.078 809 HE1 PHE 136 HE1 PHE 136 -1.296 -9.727 1.184 810 HE2 PHE 136 HE2 PHE 136 0.527 -12.569 -1.416 811 HZ PHE 136 HZ PHE 136 -1.224 -11.987 0.211 812 H ASP 137 H ASP 137 3.899 -6.809 -4.275 813 HA ASP 137 HA ASP 137 4.217 -8.943 -6.066 814 HB2 ASP 137 1HB ASP 137 6.273 -6.803 -5.469 815 HB3 ASP 137 2HB ASP 137 6.055 -7.686 -6.975 816 H ASP 138 H ASP 138 5.980 -10.398 -6.324 817 HA ASP 138 HA ASP 138 6.725 -11.594 -3.863 818 HB2 ASP 138 1HB ASP 138 7.947 -13.243 -5.243 819 HB3 ASP 138 2HB ASP 138 6.292 -13.004 -5.787 820 H ALA 139 H ALA 139 8.090 -9.096 -5.641 821 HA ALA 139 HA ALA 139 10.780 -9.444 -4.662 822 HB1 ALA 139 1HB ALA 139 10.376 -8.235 -6.750 823 HB2 ALA 139 2HB ALA 139 11.172 -7.201 -5.564 824 HB3 ALA 139 3HB ALA 139 9.445 -7.023 -5.872 825 H ASN 140 H ASN 140 7.819 -8.113 -3.537 826 HA ASN 140 HA ASN 140 9.044 -6.506 -1.449 827 HB2 ASN 140 1HB ASN 140 6.121 -7.201 -1.864 828 HB3 ASN 140 2HB ASN 140 6.756 -5.978 -0.771 829 HD21 ASN 140 1HD2 ASN 140 4.840 -5.662 -2.858 830 HD22 ASN 140 2HD2 ASN 140 5.487 -4.521 -3.985 831 H LEU 141 H LEU 141 8.095 -9.687 -1.972 832 HA LEU 141 HA LEU 141 7.446 -10.250 0.804 833 HB2 LEU 141 1HB LEU 141 7.433 -12.009 -1.650 834 HB3 LEU 141 2HB LEU 141 6.953 -12.535 -0.046 835 HG LEU 141 HG LEU 141 5.572 -10.428 -1.716 836 HD11 LEU 141 1HD1 LEU 141 5.217 -12.707 -2.525 837 HD12 LEU 141 2HD1 LEU 141 3.747 -12.038 -1.823 838 HD13 LEU 141 3HD1 LEU 141 4.704 -13.203 -0.912 839 HD21 LEU 141 1HD2 LEU 141 4.937 -11.504 1.031 840 HD22 LEU 141 2HD2 LEU 141 3.850 -10.509 0.065 841 HD23 LEU 141 3HD2 LEU 141 5.387 -9.849 0.617 842 H VAL 142 H VAL 142 8.312 -12.678 1.265 843 HA VAL 142 HA VAL 142 11.239 -12.472 1.108 844 HB VAL 142 HB VAL 142 10.422 -12.325 3.408 845 HG11 VAL 142 1HG1 VAL 142 9.265 -14.220 4.474 846 HG12 VAL 142 2HG1 VAL 142 9.118 -14.994 2.894 847 HG13 VAL 142 3HG1 VAL 142 8.303 -13.461 3.206 848 HG21 VAL 142 1HG2 VAL 142 11.744 -14.972 2.826 849 HG22 VAL 142 2HG2 VAL 142 11.679 -14.191 4.406 850 HG23 VAL 142 3HG2 VAL 142 12.551 -13.423 3.081 851 HA PRO 143 HA PRO 143 11.008 -16.028 -1.544 852 HB2 PRO 143 1HB PRO 143 13.605 -16.876 -1.203 853 HB3 PRO 143 2HB PRO 143 13.111 -15.603 -2.319 854 HG2 PRO 143 1HG PRO 143 14.295 -15.382 0.410 855 HG3 PRO 143 2HG PRO 143 14.601 -14.395 -1.030 856 HD2 PRO 143 1HD PRO 143 13.029 -13.543 0.990 857 HD3 PRO 143 2HD PRO 143 12.710 -13.104 -0.699 858 H ARG 144 H ARG 144 10.372 -18.064 -1.191 859 HA ARG 144 HA ARG 144 11.036 -19.272 1.412 860 HB2 ARG 144 1HB ARG 144 8.418 -19.470 -0.097 861 HB3 ARG 144 2HB ARG 144 8.802 -20.330 1.383 862 HG2 ARG 144 1HG ARG 144 8.685 -17.333 1.137 863 HG3 ARG 144 2HG ARG 144 7.375 -18.349 1.740 864 HD2 ARG 144 1HD ARG 144 10.115 -17.991 2.957 865 HD3 ARG 144 2HD ARG 144 8.574 -17.444 3.614 866 HE ARG 144 HE ARG 144 8.230 -20.118 3.380 867 HH11 ARG 144 1HH1 ARG 144 10.681 -18.140 4.905 868 HH12 ARG 144 2HH1 ARG 144 11.046 -19.314 6.128 869 HH21 ARG 144 1HH2 ARG 144 8.711 -21.666 4.974 870 HH22 ARG 144 2HH2 ARG 144 9.929 -21.327 6.164 871 H GLY 145 H GLY 145 11.850 -21.296 1.354 872 HA2 GLY 145 1HA GLY 145 12.339 -23.410 0.541 873 HA3 GLY 145 2HA GLY 145 11.257 -23.102 -0.810 874 H SER 146 H SER 146 14.520 -22.868 0.367 875 HA SER 146 HA SER 146 15.589 -21.421 -1.827 876 HB2 SER 146 1HB SER 146 16.995 -23.328 0.061 877 HB3 SER 146 2HB SER 146 17.763 -22.105 -0.951 878 HG SER 146 HG SER 146 16.294 -20.596 0.264 879 H GLY 147 H GLY 147 15.836 -22.105 -3.840 880 HA2 GLY 147 1HA GLY 147 16.714 -23.561 -5.487 881 HA3 GLY 147 2HA GLY 147 16.607 -24.884 -4.336 882 H LEU 148 H LEU 148 13.850 -24.230 -3.584 883 HA LEU 148 HA LEU 148 12.582 -25.528 -5.872 884 HB2 LEU 148 1HB LEU 148 11.545 -25.100 -3.065 885 HB3 LEU 148 2HB LEU 148 10.751 -26.038 -4.315 886 HG LEU 148 HG LEU 148 13.380 -26.710 -2.986 887 HD11 LEU 148 1HD1 LEU 148 12.167 -28.578 -2.025 888 HD12 LEU 148 2HD1 LEU 148 10.688 -28.056 -2.831 889 HD13 LEU 148 3HD1 LEU 148 11.405 -27.055 -1.570 890 HD21 LEU 148 1HD2 LEU 148 13.182 -28.842 -4.230 891 HD22 LEU 148 2HD2 LEU 148 13.443 -27.450 -5.278 892 HD23 LEU 148 3HD2 LEU 148 11.833 -28.157 -5.133 893 H GLU 149 H GLU 149 12.356 -23.735 -7.218 894 HA GLU 149 HA GLU 149 10.554 -21.628 -6.300 895 HB2 GLU 149 1HB GLU 149 12.674 -21.082 -7.574 896 HB3 GLU 149 2HB GLU 149 11.938 -21.842 -8.980 897 HG2 GLU 149 1HG GLU 149 11.724 -19.400 -8.995 898 HG3 GLU 149 2HG GLU 149 10.163 -20.221 -8.989 899 H HIS 150 H HIS 150 10.792 -24.339 -8.470 900 HA HIS 150 HA HIS 150 8.034 -23.924 -9.364 901 HB2 HIS 150 1HB HIS 150 10.186 -25.829 -10.307 902 HB3 HIS 150 2HB HIS 150 8.530 -25.862 -10.897 903 HD1 HIS 150 HD1 HIS 150 11.686 -24.649 -11.870 904 HD2 HIS 150 HD2 HIS 150 7.856 -23.039 -11.885 905 HE1 HIS 150 HE1 HIS 150 11.751 -22.770 -13.533 906 HE2 HIS 150 HE2 HIS 150 9.486 -21.684 -13.359 907 H HIS 151 H HIS 151 6.412 -25.081 -8.518 908 HA HIS 151 HA HIS 151 7.042 -26.775 -6.264 909 HB2 HIS 151 1HB HIS 151 5.162 -25.029 -6.399 910 HB3 HIS 151 2HB HIS 151 4.299 -26.203 -7.382 911 HD1 HIS 151 HD1 HIS 151 4.691 -25.140 -3.994 912 HD2 HIS 151 HD2 HIS 151 3.958 -28.774 -5.871 913 HE1 HIS 151 HE1 HIS 151 3.746 -26.646 -2.212 914 HE2 HIS 151 HE2 HIS 151 3.421 -28.873 -3.340 915 H HIS 152 H HIS 152 7.709 -28.769 -6.796 916 HA HIS 152 HA HIS 152 5.841 -30.435 -8.328 917 HB2 HIS 152 1HB HIS 152 8.806 -30.193 -8.829 918 HB3 HIS 152 2HB HIS 152 7.903 -31.629 -9.291 919 HD1 HIS 152 HD1 HIS 152 6.603 -31.535 -11.440 920 HD2 HIS 152 HD2 HIS 152 8.032 -27.817 -10.257 921 HE1 HIS 152 HE1 HIS 152 6.160 -29.996 -13.373 922 HE2 HIS 152 HE2 HIS 152 7.214 -27.807 -12.711 923 H HIS 153 H HIS 153 8.950 -30.656 -6.609 924 HA HIS 153 HA HIS 153 7.956 -33.033 -5.218 925 HB2 HIS 153 1HB HIS 153 10.740 -31.853 -5.385 926 HB3 HIS 153 2HB HIS 153 10.319 -33.291 -4.462 927 HD1 HIS 153 HD1 HIS 153 10.630 -35.438 -5.672 928 HD2 HIS 153 HD2 HIS 153 10.148 -32.238 -8.277 929 HE1 HIS 153 HE1 HIS 153 10.940 -36.389 -7.973 930 HE2 HIS 153 HE2 HIS 153 10.837 -34.401 -9.510 931 H HIS 154 H HIS 154 6.491 -31.326 -4.230 932 HA HIS 154 HA HIS 154 5.786 -30.192 -2.408 933 HB2 HIS 154 1HB HIS 154 8.381 -31.144 -1.169 934 HB3 HIS 154 2HB HIS 154 7.079 -30.356 -0.288 935 HD1 HIS 154 HD1 HIS 154 8.334 -33.489 -0.360 936 HD2 HIS 154 HD2 HIS 154 4.534 -32.073 -1.274 937 HE1 HIS 154 HE1 HIS 154 6.801 -35.465 -0.119 938 HE2 HIS 154 HE2 HIS 154 4.527 -34.616 -0.784 939 H HIS 155 H HIS 155 7.222 -28.614 -0.565 940 HA HIS 155 HA HIS 155 9.015 -26.857 -1.925 941 HB2 HIS 155 1HB HIS 155 6.921 -26.107 -2.961 942 HB3 HIS 155 2HB HIS 155 6.198 -25.890 -1.370 943 HD1 HIS 155 HD1 HIS 155 6.211 -23.541 -0.606 944 HD2 HIS 155 HD2 HIS 155 9.373 -24.343 -3.183 945 HE1 HIS 155 HE1 HIS 155 7.415 -21.355 -0.901 946 HE2 HIS 155 HE2 HIS 155 9.399 -21.891 -2.357 Start of MODEL 6 1 H1 MET 24 1H MET 24 -15.911 -13.543 -2.319 2 H2 MET 24 2H MET 24 -16.865 -14.724 -1.579 3 H3 MET 24 3H MET 24 -17.568 -13.281 -2.109 4 HA MET 24 HA MET 24 -16.321 -15.318 -3.849 5 HB2 MET 24 1HB MET 24 -19.224 -14.663 -3.324 6 HB3 MET 24 2HB MET 24 -18.666 -15.691 -4.636 7 HG2 MET 24 1HG MET 24 -18.269 -16.212 -1.699 8 HG3 MET 24 2HG MET 24 -19.458 -16.992 -2.738 9 HE1 MET 24 1HE MET 24 -17.975 -17.519 -5.402 10 HE2 MET 24 2HE MET 24 -18.890 -18.782 -4.581 11 HE3 MET 24 3HE MET 24 -17.250 -19.105 -5.141 12 H GLU 25 H GLU 25 -15.110 -13.609 -4.805 13 HA GLU 25 HA GLU 25 -14.669 -11.944 -6.274 14 HB2 GLU 25 1HB GLU 25 -17.055 -13.263 -7.541 15 HB3 GLU 25 2HB GLU 25 -16.173 -11.966 -8.335 16 HG2 GLU 25 1HG GLU 25 -14.127 -13.299 -8.233 17 HG3 GLU 25 2HG GLU 25 -15.020 -14.604 -7.455 18 H ASN 26 H ASN 26 -15.247 -10.431 -4.517 19 HA ASN 26 HA ASN 26 -17.713 -8.964 -4.784 20 HB2 ASN 26 1HB ASN 26 -15.195 -8.338 -3.206 21 HB3 ASN 26 2HB ASN 26 -16.701 -7.434 -3.099 22 HD21 ASN 26 1HD2 ASN 26 -15.024 -10.318 -2.207 23 HD22 ASN 26 2HD2 ASN 26 -16.219 -10.914 -1.106 24 H TYR 27 H TYR 27 -17.428 -8.536 -7.106 25 HA TYR 27 HA TYR 27 -15.187 -7.131 -8.093 26 HB2 TYR 27 1HB TYR 27 -16.539 -8.488 -9.582 27 HB3 TYR 27 2HB TYR 27 -17.940 -7.461 -9.296 28 HD1 TYR 27 HD1 TYR 27 -18.440 -5.924 -10.952 29 HD2 TYR 27 HD2 TYR 27 -14.379 -7.072 -10.392 30 HE1 TYR 27 HE1 TYR 27 -17.774 -4.466 -12.816 31 HE2 TYR 27 HE2 TYR 27 -13.706 -5.618 -12.257 32 HH TYR 27 HH TYR 27 -15.822 -3.299 -13.626 33 H LEU 28 H LEU 28 -18.302 -6.031 -6.869 34 HA LEU 28 HA LEU 28 -18.025 -3.350 -7.796 35 HB2 LEU 28 1HB LEU 28 -19.698 -4.504 -5.563 36 HB3 LEU 28 2HB LEU 28 -19.796 -2.839 -6.099 37 HG LEU 28 HG LEU 28 -20.429 -5.255 -7.800 38 HD11 LEU 28 1HD1 LEU 28 -22.251 -3.233 -6.508 39 HD12 LEU 28 2HD1 LEU 28 -22.071 -4.921 -6.034 40 HD13 LEU 28 3HD1 LEU 28 -22.748 -4.515 -7.612 41 HD21 LEU 28 1HD2 LEU 28 -19.595 -3.416 -9.143 42 HD22 LEU 28 2HD2 LEU 28 -20.703 -2.300 -8.347 43 HD23 LEU 28 3HD2 LEU 28 -21.334 -3.589 -9.375 44 H ARG 29 H ARG 29 -17.300 -4.999 -4.761 45 HA ARG 29 HA ARG 29 -16.198 -2.762 -3.434 46 HB2 ARG 29 1HB ARG 29 -16.801 -4.758 -2.193 47 HB3 ARG 29 2HB ARG 29 -15.659 -5.722 -3.118 48 HG2 ARG 29 1HG ARG 29 -13.816 -4.395 -2.180 49 HG3 ARG 29 2HG ARG 29 -14.982 -3.511 -1.194 50 HD2 ARG 29 1HD ARG 29 -14.467 -6.482 -1.093 51 HD3 ARG 29 2HD ARG 29 -13.887 -5.294 0.076 52 HE ARG 29 HE ARG 29 -16.601 -4.961 0.043 53 HH11 ARG 29 1HH1 ARG 29 -14.478 -7.694 0.569 54 HH12 ARG 29 2HH1 ARG 29 -15.536 -8.462 1.708 55 HH21 ARG 29 1HH2 ARG 29 -17.994 -5.967 1.550 56 HH22 ARG 29 2HH2 ARG 29 -17.534 -7.481 2.267 57 H LYS 30 H LYS 30 -14.872 -5.205 -5.581 58 HA LYS 30 HA LYS 30 -12.168 -4.621 -5.351 59 HB2 LYS 30 1HB LYS 30 -13.142 -6.558 -6.602 60 HB3 LYS 30 2HB LYS 30 -13.598 -5.447 -7.887 61 HG2 LYS 30 1HG LYS 30 -11.595 -6.458 -8.585 62 HG3 LYS 30 2HG LYS 30 -11.155 -4.833 -8.055 63 HD2 LYS 30 1HD LYS 30 -9.512 -6.220 -7.125 64 HD3 LYS 30 2HD LYS 30 -10.631 -5.908 -5.797 65 HE2 LYS 30 1HE LYS 30 -10.111 -8.235 -5.757 66 HE3 LYS 30 2HE LYS 30 -11.762 -8.072 -6.358 67 HZ1 LYS 30 1HZ LYS 30 -9.358 -8.437 -8.066 68 HZ2 LYS 30 2HZ LYS 30 -10.966 -8.376 -8.599 69 HZ3 LYS 30 3HZ LYS 30 -10.442 -9.669 -7.641 70 H ALA 31 H ALA 31 -14.541 -3.278 -7.697 71 HA ALA 31 HA ALA 31 -12.858 -1.471 -8.930 72 HB1 ALA 31 1HB ALA 31 -14.881 -0.255 -9.552 73 HB2 ALA 31 2HB ALA 31 -15.796 -1.153 -8.341 74 HB3 ALA 31 3HB ALA 31 -15.102 -1.995 -9.727 75 H ALA 32 H ALA 32 -14.641 -1.149 -5.905 76 HA ALA 32 HA ALA 32 -14.133 1.615 -5.536 77 HB1 ALA 32 1HB ALA 32 -14.803 1.227 -3.213 78 HB2 ALA 32 2HB ALA 32 -14.723 -0.513 -3.481 79 HB3 ALA 32 3HB ALA 32 -15.919 0.457 -4.341 80 H LEU 33 H LEU 33 -12.494 -1.322 -4.475 81 HA LEU 33 HA LEU 33 -10.460 -0.017 -2.984 82 HB2 LEU 33 1HB LEU 33 -10.364 -2.719 -4.341 83 HB3 LEU 33 2HB LEU 33 -9.296 -2.164 -3.062 84 HG LEU 33 HG LEU 33 -12.260 -2.697 -2.803 85 HD11 LEU 33 1HD1 LEU 33 -10.938 -4.725 -2.994 86 HD12 LEU 33 2HD1 LEU 33 -11.568 -4.533 -1.357 87 HD13 LEU 33 3HD1 LEU 33 -9.876 -4.171 -1.700 88 HD21 LEU 33 1HD2 LEU 33 -11.589 -0.854 -1.365 89 HD22 LEU 33 2HD2 LEU 33 -10.260 -1.819 -0.725 90 HD23 LEU 33 3HD2 LEU 33 -11.928 -2.298 -0.412 91 H THR 34 H THR 34 -10.751 -1.083 -6.320 92 HA THR 34 HA THR 34 -8.107 -0.510 -7.124 93 HB THR 34 HB THR 34 -10.600 -0.448 -8.837 94 HG1 THR 34 HG1 THR 34 -10.215 -2.452 -7.629 95 HG21 THR 34 1HG2 THR 34 -7.694 -0.878 -9.535 96 HG22 THR 34 2HG2 THR 34 -8.671 0.532 -9.944 97 HG23 THR 34 3HG2 THR 34 -9.043 -1.036 -10.657 98 H ASP 35 H ASP 35 -11.055 1.405 -6.956 99 HA ASP 35 HA ASP 35 -10.044 3.673 -8.339 100 HB2 ASP 35 1HB ASP 35 -12.451 3.319 -8.088 101 HB3 ASP 35 2HB ASP 35 -12.305 3.457 -6.338 102 H MET 36 H MET 36 -10.225 2.742 -4.945 103 HA MET 36 HA MET 36 -9.125 5.094 -3.863 104 HB2 MET 36 1HB MET 36 -10.154 3.451 -2.409 105 HB3 MET 36 2HB MET 36 -8.965 2.239 -2.868 106 HG2 MET 36 1HG MET 36 -8.510 3.174 -0.664 107 HG3 MET 36 2HG MET 36 -7.209 3.513 -1.808 108 HE1 MET 36 1HE MET 36 -6.161 5.382 -0.343 109 HE2 MET 36 2HE MET 36 -7.357 5.068 0.914 110 HE3 MET 36 3HE MET 36 -7.066 6.719 0.365 111 H LEU 37 H LEU 37 -7.625 2.143 -5.103 112 HA LEU 37 HA LEU 37 -4.951 2.839 -4.574 113 HB2 LEU 37 1HB LEU 37 -5.998 0.597 -5.339 114 HB3 LEU 37 2HB LEU 37 -5.842 1.244 -6.966 115 HG LEU 37 HG LEU 37 -4.031 -0.314 -6.386 116 HD11 LEU 37 1HD1 LEU 37 -3.116 2.525 -6.771 117 HD12 LEU 37 2HD1 LEU 37 -3.535 1.364 -8.030 118 HD13 LEU 37 3HD1 LEU 37 -2.118 1.093 -7.019 119 HD21 LEU 37 1HD2 LEU 37 -3.947 0.157 -3.978 120 HD22 LEU 37 2HD2 LEU 37 -3.200 1.719 -4.324 121 HD23 LEU 37 3HD2 LEU 37 -2.358 0.227 -4.737 122 H GLN 38 H GLN 38 -7.004 3.353 -7.434 123 HA GLN 38 HA GLN 38 -5.046 4.589 -9.030 124 HB2 GLN 38 1HB GLN 38 -8.052 4.907 -9.097 125 HB3 GLN 38 2HB GLN 38 -6.956 5.484 -10.345 126 HG2 GLN 38 1HG GLN 38 -7.512 2.636 -9.563 127 HG3 GLN 38 2HG GLN 38 -7.919 3.439 -11.077 128 HE21 GLN 38 1HE2 GLN 38 -5.416 1.971 -9.200 129 HE22 GLN 38 2HE2 GLN 38 -4.226 1.888 -10.454 130 H THR 39 H THR 39 -7.310 5.901 -6.674 131 HA THR 39 HA THR 39 -6.671 8.639 -7.234 132 HB THR 39 HB THR 39 -7.914 7.504 -4.719 133 HG1 THR 39 HG1 THR 39 -9.194 6.816 -6.407 134 HG21 THR 39 1HG2 THR 39 -7.196 9.854 -4.573 135 HG22 THR 39 2HG2 THR 39 -8.954 9.709 -4.529 136 HG23 THR 39 3HG2 THR 39 -8.148 10.229 -6.010 137 H PHE 40 H PHE 40 -5.397 6.143 -5.191 138 HA PHE 40 HA PHE 40 -3.942 7.816 -3.418 139 HB2 PHE 40 1HB PHE 40 -4.620 5.429 -2.976 140 HB3 PHE 40 2HB PHE 40 -3.350 4.936 -4.093 141 HD1 PHE 40 HD1 PHE 40 -1.823 3.828 -2.763 142 HD2 PHE 40 HD2 PHE 40 -3.278 7.632 -1.530 143 HE1 PHE 40 HE1 PHE 40 -0.182 3.862 -0.943 144 HE2 PHE 40 HE2 PHE 40 -1.633 7.677 0.294 145 HZ PHE 40 HZ PHE 40 -0.078 5.786 0.591 146 H VAL 41 H VAL 41 -3.208 6.319 -6.510 147 HA VAL 41 HA VAL 41 -0.448 6.515 -6.524 148 HB VAL 41 HB VAL 41 -2.312 6.834 -8.878 149 HG11 VAL 41 1HG1 VAL 41 -0.099 7.713 -9.395 150 HG12 VAL 41 2HG1 VAL 41 -0.390 6.198 -10.250 151 HG13 VAL 41 3HG1 VAL 41 0.638 6.218 -8.816 152 HG21 VAL 41 1HG2 VAL 41 -1.781 4.457 -9.263 153 HG22 VAL 41 2HG2 VAL 41 -2.620 4.727 -7.736 154 HG23 VAL 41 3HG2 VAL 41 -0.879 4.436 -7.748 155 HA PRO 42 HA PRO 42 -0.936 11.137 -8.295 156 HB2 PRO 42 1HB PRO 42 -3.391 11.745 -6.719 157 HB3 PRO 42 2HB PRO 42 -2.862 12.389 -8.278 158 HG2 PRO 42 1HG PRO 42 -4.791 10.559 -8.140 159 HG3 PRO 42 2HG PRO 42 -3.590 10.534 -9.444 160 HD2 PRO 42 1HD PRO 42 -3.815 8.790 -7.040 161 HD3 PRO 42 2HD PRO 42 -3.237 8.401 -8.670 162 H TYR 43 H TYR 43 -1.795 9.891 -5.087 163 HA TYR 43 HA TYR 43 -0.673 12.180 -3.708 164 HB2 TYR 43 1HB TYR 43 -1.624 9.460 -2.774 165 HB3 TYR 43 2HB TYR 43 -0.847 10.617 -1.694 166 HD1 TYR 43 HD1 TYR 43 -3.878 9.897 -3.653 167 HD2 TYR 43 HD2 TYR 43 -2.000 12.599 -0.954 168 HE1 TYR 43 HE1 TYR 43 -6.047 10.959 -3.215 169 HE2 TYR 43 HE2 TYR 43 -4.168 13.670 -0.512 170 HH TYR 43 HH TYR 43 -7.119 12.290 -1.449 171 H ARG 44 H ARG 44 0.190 8.932 -4.647 172 HA ARG 44 HA ARG 44 2.607 8.692 -3.261 173 HB2 ARG 44 1HB ARG 44 1.660 7.410 -5.814 174 HB3 ARG 44 2HB ARG 44 3.197 7.013 -5.060 175 HG2 ARG 44 1HG ARG 44 0.450 6.629 -3.899 176 HG3 ARG 44 2HG ARG 44 1.573 5.375 -4.437 177 HD2 ARG 44 1HD ARG 44 1.821 7.193 -2.048 178 HD3 ARG 44 2HD ARG 44 1.747 5.435 -2.070 179 HE ARG 44 HE ARG 44 4.005 6.270 -3.522 180 HH11 ARG 44 1HH1 ARG 44 2.821 6.106 -0.230 181 HH12 ARG 44 2HH1 ARG 44 4.405 6.128 0.479 182 HH21 ARG 44 1HH2 ARG 44 6.083 6.308 -2.617 183 HH22 ARG 44 2HH2 ARG 44 6.264 6.235 -0.886 184 H THR 45 H THR 45 1.939 9.905 -6.536 185 HA THR 45 HA THR 45 4.451 10.435 -7.410 186 HB THR 45 HB THR 45 2.116 12.330 -7.693 187 HG1 THR 45 HG1 THR 45 2.758 9.863 -8.946 188 HG21 THR 45 1HG2 THR 45 4.455 11.775 -9.524 189 HG22 THR 45 2HG2 THR 45 4.239 13.223 -8.540 190 HG23 THR 45 3HG2 THR 45 3.119 12.876 -9.858 191 H ALA 46 H ALA 46 2.584 12.471 -5.168 192 HA ALA 46 HA ALA 46 4.476 14.553 -4.943 193 HB1 ALA 46 1HB ALA 46 3.295 15.128 -2.861 194 HB2 ALA 46 2HB ALA 46 2.432 13.590 -2.934 195 HB3 ALA 46 3HB ALA 46 2.173 14.808 -4.184 196 H VAL 47 H VAL 47 4.037 11.531 -3.320 197 HA VAL 47 HA VAL 47 6.057 11.928 -1.313 198 HB VAL 47 HB VAL 47 4.759 9.351 -2.228 199 HG11 VAL 47 1HG1 VAL 47 5.549 8.445 -0.085 200 HG12 VAL 47 2HG1 VAL 47 6.398 9.959 0.233 201 HG13 VAL 47 3HG1 VAL 47 6.888 8.941 -1.121 202 HG21 VAL 47 1HG2 VAL 47 3.145 10.945 -1.328 203 HG22 VAL 47 2HG2 VAL 47 4.135 11.144 0.118 204 HG23 VAL 47 3HG2 VAL 47 3.374 9.590 -0.223 205 H GLU 48 H GLU 48 5.919 10.311 -4.447 206 HA GLU 48 HA GLU 48 8.484 9.123 -4.305 207 HB2 GLU 48 1HB GLU 48 6.922 9.931 -6.772 208 HB3 GLU 48 2HB GLU 48 8.291 8.833 -6.739 209 HG2 GLU 48 1HG GLU 48 5.595 8.381 -5.479 210 HG3 GLU 48 2HG GLU 48 6.232 7.599 -6.924 211 H LEU 49 H LEU 49 7.325 12.262 -5.344 212 HA LEU 49 HA LEU 49 9.687 13.095 -6.636 213 HB2 LEU 49 1HB LEU 49 7.194 14.341 -5.749 214 HB3 LEU 49 2HB LEU 49 8.572 15.428 -5.754 215 HG LEU 49 HG LEU 49 7.334 15.567 -7.851 216 HD11 LEU 49 1HD1 LEU 49 9.755 15.938 -7.853 217 HD12 LEU 49 2HD1 LEU 49 9.182 15.277 -9.381 218 HD13 LEU 49 3HD1 LEU 49 10.008 14.234 -8.229 219 HD21 LEU 49 1HD2 LEU 49 7.264 13.689 -9.406 220 HD22 LEU 49 2HD2 LEU 49 6.420 13.303 -7.905 221 HD23 LEU 49 3HD2 LEU 49 8.034 12.657 -8.203 222 H CYS 50 H CYS 50 8.547 13.606 -3.291 223 HA CYS 50 HA CYS 50 10.903 15.043 -2.572 224 HB2 CYS 50 1HB CYS 50 10.162 14.597 -0.207 225 HB3 CYS 50 2HB CYS 50 8.972 15.404 -1.219 226 H ALA 51 H ALA 51 9.908 11.674 -2.386 227 HA ALA 51 HA ALA 51 12.102 10.545 -1.147 228 HB1 ALA 51 1HB ALA 51 10.573 9.430 -3.492 229 HB2 ALA 51 2HB ALA 51 10.141 9.257 -1.791 230 HB3 ALA 51 3HB ALA 51 11.613 8.509 -2.409 231 H LEU 52 H LEU 52 11.827 11.716 -4.447 232 HA LEU 52 HA LEU 52 14.391 10.657 -5.231 233 HB2 LEU 52 1HB LEU 52 12.490 12.586 -6.564 234 HB3 LEU 52 2HB LEU 52 14.014 12.101 -7.276 235 HG LEU 52 HG LEU 52 11.780 10.184 -6.591 236 HD11 LEU 52 1HD1 LEU 52 12.554 11.388 -9.244 237 HD12 LEU 52 2HD1 LEU 52 11.078 11.720 -8.340 238 HD13 LEU 52 3HD1 LEU 52 11.365 10.111 -9.001 239 HD21 LEU 52 1HD2 LEU 52 14.343 9.853 -8.145 240 HD22 LEU 52 2HD2 LEU 52 13.052 8.656 -8.058 241 HD23 LEU 52 3HD2 LEU 52 13.938 9.103 -6.601 242 H GLU 53 H GLU 53 13.146 13.636 -3.957 243 HA GLU 53 HA GLU 53 15.260 15.343 -4.724 244 HB2 GLU 53 1HB GLU 53 12.879 15.896 -3.841 245 HB3 GLU 53 2HB GLU 53 13.616 15.769 -2.249 246 HG2 GLU 53 1HG GLU 53 13.597 18.062 -2.891 247 HG3 GLU 53 2HG GLU 53 15.264 17.491 -2.937 248 H HIS 54 H HIS 54 14.765 13.232 -1.996 249 HA HIS 54 HA HIS 54 17.377 14.068 -0.889 250 HB2 HIS 54 1HB HIS 54 15.521 14.350 0.685 251 HB3 HIS 54 2HB HIS 54 15.073 12.662 0.490 252 HD1 HIS 54 HD1 HIS 54 18.042 14.695 1.742 253 HD2 HIS 54 HD2 HIS 54 16.181 11.027 2.338 254 HE1 HIS 54 HE1 HIS 54 19.254 13.626 3.668 255 HE2 HIS 54 HE2 HIS 54 17.987 11.500 4.127 256 H GLY 55 H GLY 55 15.765 11.643 -2.553 257 HA2 GLY 55 1HA GLY 55 16.547 9.686 -3.468 258 HA3 GLY 55 2HA GLY 55 18.027 9.859 -2.533 259 H GLY 56 H GLY 56 16.585 10.110 0.036 260 HA2 GLY 56 1HA GLY 56 15.041 7.611 0.097 261 HA3 GLY 56 2HA GLY 56 15.826 8.343 1.489 262 H LEU 57 H LEU 57 13.079 7.504 1.231 263 HA LEU 57 HA LEU 57 11.400 9.782 0.829 264 HB2 LEU 57 1HB LEU 57 10.724 7.197 2.225 265 HB3 LEU 57 2HB LEU 57 9.596 8.372 1.574 266 HG LEU 57 HG LEU 57 11.148 7.704 -0.611 267 HD11 LEU 57 1HD1 LEU 57 10.594 5.229 1.008 268 HD12 LEU 57 2HD1 LEU 57 12.179 5.866 0.571 269 HD13 LEU 57 3HD1 LEU 57 11.101 5.253 -0.680 270 HD21 LEU 57 1HD2 LEU 57 9.135 6.540 -1.379 271 HD22 LEU 57 2HD2 LEU 57 8.754 8.082 -0.612 272 HD23 LEU 57 3HD2 LEU 57 8.498 6.575 0.264 273 H ASP 58 H ASP 58 13.468 9.062 3.251 274 HA ASP 58 HA ASP 58 12.246 9.437 5.653 275 HB2 ASP 58 1HB ASP 58 14.593 8.994 5.556 276 HB3 ASP 58 2HB ASP 58 14.901 10.494 4.690 277 H THR 59 H THR 59 12.977 11.946 3.275 278 HA THR 59 HA THR 59 12.269 14.113 4.982 279 HB THR 59 HB THR 59 13.802 14.444 3.110 280 HG1 THR 59 HG1 THR 59 11.366 15.876 3.144 281 HG21 THR 59 1HG2 THR 59 11.417 13.825 1.367 282 HG22 THR 59 2HG2 THR 59 12.891 12.868 1.509 283 HG23 THR 59 3HG2 THR 59 12.949 14.475 0.789 284 H CYS 60 H CYS 60 10.378 11.801 3.465 285 HA CYS 60 HA CYS 60 8.221 13.637 2.758 286 HB2 CYS 60 1HB CYS 60 8.408 10.644 2.364 287 HB3 CYS 60 2HB CYS 60 7.200 11.718 1.663 288 H ASP 61 H ASP 61 8.130 14.066 5.155 289 HA ASP 61 HA ASP 61 6.493 12.100 6.585 290 HB2 ASP 61 1HB ASP 61 8.358 12.977 7.852 291 HB3 ASP 61 2HB ASP 61 7.887 14.632 7.478 292 H GLY 62 H GLY 62 4.358 12.400 6.920 293 HA2 GLY 62 1HA GLY 62 2.995 14.450 5.479 294 HA3 GLY 62 2HA GLY 62 2.257 13.270 6.553 295 H GLY 63 H GLY 63 3.696 16.431 6.304 296 HA2 GLY 63 1HA GLY 63 2.432 18.048 7.814 297 HA3 GLY 63 2HA GLY 63 2.967 16.981 9.106 298 H SER 64 H SER 64 5.424 16.938 6.933 299 HA SER 64 HA SER 64 6.682 19.404 7.888 300 HB2 SER 64 1HB SER 64 8.084 16.727 8.027 301 HB3 SER 64 2HB SER 64 8.656 18.274 8.654 302 HG SER 64 HG SER 64 6.691 16.534 9.659 303 H ASN 65 H ASN 65 8.810 19.779 6.716 304 HA ASN 65 HA ASN 65 9.955 20.111 4.796 305 HB2 ASN 65 1HB ASN 65 9.302 17.181 4.555 306 HB3 ASN 65 2HB ASN 65 10.369 18.015 3.428 307 HD21 ASN 65 1HD2 ASN 65 10.839 15.856 5.466 308 HD22 ASN 65 2HD2 ASN 65 12.163 16.441 6.421 309 H GLY 66 H GLY 66 7.261 20.916 4.622 310 HA2 GLY 66 1HA GLY 66 6.075 21.922 2.895 311 HA3 GLY 66 2HA GLY 66 7.063 21.038 1.739 312 H ILE 67 H ILE 67 6.301 18.568 3.465 313 HA ILE 67 HA ILE 67 4.056 17.820 1.818 314 HB ILE 67 HB ILE 67 5.403 16.256 4.031 315 HG12 ILE 67 1HG1 ILE 67 7.005 16.822 2.244 316 HG13 ILE 67 2HG1 ILE 67 6.645 15.100 2.256 317 HG21 ILE 67 1HG2 ILE 67 3.638 15.312 1.776 318 HG22 ILE 67 2HG2 ILE 67 3.152 15.468 3.463 319 HG23 ILE 67 3HG2 ILE 67 4.391 14.298 3.007 320 HD11 ILE 67 1HD1 ILE 67 5.534 17.142 0.350 321 HD12 ILE 67 2HD1 ILE 67 5.088 15.437 0.389 322 HD13 ILE 67 3HD1 ILE 67 6.741 15.907 -0.004 323 HA PRO 68 HA PRO 68 1.278 19.202 5.024 324 HB2 PRO 68 1HB PRO 68 -1.034 18.702 3.731 325 HB3 PRO 68 2HB PRO 68 0.005 20.070 3.317 326 HG2 PRO 68 1HG PRO 68 -0.305 17.439 1.945 327 HG3 PRO 68 2HG PRO 68 -0.078 19.056 1.246 328 HD2 PRO 68 1HD PRO 68 1.922 17.168 1.546 329 HD3 PRO 68 2HD PRO 68 2.203 18.920 1.409 330 H SER 69 H SER 69 0.117 18.267 6.630 331 HA SER 69 HA SER 69 0.167 15.657 7.349 332 HB2 SER 69 1HB SER 69 -2.181 17.520 7.792 333 HB3 SER 69 2HB SER 69 -1.740 16.132 8.791 334 HG SER 69 HG SER 69 -0.624 17.551 9.866 335 HA PRO 70 HA PRO 70 -1.817 13.229 4.350 336 HB2 PRO 70 1HB PRO 70 -3.130 11.445 6.071 337 HB3 PRO 70 2HB PRO 70 -1.497 11.269 5.427 338 HG2 PRO 70 1HG PRO 70 -2.392 12.293 8.073 339 HG3 PRO 70 2HG PRO 70 -0.948 11.353 7.661 340 HD2 PRO 70 1HD PRO 70 -0.787 13.972 8.179 341 HD3 PRO 70 2HD PRO 70 0.211 13.223 6.913 342 H THR 71 H THR 71 -3.513 13.719 3.208 343 HA THR 71 HA THR 71 -5.838 14.879 4.513 344 HB THR 71 HB THR 71 -6.472 15.528 2.164 345 HG1 THR 71 HG1 THR 71 -5.087 13.808 1.232 346 HG21 THR 71 1HG2 THR 71 -4.744 17.276 1.967 347 HG22 THR 71 2HG2 THR 71 -3.764 16.422 3.158 348 HG23 THR 71 3HG2 THR 71 -5.321 17.103 3.624 349 H THR 72 H THR 72 -7.704 13.874 4.694 350 HA THR 72 HA THR 72 -8.080 11.361 3.243 351 HB THR 72 HB THR 72 -9.956 11.002 4.908 352 HG1 THR 72 HG1 THR 72 -10.110 12.349 6.629 353 HG21 THR 72 1HG2 THR 72 -8.465 10.294 6.702 354 HG22 THR 72 2HG2 THR 72 -7.175 11.303 6.045 355 HG23 THR 72 3HG2 THR 72 -7.762 9.916 5.130 356 H THR 73 H THR 73 -9.488 11.245 1.675 357 HA THR 73 HA THR 73 -11.113 13.505 0.954 358 HB THR 73 HB THR 73 -11.693 12.289 -1.035 359 HG1 THR 73 HG1 THR 73 -11.013 10.048 -1.234 360 HG21 THR 73 1HG2 THR 73 -9.412 13.185 -1.009 361 HG22 THR 73 2HG2 THR 73 -9.505 11.702 -1.962 362 HG23 THR 73 3HG2 THR 73 -8.822 11.663 -0.336 363 H ARG 74 H ARG 74 -13.467 12.821 0.197 364 HA ARG 74 HA ARG 74 -14.973 12.327 2.447 365 HB2 ARG 74 1HB ARG 74 -16.896 11.988 0.988 366 HB3 ARG 74 2HB ARG 74 -15.930 13.342 0.437 367 HG2 ARG 74 1HG ARG 74 -15.738 10.588 -0.765 368 HG3 ARG 74 2HG ARG 74 -16.855 11.815 -1.347 369 HD2 ARG 74 1HD ARG 74 -14.968 13.306 -1.830 370 HD3 ARG 74 2HD ARG 74 -13.850 12.080 -1.236 371 HE ARG 74 HE ARG 74 -15.522 11.080 -3.319 372 HH11 ARG 74 1HH1 ARG 74 -12.677 13.048 -2.737 373 HH12 ARG 74 2HH1 ARG 74 -11.954 12.667 -4.269 374 HH21 ARG 74 1HH2 ARG 74 -14.571 10.596 -5.331 375 HH22 ARG 74 2HH2 ARG 74 -13.024 11.271 -5.736 376 H TYR 75 H TYR 75 -13.715 9.924 0.131 377 HA TYR 75 HA TYR 75 -15.119 7.838 1.581 378 HB2 TYR 75 1HB TYR 75 -13.503 7.812 -0.962 379 HB3 TYR 75 2HB TYR 75 -14.114 6.344 -0.196 380 HD1 TYR 75 HD1 TYR 75 -14.751 8.429 -2.802 381 HD2 TYR 75 HD2 TYR 75 -16.761 6.775 0.562 382 HE1 TYR 75 HE1 TYR 75 -16.904 8.706 -3.957 383 HE2 TYR 75 HE2 TYR 75 -18.918 7.048 -0.582 384 HH TYR 75 HH TYR 75 -19.865 8.521 -2.408 385 H VAL 76 H VAL 76 -12.026 9.295 1.687 386 HA VAL 76 HA VAL 76 -10.648 6.857 2.417 387 HB VAL 76 HB VAL 76 -9.698 9.724 2.519 388 HG11 VAL 76 1HG1 VAL 76 -8.580 8.297 4.208 389 HG12 VAL 76 2HG1 VAL 76 -7.476 8.839 2.943 390 HG13 VAL 76 3HG1 VAL 76 -8.104 7.191 2.921 391 HG21 VAL 76 1HG2 VAL 76 -8.316 9.046 0.597 392 HG22 VAL 76 2HG2 VAL 76 -10.041 8.893 0.258 393 HG23 VAL 76 3HG2 VAL 76 -9.085 7.459 0.625 394 H SER 77 H SER 77 -10.500 6.029 4.341 395 HA SER 77 HA SER 77 -12.018 7.293 6.455 396 HB2 SER 77 1HB SER 77 -10.730 4.552 6.400 397 HB3 SER 77 2HB SER 77 -11.992 5.113 7.505 398 HG SER 77 HG SER 77 -13.458 5.014 5.920 399 H ALA 78 H ALA 78 -8.704 6.136 5.911 400 HA ALA 78 HA ALA 78 -7.624 7.928 7.819 401 HB1 ALA 78 1HB ALA 78 -8.582 6.360 9.413 402 HB2 ALA 78 2HB ALA 78 -6.820 6.302 9.462 403 HB3 ALA 78 3HB ALA 78 -7.721 5.030 8.638 404 H MET 79 H MET 79 -5.489 8.176 7.554 405 HA MET 79 HA MET 79 -3.763 6.162 6.534 406 HB2 MET 79 1HB MET 79 -3.130 7.345 4.437 407 HB3 MET 79 2HB MET 79 -4.759 6.685 4.398 408 HG2 MET 79 1HG MET 79 -5.707 8.866 4.778 409 HG3 MET 79 2HG MET 79 -4.102 9.566 4.985 410 HE1 MET 79 1HE MET 79 -2.421 8.157 2.657 411 HE2 MET 79 2HE MET 79 -2.361 9.873 3.060 412 HE3 MET 79 3HE MET 79 -2.617 9.367 1.389 413 H SER 80 H SER 80 -1.672 6.658 6.971 414 HA SER 80 HA SER 80 -1.047 9.429 7.727 415 HB2 SER 80 1HB SER 80 -0.130 6.945 9.204 416 HB3 SER 80 2HB SER 80 0.306 8.606 9.604 417 HG SER 80 HG SER 80 -2.217 8.755 9.617 418 H VAL 81 H VAL 81 1.155 10.053 7.383 419 HA VAL 81 HA VAL 81 2.573 8.280 5.507 420 HB VAL 81 HB VAL 81 2.551 11.306 5.500 421 HG11 VAL 81 1HG1 VAL 81 4.663 10.436 4.706 422 HG12 VAL 81 2HG1 VAL 81 3.736 11.081 3.352 423 HG13 VAL 81 3HG1 VAL 81 3.829 9.339 3.606 424 HG21 VAL 81 1HG2 VAL 81 1.240 9.370 3.602 425 HG22 VAL 81 2HG2 VAL 81 1.293 11.122 3.414 426 HG23 VAL 81 3HG2 VAL 81 0.415 10.407 4.765 427 H ALA 82 H ALA 82 4.412 7.549 6.375 428 HA ALA 82 HA ALA 82 5.918 9.330 8.149 429 HB1 ALA 82 1HB ALA 82 6.391 7.487 9.662 430 HB2 ALA 82 2HB ALA 82 5.405 6.404 8.680 431 HB3 ALA 82 3HB ALA 82 4.649 7.745 9.542 432 H LYS 83 H LYS 83 7.654 9.687 7.101 433 HA LYS 83 HA LYS 83 9.490 9.504 5.694 434 HB2 LYS 83 1HB LYS 83 9.620 6.666 6.748 435 HB3 LYS 83 2HB LYS 83 10.954 7.628 6.124 436 HG2 LYS 83 1HG LYS 83 9.406 8.278 8.625 437 HG3 LYS 83 2HG LYS 83 10.942 7.413 8.592 438 HD2 LYS 83 1HD LYS 83 12.008 9.350 7.550 439 HD3 LYS 83 2HD LYS 83 10.472 10.216 7.576 440 HE2 LYS 83 1HE LYS 83 10.450 10.191 9.983 441 HE3 LYS 83 2HE LYS 83 11.888 9.175 10.020 442 HZ1 LYS 83 1HZ LYS 83 11.728 11.967 9.036 443 HZ2 LYS 83 2HZ LYS 83 13.107 10.989 8.927 444 HZ3 LYS 83 3HZ LYS 83 12.501 11.438 10.444 445 H GLY 84 H GLY 84 7.111 9.159 4.385 446 HA2 GLY 84 1HA GLY 84 6.447 8.568 2.247 447 HA3 GLY 84 2HA GLY 84 7.857 7.525 2.125 448 H VAL 85 H VAL 85 7.111 6.168 4.650 449 HA VAL 85 HA VAL 85 5.481 4.087 3.629 450 HB VAL 85 HB VAL 85 6.092 4.683 6.533 451 HG11 VAL 85 1HG1 VAL 85 5.262 2.129 5.165 452 HG12 VAL 85 2HG1 VAL 85 4.293 3.081 6.292 453 HG13 VAL 85 3HG1 VAL 85 5.753 2.266 6.854 454 HG21 VAL 85 1HG2 VAL 85 7.616 2.984 4.561 455 HG22 VAL 85 2HG2 VAL 85 7.966 3.128 6.283 456 HG23 VAL 85 3HG2 VAL 85 8.144 4.529 5.227 457 H VAL 86 H VAL 86 3.250 3.622 3.960 458 HA VAL 86 HA VAL 86 1.721 5.771 5.210 459 HB VAL 86 HB VAL 86 1.127 4.729 2.430 460 HG11 VAL 86 1HG1 VAL 86 -0.258 6.826 4.100 461 HG12 VAL 86 2HG1 VAL 86 -0.889 5.229 3.698 462 HG13 VAL 86 3HG1 VAL 86 -0.648 6.427 2.428 463 HG21 VAL 86 1HG2 VAL 86 1.594 7.037 1.693 464 HG22 VAL 86 2HG2 VAL 86 3.018 6.251 2.378 465 HG23 VAL 86 3HG2 VAL 86 2.119 7.434 3.330 466 H SER 87 H SER 87 0.638 4.754 6.712 467 HA SER 87 HA SER 87 -0.526 2.128 6.145 468 HB2 SER 87 1HB SER 87 -0.474 3.604 8.785 469 HB3 SER 87 2HB SER 87 -0.831 1.894 8.527 470 HG SER 87 HG SER 87 1.640 3.031 7.748 471 H LEU 88 H LEU 88 -2.553 1.894 5.617 472 HA LEU 88 HA LEU 88 -4.449 4.091 6.166 473 HB2 LEU 88 1HB LEU 88 -4.613 2.092 3.907 474 HB3 LEU 88 2HB LEU 88 -5.639 3.493 4.159 475 HG LEU 88 HG LEU 88 -3.350 4.799 3.920 476 HD11 LEU 88 1HD1 LEU 88 -2.837 2.247 2.399 477 HD12 LEU 88 2HD1 LEU 88 -1.906 2.874 3.760 478 HD13 LEU 88 3HD1 LEU 88 -1.911 3.738 2.224 479 HD21 LEU 88 1HD2 LEU 88 -4.888 3.651 1.595 480 HD22 LEU 88 2HD2 LEU 88 -3.812 5.046 1.525 481 HD23 LEU 88 3HD2 LEU 88 -5.284 5.117 2.495 482 H THR 89 H THR 89 -6.034 3.544 7.537 483 HA THR 89 HA THR 89 -6.439 0.669 8.016 484 HB THR 89 HB THR 89 -6.730 2.909 10.027 485 HG1 THR 89 HG1 THR 89 -4.580 1.184 9.355 486 HG21 THR 89 1HG2 THR 89 -6.749 1.083 11.678 487 HG22 THR 89 2HG2 THR 89 -6.710 -0.097 10.369 488 HG23 THR 89 3HG2 THR 89 -8.106 0.966 10.560 489 H GLY 90 H GLY 90 -8.442 -0.113 8.380 490 HA2 GLY 90 1HA GLY 90 -10.683 -0.374 7.898 491 HA3 GLY 90 2HA GLY 90 -10.833 1.107 8.823 492 H GLN 91 H GLN 91 -9.471 0.522 5.605 493 HA GLN 91 HA GLN 91 -10.931 2.828 4.625 494 HB2 GLN 91 1HB GLN 91 -8.533 2.463 4.104 495 HB3 GLN 91 2HB GLN 91 -8.968 1.013 3.210 496 HG2 GLN 91 1HG GLN 91 -8.516 2.974 1.785 497 HG3 GLN 91 2HG GLN 91 -10.132 2.299 1.570 498 HE21 GLN 91 1HE2 GLN 91 -11.885 3.529 2.040 499 HE22 GLN 91 2HE2 GLN 91 -11.806 5.189 2.512 500 H GLU 92 H GLU 92 -12.788 2.718 3.516 501 HA GLU 92 HA GLU 92 -14.593 1.911 2.394 502 HB2 GLU 92 1HB GLU 92 -12.563 -0.073 1.350 503 HB3 GLU 92 2HB GLU 92 -14.194 0.099 0.720 504 HG2 GLU 92 1HG GLU 92 -12.110 2.262 0.718 505 HG3 GLU 92 2HG GLU 92 -12.511 1.234 -0.650 506 H SER 93 H SER 93 -14.706 -1.091 1.758 507 HA SER 93 HA SER 93 -16.193 -1.936 3.991 508 HB2 SER 93 1HB SER 93 -14.923 -3.727 1.920 509 HB3 SER 93 2HB SER 93 -16.412 -4.008 2.827 510 HG SER 93 HG SER 93 -17.235 -2.085 1.732 511 H LEU 94 H LEU 94 -12.881 -1.693 3.613 512 HA LEU 94 HA LEU 94 -12.121 -4.186 4.852 513 HB2 LEU 94 1HB LEU 94 -10.389 -1.828 4.124 514 HB3 LEU 94 2HB LEU 94 -9.851 -3.461 4.482 515 HG LEU 94 HG LEU 94 -11.501 -2.649 2.083 516 HD11 LEU 94 1HD1 LEU 94 -9.264 -1.792 1.900 517 HD12 LEU 94 2HD1 LEU 94 -9.446 -3.176 0.821 518 HD13 LEU 94 3HD1 LEU 94 -8.587 -3.356 2.351 519 HD21 LEU 94 1HD2 LEU 94 -11.072 -4.917 1.282 520 HD22 LEU 94 2HD2 LEU 94 -11.983 -4.929 2.792 521 HD23 LEU 94 3HD2 LEU 94 -10.262 -5.303 2.800 522 H ASN 95 H ASN 95 -13.746 -2.540 6.475 523 HA ASN 95 HA ASN 95 -12.419 -1.053 8.405 524 HB2 ASN 95 1HB ASN 95 -14.881 -1.255 8.256 525 HB3 ASN 95 2HB ASN 95 -14.763 -2.911 8.847 526 HD21 ASN 95 1HD2 ASN 95 -15.953 -2.535 10.680 527 HD22 ASN 95 2HD2 ASN 95 -15.369 -1.584 12.001 528 H GLY 96 H GLY 96 -11.273 -1.511 10.220 529 HA2 GLY 96 1HA GLY 96 -10.122 -2.781 11.786 530 HA3 GLY 96 2HA GLY 96 -10.900 -4.221 11.140 531 H LEU 97 H LEU 97 -9.869 -3.113 8.414 532 HA LEU 97 HA LEU 97 -7.402 -4.650 8.517 533 HB2 LEU 97 1HB LEU 97 -9.114 -5.136 6.819 534 HB3 LEU 97 2HB LEU 97 -8.977 -3.498 6.214 535 HG LEU 97 HG LEU 97 -6.579 -5.299 6.168 536 HD11 LEU 97 1HD1 LEU 97 -7.254 -6.044 3.932 537 HD12 LEU 97 2HD1 LEU 97 -8.803 -5.234 4.131 538 HD13 LEU 97 3HD1 LEU 97 -8.384 -6.598 5.164 539 HD21 LEU 97 1HD2 LEU 97 -7.543 -3.066 4.382 540 HD22 LEU 97 2HD2 LEU 97 -6.026 -3.947 4.209 541 HD23 LEU 97 3HD2 LEU 97 -6.299 -2.929 5.622 542 H SER 98 H SER 98 -5.406 -3.796 8.211 543 HA SER 98 HA SER 98 -5.260 -0.921 7.585 544 HB2 SER 98 1HB SER 98 -4.729 -1.545 10.001 545 HB3 SER 98 2HB SER 98 -3.311 -2.382 9.370 546 HG SER 98 HG SER 98 -2.606 -0.373 9.850 547 H VAL 99 H VAL 99 -4.244 -0.537 5.763 548 HA VAL 99 HA VAL 99 -2.502 -2.568 4.588 549 HB VAL 99 HB VAL 99 -3.383 0.093 3.438 550 HG11 VAL 99 1HG1 VAL 99 -1.323 -0.754 2.447 551 HG12 VAL 99 2HG1 VAL 99 -2.661 -0.816 1.301 552 HG13 VAL 99 3HG1 VAL 99 -2.119 -2.292 2.098 553 HG21 VAL 99 1HG2 VAL 99 -5.306 -1.355 3.804 554 HG22 VAL 99 2HG2 VAL 99 -4.497 -2.664 2.943 555 HG23 VAL 99 3HG2 VAL 99 -4.961 -1.195 2.083 556 H VAL 100 H VAL 100 -0.288 -2.360 4.532 557 HA VAL 100 HA VAL 100 0.796 0.165 5.582 558 HB VAL 100 HB VAL 100 1.982 -2.595 5.939 559 HG11 VAL 100 1HG1 VAL 100 2.795 0.074 7.096 560 HG12 VAL 100 2HG1 VAL 100 3.654 -0.813 5.836 561 HG13 VAL 100 3HG1 VAL 100 3.541 -1.482 7.464 562 HG21 VAL 100 1HG2 VAL 100 1.394 -2.302 8.327 563 HG22 VAL 100 2HG2 VAL 100 -0.020 -2.397 7.277 564 HG23 VAL 100 3HG2 VAL 100 0.510 -0.835 7.902 565 H MET 101 H MET 101 1.479 1.189 3.817 566 HA MET 101 HA MET 101 2.808 -0.339 1.697 567 HB2 MET 101 1HB MET 101 0.986 1.326 1.171 568 HB3 MET 101 2HB MET 101 2.077 2.596 1.703 569 HG2 MET 101 1HG MET 101 3.652 2.005 -0.047 570 HG3 MET 101 2HG MET 101 2.596 0.694 -0.570 571 HE1 MET 101 1HE MET 101 2.059 1.284 -2.980 572 HE2 MET 101 2HE MET 101 3.382 2.445 -2.869 573 HE3 MET 101 3HE MET 101 1.838 2.932 -3.568 574 H THR 102 H THR 102 4.901 -0.639 1.989 575 HA THR 102 HA THR 102 6.519 1.524 3.151 576 HB THR 102 HB THR 102 7.395 -1.341 2.792 577 HG1 THR 102 HG1 THR 102 6.460 -0.337 5.262 578 HG21 THR 102 1HG2 THR 102 9.150 0.328 3.207 579 HG22 THR 102 2HG2 THR 102 8.979 -0.786 4.563 580 HG23 THR 102 3HG2 THR 102 8.308 0.842 4.670 581 HA PRO 103 HA PRO 103 7.762 1.726 -1.247 582 HB2 PRO 103 1HB PRO 103 8.257 4.365 -1.263 583 HB3 PRO 103 2HB PRO 103 6.606 3.728 -1.336 584 HG2 PRO 103 1HG PRO 103 8.116 4.790 1.030 585 HG3 PRO 103 2HG PRO 103 6.445 5.119 0.533 586 HD2 PRO 103 1HD PRO 103 7.106 3.326 2.465 587 HD3 PRO 103 2HD PRO 103 5.663 3.156 1.435 588 H GLY 104 H GLY 104 9.748 2.213 -2.284 589 HA2 GLY 104 1HA GLY 104 11.929 3.312 -2.157 590 HA3 GLY 104 2HA GLY 104 12.009 2.795 -0.478 591 H TRP 105 H TRP 105 14.139 2.093 -1.595 592 HA TRP 105 HA TRP 105 13.774 -0.733 -2.323 593 HB2 TRP 105 1HB TRP 105 16.054 -0.525 -3.427 594 HB3 TRP 105 2HB TRP 105 14.737 0.310 -4.238 595 HD1 TRP 105 HD1 TRP 105 14.764 3.006 -4.166 596 HE1 TRP 105 HE1 TRP 105 16.683 4.679 -3.785 597 HE3 TRP 105 HE3 TRP 105 18.222 -0.174 -2.145 598 HZ2 TRP 105 HZ2 TRP 105 19.313 4.651 -2.763 599 HZ3 TRP 105 HZ3 TRP 105 20.414 0.731 -1.495 600 HH2 TRP 105 HH2 TRP 105 20.948 3.091 -1.799 601 H ASP 106 H ASP 106 14.695 -2.184 -0.984 602 HA ASP 106 HA ASP 106 16.798 -1.320 0.833 603 HB2 ASP 106 1HB ASP 106 14.637 -0.791 1.978 604 HB3 ASP 106 2HB ASP 106 14.237 -2.506 1.912 605 H ASN 107 H ASN 107 18.282 -2.794 0.722 606 HA ASN 107 HA ASN 107 17.876 -5.326 -0.483 607 HB2 ASN 107 1HB ASN 107 19.985 -4.045 -0.644 608 HB3 ASN 107 2HB ASN 107 20.251 -4.284 1.078 609 HD21 ASN 107 1HD2 ASN 107 22.183 -5.319 0.757 610 HD22 ASN 107 2HD2 ASN 107 22.295 -6.922 0.118 611 H ALA 108 H ALA 108 18.006 -4.255 2.852 612 HA ALA 108 HA ALA 108 18.515 -6.848 3.945 613 HB1 ALA 108 1HB ALA 108 17.516 -4.351 5.305 614 HB2 ALA 108 2HB ALA 108 19.205 -4.811 5.099 615 HB3 ALA 108 3HB ALA 108 18.139 -5.792 6.107 616 H ASN 109 H ASN 109 15.623 -4.784 3.715 617 HA ASN 109 HA ASN 109 13.978 -6.864 4.893 618 HB2 ASN 109 1HB ASN 109 13.322 -4.121 3.808 619 HB3 ASN 109 2HB ASN 109 12.102 -5.220 4.442 620 HD21 ASN 109 1HD2 ASN 109 13.905 -6.237 6.531 621 HD22 ASN 109 2HD2 ASN 109 13.989 -4.984 7.718 622 H GLY 110 H GLY 110 15.036 -6.033 1.793 623 HA2 GLY 110 1HA GLY 110 14.651 -7.160 -0.198 624 HA3 GLY 110 2HA GLY 110 13.399 -8.094 0.609 625 H VAL 111 H VAL 111 13.597 -4.591 0.472 626 HA VAL 111 HA VAL 111 10.928 -4.545 -0.716 627 HB VAL 111 HB VAL 111 12.535 -2.304 0.532 628 HG11 VAL 111 1HG1 VAL 111 10.420 -1.053 0.516 629 HG12 VAL 111 2HG1 VAL 111 9.661 -2.373 -0.377 630 HG13 VAL 111 3HG1 VAL 111 10.969 -1.447 -1.114 631 HG21 VAL 111 1HG2 VAL 111 10.979 -2.508 2.407 632 HG22 VAL 111 2HG2 VAL 111 11.880 -4.002 2.157 633 HG23 VAL 111 3HG2 VAL 111 10.206 -3.882 1.619 634 H THR 112 H THR 112 10.496 -3.714 -2.683 635 HA THR 112 HA THR 112 12.634 -2.431 -4.213 636 HB THR 112 HB THR 112 11.058 -4.728 -5.383 637 HG1 THR 112 HG1 THR 112 12.309 -5.802 -3.967 638 HG21 THR 112 1HG2 THR 112 13.596 -3.339 -6.250 639 HG22 THR 112 2HG2 THR 112 12.004 -3.138 -6.982 640 HG23 THR 112 3HG2 THR 112 12.832 -4.694 -7.079 641 H GLY 113 H GLY 113 11.342 -0.543 -4.026 642 HA2 GLY 113 1HA GLY 113 10.072 0.878 -5.463 643 HA3 GLY 113 2HA GLY 113 9.126 -0.519 -5.956 644 H TRP 114 H TRP 114 7.525 -1.339 -4.523 645 HA TRP 114 HA TRP 114 6.887 0.280 -2.177 646 HB2 TRP 114 1HB TRP 114 4.873 -0.368 -4.344 647 HB3 TRP 114 2HB TRP 114 4.516 0.430 -2.816 648 HD1 TRP 114 HD1 TRP 114 5.367 2.992 -2.556 649 HE1 TRP 114 HE1 TRP 114 5.869 4.798 -4.337 650 HE3 TRP 114 HE3 TRP 114 5.750 -0.025 -6.655 651 HZ2 TRP 114 HZ2 TRP 114 6.343 4.901 -7.114 652 HZ3 TRP 114 HZ3 TRP 114 6.224 0.999 -8.838 653 HH2 TRP 114 HH2 TRP 114 6.513 3.413 -9.062 654 H ALA 115 H ALA 115 6.639 -1.109 -0.530 655 HA ALA 115 HA ALA 115 5.676 -3.813 -1.099 656 HB1 ALA 115 1HB ALA 115 7.690 -3.562 0.309 657 HB2 ALA 115 2HB ALA 115 6.367 -4.366 1.157 658 HB3 ALA 115 3HB ALA 115 6.727 -2.674 1.490 659 H ARG 116 H ARG 116 3.579 -4.081 -1.052 660 HA ARG 116 HA ARG 116 1.964 -2.387 0.731 661 HB2 ARG 116 1HB ARG 116 1.239 -3.758 -1.862 662 HB3 ARG 116 2HB ARG 116 0.083 -2.929 -0.826 663 HG2 ARG 116 1HG ARG 116 1.131 -0.826 -1.209 664 HG3 ARG 116 2HG ARG 116 2.492 -1.590 -2.032 665 HD2 ARG 116 1HD ARG 116 -0.356 -1.729 -3.006 666 HD3 ARG 116 2HD ARG 116 0.811 -0.528 -3.552 667 HE ARG 116 HE ARG 116 1.889 -3.114 -3.873 668 HH11 ARG 116 1HH1 ARG 116 -0.595 -1.054 -5.228 669 HH12 ARG 116 2HH1 ARG 116 -0.455 -1.720 -6.822 670 HH21 ARG 116 1HH2 ARG 116 2.093 -3.988 -5.979 671 HH22 ARG 116 2HH2 ARG 116 1.059 -3.380 -7.249 672 H ASN 117 H ASN 117 0.734 -3.341 2.265 673 HA ASN 117 HA ASN 117 0.300 -6.226 2.112 674 HB2 ASN 117 1HB ASN 117 2.425 -5.769 3.402 675 HB3 ASN 117 2HB ASN 117 1.436 -4.928 4.593 676 HD21 ASN 117 1HD2 ASN 117 2.249 -7.998 3.194 677 HD22 ASN 117 2HD2 ASN 117 1.510 -8.977 4.414 678 H CYS 118 H CYS 118 -1.648 -6.811 2.848 679 HA CYS 118 HA CYS 118 -3.282 -4.767 4.175 680 HB2 CYS 118 1HB CYS 118 -4.098 -7.334 2.783 681 HB3 CYS 118 2HB CYS 118 -5.204 -6.156 3.489 682 H ASN 119 H ASN 119 -3.425 -4.944 6.331 683 HA ASN 119 HA ASN 119 -3.091 -7.618 7.515 684 HB2 ASN 119 1HB ASN 119 -2.727 -4.886 8.774 685 HB3 ASN 119 2HB ASN 119 -2.518 -6.421 9.611 686 HD21 ASN 119 1HD2 ASN 119 -1.196 -4.218 7.282 687 HD22 ASN 119 2HD2 ASN 119 0.367 -4.952 7.174 688 H ILE 120 H ILE 120 -5.060 -8.474 7.680 689 HA ILE 120 HA ILE 120 -6.918 -7.081 9.450 690 HB ILE 120 HB ILE 120 -7.846 -6.737 7.272 691 HG12 ILE 120 1HG1 ILE 120 -10.002 -7.956 7.453 692 HG13 ILE 120 2HG1 ILE 120 -9.295 -8.953 8.715 693 HG21 ILE 120 1HG2 ILE 120 -8.448 -8.618 5.783 694 HG22 ILE 120 2HG2 ILE 120 -7.552 -9.698 6.850 695 HG23 ILE 120 3HG2 ILE 120 -6.711 -8.404 5.997 696 HD11 ILE 120 1HD1 ILE 120 -8.982 -6.951 10.094 697 HD12 ILE 120 2HD1 ILE 120 -10.671 -7.206 9.660 698 HD13 ILE 120 3HD1 ILE 120 -9.723 -5.978 8.825 699 H GLN 121 H GLN 121 -6.840 -8.318 11.245 700 HA GLN 121 HA GLN 121 -5.778 -10.966 11.055 701 HB2 GLN 121 1HB GLN 121 -6.716 -9.355 13.424 702 HB3 GLN 121 2HB GLN 121 -6.025 -10.963 13.557 703 HG2 GLN 121 1HG GLN 121 -4.295 -9.438 14.037 704 HG3 GLN 121 2HG GLN 121 -3.973 -10.065 12.423 705 HE21 GLN 121 1HE2 GLN 121 -2.699 -8.297 11.905 706 HE22 GLN 121 2HE2 GLN 121 -3.369 -6.737 11.583 707 H SER 122 H SER 122 -8.972 -9.630 11.703 708 HA SER 122 HA SER 122 -9.932 -12.286 12.469 709 HB2 SER 122 1HB SER 122 -11.962 -11.027 13.242 710 HB3 SER 122 2HB SER 122 -10.464 -10.535 14.037 711 HG SER 122 HG SER 122 -11.793 -9.204 11.890 712 H ASP 123 H ASP 123 -9.726 -10.657 9.612 713 HA ASP 123 HA ASP 123 -12.233 -11.804 8.638 714 HB2 ASP 123 1HB ASP 123 -11.474 -8.900 8.335 715 HB3 ASP 123 2HB ASP 123 -12.724 -9.681 7.379 716 H SER 124 H SER 124 -10.837 -13.317 7.602 717 HA SER 124 HA SER 124 -8.782 -12.649 5.824 718 HB2 SER 124 1HB SER 124 -10.606 -15.063 5.752 719 HB3 SER 124 2HB SER 124 -9.029 -14.929 4.974 720 HG SER 124 HG SER 124 -8.058 -14.823 6.964 721 H ALA 125 H ALA 125 -12.245 -12.642 5.381 722 HA ALA 125 HA ALA 125 -12.361 -12.795 2.581 723 HB1 ALA 125 1HB ALA 125 -14.318 -13.070 4.018 724 HB2 ALA 125 2HB ALA 125 -14.587 -11.831 2.793 725 HB3 ALA 125 3HB ALA 125 -14.234 -11.365 4.457 726 H LEU 126 H LEU 126 -11.885 -10.075 4.762 727 HA LEU 126 HA LEU 126 -12.082 -8.071 2.757 728 HB2 LEU 126 1HB LEU 126 -10.736 -7.998 5.454 729 HB3 LEU 126 2HB LEU 126 -11.041 -6.596 4.447 730 HG LEU 126 HG LEU 126 -13.134 -8.359 5.724 731 HD11 LEU 126 1HD1 LEU 126 -13.667 -6.339 7.015 732 HD12 LEU 126 2HD1 LEU 126 -12.278 -5.529 6.291 733 HD13 LEU 126 3HD1 LEU 126 -12.037 -6.929 7.332 734 HD21 LEU 126 1HD2 LEU 126 -14.746 -6.720 4.875 735 HD22 LEU 126 2HD2 LEU 126 -13.904 -7.551 3.568 736 HD23 LEU 126 3HD2 LEU 126 -13.447 -5.905 4.004 737 H GLN 127 H GLN 127 -9.467 -9.981 4.115 738 HA GLN 127 HA GLN 127 -7.332 -8.613 2.910 739 HB2 GLN 127 1HB GLN 127 -6.771 -10.165 4.610 740 HB3 GLN 127 2HB GLN 127 -7.634 -11.471 3.806 741 HG2 GLN 127 1HG GLN 127 -5.994 -11.589 2.077 742 HG3 GLN 127 2HG GLN 127 -5.191 -10.132 2.660 743 HE21 GLN 127 1HE2 GLN 127 -3.246 -11.293 2.809 744 HE22 GLN 127 2HE2 GLN 127 -2.950 -12.389 4.115 745 H GLN 128 H GLN 128 -9.366 -11.267 1.747 746 HA GLN 128 HA GLN 128 -7.933 -11.990 -0.506 747 HB2 GLN 128 1HB GLN 128 -10.065 -13.012 0.505 748 HB3 GLN 128 2HB GLN 128 -10.944 -11.832 -0.450 749 HG2 GLN 128 1HG GLN 128 -9.001 -13.736 -1.710 750 HG3 GLN 128 2HG GLN 128 -10.664 -14.197 -1.379 751 HE21 GLN 128 1HE2 GLN 128 -8.555 -12.332 -3.376 752 HE22 GLN 128 2HE2 GLN 128 -9.743 -11.837 -4.531 753 H ALA 129 H ALA 129 -10.467 -9.510 -0.240 754 HA ALA 129 HA ALA 129 -10.231 -8.682 -2.949 755 HB1 ALA 129 1HB ALA 129 -12.291 -8.388 -1.664 756 HB2 ALA 129 2HB ALA 129 -11.709 -6.856 -2.319 757 HB3 ALA 129 3HB ALA 129 -11.467 -7.235 -0.613 758 H CYS 130 H CYS 130 -8.911 -7.505 0.106 759 HA CYS 130 HA CYS 130 -7.807 -5.108 -0.933 760 HB2 CYS 130 1HB CYS 130 -8.251 -5.494 1.472 761 HB3 CYS 130 2HB CYS 130 -6.956 -6.690 1.503 762 H GLU 131 H GLU 131 -6.449 -8.293 -0.273 763 HA GLU 131 HA GLU 131 -3.779 -7.772 -0.908 764 HB2 GLU 131 1HB GLU 131 -4.643 -9.757 0.314 765 HB3 GLU 131 2HB GLU 131 -5.317 -10.357 -1.192 766 HG2 GLU 131 1HG GLU 131 -2.993 -10.384 -2.119 767 HG3 GLU 131 2HG GLU 131 -2.417 -10.019 -0.489 768 H ASP 132 H ASP 132 -6.541 -8.334 -2.918 769 HA ASP 132 HA ASP 132 -5.132 -9.062 -5.270 770 HB2 ASP 132 1HB ASP 132 -7.561 -9.477 -4.907 771 HB3 ASP 132 2HB ASP 132 -7.847 -7.747 -5.047 772 H VAL 133 H VAL 133 -6.479 -5.950 -4.156 773 HA VAL 133 HA VAL 133 -5.309 -4.556 -6.410 774 HB VAL 133 HB VAL 133 -6.806 -3.480 -4.013 775 HG11 VAL 133 1HG1 VAL 133 -7.042 -1.426 -5.307 776 HG12 VAL 133 2HG1 VAL 133 -6.045 -2.112 -6.590 777 HG13 VAL 133 3HG1 VAL 133 -5.344 -1.794 -5.004 778 HG21 VAL 133 1HG2 VAL 133 -7.716 -4.028 -6.835 779 HG22 VAL 133 2HG2 VAL 133 -8.674 -3.230 -5.588 780 HG23 VAL 133 3HG2 VAL 133 -8.198 -4.915 -5.389 781 H PHE 134 H PHE 134 -4.873 -4.641 -2.916 782 HA PHE 134 HA PHE 134 -2.601 -2.830 -3.030 783 HB2 PHE 134 1HB PHE 134 -4.103 -4.019 -0.694 784 HB3 PHE 134 2HB PHE 134 -2.704 -2.969 -0.530 785 HD1 PHE 134 HD1 PHE 134 -2.834 -0.606 -1.258 786 HD2 PHE 134 HD2 PHE 134 -6.256 -3.137 -1.223 787 HE1 PHE 134 HE1 PHE 134 -4.292 1.370 -1.388 788 HE2 PHE 134 HE2 PHE 134 -7.718 -1.163 -1.359 789 HZ PHE 134 HZ PHE 134 -6.736 1.092 -1.445 790 H ARG 135 H ARG 135 -2.505 -5.494 -4.122 791 HA ARG 135 HA ARG 135 -1.483 -7.536 -2.642 792 HB2 ARG 135 1HB ARG 135 -0.558 -8.403 -4.698 793 HB3 ARG 135 2HB ARG 135 -2.065 -7.575 -5.079 794 HG2 ARG 135 1HG ARG 135 -0.922 -5.696 -5.952 795 HG3 ARG 135 2HG ARG 135 0.622 -6.256 -5.315 796 HD2 ARG 135 1HD ARG 135 0.395 -8.249 -6.843 797 HD3 ARG 135 2HD ARG 135 -0.969 -7.415 -7.588 798 HE ARG 135 HE ARG 135 1.812 -6.408 -7.553 799 HH11 ARG 135 1HH1 ARG 135 -1.352 -6.604 -9.047 800 HH12 ARG 135 2HH1 ARG 135 -0.895 -5.656 -10.420 801 HH21 ARG 135 1HH2 ARG 135 2.406 -5.165 -9.328 802 HH22 ARG 135 2HH2 ARG 135 1.255 -4.827 -10.585 803 H PHE 136 H PHE 136 0.506 -8.305 -2.091 804 HA PHE 136 HA PHE 136 2.718 -6.423 -2.028 805 HB2 PHE 136 1HB PHE 136 3.776 -8.563 -0.846 806 HB3 PHE 136 2HB PHE 136 2.745 -7.433 0.024 807 HD1 PHE 136 HD1 PHE 136 2.696 -10.684 -1.785 808 HD2 PHE 136 HD2 PHE 136 0.786 -8.163 1.069 809 HE1 PHE 136 HE1 PHE 136 1.204 -12.532 -1.154 810 HE2 PHE 136 HE2 PHE 136 -0.714 -10.010 1.695 811 HZ PHE 136 HZ PHE 136 -0.505 -12.196 0.585 812 H ASP 137 H ASP 137 3.907 -6.324 -3.785 813 HA ASP 137 HA ASP 137 3.933 -8.333 -5.781 814 HB2 ASP 137 1HB ASP 137 5.766 -5.948 -5.420 815 HB3 ASP 137 2HB ASP 137 5.616 -6.910 -6.885 816 H ASP 138 H ASP 138 5.549 -9.732 -6.386 817 HA ASP 138 HA ASP 138 6.737 -11.089 -4.249 818 HB2 ASP 138 1HB ASP 138 7.552 -12.642 -5.832 819 HB3 ASP 138 2HB ASP 138 6.050 -12.032 -6.515 820 H ALA 139 H ALA 139 7.934 -8.494 -6.141 821 HA ALA 139 HA ALA 139 10.718 -8.957 -5.674 822 HB1 ALA 139 1HB ALA 139 11.033 -6.695 -6.532 823 HB2 ALA 139 2HB ALA 139 9.294 -6.411 -6.446 824 HB3 ALA 139 3HB ALA 139 9.938 -7.614 -7.567 825 H ASN 140 H ASN 140 8.149 -7.801 -3.813 826 HA ASN 140 HA ASN 140 9.933 -6.418 -1.927 827 HB2 ASN 140 1HB ASN 140 6.951 -6.209 -2.394 828 HB3 ASN 140 2HB ASN 140 7.766 -5.476 -1.015 829 HD21 ASN 140 1HD2 ASN 140 7.371 -5.406 -4.479 830 HD22 ASN 140 2HD2 ASN 140 8.063 -3.842 -4.723 831 H LEU 141 H LEU 141 9.180 -9.371 -2.333 832 HA LEU 141 HA LEU 141 8.138 -9.902 0.361 833 HB2 LEU 141 1HB LEU 141 8.073 -11.576 -2.142 834 HB3 LEU 141 2HB LEU 141 7.634 -12.193 -0.563 835 HG LEU 141 HG LEU 141 6.225 -10.036 -2.130 836 HD11 LEU 141 1HD1 LEU 141 5.249 -12.712 -1.144 837 HD12 LEU 141 2HD1 LEU 141 5.810 -12.394 -2.783 838 HD13 LEU 141 3HD1 LEU 141 4.382 -11.569 -2.166 839 HD21 LEU 141 1HD2 LEU 141 4.592 -10.143 -0.193 840 HD22 LEU 141 2HD2 LEU 141 6.108 -9.303 0.108 841 HD23 LEU 141 3HD2 LEU 141 5.871 -10.941 0.716 842 H VAL 142 H VAL 142 8.850 -12.289 0.970 843 HA VAL 142 HA VAL 142 11.788 -12.290 0.888 844 HB VAL 142 HB VAL 142 9.982 -13.707 2.853 845 HG11 VAL 142 1HG1 VAL 142 12.041 -13.998 4.164 846 HG12 VAL 142 2HG1 VAL 142 12.961 -13.266 2.850 847 HG13 VAL 142 3HG1 VAL 142 12.124 -14.797 2.594 848 HG21 VAL 142 1HG2 VAL 142 9.761 -11.308 3.130 849 HG22 VAL 142 2HG2 VAL 142 11.515 -11.133 3.187 850 HG23 VAL 142 3HG2 VAL 142 10.672 -11.995 4.476 851 HA PRO 143 HA PRO 143 11.110 -15.691 -1.885 852 HB2 PRO 143 1HB PRO 143 13.718 -16.442 -2.153 853 HB3 PRO 143 2HB PRO 143 13.009 -15.063 -2.996 854 HG2 PRO 143 1HG PRO 143 14.688 -15.116 -0.526 855 HG3 PRO 143 2HG PRO 143 14.728 -13.979 -1.886 856 HD2 PRO 143 1HD PRO 143 13.535 -13.401 0.481 857 HD3 PRO 143 2HD PRO 143 12.965 -12.743 -1.066 858 H ARG 144 H ARG 144 10.556 -17.725 -1.495 859 HA ARG 144 HA ARG 144 11.599 -19.049 0.900 860 HB2 ARG 144 1HB ARG 144 9.312 -19.862 -0.914 861 HB3 ARG 144 2HB ARG 144 9.778 -20.669 0.573 862 HG2 ARG 144 1HG ARG 144 8.772 -17.836 0.381 863 HG3 ARG 144 2HG ARG 144 7.816 -19.235 0.869 864 HD2 ARG 144 1HD ARG 144 10.234 -18.122 2.297 865 HD3 ARG 144 2HD ARG 144 8.557 -18.011 2.825 866 HE ARG 144 HE ARG 144 8.881 -20.658 2.650 867 HH11 ARG 144 1HH1 ARG 144 10.876 -18.196 4.144 868 HH12 ARG 144 2HH1 ARG 144 11.511 -19.272 5.349 869 HH21 ARG 144 1HH2 ARG 144 9.695 -22.058 4.238 870 HH22 ARG 144 2HH2 ARG 144 10.821 -21.464 5.419 871 H GLY 145 H GLY 145 13.414 -20.170 0.559 872 HA2 GLY 145 1HA GLY 145 14.552 -22.044 -0.382 873 HA3 GLY 145 2HA GLY 145 13.576 -21.860 -1.837 874 H SER 146 H SER 146 16.320 -20.674 -0.049 875 HA SER 146 HA SER 146 16.999 -18.870 -2.272 876 HB2 SER 146 1HB SER 146 17.998 -18.821 0.591 877 HB3 SER 146 2HB SER 146 18.376 -17.638 -0.664 878 HG SER 146 HG SER 146 15.962 -17.406 -0.762 879 H GLY 147 H GLY 147 19.333 -18.721 -2.799 880 HA2 GLY 147 1HA GLY 147 21.466 -19.589 -3.067 881 HA3 GLY 147 2HA GLY 147 21.080 -20.825 -1.878 882 H LEU 148 H LEU 148 19.048 -20.242 -4.630 883 HA LEU 148 HA LEU 148 19.726 -22.916 -5.630 884 HB2 LEU 148 1HB LEU 148 17.329 -21.182 -6.246 885 HB3 LEU 148 2HB LEU 148 17.573 -22.827 -6.797 886 HG LEU 148 HG LEU 148 17.184 -21.973 -3.922 887 HD11 LEU 148 1HD1 LEU 148 15.151 -21.762 -5.250 888 HD12 LEU 148 2HD1 LEU 148 15.029 -23.107 -4.115 889 HD13 LEU 148 3HD1 LEU 148 15.341 -23.419 -5.823 890 HD21 LEU 148 1HD2 LEU 148 17.501 -24.707 -5.160 891 HD22 LEU 148 2HD2 LEU 148 16.971 -24.409 -3.505 892 HD23 LEU 148 3HD2 LEU 148 18.589 -23.928 -4.010 893 H GLU 149 H GLU 149 21.555 -22.420 -6.854 894 HA GLU 149 HA GLU 149 21.426 -20.273 -8.784 895 HB2 GLU 149 1HB GLU 149 23.508 -21.118 -7.451 896 HB3 GLU 149 2HB GLU 149 23.608 -22.328 -8.721 897 HG2 GLU 149 1HG GLU 149 25.049 -20.409 -9.164 898 HG3 GLU 149 2HG GLU 149 23.805 -20.598 -10.400 899 H HIS 150 H HIS 150 20.780 -23.631 -8.655 900 HA HIS 150 HA HIS 150 20.838 -24.075 -11.500 901 HB2 HIS 150 1HB HIS 150 21.162 -25.904 -9.832 902 HB3 HIS 150 2HB HIS 150 19.494 -25.693 -9.317 903 HD1 HIS 150 HD1 HIS 150 18.132 -27.545 -10.204 904 HD2 HIS 150 HD2 HIS 150 21.022 -26.313 -12.929 905 HE1 HIS 150 HE1 HIS 150 17.806 -28.988 -12.237 906 HE2 HIS 150 HE2 HIS 150 19.597 -28.264 -13.854 907 H HIS 151 H HIS 151 19.601 -22.145 -11.991 908 HA HIS 151 HA HIS 151 16.855 -21.981 -11.128 909 HB2 HIS 151 1HB HIS 151 16.776 -19.910 -12.455 910 HB3 HIS 151 2HB HIS 151 18.146 -19.926 -11.357 911 HD1 HIS 151 HD1 HIS 151 17.343 -18.994 -14.661 912 HD2 HIS 151 HD2 HIS 151 20.602 -20.878 -12.903 913 HE1 HIS 151 HE1 HIS 151 19.238 -18.744 -16.296 914 HE2 HIS 151 HE2 HIS 151 21.225 -19.797 -15.163 915 H HIS 152 H HIS 152 15.031 -22.227 -12.356 916 HA HIS 152 HA HIS 152 15.375 -24.058 -14.601 917 HB2 HIS 152 1HB HIS 152 12.924 -23.342 -12.976 918 HB3 HIS 152 2HB HIS 152 12.953 -24.527 -14.275 919 HD1 HIS 152 HD1 HIS 152 14.039 -23.993 -10.737 920 HD2 HIS 152 HD2 HIS 152 14.087 -26.994 -13.610 921 HE1 HIS 152 HE1 HIS 152 14.680 -26.088 -9.510 922 HE2 HIS 152 HE2 HIS 152 14.692 -27.899 -11.262 923 H HIS 153 H HIS 153 16.101 -21.843 -15.675 924 HA HIS 153 HA HIS 153 13.758 -20.466 -16.770 925 HB2 HIS 153 1HB HIS 153 15.742 -19.148 -15.944 926 HB3 HIS 153 2HB HIS 153 16.678 -19.839 -17.263 927 HD1 HIS 153 HD1 HIS 153 16.642 -18.562 -19.415 928 HD2 HIS 153 HD2 HIS 153 13.472 -17.537 -16.923 929 HE1 HIS 153 HE1 HIS 153 15.483 -16.644 -20.545 930 HE2 HIS 153 HE2 HIS 153 13.607 -15.999 -18.995 931 H HIS 154 H HIS 154 15.616 -23.097 -17.390 932 HA HIS 154 HA HIS 154 15.840 -24.526 -19.121 933 HB2 HIS 154 1HB HIS 154 13.601 -22.843 -20.236 934 HB3 HIS 154 2HB HIS 154 14.256 -24.233 -21.094 935 HD1 HIS 154 HD1 HIS 154 12.658 -26.101 -20.832 936 HD2 HIS 154 HD2 HIS 154 13.070 -23.921 -17.315 937 HE1 HIS 154 HE1 HIS 154 11.239 -27.288 -19.127 938 HE2 HIS 154 HE2 HIS 154 11.551 -25.989 -16.992 939 H HIS 155 H HIS 155 17.656 -22.510 -18.895 940 HA HIS 155 HA HIS 155 18.154 -21.320 -21.475 941 HB2 HIS 155 1HB HIS 155 18.788 -20.172 -19.376 942 HB3 HIS 155 2HB HIS 155 19.910 -21.475 -19.015 943 HD1 HIS 155 HD1 HIS 155 22.172 -21.450 -20.198 944 HD2 HIS 155 HD2 HIS 155 19.610 -18.424 -21.442 945 HE1 HIS 155 HE1 HIS 155 23.581 -19.899 -21.588 946 HE2 HIS 155 HE2 HIS 155 21.958 -18.198 -22.492 Start of MODEL 7 1 H1 MET 24 1H MET 24 -15.294 -15.259 -3.254 2 H2 MET 24 2H MET 24 -13.949 -16.246 -3.515 3 H3 MET 24 3H MET 24 -15.098 -16.046 -4.738 4 HA MET 24 HA MET 24 -13.364 -13.913 -3.644 5 HB2 MET 24 1HB MET 24 -13.239 -15.416 -6.265 6 HB3 MET 24 2HB MET 24 -12.312 -13.968 -5.911 7 HG2 MET 24 1HG MET 24 -11.181 -15.130 -4.094 8 HG3 MET 24 2HG MET 24 -12.112 -16.581 -4.442 9 HE1 MET 24 1HE MET 24 -9.944 -18.041 -4.653 10 HE2 MET 24 2HE MET 24 -8.954 -16.632 -4.267 11 HE3 MET 24 3HE MET 24 -8.567 -17.622 -5.674 12 H GLU 25 H GLU 25 -16.385 -14.214 -4.279 13 HA GLU 25 HA GLU 25 -16.749 -12.407 -6.497 14 HB2 GLU 25 1HB GLU 25 -18.766 -13.416 -4.485 15 HB3 GLU 25 2HB GLU 25 -19.133 -12.577 -5.984 16 HG2 GLU 25 1HG GLU 25 -18.124 -14.446 -7.236 17 HG3 GLU 25 2HG GLU 25 -17.883 -15.297 -5.710 18 H ASN 26 H ASN 26 -15.448 -10.679 -5.615 19 HA ASN 26 HA ASN 26 -17.018 -8.974 -3.818 20 HB2 ASN 26 1HB ASN 26 -14.016 -9.326 -3.579 21 HB3 ASN 26 2HB ASN 26 -15.026 -8.294 -2.574 22 HD21 ASN 26 1HD2 ASN 26 -16.508 -9.312 -1.110 23 HD22 ASN 26 2HD2 ASN 26 -16.192 -10.913 -0.531 24 H TYR 27 H TYR 27 -16.772 -8.955 -6.672 25 HA TYR 27 HA TYR 27 -14.753 -7.267 -7.629 26 HB2 TYR 27 1HB TYR 27 -15.966 -8.626 -9.193 27 HB3 TYR 27 2HB TYR 27 -17.493 -7.869 -8.753 28 HD1 TYR 27 HD1 TYR 27 -18.247 -5.944 -9.885 29 HD2 TYR 27 HD2 TYR 27 -14.196 -7.175 -10.349 30 HE1 TYR 27 HE1 TYR 27 -17.938 -4.248 -11.635 31 HE2 TYR 27 HE2 TYR 27 -13.881 -5.481 -12.103 32 HH TYR 27 HH TYR 27 -15.990 -2.941 -12.599 33 H LEU 28 H LEU 28 -17.949 -6.537 -6.344 34 HA LEU 28 HA LEU 28 -18.068 -3.833 -7.136 35 HB2 LEU 28 1HB LEU 28 -19.320 -5.264 -4.790 36 HB3 LEU 28 2HB LEU 28 -19.677 -3.601 -5.204 37 HG LEU 28 HG LEU 28 -20.192 -5.960 -7.020 38 HD11 LEU 28 1HD1 LEU 28 -22.085 -4.377 -5.287 39 HD12 LEU 28 2HD1 LEU 28 -21.620 -6.064 -5.058 40 HD13 LEU 28 3HD1 LEU 28 -22.555 -5.592 -6.476 41 HD21 LEU 28 1HD2 LEU 28 -19.824 -3.889 -8.239 42 HD22 LEU 28 2HD2 LEU 28 -20.984 -3.055 -7.208 43 HD23 LEU 28 3HD2 LEU 28 -21.529 -4.334 -8.293 44 H ARG 29 H ARG 29 -16.940 -5.357 -4.152 45 HA ARG 29 HA ARG 29 -16.044 -2.961 -2.942 46 HB2 ARG 29 1HB ARG 29 -16.480 -4.908 -1.587 47 HB3 ARG 29 2HB ARG 29 -15.284 -5.848 -2.471 48 HG2 ARG 29 1HG ARG 29 -13.496 -4.633 -1.539 49 HG3 ARG 29 2HG ARG 29 -14.573 -3.391 -0.899 50 HD2 ARG 29 1HD ARG 29 -13.894 -4.788 0.914 51 HD3 ARG 29 2HD ARG 29 -15.589 -5.123 0.566 52 HE ARG 29 HE ARG 29 -13.738 -6.904 -0.738 53 HH11 ARG 29 1HH1 ARG 29 -15.751 -6.321 2.050 54 HH12 ARG 29 2HH1 ARG 29 -15.671 -7.954 2.623 55 HH21 ARG 29 1HH2 ARG 29 -13.624 -9.088 0.026 56 HH22 ARG 29 2HH2 ARG 29 -14.460 -9.516 1.483 57 H LYS 30 H LYS 30 -14.532 -5.303 -5.082 58 HA LYS 30 HA LYS 30 -11.884 -4.448 -4.816 59 HB2 LYS 30 1HB LYS 30 -13.312 -5.741 -7.129 60 HB3 LYS 30 2HB LYS 30 -11.596 -5.369 -7.170 61 HG2 LYS 30 1HG LYS 30 -11.296 -6.782 -5.150 62 HG3 LYS 30 2HG LYS 30 -12.996 -7.239 -5.270 63 HD2 LYS 30 1HD LYS 30 -12.572 -8.129 -7.529 64 HD3 LYS 30 2HD LYS 30 -10.865 -7.716 -7.353 65 HE2 LYS 30 1HE LYS 30 -10.769 -9.205 -5.366 66 HE3 LYS 30 2HE LYS 30 -12.434 -9.684 -5.690 67 HZ1 LYS 30 1HZ LYS 30 -10.886 -11.288 -6.588 68 HZ2 LYS 30 2HZ LYS 30 -10.111 -10.091 -7.503 69 HZ3 LYS 30 3HZ LYS 30 -11.713 -10.523 -7.853 70 H ALA 31 H ALA 31 -14.359 -3.388 -7.234 71 HA ALA 31 HA ALA 31 -12.834 -1.482 -8.486 72 HB1 ALA 31 1HB ALA 31 -15.050 -2.201 -9.233 73 HB2 ALA 31 2HB ALA 31 -14.934 -0.443 -9.130 74 HB3 ALA 31 3HB ALA 31 -15.780 -1.348 -7.873 75 H ALA 32 H ALA 32 -14.581 -1.223 -5.424 76 HA ALA 32 HA ALA 32 -14.287 1.575 -5.119 77 HB1 ALA 32 1HB ALA 32 -15.874 0.272 -3.785 78 HB2 ALA 32 2HB ALA 32 -14.775 1.187 -2.753 79 HB3 ALA 32 3HB ALA 32 -14.532 -0.545 -2.982 80 H LEU 33 H LEU 33 -12.341 -1.184 -4.172 81 HA LEU 33 HA LEU 33 -10.283 0.283 -2.882 82 HB2 LEU 33 1HB LEU 33 -10.092 -2.413 -4.235 83 HB3 LEU 33 2HB LEU 33 -9.010 -1.779 -3.004 84 HG LEU 33 HG LEU 33 -11.917 -2.500 -2.606 85 HD11 LEU 33 1HD1 LEU 33 -11.086 -4.315 -1.241 86 HD12 LEU 33 2HD1 LEU 33 -9.423 -3.843 -1.586 87 HD13 LEU 33 3HD1 LEU 33 -10.457 -4.440 -2.884 88 HD21 LEU 33 1HD2 LEU 33 -11.510 -2.077 -0.240 89 HD22 LEU 33 2HD2 LEU 33 -11.260 -0.619 -1.200 90 HD23 LEU 33 3HD2 LEU 33 -9.873 -1.536 -0.611 91 H THR 34 H THR 34 -10.948 -0.652 -6.166 92 HA THR 34 HA THR 34 -8.453 -0.027 -7.317 93 HB THR 34 HB THR 34 -11.199 0.086 -8.585 94 HG1 THR 34 HG1 THR 34 -10.597 -1.977 -7.657 95 HG21 THR 34 1HG2 THR 34 -9.999 -0.252 -10.699 96 HG22 THR 34 2HG2 THR 34 -8.462 -0.175 -9.839 97 HG23 THR 34 3HG2 THR 34 -9.503 1.247 -9.915 98 H ASP 35 H ASP 35 -11.391 1.884 -6.764 99 HA ASP 35 HA ASP 35 -10.466 4.249 -7.999 100 HB2 ASP 35 1HB ASP 35 -12.601 3.653 -5.979 101 HB3 ASP 35 2HB ASP 35 -12.174 5.323 -6.342 102 H MET 36 H MET 36 -10.184 2.986 -4.728 103 HA MET 36 HA MET 36 -8.904 5.259 -3.631 104 HB2 MET 36 1HB MET 36 -9.833 3.512 -2.189 105 HB3 MET 36 2HB MET 36 -8.651 2.359 -2.803 106 HG2 MET 36 1HG MET 36 -8.060 3.281 -0.593 107 HG3 MET 36 2HG MET 36 -6.848 3.600 -1.838 108 HE1 MET 36 1HE MET 36 -5.644 5.517 -0.592 109 HE2 MET 36 2HE MET 36 -6.671 5.198 0.805 110 HE3 MET 36 3HE MET 36 -6.471 6.849 0.216 111 H LEU 37 H LEU 37 -7.672 2.344 -5.207 112 HA LEU 37 HA LEU 37 -4.934 2.899 -5.004 113 HB2 LEU 37 1HB LEU 37 -6.217 0.799 -5.854 114 HB3 LEU 37 2HB LEU 37 -6.185 1.604 -7.416 115 HG LEU 37 HG LEU 37 -4.426 -0.083 -7.231 116 HD11 LEU 37 1HD1 LEU 37 -2.496 1.272 -7.869 117 HD12 LEU 37 2HD1 LEU 37 -3.321 2.715 -7.282 118 HD13 LEU 37 3HD1 LEU 37 -3.979 1.819 -8.650 119 HD21 LEU 37 1HD2 LEU 37 -3.316 1.578 -4.977 120 HD22 LEU 37 2HD2 LEU 37 -2.574 0.145 -5.687 121 HD23 LEU 37 3HD2 LEU 37 -4.097 0.007 -4.809 122 H GLN 38 H GLN 38 -7.347 3.845 -7.419 123 HA GLN 38 HA GLN 38 -5.646 5.230 -9.168 124 HB2 GLN 38 1HB GLN 38 -8.570 5.681 -8.547 125 HB3 GLN 38 2HB GLN 38 -7.713 6.441 -9.881 126 HG2 GLN 38 1HG GLN 38 -8.177 3.491 -9.509 127 HG3 GLN 38 2HG GLN 38 -9.012 4.546 -10.644 128 HE21 GLN 38 1HE2 GLN 38 -6.108 2.805 -9.958 129 HE22 GLN 38 2HE2 GLN 38 -5.361 3.028 -11.502 130 H THR 39 H THR 39 -7.207 6.212 -6.186 131 HA THR 39 HA THR 39 -6.547 8.991 -6.442 132 HB THR 39 HB THR 39 -7.256 7.467 -3.925 133 HG1 THR 39 HG1 THR 39 -8.898 7.184 -5.463 134 HG21 THR 39 1HG2 THR 39 -7.546 10.392 -4.639 135 HG22 THR 39 2HG2 THR 39 -6.340 9.718 -3.539 136 HG23 THR 39 3HG2 THR 39 -8.054 9.641 -3.126 137 H PHE 40 H PHE 40 -5.009 6.160 -5.111 138 HA PHE 40 HA PHE 40 -2.961 7.516 -3.680 139 HB2 PHE 40 1HB PHE 40 -3.562 5.166 -3.219 140 HB3 PHE 40 2HB PHE 40 -2.960 4.709 -4.808 141 HD1 PHE 40 HD1 PHE 40 -1.070 3.444 -4.559 142 HD2 PHE 40 HD2 PHE 40 -1.554 6.911 -2.137 143 HE1 PHE 40 HE1 PHE 40 1.186 3.114 -3.646 144 HE2 PHE 40 HE2 PHE 40 0.701 6.586 -1.215 145 HZ PHE 40 HZ PHE 40 2.079 4.689 -1.971 146 H VAL 41 H VAL 41 -3.349 6.465 -6.985 147 HA VAL 41 HA VAL 41 -0.816 6.422 -7.979 148 HB VAL 41 HB VAL 41 -3.307 7.464 -9.313 149 HG11 VAL 41 1HG1 VAL 41 -1.350 8.422 -10.419 150 HG12 VAL 41 2HG1 VAL 41 -2.140 7.216 -11.437 151 HG13 VAL 41 3HG1 VAL 41 -0.653 6.809 -10.578 152 HG21 VAL 41 1HG2 VAL 41 -3.277 5.281 -10.418 153 HG22 VAL 41 2HG2 VAL 41 -3.366 5.121 -8.663 154 HG23 VAL 41 3HG2 VAL 41 -1.839 4.841 -9.498 155 HA PRO 42 HA PRO 42 -0.772 11.285 -8.664 156 HB2 PRO 42 1HB PRO 42 -2.549 12.070 -6.417 157 HB3 PRO 42 2HB PRO 42 -2.350 12.810 -8.009 158 HG2 PRO 42 1HG PRO 42 -4.508 11.350 -7.428 159 HG3 PRO 42 2HG PRO 42 -3.766 11.303 -9.037 160 HD2 PRO 42 1HD PRO 42 -3.619 9.309 -6.820 161 HD3 PRO 42 2HD PRO 42 -3.692 9.051 -8.572 162 H TYR 43 H TYR 43 -1.437 10.119 -5.312 163 HA TYR 43 HA TYR 43 0.525 11.595 -4.033 164 HB2 TYR 43 1HB TYR 43 -0.649 8.879 -3.433 165 HB3 TYR 43 2HB TYR 43 0.534 9.643 -2.373 166 HD1 TYR 43 HD1 TYR 43 -2.865 10.065 -3.829 167 HD2 TYR 43 HD2 TYR 43 -0.121 11.257 -0.800 168 HE1 TYR 43 HE1 TYR 43 -4.671 11.257 -2.666 169 HE2 TYR 43 HE2 TYR 43 -1.921 12.457 0.366 170 HH TYR 43 HH TYR 43 -4.081 13.430 -0.078 171 H ARG 44 H ARG 44 0.812 8.572 -5.814 172 HA ARG 44 HA ARG 44 3.287 7.716 -4.881 173 HB2 ARG 44 1HB ARG 44 2.185 7.423 -7.675 174 HB3 ARG 44 2HB ARG 44 3.512 6.488 -6.999 175 HG2 ARG 44 1HG ARG 44 1.934 5.650 -5.262 176 HG3 ARG 44 2HG ARG 44 0.630 6.453 -6.146 177 HD2 ARG 44 1HD ARG 44 2.399 4.194 -7.078 178 HD3 ARG 44 2HD ARG 44 0.649 4.177 -6.864 179 HE ARG 44 HE ARG 44 1.682 6.050 -8.832 180 HH11 ARG 44 1HH1 ARG 44 0.254 2.915 -8.209 181 HH12 ARG 44 2HH1 ARG 44 -0.228 2.668 -9.857 182 HH21 ARG 44 1HH2 ARG 44 1.062 5.728 -10.998 183 HH22 ARG 44 2HH2 ARG 44 0.233 4.269 -11.443 184 H THR 45 H THR 45 2.651 9.645 -7.804 185 HA THR 45 HA THR 45 5.198 10.317 -8.502 186 HB THR 45 HB THR 45 2.849 12.222 -8.524 187 HG1 THR 45 HG1 THR 45 3.661 10.185 -10.359 188 HG21 THR 45 1HG2 THR 45 4.976 13.303 -9.055 189 HG22 THR 45 2HG2 THR 45 3.956 13.186 -10.490 190 HG23 THR 45 3HG2 THR 45 5.306 12.073 -10.275 191 H ALA 46 H ALA 46 3.222 11.911 -6.013 192 HA ALA 46 HA ALA 46 5.110 13.922 -5.369 193 HB1 ALA 46 1HB ALA 46 2.922 12.734 -3.661 194 HB2 ALA 46 2HB ALA 46 2.756 14.110 -4.753 195 HB3 ALA 46 3HB ALA 46 3.789 14.236 -3.330 196 H VAL 47 H VAL 47 4.530 10.682 -4.187 197 HA VAL 47 HA VAL 47 6.365 10.709 -2.034 198 HB VAL 47 HB VAL 47 5.340 8.383 -3.678 199 HG11 VAL 47 1HG1 VAL 47 6.831 8.320 -1.055 200 HG12 VAL 47 2HG1 VAL 47 7.477 7.816 -2.617 201 HG13 VAL 47 3HG1 VAL 47 6.136 6.931 -1.891 202 HG21 VAL 47 1HG2 VAL 47 3.598 9.546 -2.453 203 HG22 VAL 47 2HG2 VAL 47 4.543 9.442 -0.968 204 HG23 VAL 47 3HG2 VAL 47 3.912 7.974 -1.715 205 H GLU 48 H GLU 48 6.707 9.860 -5.453 206 HA GLU 48 HA GLU 48 9.417 9.045 -5.279 207 HB2 GLU 48 1HB GLU 48 7.882 10.160 -7.640 208 HB3 GLU 48 2HB GLU 48 9.458 9.392 -7.737 209 HG2 GLU 48 1HG GLU 48 6.915 8.077 -6.807 210 HG3 GLU 48 2HG GLU 48 7.669 7.877 -8.389 211 H LEU 49 H LEU 49 7.845 12.145 -5.831 212 HA LEU 49 HA LEU 49 10.188 13.598 -6.450 213 HB2 LEU 49 1HB LEU 49 7.393 14.244 -5.766 214 HB3 LEU 49 2HB LEU 49 8.562 15.499 -5.409 215 HG LEU 49 HG LEU 49 7.519 15.818 -7.606 216 HD11 LEU 49 1HD1 LEU 49 9.538 16.160 -8.890 217 HD12 LEU 49 2HD1 LEU 49 10.431 15.080 -7.823 218 HD13 LEU 49 3HD1 LEU 49 9.805 16.609 -7.206 219 HD21 LEU 49 1HD2 LEU 49 7.090 13.483 -8.172 220 HD22 LEU 49 2HD2 LEU 49 8.824 13.202 -8.337 221 HD23 LEU 49 3HD2 LEU 49 8.000 14.295 -9.447 222 H CYS 50 H CYS 50 8.429 13.127 -3.380 223 HA CYS 50 HA CYS 50 10.246 14.769 -1.911 224 HB2 CYS 50 1HB CYS 50 9.111 13.985 0.079 225 HB3 CYS 50 2HB CYS 50 7.921 14.336 -1.166 226 H ALA 51 H ALA 51 10.304 11.522 -3.005 227 HA ALA 51 HA ALA 51 12.100 10.481 -1.028 228 HB1 ALA 51 1HB ALA 51 12.338 8.575 -2.509 229 HB2 ALA 51 2HB ALA 51 11.531 9.454 -3.807 230 HB3 ALA 51 3HB ALA 51 10.637 9.011 -2.353 231 H LEU 52 H LEU 52 12.406 11.858 -4.265 232 HA LEU 52 HA LEU 52 15.148 11.117 -4.551 233 HB2 LEU 52 1HB LEU 52 13.561 11.411 -6.448 234 HB3 LEU 52 2HB LEU 52 13.548 13.137 -6.132 235 HG LEU 52 HG LEU 52 16.003 13.174 -6.612 236 HD11 LEU 52 1HD1 LEU 52 16.951 11.268 -7.842 237 HD12 LEU 52 2HD1 LEU 52 15.491 10.339 -7.500 238 HD13 LEU 52 3HD1 LEU 52 16.540 10.855 -6.179 239 HD21 LEU 52 1HD2 LEU 52 14.357 13.832 -8.284 240 HD22 LEU 52 2HD2 LEU 52 14.215 12.157 -8.815 241 HD23 LEU 52 3HD2 LEU 52 15.734 13.025 -9.034 242 H GLU 53 H GLU 53 13.504 13.894 -3.295 243 HA GLU 53 HA GLU 53 15.472 15.852 -3.596 244 HB2 GLU 53 1HB GLU 53 13.152 16.319 -2.919 245 HB3 GLU 53 2HB GLU 53 13.448 15.545 -1.370 246 HG2 GLU 53 1HG GLU 53 13.529 17.934 -1.122 247 HG3 GLU 53 2HG GLU 53 15.131 17.255 -0.854 248 H HIS 54 H HIS 54 14.947 13.528 -0.982 249 HA HIS 54 HA HIS 54 17.491 14.424 0.226 250 HB2 HIS 54 1HB HIS 54 15.217 12.943 1.571 251 HB3 HIS 54 2HB HIS 54 16.682 13.525 2.353 252 HD1 HIS 54 HD1 HIS 54 16.695 15.930 3.145 253 HD2 HIS 54 HD2 HIS 54 13.396 15.012 0.788 254 HE1 HIS 54 HE1 HIS 54 15.159 17.908 3.330 255 HE2 HIS 54 HE2 HIS 54 13.246 17.395 1.774 256 H GLY 55 H GLY 55 16.005 11.969 -1.460 257 HA2 GLY 55 1HA GLY 55 16.779 9.968 -2.269 258 HA3 GLY 55 2HA GLY 55 18.236 10.172 -1.306 259 H GLY 56 H GLY 56 16.756 10.480 1.237 260 HA2 GLY 56 1HA GLY 56 15.318 7.932 1.358 261 HA3 GLY 56 2HA GLY 56 15.963 8.808 2.738 262 H LEU 57 H LEU 57 13.270 7.717 2.105 263 HA LEU 57 HA LEU 57 11.492 9.929 1.803 264 HB2 LEU 57 1HB LEU 57 11.114 7.074 2.670 265 HB3 LEU 57 2HB LEU 57 9.792 8.225 2.638 266 HG LEU 57 HG LEU 57 11.439 7.699 0.184 267 HD11 LEU 57 1HD1 LEU 57 9.783 6.048 -0.499 268 HD12 LEU 57 2HD1 LEU 57 8.979 6.194 1.063 269 HD13 LEU 57 3HD1 LEU 57 10.613 5.534 0.969 270 HD21 LEU 57 1HD2 LEU 57 8.645 8.716 0.679 271 HD22 LEU 57 2HD2 LEU 57 9.336 8.405 -0.912 272 HD23 LEU 57 3HD2 LEU 57 10.030 9.654 0.120 273 H ASP 58 H ASP 58 13.466 9.127 4.270 274 HA ASP 58 HA ASP 58 12.082 9.095 6.621 275 HB2 ASP 58 1HB ASP 58 14.677 10.529 6.044 276 HB3 ASP 58 2HB ASP 58 14.074 10.163 7.655 277 H THR 59 H THR 59 12.740 11.883 4.601 278 HA THR 59 HA THR 59 11.638 13.688 6.602 279 HB THR 59 HB THR 59 12.222 15.292 4.512 280 HG1 THR 59 HG1 THR 59 14.338 13.453 4.361 281 HG21 THR 59 1HG2 THR 59 14.389 15.686 5.602 282 HG22 THR 59 2HG2 THR 59 14.196 14.186 6.510 283 HG23 THR 59 3HG2 THR 59 13.089 15.533 6.784 284 H CYS 60 H CYS 60 10.300 11.739 4.366 285 HA CYS 60 HA CYS 60 8.426 13.736 3.323 286 HB2 CYS 60 1HB CYS 60 9.503 12.123 1.746 287 HB3 CYS 60 2HB CYS 60 8.693 10.808 2.586 288 H ASP 61 H ASP 61 7.628 13.934 5.577 289 HA ASP 61 HA ASP 61 5.823 11.723 6.330 290 HB2 ASP 61 1HB ASP 61 7.717 12.260 7.924 291 HB3 ASP 61 2HB ASP 61 6.956 13.828 8.183 292 H GLY 62 H GLY 62 3.745 12.255 7.080 293 HA2 GLY 62 1HA GLY 62 2.511 14.287 5.557 294 HA3 GLY 62 2HA GLY 62 1.737 13.321 6.802 295 H GLY 63 H GLY 63 2.967 16.367 5.952 296 HA2 GLY 63 1HA GLY 63 2.089 18.259 7.200 297 HA3 GLY 63 2HA GLY 63 2.383 17.346 8.671 298 H SER 64 H SER 64 4.921 16.940 6.479 299 HA SER 64 HA SER 64 6.355 19.311 7.395 300 HB2 SER 64 1HB SER 64 8.344 17.848 7.953 301 HB3 SER 64 2HB SER 64 6.983 17.714 9.067 302 HG SER 64 HG SER 64 6.344 15.863 7.679 303 H ASN 65 H ASN 65 8.386 19.653 6.184 304 HA ASN 65 HA ASN 65 9.478 19.954 4.225 305 HB2 ASN 65 1HB ASN 65 9.000 16.980 4.176 306 HB3 ASN 65 2HB ASN 65 9.944 17.793 2.934 307 HD21 ASN 65 1HD2 ASN 65 11.957 18.682 3.475 308 HD22 ASN 65 2HD2 ASN 65 12.775 18.266 4.946 309 H GLY 66 H GLY 66 6.640 20.448 4.107 310 HA2 GLY 66 1HA GLY 66 5.272 21.244 2.425 311 HA3 GLY 66 2HA GLY 66 6.423 20.629 1.245 312 H ILE 67 H ILE 67 5.681 18.169 3.348 313 HA ILE 67 HA ILE 67 3.938 16.893 1.421 314 HB ILE 67 HB ILE 67 4.921 15.879 4.100 315 HG12 ILE 67 1HG1 ILE 67 6.809 16.301 2.615 316 HG13 ILE 67 2HG1 ILE 67 6.554 14.567 2.783 317 HG21 ILE 67 1HG2 ILE 67 2.906 14.739 3.290 318 HG22 ILE 67 2HG2 ILE 67 4.309 13.670 3.289 319 HG23 ILE 67 3HG2 ILE 67 3.732 14.367 1.775 320 HD11 ILE 67 1HD1 ILE 67 5.759 16.278 0.445 321 HD12 ILE 67 2HD1 ILE 67 5.390 14.563 0.616 322 HD13 ILE 67 3HD1 ILE 67 7.066 15.097 0.505 323 HA PRO 68 HA PRO 68 0.318 18.575 3.315 324 HB2 PRO 68 1HB PRO 68 -1.472 16.699 2.362 325 HB3 PRO 68 2HB PRO 68 -0.910 18.110 1.460 326 HG2 PRO 68 1HG PRO 68 0.018 15.275 1.314 327 HG3 PRO 68 2HG PRO 68 -0.219 16.454 0.004 328 HD2 PRO 68 1HD PRO 68 2.227 15.864 0.954 329 HD3 PRO 68 2HD PRO 68 1.808 17.509 0.426 330 H SER 69 H SER 69 -1.439 17.960 4.746 331 HA SER 69 HA SER 69 -0.478 16.073 6.737 332 HB2 SER 69 1HB SER 69 -1.145 18.295 7.512 333 HB3 SER 69 2HB SER 69 -2.739 18.094 6.789 334 HG SER 69 HG SER 69 -2.986 17.594 8.908 335 HA PRO 70 HA PRO 70 -2.939 12.800 5.138 336 HB2 PRO 70 1HB PRO 70 -3.334 11.473 7.550 337 HB3 PRO 70 2HB PRO 70 -1.935 11.275 6.491 338 HG2 PRO 70 1HG PRO 70 -2.241 12.960 8.935 339 HG3 PRO 70 2HG PRO 70 -0.849 12.008 8.394 340 HD2 PRO 70 1HD PRO 70 -0.892 14.664 8.099 341 HD3 PRO 70 2HD PRO 70 -0.194 13.618 6.844 342 H THR 71 H THR 71 -4.983 12.827 4.634 343 HA THR 71 HA THR 71 -7.023 13.396 6.633 344 HB THR 71 HB THR 71 -6.481 15.582 5.590 345 HG1 THR 71 HG1 THR 71 -8.780 15.808 4.639 346 HG21 THR 71 1HG2 THR 71 -5.743 14.802 3.403 347 HG22 THR 71 2HG2 THR 71 -7.044 15.979 3.234 348 HG23 THR 71 3HG2 THR 71 -7.379 14.260 3.031 349 H THR 72 H THR 72 -9.246 13.324 5.133 350 HA THR 72 HA THR 72 -8.988 10.855 3.583 351 HB THR 72 HB THR 72 -11.085 10.012 4.676 352 HG1 THR 72 HG1 THR 72 -11.489 10.971 6.796 353 HG21 THR 72 1HG2 THR 72 -9.961 9.148 6.638 354 HG22 THR 72 2HG2 THR 72 -8.757 10.433 6.549 355 HG23 THR 72 3HG2 THR 72 -8.827 9.202 5.290 356 H THR 73 H THR 73 -9.908 11.037 1.692 357 HA THR 73 HA THR 73 -11.884 13.049 1.125 358 HB THR 73 HB THR 73 -11.908 12.008 -1.159 359 HG1 THR 73 HG1 THR 73 -11.032 10.114 -1.408 360 HG21 THR 73 1HG2 THR 73 -9.196 12.733 -0.056 361 HG22 THR 73 2HG2 THR 73 -10.404 13.860 -0.674 362 HG23 THR 73 3HG2 THR 73 -9.630 12.711 -1.764 363 H ARG 74 H ARG 74 -13.809 11.963 -0.356 364 HA ARG 74 HA ARG 74 -15.582 11.139 1.590 365 HB2 ARG 74 1HB ARG 74 -16.314 12.141 -0.499 366 HB3 ARG 74 2HB ARG 74 -15.754 10.738 -1.399 367 HG2 ARG 74 1HG ARG 74 -18.169 10.708 -1.139 368 HG3 ARG 74 2HG ARG 74 -17.425 9.350 -0.297 369 HD2 ARG 74 1HD ARG 74 -17.643 10.492 1.824 370 HD3 ARG 74 2HD ARG 74 -18.271 11.931 1.021 371 HE ARG 74 HE ARG 74 -20.001 9.970 0.279 372 HH11 ARG 74 1HH1 ARG 74 -18.833 11.120 3.375 373 HH12 ARG 74 2HH1 ARG 74 -20.292 10.708 4.220 374 HH21 ARG 74 1HH2 ARG 74 -21.915 9.442 1.380 375 HH22 ARG 74 2HH2 ARG 74 -22.047 9.744 3.085 376 H TYR 75 H TYR 75 -13.877 9.023 -0.788 377 HA TYR 75 HA TYR 75 -14.970 6.742 0.661 378 HB2 TYR 75 1HB TYR 75 -13.434 6.803 -1.941 379 HB3 TYR 75 2HB TYR 75 -14.256 5.407 -1.240 380 HD1 TYR 75 HD1 TYR 75 -14.532 7.450 -3.859 381 HD2 TYR 75 HD2 TYR 75 -16.839 6.356 -0.458 382 HE1 TYR 75 HE1 TYR 75 -16.585 8.065 -5.058 383 HE2 TYR 75 HE2 TYR 75 -18.899 6.970 -1.651 384 HH TYR 75 HH TYR 75 -19.598 8.390 -3.508 385 H VAL 76 H VAL 76 -12.696 8.450 1.669 386 HA VAL 76 HA VAL 76 -10.845 6.189 2.084 387 HB VAL 76 HB VAL 76 -10.261 9.144 2.398 388 HG11 VAL 76 1HG1 VAL 76 -8.371 6.818 2.754 389 HG12 VAL 76 2HG1 VAL 76 -9.149 7.665 4.088 390 HG13 VAL 76 3HG1 VAL 76 -8.029 8.528 3.033 391 HG21 VAL 76 1HG2 VAL 76 -10.303 8.453 0.077 392 HG22 VAL 76 2HG2 VAL 76 -9.241 7.091 0.440 393 HG23 VAL 76 3HG2 VAL 76 -8.638 8.742 0.585 394 H SER 77 H SER 77 -10.668 5.389 4.069 395 HA SER 77 HA SER 77 -12.513 6.412 6.063 396 HB2 SER 77 1HB SER 77 -10.816 3.903 6.054 397 HB3 SER 77 2HB SER 77 -12.071 4.293 7.230 398 HG SER 77 HG SER 77 -13.555 3.729 5.852 399 H ALA 78 H ALA 78 -9.041 5.742 5.760 400 HA ALA 78 HA ALA 78 -8.316 7.787 7.580 401 HB1 ALA 78 1HB ALA 78 -8.144 4.954 8.604 402 HB2 ALA 78 2HB ALA 78 -9.117 6.261 9.277 403 HB3 ALA 78 3HB ALA 78 -7.356 6.343 9.350 404 H MET 79 H MET 79 -6.069 8.109 7.630 405 HA MET 79 HA MET 79 -4.252 6.211 6.518 406 HB2 MET 79 1HB MET 79 -3.502 7.583 4.602 407 HB3 MET 79 2HB MET 79 -5.147 6.993 4.404 408 HG2 MET 79 1HG MET 79 -6.076 9.094 4.698 409 HG3 MET 79 2HG MET 79 -4.646 9.721 5.518 410 HE1 MET 79 1HE MET 79 -4.742 7.609 2.198 411 HE2 MET 79 2HE MET 79 -4.806 8.878 0.977 412 HE3 MET 79 3HE MET 79 -6.178 8.623 2.054 413 H SER 80 H SER 80 -2.185 6.656 7.078 414 HA SER 80 HA SER 80 -1.527 9.370 8.000 415 HB2 SER 80 1HB SER 80 -0.709 6.817 9.421 416 HB3 SER 80 2HB SER 80 -0.294 8.461 9.908 417 HG SER 80 HG SER 80 -2.967 8.175 9.576 418 H VAL 81 H VAL 81 0.436 10.094 7.328 419 HA VAL 81 HA VAL 81 1.957 8.280 5.589 420 HB VAL 81 HB VAL 81 2.045 11.304 5.678 421 HG11 VAL 81 1HG1 VAL 81 4.084 10.333 4.796 422 HG12 VAL 81 2HG1 VAL 81 3.163 11.092 3.498 423 HG13 VAL 81 3HG1 VAL 81 3.153 9.338 3.676 424 HG21 VAL 81 1HG2 VAL 81 -0.155 10.593 4.979 425 HG22 VAL 81 2HG2 VAL 81 0.546 9.479 3.806 426 HG23 VAL 81 3HG2 VAL 81 0.735 11.220 3.591 427 H ALA 82 H ALA 82 3.802 7.513 6.393 428 HA ALA 82 HA ALA 82 5.294 9.143 8.323 429 HB1 ALA 82 1HB ALA 82 5.690 7.179 9.715 430 HB2 ALA 82 2HB ALA 82 4.676 6.207 8.646 431 HB3 ALA 82 3HB ALA 82 3.963 7.519 9.588 432 H LYS 83 H LYS 83 7.083 9.515 7.377 433 HA LYS 83 HA LYS 83 9.009 9.361 6.084 434 HB2 LYS 83 1HB LYS 83 9.016 6.410 6.721 435 HB3 LYS 83 2HB LYS 83 10.394 7.466 6.466 436 HG2 LYS 83 1HG LYS 83 8.538 7.678 8.825 437 HG3 LYS 83 2HG LYS 83 10.032 6.743 8.830 438 HD2 LYS 83 1HD LYS 83 11.288 8.794 8.316 439 HD3 LYS 83 2HD LYS 83 9.785 9.716 8.376 440 HE2 LYS 83 1HE LYS 83 10.986 9.927 10.474 441 HE3 LYS 83 2HE LYS 83 9.485 9.039 10.720 442 HZ1 LYS 83 1HZ LYS 83 12.146 7.770 10.384 443 HZ2 LYS 83 2HZ LYS 83 10.697 6.991 10.774 444 HZ3 LYS 83 3HZ LYS 83 11.405 8.058 11.877 445 H GLY 84 H GLY 84 6.722 9.281 4.587 446 HA2 GLY 84 1HA GLY 84 6.121 8.895 2.386 447 HA3 GLY 84 2HA GLY 84 7.489 7.798 2.239 448 H VAL 85 H VAL 85 6.586 6.279 4.588 449 HA VAL 85 HA VAL 85 4.900 4.359 3.375 450 HB VAL 85 HB VAL 85 5.436 4.735 6.330 451 HG11 VAL 85 1HG1 VAL 85 3.545 3.269 5.931 452 HG12 VAL 85 2HG1 VAL 85 4.929 2.343 6.512 453 HG13 VAL 85 3HG1 VAL 85 4.501 2.315 4.799 454 HG21 VAL 85 1HG2 VAL 85 6.902 3.063 4.296 455 HG22 VAL 85 2HG2 VAL 85 7.212 3.079 6.032 456 HG23 VAL 85 3HG2 VAL 85 7.507 4.528 5.070 457 H VAL 86 H VAL 86 2.643 3.920 3.672 458 HA VAL 86 HA VAL 86 1.150 6.077 4.980 459 HB VAL 86 HB VAL 86 0.490 4.948 2.247 460 HG11 VAL 86 1HG1 VAL 86 -1.288 6.638 2.217 461 HG12 VAL 86 2HG1 VAL 86 -0.872 7.095 3.869 462 HG13 VAL 86 3HG1 VAL 86 -1.506 5.481 3.533 463 HG21 VAL 86 1HG2 VAL 86 2.376 6.469 2.109 464 HG22 VAL 86 2HG2 VAL 86 1.495 7.680 3.038 465 HG23 VAL 86 3HG2 VAL 86 0.937 7.229 1.427 466 H SER 87 H SER 87 0.208 5.036 6.584 467 HA SER 87 HA SER 87 -0.860 2.344 6.117 468 HB2 SER 87 1HB SER 87 0.752 2.809 8.024 469 HB3 SER 87 2HB SER 87 -0.544 3.733 8.782 470 HG SER 87 HG SER 87 -1.794 1.848 8.840 471 H LEU 88 H LEU 88 -2.923 1.939 6.024 472 HA LEU 88 HA LEU 88 -4.833 4.066 6.740 473 HB2 LEU 88 1HB LEU 88 -5.148 1.900 4.661 474 HB3 LEU 88 2HB LEU 88 -6.312 3.162 5.025 475 HG LEU 88 HG LEU 88 -4.326 4.759 4.363 476 HD11 LEU 88 1HD1 LEU 88 -2.630 3.057 4.088 477 HD12 LEU 88 2HD1 LEU 88 -2.977 3.817 2.535 478 HD13 LEU 88 3HD1 LEU 88 -3.627 2.218 2.899 479 HD21 LEU 88 1HD2 LEU 88 -6.458 4.687 3.233 480 HD22 LEU 88 2HD2 LEU 88 -5.985 3.217 2.379 481 HD23 LEU 88 3HD2 LEU 88 -5.151 4.736 2.050 482 H THR 89 H THR 89 -6.787 3.443 7.738 483 HA THR 89 HA THR 89 -6.770 0.711 8.824 484 HB THR 89 HB THR 89 -7.731 3.166 10.302 485 HG1 THR 89 HG1 THR 89 -5.566 3.397 10.327 486 HG21 THR 89 1HG2 THR 89 -7.741 1.683 12.247 487 HG22 THR 89 2HG2 THR 89 -7.200 0.338 11.240 488 HG23 THR 89 3HG2 THR 89 -8.793 1.051 10.979 489 H GLY 90 H GLY 90 -8.499 -0.428 8.497 490 HA2 GLY 90 1HA GLY 90 -10.630 -1.063 7.889 491 HA3 GLY 90 2HA GLY 90 -11.122 0.284 8.899 492 H GLN 91 H GLN 91 -9.526 0.127 5.723 493 HA GLN 91 HA GLN 91 -11.053 2.344 4.771 494 HB2 GLN 91 1HB GLN 91 -8.751 1.903 4.047 495 HB3 GLN 91 2HB GLN 91 -9.270 0.403 3.290 496 HG2 GLN 91 1HG GLN 91 -8.914 2.190 1.671 497 HG3 GLN 91 2HG GLN 91 -10.587 1.633 1.685 498 HE21 GLN 91 1HE2 GLN 91 -12.192 3.025 2.282 499 HE22 GLN 91 2HE2 GLN 91 -11.938 4.708 2.547 500 H GLU 92 H GLU 92 -12.988 2.335 3.856 501 HA GLU 92 HA GLU 92 -14.964 1.652 2.998 502 HB2 GLU 92 1HB GLU 92 -13.091 -0.164 1.486 503 HB3 GLU 92 2HB GLU 92 -14.817 -0.088 1.153 504 HG2 GLU 92 1HG GLU 92 -12.834 2.151 0.900 505 HG3 GLU 92 2HG GLU 92 -13.669 1.309 -0.400 506 H SER 93 H SER 93 -15.213 -1.314 2.109 507 HA SER 93 HA SER 93 -16.576 -2.246 4.379 508 HB2 SER 93 1HB SER 93 -15.503 -4.058 2.242 509 HB3 SER 93 2HB SER 93 -17.045 -4.146 3.092 510 HG SER 93 HG SER 93 -17.691 -2.259 1.960 511 H LEU 94 H LEU 94 -13.277 -2.123 3.765 512 HA LEU 94 HA LEU 94 -12.557 -4.646 4.979 513 HB2 LEU 94 1HB LEU 94 -10.757 -2.381 4.126 514 HB3 LEU 94 2HB LEU 94 -10.284 -4.041 4.463 515 HG LEU 94 HG LEU 94 -12.028 -3.152 2.157 516 HD11 LEU 94 1HD1 LEU 94 -9.183 -4.133 2.165 517 HD12 LEU 94 2HD1 LEU 94 -9.686 -2.460 1.932 518 HD13 LEU 94 3HD1 LEU 94 -10.138 -3.690 0.752 519 HD21 LEU 94 1HD2 LEU 94 -12.618 -5.383 2.877 520 HD22 LEU 94 2HD2 LEU 94 -10.920 -5.865 2.867 521 HD23 LEU 94 3HD2 LEU 94 -11.732 -5.458 1.356 522 H ASN 95 H ASN 95 -14.031 -2.932 6.638 523 HA ASN 95 HA ASN 95 -12.594 -1.389 8.439 524 HB2 ASN 95 1HB ASN 95 -15.139 -1.808 8.265 525 HB3 ASN 95 2HB ASN 95 -14.841 -3.198 9.302 526 HD21 ASN 95 1HD2 ASN 95 -16.392 -0.780 9.800 527 HD22 ASN 95 2HD2 ASN 95 -15.723 -0.059 11.224 528 H GLY 96 H GLY 96 -11.417 -1.815 10.261 529 HA2 GLY 96 1HA GLY 96 -10.282 -3.104 11.846 530 HA3 GLY 96 2HA GLY 96 -10.970 -4.550 11.117 531 H LEU 97 H LEU 97 -10.029 -3.610 8.420 532 HA LEU 97 HA LEU 97 -7.516 -4.963 8.504 533 HB2 LEU 97 1HB LEU 97 -8.945 -5.322 6.627 534 HB3 LEU 97 2HB LEU 97 -9.058 -3.599 6.306 535 HG LEU 97 HG LEU 97 -6.672 -3.581 5.657 536 HD11 LEU 97 1HD1 LEU 97 -6.807 -6.573 5.838 537 HD12 LEU 97 2HD1 LEU 97 -6.070 -5.553 7.071 538 HD13 LEU 97 3HD1 LEU 97 -5.416 -5.569 5.437 539 HD21 LEU 97 1HD2 LEU 97 -8.436 -5.556 4.223 540 HD22 LEU 97 2HD2 LEU 97 -6.943 -4.886 3.564 541 HD23 LEU 97 3HD2 LEU 97 -8.303 -3.823 3.919 542 H SER 98 H SER 98 -5.585 -4.109 8.821 543 HA SER 98 HA SER 98 -5.219 -1.227 8.454 544 HB2 SER 98 1HB SER 98 -4.563 -2.142 10.646 545 HB3 SER 98 2HB SER 98 -3.458 -3.263 9.853 546 HG SER 98 HG SER 98 -3.288 -0.431 9.674 547 H VAL 99 H VAL 99 -4.505 -0.652 6.533 548 HA VAL 99 HA VAL 99 -2.893 -2.530 4.947 549 HB VAL 99 HB VAL 99 -4.147 0.065 4.036 550 HG11 VAL 99 1HG1 VAL 99 -3.037 -2.261 2.478 551 HG12 VAL 99 2HG1 VAL 99 -2.302 -0.667 2.647 552 HG13 VAL 99 3HG1 VAL 99 -3.831 -0.847 1.786 553 HG21 VAL 99 1HG2 VAL 99 -5.237 -2.733 3.765 554 HG22 VAL 99 2HG2 VAL 99 -5.911 -1.291 3.005 555 HG23 VAL 99 3HG2 VAL 99 -5.910 -1.443 4.761 556 H VAL 100 H VAL 100 -0.717 -2.192 4.820 557 HA VAL 100 HA VAL 100 0.229 0.508 5.515 558 HB VAL 100 HB VAL 100 1.722 -2.096 5.885 559 HG11 VAL 100 1HG1 VAL 100 3.323 -0.749 7.146 560 HG12 VAL 100 2HG1 VAL 100 2.389 0.704 6.791 561 HG13 VAL 100 3HG1 VAL 100 3.180 -0.176 5.484 562 HG21 VAL 100 1HG2 VAL 100 -0.140 -1.980 7.439 563 HG22 VAL 100 2HG2 VAL 100 0.344 -0.355 7.930 564 HG23 VAL 100 3HG2 VAL 100 1.383 -1.732 8.297 565 H MET 101 H MET 101 0.543 1.449 3.597 566 HA MET 101 HA MET 101 1.816 0.003 1.409 567 HB2 MET 101 1HB MET 101 -0.006 1.623 0.939 568 HB3 MET 101 2HB MET 101 0.984 2.911 1.607 569 HG2 MET 101 1HG MET 101 1.137 3.034 -0.750 570 HG3 MET 101 2HG MET 101 2.677 2.432 -0.148 571 HE1 MET 101 1HE MET 101 -0.631 1.622 -2.016 572 HE2 MET 101 2HE MET 101 -0.761 0.509 -0.655 573 HE3 MET 101 3HE MET 101 -0.519 -0.116 -2.285 574 H THR 102 H THR 102 3.952 -0.244 1.462 575 HA THR 102 HA THR 102 5.549 1.792 2.879 576 HB THR 102 HB THR 102 6.361 -1.076 2.432 577 HG1 THR 102 HG1 THR 102 4.297 -0.499 3.766 578 HG21 THR 102 1HG2 THR 102 7.204 0.978 4.482 579 HG22 THR 102 2HG2 THR 102 8.128 0.524 3.050 580 HG23 THR 102 3HG2 THR 102 7.841 -0.660 4.327 581 HA PRO 103 HA PRO 103 7.277 2.158 -1.345 582 HB2 PRO 103 1HB PRO 103 8.178 4.762 -0.393 583 HB3 PRO 103 2HB PRO 103 7.101 4.387 -1.742 584 HG2 PRO 103 1HG PRO 103 6.249 5.583 0.554 585 HG3 PRO 103 2HG PRO 103 5.213 4.553 -0.452 586 HD2 PRO 103 1HD PRO 103 6.626 3.910 2.105 587 HD3 PRO 103 2HD PRO 103 5.013 3.405 1.545 588 H GLY 104 H GLY 104 9.239 1.387 -1.722 589 HA2 GLY 104 1HA GLY 104 11.527 1.063 -1.540 590 HA3 GLY 104 2HA GLY 104 11.563 2.266 -0.259 591 H TRP 105 H TRP 105 12.987 -0.187 -0.252 592 HA TRP 105 HA TRP 105 12.053 -1.260 2.264 593 HB2 TRP 105 1HB TRP 105 10.813 -2.613 0.583 594 HB3 TRP 105 2HB TRP 105 12.346 -3.085 -0.140 595 HD1 TRP 105 HD1 TRP 105 13.690 -5.028 1.010 596 HE1 TRP 105 HE1 TRP 105 13.162 -6.652 2.934 597 HE3 TRP 105 HE3 TRP 105 9.536 -2.717 2.892 598 HZ2 TRP 105 HZ2 TRP 105 11.231 -6.914 4.982 599 HZ3 TRP 105 HZ3 TRP 105 8.406 -3.720 4.834 600 HH2 TRP 105 HH2 TRP 105 9.238 -5.774 5.855 601 H ASP 106 H ASP 106 14.169 -2.208 -0.402 602 HA ASP 106 HA ASP 106 16.519 -1.652 1.241 603 HB2 ASP 106 1HB ASP 106 16.061 -4.087 1.457 604 HB3 ASP 106 2HB ASP 106 16.110 -4.233 -0.298 605 H ASN 107 H ASN 107 17.896 -0.483 0.106 606 HA ASN 107 HA ASN 107 17.159 0.601 -2.341 607 HB2 ASN 107 1HB ASN 107 18.681 1.678 -0.698 608 HB3 ASN 107 2HB ASN 107 19.944 0.545 -1.167 609 HD21 ASN 107 1HD2 ASN 107 17.607 2.153 -3.271 610 HD22 ASN 107 2HD2 ASN 107 18.778 3.053 -4.170 611 H ALA 108 H ALA 108 19.340 -2.080 -1.662 612 HA ALA 108 HA ALA 108 20.162 -2.246 -4.432 613 HB1 ALA 108 1HB ALA 108 21.571 -4.083 -3.708 614 HB2 ALA 108 2HB ALA 108 20.798 -4.073 -2.124 615 HB3 ALA 108 3HB ALA 108 21.768 -2.694 -2.639 616 H ASN 109 H ASN 109 18.287 -4.245 -2.153 617 HA ASN 109 HA ASN 109 17.864 -6.272 -4.166 618 HB2 ASN 109 1HB ASN 109 16.888 -5.978 -1.326 619 HB3 ASN 109 2HB ASN 109 16.415 -7.322 -2.360 620 HD21 ASN 109 1HD2 ASN 109 19.016 -5.823 -0.611 621 HD22 ASN 109 2HD2 ASN 109 20.098 -7.178 -0.686 622 H GLY 110 H GLY 110 16.121 -3.513 -3.022 623 HA2 GLY 110 1HA GLY 110 13.673 -4.536 -4.316 624 HA3 GLY 110 2HA GLY 110 13.686 -3.390 -2.985 625 H VAL 111 H VAL 111 13.108 -3.640 -6.142 626 HA VAL 111 HA VAL 111 13.493 -0.760 -6.492 627 HB VAL 111 HB VAL 111 15.365 -1.978 -7.642 628 HG11 VAL 111 1HG1 VAL 111 14.195 -3.977 -8.318 629 HG12 VAL 111 2HG1 VAL 111 14.887 -3.173 -9.726 630 HG13 VAL 111 3HG1 VAL 111 13.160 -3.041 -9.395 631 HG21 VAL 111 1HG2 VAL 111 13.489 -0.452 -9.440 632 HG22 VAL 111 2HG2 VAL 111 15.201 -0.739 -9.748 633 HG23 VAL 111 3HG2 VAL 111 14.707 0.243 -8.369 634 H THR 112 H THR 112 11.306 -2.572 -5.808 635 HA THR 112 HA THR 112 9.612 -2.640 -8.173 636 HB THR 112 HB THR 112 9.665 -4.625 -6.720 637 HG1 THR 112 HG1 THR 112 7.174 -3.231 -6.734 638 HG21 THR 112 1HG2 THR 112 10.063 -3.565 -4.567 639 HG22 THR 112 2HG2 THR 112 8.603 -4.552 -4.495 640 HG23 THR 112 3HG2 THR 112 8.477 -2.798 -4.626 641 H GLY 113 H GLY 113 10.294 -0.553 -5.641 642 HA2 GLY 113 1HA GLY 113 9.407 1.606 -5.442 643 HA3 GLY 113 2HA GLY 113 7.991 1.086 -6.341 644 H TRP 114 H TRP 114 6.271 0.115 -5.248 645 HA TRP 114 HA TRP 114 6.275 0.764 -2.391 646 HB2 TRP 114 1HB TRP 114 4.024 0.555 -4.392 647 HB3 TRP 114 2HB TRP 114 3.764 0.748 -2.659 648 HD1 TRP 114 HD1 TRP 114 4.077 3.140 -1.643 649 HE1 TRP 114 HE1 TRP 114 4.528 5.461 -2.654 650 HE3 TRP 114 HE3 TRP 114 5.286 1.724 -6.399 651 HZ2 TRP 114 HZ2 TRP 114 5.293 6.548 -5.146 652 HZ3 TRP 114 HZ3 TRP 114 5.861 3.463 -8.039 653 HH2 TRP 114 HH2 TRP 114 5.863 5.826 -7.424 654 H ALA 115 H ALA 115 6.122 -0.757 -0.913 655 HA ALA 115 HA ALA 115 5.361 -3.470 -1.710 656 HB1 ALA 115 1HB ALA 115 6.615 -2.478 0.851 657 HB2 ALA 115 2HB ALA 115 7.483 -3.206 -0.499 658 HB3 ALA 115 3HB ALA 115 6.323 -4.163 0.422 659 H ARG 116 H ARG 116 3.535 -4.387 -0.979 660 HA ARG 116 HA ARG 116 1.784 -2.654 0.634 661 HB2 ARG 116 1HB ARG 116 1.004 -4.768 -1.376 662 HB3 ARG 116 2HB ARG 116 -0.122 -3.830 -0.405 663 HG2 ARG 116 1HG ARG 116 -0.158 -2.718 -2.422 664 HG3 ARG 116 2HG ARG 116 1.016 -1.778 -1.501 665 HD2 ARG 116 1HD ARG 116 2.835 -3.041 -2.587 666 HD3 ARG 116 2HD ARG 116 1.634 -3.908 -3.542 667 HE ARG 116 HE ARG 116 1.803 -0.982 -3.709 668 HH11 ARG 116 1HH1 ARG 116 1.990 -4.128 -5.233 669 HH12 ARG 116 2HH1 ARG 116 2.207 -3.484 -6.826 670 HH21 ARG 116 1HH2 ARG 116 2.058 -0.132 -5.825 671 HH22 ARG 116 2HH2 ARG 116 2.240 -1.219 -7.164 672 H ASN 117 H ASN 117 0.796 -3.399 2.419 673 HA ASN 117 HA ASN 117 0.845 -6.256 3.005 674 HB2 ASN 117 1HB ASN 117 2.887 -5.381 4.068 675 HB3 ASN 117 2HB ASN 117 1.928 -4.174 4.917 676 HD21 ASN 117 1HD2 ASN 117 2.659 -4.990 6.916 677 HD22 ASN 117 2HD2 ASN 117 2.021 -6.460 7.572 678 H CYS 118 H CYS 118 -1.226 -6.693 3.314 679 HA CYS 118 HA CYS 118 -2.868 -4.781 4.814 680 HB2 CYS 118 1HB CYS 118 -3.484 -6.838 2.739 681 HB3 CYS 118 2HB CYS 118 -4.717 -6.493 3.951 682 H ASN 119 H ASN 119 -3.150 -5.170 6.895 683 HA ASN 119 HA ASN 119 -2.698 -7.912 7.875 684 HB2 ASN 119 1HB ASN 119 -2.632 -5.308 9.422 685 HB3 ASN 119 2HB ASN 119 -2.146 -6.891 10.017 686 HD21 ASN 119 1HD2 ASN 119 -1.304 -4.199 7.997 687 HD22 ASN 119 2HD2 ASN 119 0.354 -4.635 7.766 688 H ILE 120 H ILE 120 -4.677 -8.863 7.863 689 HA ILE 120 HA ILE 120 -6.548 -7.800 9.827 690 HB ILE 120 HB ILE 120 -7.530 -7.157 7.725 691 HG12 ILE 120 1HG1 ILE 120 -9.665 -8.497 7.796 692 HG13 ILE 120 2HG1 ILE 120 -8.895 -9.517 9.000 693 HG21 ILE 120 1HG2 ILE 120 -8.134 -8.762 5.990 694 HG22 ILE 120 2HG2 ILE 120 -7.326 -10.041 6.895 695 HG23 ILE 120 3HG2 ILE 120 -6.391 -8.695 6.246 696 HD11 ILE 120 1HD1 ILE 120 -9.372 -6.559 9.273 697 HD12 ILE 120 2HD1 ILE 120 -8.675 -7.620 10.497 698 HD13 ILE 120 3HD1 ILE 120 -10.352 -7.830 10.000 699 H GLN 121 H GLN 121 -6.338 -9.291 11.408 700 HA GLN 121 HA GLN 121 -5.316 -11.889 10.779 701 HB2 GLN 121 1HB GLN 121 -5.172 -12.258 13.164 702 HB3 GLN 121 2HB GLN 121 -4.561 -10.662 12.775 703 HG2 GLN 121 1HG GLN 121 -7.285 -11.252 13.919 704 HG3 GLN 121 2HG GLN 121 -5.888 -10.705 14.838 705 HE21 GLN 121 1HE2 GLN 121 -5.147 -8.573 14.547 706 HE22 GLN 121 2HE2 GLN 121 -6.171 -7.353 13.873 707 H SER 122 H SER 122 -8.470 -10.668 11.799 708 HA SER 122 HA SER 122 -9.432 -13.354 12.308 709 HB2 SER 122 1HB SER 122 -11.554 -12.158 12.919 710 HB3 SER 122 2HB SER 122 -10.138 -11.628 13.830 711 HG SER 122 HG SER 122 -11.474 -10.319 11.696 712 H ASP 123 H ASP 123 -9.452 -11.189 9.637 713 HA ASP 123 HA ASP 123 -11.605 -12.733 8.376 714 HB2 ASP 123 1HB ASP 123 -11.402 -9.717 8.435 715 HB3 ASP 123 2HB ASP 123 -12.500 -10.617 7.394 716 H SER 124 H SER 124 -9.946 -13.800 7.199 717 HA SER 124 HA SER 124 -8.027 -12.513 5.615 718 HB2 SER 124 1HB SER 124 -9.330 -15.217 5.230 719 HB3 SER 124 2HB SER 124 -7.880 -14.667 4.392 720 HG SER 124 HG SER 124 -8.235 -15.375 7.083 721 H ALA 125 H ALA 125 -11.425 -12.927 5.106 722 HA ALA 125 HA ALA 125 -11.543 -12.777 2.311 723 HB1 ALA 125 1HB ALA 125 -13.536 -11.733 4.314 724 HB2 ALA 125 2HB ALA 125 -13.467 -13.380 3.684 725 HB3 ALA 125 3HB ALA 125 -13.845 -12.038 2.604 726 H LEU 126 H LEU 126 -11.229 -10.280 4.762 727 HA LEU 126 HA LEU 126 -11.593 -8.076 3.012 728 HB2 LEU 126 1HB LEU 126 -10.042 -8.201 5.600 729 HB3 LEU 126 2HB LEU 126 -10.582 -6.739 4.798 730 HG LEU 126 HG LEU 126 -12.297 -8.828 6.137 731 HD11 LEU 126 1HD1 LEU 126 -11.254 -7.274 7.660 732 HD12 LEU 126 2HD1 LEU 126 -12.980 -6.933 7.539 733 HD13 LEU 126 3HD1 LEU 126 -11.818 -5.909 6.696 734 HD21 LEU 126 1HD2 LEU 126 -14.214 -7.413 5.523 735 HD22 LEU 126 2HD2 LEU 126 -13.427 -8.129 4.118 736 HD23 LEU 126 3HD2 LEU 126 -13.149 -6.435 4.515 737 H GLN 127 H GLN 127 -8.818 -9.949 4.091 738 HA GLN 127 HA GLN 127 -6.838 -8.444 2.758 739 HB2 GLN 127 1HB GLN 127 -6.209 -10.050 4.470 740 HB3 GLN 127 2HB GLN 127 -6.887 -11.369 3.524 741 HG2 GLN 127 1HG GLN 127 -5.209 -11.008 1.794 742 HG3 GLN 127 2HG GLN 127 -4.534 -9.667 2.720 743 HE21 GLN 127 1HE2 GLN 127 -4.831 -13.105 2.455 744 HE22 GLN 127 2HE2 GLN 127 -3.647 -13.507 3.647 745 H GLN 128 H GLN 128 -8.907 -11.109 1.777 746 HA GLN 128 HA GLN 128 -7.731 -11.794 -0.640 747 HB2 GLN 128 1HB GLN 128 -10.651 -11.765 0.138 748 HB3 GLN 128 2HB GLN 128 -10.032 -12.533 -1.316 749 HG2 GLN 128 1HG GLN 128 -9.324 -13.255 1.518 750 HG3 GLN 128 2HG GLN 128 -10.388 -14.159 0.442 751 HE21 GLN 128 1HE2 GLN 128 -7.878 -14.926 1.789 752 HE22 GLN 128 2HE2 GLN 128 -6.822 -15.467 0.533 753 H ALA 129 H ALA 129 -10.118 -9.267 0.034 754 HA ALA 129 HA ALA 129 -10.385 -8.425 -2.665 755 HB1 ALA 129 1HB ALA 129 -12.097 -7.981 -0.978 756 HB2 ALA 129 2HB ALA 129 -11.543 -6.492 -1.744 757 HB3 ALA 129 3HB ALA 129 -10.979 -6.914 -0.127 758 H CYS 130 H CYS 130 -8.459 -7.272 0.074 759 HA CYS 130 HA CYS 130 -7.251 -5.097 -1.242 760 HB2 CYS 130 1HB CYS 130 -6.991 -5.067 1.083 761 HB3 CYS 130 2HB CYS 130 -6.506 -6.761 1.148 762 H GLU 131 H GLU 131 -6.296 -8.454 -0.857 763 HA GLU 131 HA GLU 131 -3.768 -8.403 -1.967 764 HB2 GLU 131 1HB GLU 131 -4.823 -10.291 -0.747 765 HB3 GLU 131 2HB GLU 131 -5.833 -10.603 -2.149 766 HG2 GLU 131 1HG GLU 131 -3.689 -10.949 -3.443 767 HG3 GLU 131 2HG GLU 131 -2.866 -10.950 -1.880 768 H ASP 132 H ASP 132 -6.878 -8.296 -3.558 769 HA ASP 132 HA ASP 132 -5.894 -9.018 -6.141 770 HB2 ASP 132 1HB ASP 132 -8.304 -9.173 -5.383 771 HB3 ASP 132 2HB ASP 132 -8.389 -7.423 -5.536 772 H VAL 133 H VAL 133 -6.847 -5.867 -4.729 773 HA VAL 133 HA VAL 133 -5.850 -4.480 -7.077 774 HB VAL 133 HB VAL 133 -7.056 -3.352 -4.546 775 HG11 VAL 133 1HG1 VAL 133 -5.675 -1.730 -5.751 776 HG12 VAL 133 2HG1 VAL 133 -7.387 -1.316 -5.842 777 HG13 VAL 133 3HG1 VAL 133 -6.585 -2.054 -7.228 778 HG21 VAL 133 1HG2 VAL 133 -9.085 -3.064 -5.943 779 HG22 VAL 133 2HG2 VAL 133 -8.661 -4.753 -5.663 780 HG23 VAL 133 3HG2 VAL 133 -8.298 -3.997 -7.215 781 H PHE 134 H PHE 134 -5.162 -4.567 -3.638 782 HA PHE 134 HA PHE 134 -2.824 -2.879 -3.904 783 HB2 PHE 134 1HB PHE 134 -4.221 -4.064 -1.503 784 HB3 PHE 134 2HB PHE 134 -2.709 -3.173 -1.386 785 HD1 PHE 134 HD1 PHE 134 -6.300 -2.934 -1.846 786 HD2 PHE 134 HD2 PHE 134 -2.635 -0.776 -1.949 787 HE1 PHE 134 HE1 PHE 134 -7.546 -0.817 -1.778 788 HE2 PHE 134 HE2 PHE 134 -3.875 1.345 -1.874 789 HZ PHE 134 HZ PHE 134 -6.335 1.326 -1.793 790 H ARG 135 H ARG 135 -2.925 -5.485 -5.118 791 HA ARG 135 HA ARG 135 -1.882 -7.611 -3.734 792 HB2 ARG 135 1HB ARG 135 -1.030 -8.374 -5.973 793 HB3 ARG 135 2HB ARG 135 -2.719 -7.879 -5.965 794 HG2 ARG 135 1HG ARG 135 -2.009 -5.662 -6.841 795 HG3 ARG 135 2HG ARG 135 -0.370 -6.296 -6.983 796 HD2 ARG 135 1HD ARG 135 -1.132 -7.982 -8.556 797 HD3 ARG 135 2HD ARG 135 -2.801 -7.440 -8.361 798 HE ARG 135 HE ARG 135 -0.928 -5.417 -9.250 799 HH11 ARG 135 1HH1 ARG 135 -3.270 -7.844 -10.204 800 HH12 ARG 135 2HH1 ARG 135 -3.571 -7.118 -11.751 801 HH21 ARG 135 1HH2 ARG 135 -1.331 -4.469 -11.289 802 HH22 ARG 135 2HH2 ARG 135 -2.467 -5.214 -12.370 803 H PHE 136 H PHE 136 0.086 -8.379 -3.261 804 HA PHE 136 HA PHE 136 2.231 -6.393 -3.193 805 HB2 PHE 136 1HB PHE 136 3.086 -8.362 -1.521 806 HB3 PHE 136 2HB PHE 136 2.153 -6.959 -1.010 807 HD1 PHE 136 HD1 PHE 136 0.049 -7.219 -0.025 808 HD2 PHE 136 HD2 PHE 136 1.822 -10.506 -2.069 809 HE1 PHE 136 HE1 PHE 136 -1.718 -8.699 0.830 810 HE2 PHE 136 HE2 PHE 136 0.058 -11.991 -1.215 811 HZ PHE 136 HZ PHE 136 -1.717 -11.087 0.237 812 H ASP 137 H ASP 137 3.800 -6.596 -4.556 813 HA ASP 137 HA ASP 137 4.183 -8.663 -6.360 814 HB2 ASP 137 1HB ASP 137 6.263 -6.717 -5.331 815 HB3 ASP 137 2HB ASP 137 6.354 -7.633 -6.830 816 H ASP 138 H ASP 138 5.122 -10.572 -6.274 817 HA ASP 138 HA ASP 138 5.750 -11.799 -3.849 818 HB2 ASP 138 1HB ASP 138 6.424 -12.640 -6.675 819 HB3 ASP 138 2HB ASP 138 6.642 -13.668 -5.264 820 H ALA 139 H ALA 139 7.674 -9.861 -5.906 821 HA ALA 139 HA ALA 139 10.243 -10.843 -5.259 822 HB1 ALA 139 1HB ALA 139 9.437 -8.046 -6.048 823 HB2 ALA 139 2HB ALA 139 9.820 -9.358 -7.162 824 HB3 ALA 139 3HB ALA 139 11.069 -8.711 -6.098 825 H ASN 140 H ASN 140 7.962 -8.987 -3.506 826 HA ASN 140 HA ASN 140 9.915 -7.945 -1.611 827 HB2 ASN 140 1HB ASN 140 8.009 -6.530 -2.247 828 HB3 ASN 140 2HB ASN 140 6.884 -7.762 -1.686 829 HD21 ASN 140 1HD2 ASN 140 9.858 -6.717 -0.089 830 HD22 ASN 140 2HD2 ASN 140 9.081 -6.068 1.309 831 H LEU 141 H LEU 141 8.028 -10.717 -2.084 832 HA LEU 141 HA LEU 141 8.046 -11.372 0.785 833 HB2 LEU 141 1HB LEU 141 6.279 -12.526 -1.366 834 HB3 LEU 141 2HB LEU 141 6.172 -12.846 0.353 835 HG LEU 141 HG LEU 141 5.631 -10.176 -0.954 836 HD11 LEU 141 1HD1 LEU 141 3.766 -12.283 0.123 837 HD12 LEU 141 2HD1 LEU 141 3.940 -11.778 -1.559 838 HD13 LEU 141 3HD1 LEU 141 3.285 -10.657 -0.364 839 HD21 LEU 141 1HD2 LEU 141 4.718 -9.566 1.245 840 HD22 LEU 141 2HD2 LEU 141 6.443 -9.921 1.322 841 HD23 LEU 141 3HD2 LEU 141 5.272 -11.109 1.896 842 H VAL 142 H VAL 142 10.084 -12.333 0.852 843 HA VAL 142 HA VAL 142 11.029 -14.247 -0.976 844 HB VAL 142 HB VAL 142 11.710 -13.991 1.961 845 HG11 VAL 142 1HG1 VAL 142 12.412 -16.134 1.035 846 HG12 VAL 142 2HG1 VAL 142 13.807 -15.108 1.367 847 HG13 VAL 142 3HG1 VAL 142 13.232 -15.306 -0.288 848 HG21 VAL 142 1HG2 VAL 142 12.096 -11.902 0.780 849 HG22 VAL 142 2HG2 VAL 142 13.009 -12.751 -0.465 850 HG23 VAL 142 3HG2 VAL 142 13.632 -12.668 1.182 851 HA PRO 143 HA PRO 143 8.253 -17.547 0.143 852 HB2 PRO 143 1HB PRO 143 9.296 -19.439 -1.490 853 HB3 PRO 143 2HB PRO 143 8.274 -18.127 -2.079 854 HG2 PRO 143 1HG PRO 143 11.244 -18.407 -2.173 855 HG3 PRO 143 2HG PRO 143 10.136 -17.757 -3.397 856 HD2 PRO 143 1HD PRO 143 11.636 -16.197 -1.718 857 HD3 PRO 143 2HD PRO 143 10.094 -15.681 -2.427 858 H ARG 144 H ARG 144 8.318 -18.974 1.765 859 HA ARG 144 HA ARG 144 10.950 -20.034 2.564 860 HB2 ARG 144 1HB ARG 144 8.617 -19.644 4.436 861 HB3 ARG 144 2HB ARG 144 10.293 -19.967 4.850 862 HG2 ARG 144 1HG ARG 144 9.152 -17.413 3.740 863 HG3 ARG 144 2HG ARG 144 9.818 -17.683 5.350 864 HD2 ARG 144 1HD ARG 144 11.368 -17.827 2.763 865 HD3 ARG 144 2HD ARG 144 11.375 -16.471 3.884 866 HE ARG 144 HE ARG 144 12.207 -18.344 5.510 867 HH11 ARG 144 1HH1 ARG 144 13.064 -17.945 2.136 868 HH12 ARG 144 2HH1 ARG 144 14.673 -18.553 2.343 869 HH21 ARG 144 1HH2 ARG 144 14.336 -19.127 5.786 870 HH22 ARG 144 2HH2 ARG 144 15.400 -19.214 4.418 871 H GLY 145 H GLY 145 10.965 -22.032 1.685 872 HA2 GLY 145 1HA GLY 145 10.393 -24.336 1.922 873 HA3 GLY 145 2HA GLY 145 8.786 -23.845 2.448 874 H SER 146 H SER 146 8.565 -25.695 0.691 875 HA SER 146 HA SER 146 8.574 -24.516 -1.996 876 HB2 SER 146 1HB SER 146 8.277 -26.927 -2.729 877 HB3 SER 146 2HB SER 146 9.803 -26.563 -1.924 878 HG SER 146 HG SER 146 7.850 -27.299 -0.162 879 H GLY 147 H GLY 147 6.711 -23.785 -2.790 880 HA2 GLY 147 1HA GLY 147 4.522 -24.084 -3.581 881 HA3 GLY 147 2HA GLY 147 4.318 -25.400 -2.441 882 H LEU 148 H LEU 148 5.589 -23.076 -0.598 883 HA LEU 148 HA LEU 148 2.962 -22.391 0.438 884 HB2 LEU 148 1HB LEU 148 5.721 -21.856 1.549 885 HB3 LEU 148 2HB LEU 148 4.215 -21.494 2.371 886 HG LEU 148 HG LEU 148 5.201 -24.254 1.638 887 HD11 LEU 148 1HD1 LEU 148 6.478 -23.270 3.452 888 HD12 LEU 148 2HD1 LEU 148 5.430 -24.554 4.058 889 HD13 LEU 148 3HD1 LEU 148 4.987 -22.863 4.302 890 HD21 LEU 148 1HD2 LEU 148 3.298 -24.993 3.074 891 HD22 LEU 148 2HD2 LEU 148 2.812 -24.251 1.553 892 HD23 LEU 148 3HD2 LEU 148 2.706 -23.334 3.057 893 H GLU 149 H GLU 149 2.229 -20.922 -1.065 894 HA GLU 149 HA GLU 149 3.707 -18.473 -1.545 895 HB2 GLU 149 1HB GLU 149 0.899 -19.266 -2.363 896 HB3 GLU 149 2HB GLU 149 1.777 -17.857 -2.943 897 HG2 GLU 149 1HG GLU 149 2.669 -20.698 -3.363 898 HG3 GLU 149 2HG GLU 149 1.738 -19.760 -4.528 899 H HIS 150 H HIS 150 1.010 -19.649 0.332 900 HA HIS 150 HA HIS 150 0.013 -17.174 1.242 901 HB2 HIS 150 1HB HIS 150 -1.269 -19.250 1.470 902 HB3 HIS 150 2HB HIS 150 -0.061 -19.893 2.577 903 HD1 HIS 150 HD1 HIS 150 -0.238 -19.228 5.018 904 HD2 HIS 150 HD2 HIS 150 -2.864 -17.132 2.566 905 HE1 HIS 150 HE1 HIS 150 -1.757 -17.967 6.574 906 HE2 HIS 150 HE2 HIS 150 -3.400 -16.785 5.075 907 H HIS 151 H HIS 151 1.362 -15.749 2.090 908 HA HIS 151 HA HIS 151 3.539 -16.587 3.804 909 HB2 HIS 151 1HB HIS 151 2.776 -14.045 2.453 910 HB3 HIS 151 2HB HIS 151 3.778 -13.939 3.897 911 HD1 HIS 151 HD1 HIS 151 3.829 -15.291 0.366 912 HD2 HIS 151 HD2 HIS 151 6.405 -14.724 3.589 913 HE1 HIS 151 HE1 HIS 151 6.139 -15.738 -0.521 914 HE2 HIS 151 HE2 HIS 151 7.666 -15.507 1.474 915 H HIS 152 H HIS 152 3.482 -16.649 5.904 916 HA HIS 152 HA HIS 152 1.083 -15.811 7.301 917 HB2 HIS 152 1HB HIS 152 2.039 -18.013 7.791 918 HB3 HIS 152 2HB HIS 152 3.563 -17.268 8.254 919 HD1 HIS 152 HD1 HIS 152 -0.013 -17.608 9.431 920 HD2 HIS 152 HD2 HIS 152 3.706 -16.429 10.872 921 HE1 HIS 152 HE1 HIS 152 -0.299 -17.354 11.912 922 HE2 HIS 152 HE2 HIS 152 1.925 -16.519 12.745 923 H HIS 153 H HIS 153 0.896 -13.933 8.319 924 HA HIS 153 HA HIS 153 2.831 -11.939 8.259 925 HB2 HIS 153 1HB HIS 153 0.293 -12.296 9.796 926 HB3 HIS 153 2HB HIS 153 1.366 -10.966 10.217 927 HD1 HIS 153 HD1 HIS 153 -1.376 -11.763 8.034 928 HD2 HIS 153 HD2 HIS 153 1.971 -9.308 7.815 929 HE1 HIS 153 HE1 HIS 153 -1.860 -10.119 6.194 930 HE2 HIS 153 HE2 HIS 153 0.138 -8.577 6.150 931 H HIS 154 H HIS 154 4.676 -11.788 9.246 932 HA HIS 154 HA HIS 154 5.215 -13.387 11.608 933 HB2 HIS 154 1HB HIS 154 7.048 -11.645 9.948 934 HB3 HIS 154 2HB HIS 154 7.561 -12.673 11.279 935 HD1 HIS 154 HD1 HIS 154 7.674 -12.685 7.805 936 HD2 HIS 154 HD2 HIS 154 6.485 -15.518 10.613 937 HE1 HIS 154 HE1 HIS 154 7.789 -14.903 6.622 938 HE2 HIS 154 HE2 HIS 154 7.104 -16.605 8.345 939 H HIS 155 H HIS 155 5.836 -12.585 13.572 940 HA HIS 155 HA HIS 155 5.223 -9.744 14.017 941 HB2 HIS 155 1HB HIS 155 5.047 -12.118 15.887 942 HB3 HIS 155 2HB HIS 155 4.822 -10.449 16.395 943 HD1 HIS 155 HD1 HIS 155 3.225 -13.093 14.223 944 HD2 HIS 155 HD2 HIS 155 2.319 -9.414 15.936 945 HE1 HIS 155 HE1 HIS 155 0.763 -12.753 13.836 946 HE2 HIS 155 HE2 HIS 155 0.212 -10.586 14.991 Start of MODEL 8 1 H1 MET 24 1H MET 24 -17.336 -14.877 -9.024 2 H2 MET 24 2H MET 24 -16.296 -13.593 -9.372 3 H3 MET 24 3H MET 24 -17.408 -14.109 -10.530 4 HA MET 24 HA MET 24 -18.057 -12.041 -9.424 5 HB2 MET 24 1HB MET 24 -20.374 -12.722 -8.952 6 HB3 MET 24 2HB MET 24 -19.764 -13.433 -10.436 7 HG2 MET 24 1HG MET 24 -19.465 -15.557 -9.364 8 HG3 MET 24 2HG MET 24 -19.880 -14.868 -7.796 9 HE1 MET 24 1HE MET 24 -23.677 -14.012 -8.277 10 HE2 MET 24 2HE MET 24 -22.352 -12.930 -8.694 11 HE3 MET 24 3HE MET 24 -22.271 -13.891 -7.218 12 H GLU 25 H GLU 25 -16.164 -12.516 -7.601 13 HA GLU 25 HA GLU 25 -17.650 -12.500 -5.055 14 HB2 GLU 25 1HB GLU 25 -14.778 -13.302 -5.545 15 HB3 GLU 25 2HB GLU 25 -15.531 -13.179 -3.962 16 HG2 GLU 25 1HG GLU 25 -17.127 -14.932 -4.614 17 HG3 GLU 25 2HG GLU 25 -16.295 -15.082 -6.162 18 H ASN 26 H ASN 26 -17.928 -10.465 -4.457 19 HA ASN 26 HA ASN 26 -17.524 -8.308 -3.870 20 HB2 ASN 26 1HB ASN 26 -14.675 -9.331 -3.750 21 HB3 ASN 26 2HB ASN 26 -15.169 -7.745 -3.171 22 HD21 ASN 26 1HD2 ASN 26 -14.021 -10.102 -1.810 23 HD22 ASN 26 2HD2 ASN 26 -15.106 -10.455 -0.509 24 H TYR 27 H TYR 27 -17.710 -8.871 -6.635 25 HA TYR 27 HA TYR 27 -15.613 -7.930 -8.213 26 HB2 TYR 27 1HB TYR 27 -17.446 -9.260 -9.110 27 HB3 TYR 27 2HB TYR 27 -18.582 -7.957 -8.795 28 HD1 TYR 27 HD1 TYR 27 -19.208 -6.690 -10.616 29 HD2 TYR 27 HD2 TYR 27 -15.334 -8.450 -10.602 30 HE1 TYR 27 HE1 TYR 27 -18.801 -5.792 -12.861 31 HE2 TYR 27 HE2 TYR 27 -14.917 -7.554 -12.855 32 HH TYR 27 HH TYR 27 -16.881 -5.190 -14.282 33 H LEU 28 H LEU 28 -18.507 -6.153 -7.091 34 HA LEU 28 HA LEU 28 -17.765 -3.697 -8.271 35 HB2 LEU 28 1HB LEU 28 -19.563 -4.314 -5.929 36 HB3 LEU 28 2HB LEU 28 -19.350 -2.698 -6.568 37 HG LEU 28 HG LEU 28 -20.469 -5.045 -8.107 38 HD11 LEU 28 1HD1 LEU 28 -22.594 -3.833 -7.957 39 HD12 LEU 28 2HD1 LEU 28 -21.830 -2.634 -6.914 40 HD13 LEU 28 3HD1 LEU 28 -21.994 -4.303 -6.367 41 HD21 LEU 28 1HD2 LEU 28 -19.340 -3.512 -9.588 42 HD22 LEU 28 2HD2 LEU 28 -20.136 -2.136 -8.828 43 HD23 LEU 28 3HD2 LEU 28 -21.084 -3.297 -9.756 44 H ARG 29 H ARG 29 -17.107 -5.124 -5.136 45 HA ARG 29 HA ARG 29 -15.901 -2.839 -3.986 46 HB2 ARG 29 1HB ARG 29 -16.725 -4.681 -2.623 47 HB3 ARG 29 2HB ARG 29 -15.547 -5.769 -3.339 48 HG2 ARG 29 1HG ARG 29 -13.737 -4.607 -2.304 49 HG3 ARG 29 2HG ARG 29 -14.816 -3.328 -1.740 50 HD2 ARG 29 1HD ARG 29 -14.854 -6.219 -0.876 51 HD3 ARG 29 2HD ARG 29 -14.301 -4.841 0.083 52 HE ARG 29 HE ARG 29 -16.848 -4.173 -0.548 53 HH11 ARG 29 1HH1 ARG 29 -15.423 -7.045 0.882 54 HH12 ARG 29 2HH1 ARG 29 -16.833 -7.425 1.817 55 HH21 ARG 29 1HH2 ARG 29 -18.697 -4.683 0.682 56 HH22 ARG 29 2HH2 ARG 29 -18.692 -6.081 1.705 57 H LYS 30 H LYS 30 -14.689 -5.478 -5.958 58 HA LYS 30 HA LYS 30 -11.951 -5.088 -5.710 59 HB2 LYS 30 1HB LYS 30 -13.604 -5.933 -8.090 60 HB3 LYS 30 2HB LYS 30 -11.849 -5.903 -8.123 61 HG2 LYS 30 1HG LYS 30 -13.572 -7.573 -6.306 62 HG3 LYS 30 2HG LYS 30 -12.662 -8.140 -7.705 63 HD2 LYS 30 1HD LYS 30 -10.587 -7.321 -6.548 64 HD3 LYS 30 2HD LYS 30 -11.578 -7.051 -5.113 65 HE2 LYS 30 1HE LYS 30 -10.546 -9.190 -4.883 66 HE3 LYS 30 2HE LYS 30 -12.252 -9.457 -5.231 67 HZ1 LYS 30 1HZ LYS 30 -10.901 -10.947 -6.524 68 HZ2 LYS 30 2HZ LYS 30 -10.013 -9.662 -7.172 69 HZ3 LYS 30 3HZ LYS 30 -11.647 -9.840 -7.564 70 H ALA 31 H ALA 31 -14.179 -3.585 -8.084 71 HA ALA 31 HA ALA 31 -12.315 -1.825 -9.172 72 HB1 ALA 31 1HB ALA 31 -14.474 -2.335 -10.203 73 HB2 ALA 31 2HB ALA 31 -14.234 -0.598 -10.022 74 HB3 ALA 31 3HB ALA 31 -15.294 -1.462 -8.909 75 H ALA 32 H ALA 32 -14.446 -1.485 -6.369 76 HA ALA 32 HA ALA 32 -14.061 1.254 -5.910 77 HB1 ALA 32 1HB ALA 32 -14.531 -0.885 -3.835 78 HB2 ALA 32 2HB ALA 32 -15.793 -0.112 -4.796 79 HB3 ALA 32 3HB ALA 32 -14.841 0.842 -3.658 80 H LEU 33 H LEU 33 -12.304 -1.565 -4.706 81 HA LEU 33 HA LEU 33 -10.427 -0.133 -3.149 82 HB2 LEU 33 1HB LEU 33 -10.132 -2.831 -4.487 83 HB3 LEU 33 2HB LEU 33 -9.126 -2.214 -3.184 84 HG LEU 33 HG LEU 33 -12.083 -2.803 -2.965 85 HD11 LEU 33 1HD1 LEU 33 -9.699 -4.355 -1.987 86 HD12 LEU 33 2HD1 LEU 33 -10.840 -4.847 -3.239 87 HD13 LEU 33 3HD1 LEU 33 -11.378 -4.691 -1.566 88 HD21 LEU 33 1HD2 LEU 33 -11.367 -1.029 -1.457 89 HD22 LEU 33 2HD2 LEU 33 -10.064 -2.053 -0.856 90 HD23 LEU 33 3HD2 LEU 33 -11.743 -2.504 -0.567 91 H THR 34 H THR 34 -10.565 -1.091 -6.507 92 HA THR 34 HA THR 34 -7.925 -0.353 -7.209 93 HB THR 34 HB THR 34 -10.391 -0.447 -8.960 94 HG1 THR 34 HG1 THR 34 -10.001 -2.459 -7.971 95 HG21 THR 34 1HG2 THR 34 -8.791 -0.795 -10.797 96 HG22 THR 34 2HG2 THR 34 -7.456 -0.576 -9.668 97 HG23 THR 34 3HG2 THR 34 -8.548 0.765 -10.011 98 H ASP 35 H ASP 35 -10.982 1.388 -7.012 99 HA ASP 35 HA ASP 35 -10.088 3.760 -8.299 100 HB2 ASP 35 1HB ASP 35 -12.373 3.225 -6.398 101 HB3 ASP 35 2HB ASP 35 -12.043 4.823 -7.053 102 H MET 36 H MET 36 -10.216 2.667 -4.957 103 HA MET 36 HA MET 36 -9.275 5.038 -3.759 104 HB2 MET 36 1HB MET 36 -8.848 2.191 -2.818 105 HB3 MET 36 2HB MET 36 -8.656 3.639 -1.842 106 HG2 MET 36 1HG MET 36 -11.212 2.611 -3.047 107 HG3 MET 36 2HG MET 36 -10.754 2.567 -1.343 108 HE1 MET 36 1HE MET 36 -10.426 4.784 0.137 109 HE2 MET 36 2HE MET 36 -10.731 6.412 -0.467 110 HE3 MET 36 3HE MET 36 -9.361 5.486 -1.079 111 H LEU 37 H LEU 37 -7.608 2.221 -5.081 112 HA LEU 37 HA LEU 37 -4.979 3.027 -4.479 113 HB2 LEU 37 1HB LEU 37 -5.548 0.758 -5.187 114 HB3 LEU 37 2HB LEU 37 -6.031 1.360 -6.769 115 HG LEU 37 HG LEU 37 -3.616 2.137 -7.052 116 HD11 LEU 37 1HD1 LEU 37 -2.921 2.027 -4.729 117 HD12 LEU 37 2HD1 LEU 37 -1.946 0.938 -5.716 118 HD13 LEU 37 3HD1 LEU 37 -3.234 0.291 -4.698 119 HD21 LEU 37 1HD2 LEU 37 -4.566 0.202 -8.198 120 HD22 LEU 37 2HD2 LEU 37 -4.171 -0.816 -6.811 121 HD23 LEU 37 3HD2 LEU 37 -2.881 -0.074 -7.757 122 H GLN 38 H GLN 38 -7.018 3.561 -7.327 123 HA GLN 38 HA GLN 38 -5.117 4.968 -8.850 124 HB2 GLN 38 1HB GLN 38 -8.132 4.970 -8.918 125 HB3 GLN 38 2HB GLN 38 -7.143 5.834 -10.088 126 HG2 GLN 38 1HG GLN 38 -7.057 2.868 -9.591 127 HG3 GLN 38 2HG GLN 38 -7.900 3.660 -10.921 128 HE21 GLN 38 1HE2 GLN 38 -6.713 4.572 -12.591 129 HE22 GLN 38 2HE2 GLN 38 -5.041 4.199 -12.846 130 H THR 39 H THR 39 -7.342 6.000 -6.360 131 HA THR 39 HA THR 39 -6.946 8.806 -6.793 132 HB THR 39 HB THR 39 -7.944 7.393 -4.307 133 HG1 THR 39 HG1 THR 39 -9.289 6.878 -6.038 134 HG21 THR 39 1HG2 THR 39 -9.010 9.522 -3.779 135 HG22 THR 39 2HG2 THR 39 -8.347 10.238 -5.248 136 HG23 THR 39 3HG2 THR 39 -7.267 9.741 -3.945 137 H PHE 40 H PHE 40 -5.397 6.310 -4.908 138 HA PHE 40 HA PHE 40 -3.816 8.062 -3.317 139 HB2 PHE 40 1HB PHE 40 -4.279 5.714 -2.671 140 HB3 PHE 40 2HB PHE 40 -3.296 5.168 -4.026 141 HD1 PHE 40 HD1 PHE 40 -1.226 4.434 -3.470 142 HD2 PHE 40 HD2 PHE 40 -2.930 7.623 -1.228 143 HE1 PHE 40 HE1 PHE 40 0.806 4.552 -2.099 144 HE2 PHE 40 HE2 PHE 40 -0.901 7.740 0.157 145 HZ PHE 40 HZ PHE 40 0.974 6.206 -0.283 146 H VAL 41 H VAL 41 -3.435 6.577 -6.457 147 HA VAL 41 HA VAL 41 -0.759 6.713 -6.935 148 HB VAL 41 HB VAL 41 -3.013 7.252 -8.855 149 HG11 VAL 41 1HG1 VAL 41 -1.416 6.893 -10.664 150 HG12 VAL 41 2HG1 VAL 41 -0.103 6.797 -9.490 151 HG13 VAL 41 3HG1 VAL 41 -0.980 8.311 -9.707 152 HG21 VAL 41 1HG2 VAL 41 -2.529 4.969 -9.600 153 HG22 VAL 41 2HG2 VAL 41 -2.968 5.021 -7.892 154 HG23 VAL 41 3HG2 VAL 41 -1.277 4.840 -8.363 155 HA PRO 42 HA PRO 42 -1.024 11.372 -8.418 156 HB2 PRO 42 1HB PRO 42 -3.263 12.316 -6.716 157 HB3 PRO 42 2HB PRO 42 -2.837 12.763 -8.373 158 HG2 PRO 42 1HG PRO 42 -4.924 11.177 -7.874 159 HG3 PRO 42 2HG PRO 42 -3.886 10.917 -9.285 160 HD2 PRO 42 1HD PRO 42 -3.969 9.435 -6.692 161 HD3 PRO 42 2HD PRO 42 -3.722 8.823 -8.337 162 H TYR 43 H TYR 43 -1.807 10.284 -5.139 163 HA TYR 43 HA TYR 43 -0.527 12.550 -3.908 164 HB2 TYR 43 1HB TYR 43 -1.629 9.956 -2.815 165 HB3 TYR 43 2HB TYR 43 -0.789 11.136 -1.801 166 HD1 TYR 43 HD1 TYR 43 -1.901 13.056 -0.997 167 HD2 TYR 43 HD2 TYR 43 -3.738 10.683 -4.015 168 HE1 TYR 43 HE1 TYR 43 -3.983 14.339 -0.733 169 HE2 TYR 43 HE2 TYR 43 -5.822 11.954 -3.753 170 HH TYR 43 HH TYR 43 -5.985 14.858 -1.874 171 H ARG 44 H ARG 44 0.378 9.416 -5.039 172 HA ARG 44 HA ARG 44 2.723 8.989 -3.570 173 HB2 ARG 44 1HB ARG 44 2.218 8.239 -6.450 174 HB3 ARG 44 2HB ARG 44 3.458 7.557 -5.409 175 HG2 ARG 44 1HG ARG 44 1.662 6.700 -3.930 176 HG3 ARG 44 2HG ARG 44 0.479 7.271 -5.112 177 HD2 ARG 44 1HD ARG 44 2.608 5.162 -5.491 178 HD3 ARG 44 2HD ARG 44 0.858 4.942 -5.546 179 HE ARG 44 HE ARG 44 1.860 6.786 -7.519 180 HH11 ARG 44 1HH1 ARG 44 1.187 3.429 -6.804 181 HH12 ARG 44 2HH1 ARG 44 1.137 2.951 -8.468 182 HH21 ARG 44 1HH2 ARG 44 1.802 6.162 -9.711 183 HH22 ARG 44 2HH2 ARG 44 1.480 4.506 -10.130 184 H THR 45 H THR 45 2.123 10.852 -6.500 185 HA THR 45 HA THR 45 4.621 11.556 -7.280 186 HB THR 45 HB THR 45 2.359 13.544 -7.067 187 HG1 THR 45 HG1 THR 45 2.827 11.583 -9.090 188 HG21 THR 45 1HG2 THR 45 4.602 13.227 -9.063 189 HG22 THR 45 2HG2 THR 45 4.463 14.493 -7.844 190 HG23 THR 45 3HG2 THR 45 3.301 14.413 -9.167 191 H ALA 46 H ALA 46 2.875 12.893 -4.509 192 HA ALA 46 HA ALA 46 4.739 14.938 -3.880 193 HB1 ALA 46 1HB ALA 46 2.833 13.461 -2.058 194 HB2 ALA 46 2HB ALA 46 2.459 14.914 -2.984 195 HB3 ALA 46 3HB ALA 46 3.651 14.980 -1.686 196 H VAL 47 H VAL 47 4.399 11.596 -2.988 197 HA VAL 47 HA VAL 47 6.524 11.560 -1.057 198 HB VAL 47 HB VAL 47 5.127 9.281 -2.479 199 HG11 VAL 47 1HG1 VAL 47 7.340 8.586 -1.740 200 HG12 VAL 47 2HG1 VAL 47 6.090 7.834 -0.748 201 HG13 VAL 47 3HG1 VAL 47 7.007 9.203 -0.122 202 HG21 VAL 47 1HG2 VAL 47 3.964 8.983 -0.333 203 HG22 VAL 47 2HG2 VAL 47 3.638 10.562 -1.048 204 HG23 VAL 47 3HG2 VAL 47 4.775 10.419 0.294 205 H GLU 48 H GLU 48 6.169 10.654 -4.441 206 HA GLU 48 HA GLU 48 8.713 9.491 -4.769 207 HB2 GLU 48 1HB GLU 48 6.925 10.777 -6.849 208 HB3 GLU 48 2HB GLU 48 8.300 9.740 -7.190 209 HG2 GLU 48 1HG GLU 48 5.771 8.938 -5.764 210 HG3 GLU 48 2HG GLU 48 6.234 8.512 -7.412 211 H LEU 49 H LEU 49 7.521 12.788 -5.299 212 HA LEU 49 HA LEU 49 9.878 13.851 -6.393 213 HB2 LEU 49 1HB LEU 49 7.443 14.934 -5.132 214 HB3 LEU 49 2HB LEU 49 8.851 15.980 -5.054 215 HG LEU 49 HG LEU 49 7.397 16.469 -6.990 216 HD11 LEU 49 1HD1 LEU 49 10.114 15.396 -7.732 217 HD12 LEU 49 2HD1 LEU 49 9.775 16.997 -7.079 218 HD13 LEU 49 3HD1 LEU 49 9.159 16.545 -8.667 219 HD21 LEU 49 1HD2 LEU 49 8.211 13.730 -7.949 220 HD22 LEU 49 2HD2 LEU 49 7.302 14.927 -8.870 221 HD23 LEU 49 3HD2 LEU 49 6.593 14.202 -7.427 222 H CYS 50 H CYS 50 8.802 13.518 -3.054 223 HA CYS 50 HA CYS 50 11.024 14.722 -1.826 224 HB2 CYS 50 1HB CYS 50 9.148 14.321 -0.457 225 HB3 CYS 50 2HB CYS 50 9.034 12.638 -0.952 226 H ALA 51 H ALA 51 10.365 11.323 -2.601 227 HA ALA 51 HA ALA 51 12.834 10.262 -1.825 228 HB1 ALA 51 1HB ALA 51 12.257 8.331 -3.165 229 HB2 ALA 51 2HB ALA 51 11.023 9.262 -4.013 230 HB3 ALA 51 3HB ALA 51 10.838 8.914 -2.295 231 H LEU 52 H LEU 52 12.030 12.147 -4.592 232 HA LEU 52 HA LEU 52 14.309 11.280 -6.138 233 HB2 LEU 52 1HB LEU 52 12.329 13.519 -6.544 234 HB3 LEU 52 2HB LEU 52 13.666 13.216 -7.632 235 HG LEU 52 HG LEU 52 11.417 11.281 -7.053 236 HD11 LEU 52 1HD1 LEU 52 10.714 11.763 -9.345 237 HD12 LEU 52 2HD1 LEU 52 11.975 12.988 -9.472 238 HD13 LEU 52 3HD1 LEU 52 10.652 13.200 -8.326 239 HD21 LEU 52 1HD2 LEU 52 12.355 10.037 -8.978 240 HD22 LEU 52 2HD2 LEU 52 13.431 10.077 -7.584 241 HD23 LEU 52 3HD2 LEU 52 13.742 11.127 -8.966 242 H GLU 53 H GLU 53 13.405 14.212 -4.341 243 HA GLU 53 HA GLU 53 15.795 15.581 -5.106 244 HB2 GLU 53 1HB GLU 53 13.546 16.629 -4.573 245 HB3 GLU 53 2HB GLU 53 13.919 16.355 -2.879 246 HG2 GLU 53 1HG GLU 53 15.997 17.763 -4.403 247 HG3 GLU 53 2HG GLU 53 14.474 18.626 -4.228 248 H HIS 54 H HIS 54 14.777 13.771 -2.286 249 HA HIS 54 HA HIS 54 17.345 14.410 -0.984 250 HB2 HIS 54 1HB HIS 54 14.779 13.289 0.157 251 HB3 HIS 54 2HB HIS 54 16.272 13.434 1.075 252 HD1 HIS 54 HD1 HIS 54 13.228 15.145 0.686 253 HD2 HIS 54 HD2 HIS 54 17.201 16.360 0.808 254 HE1 HIS 54 HE1 HIS 54 13.172 17.581 1.306 255 HE2 HIS 54 HE2 HIS 54 15.573 18.330 1.222 256 H GLY 55 H GLY 55 15.708 12.050 -2.688 257 HA2 GLY 55 1HA GLY 55 16.297 10.011 -3.484 258 HA3 GLY 55 2HA GLY 55 17.884 10.257 -2.781 259 H GLY 56 H GLY 56 16.875 10.398 0.034 260 HA2 GLY 56 1HA GLY 56 15.716 7.747 0.270 261 HA3 GLY 56 2HA GLY 56 16.375 8.710 1.579 262 H LEU 57 H LEU 57 13.805 7.240 1.203 263 HA LEU 57 HA LEU 57 11.727 9.211 1.192 264 HB2 LEU 57 1HB LEU 57 11.754 6.325 2.078 265 HB3 LEU 57 2HB LEU 57 10.313 7.323 1.981 266 HG LEU 57 HG LEU 57 11.915 7.181 -0.492 267 HD11 LEU 57 1HD1 LEU 57 10.421 4.800 0.582 268 HD12 LEU 57 2HD1 LEU 57 12.144 4.893 0.216 269 HD13 LEU 57 3HD1 LEU 57 10.959 4.984 -1.086 270 HD21 LEU 57 1HD2 LEU 57 8.979 6.891 0.128 271 HD22 LEU 57 2HD2 LEU 57 9.688 7.017 -1.481 272 HD23 LEU 57 3HD2 LEU 57 9.792 8.377 -0.363 273 H ASP 58 H ASP 58 14.059 8.489 3.387 274 HA ASP 58 HA ASP 58 12.790 8.370 5.851 275 HB2 ASP 58 1HB ASP 58 15.437 9.670 5.195 276 HB3 ASP 58 2HB ASP 58 14.908 9.175 6.799 277 H THR 59 H THR 59 13.513 11.114 3.811 278 HA THR 59 HA THR 59 12.678 13.043 5.783 279 HB THR 59 HB THR 59 12.923 14.669 3.895 280 HG1 THR 59 HG1 THR 59 12.466 12.943 2.266 281 HG21 THR 59 1HG2 THR 59 14.817 14.179 5.357 282 HG22 THR 59 2HG2 THR 59 15.361 14.445 3.701 283 HG23 THR 59 3HG2 THR 59 15.257 12.805 4.343 284 H CYS 60 H CYS 60 11.013 10.922 3.859 285 HA CYS 60 HA CYS 60 9.010 12.790 2.910 286 HB2 CYS 60 1HB CYS 60 9.137 9.785 2.606 287 HB3 CYS 60 2HB CYS 60 8.071 10.876 1.729 288 H ASP 61 H ASP 61 8.608 13.283 5.277 289 HA ASP 61 HA ASP 61 6.635 11.395 6.393 290 HB2 ASP 61 1HB ASP 61 8.687 12.100 7.773 291 HB3 ASP 61 2HB ASP 61 7.920 13.685 7.882 292 H GLY 62 H GLY 62 4.591 12.138 6.920 293 HA2 GLY 62 1HA GLY 62 3.575 14.094 5.153 294 HA3 GLY 62 2HA GLY 62 2.674 13.300 6.436 295 H GLY 63 H GLY 63 3.672 16.215 5.321 296 HA2 GLY 63 1HA GLY 63 2.919 18.198 6.437 297 HA3 GLY 63 2HA GLY 63 3.269 17.417 7.973 298 H SER 64 H SER 64 5.774 16.754 5.875 299 HA SER 64 HA SER 64 7.234 19.201 6.481 300 HB2 SER 64 1HB SER 64 9.114 17.894 7.465 301 HB3 SER 64 2HB SER 64 7.645 17.830 8.435 302 HG SER 64 HG SER 64 7.546 15.825 6.698 303 H ASN 65 H ASN 65 9.470 19.128 5.476 304 HA ASN 65 HA ASN 65 10.742 19.037 3.606 305 HB2 ASN 65 1HB ASN 65 9.813 16.172 3.755 306 HB3 ASN 65 2HB ASN 65 10.994 16.728 2.576 307 HD21 ASN 65 1HD2 ASN 65 10.390 16.095 5.949 308 HD22 ASN 65 2HD2 ASN 65 12.041 16.176 6.465 309 H GLY 66 H GLY 66 8.083 19.991 3.184 310 HA2 GLY 66 1HA GLY 66 7.150 20.877 1.239 311 HA3 GLY 66 2HA GLY 66 8.090 19.727 0.296 312 H ILE 67 H ILE 67 6.796 17.794 2.503 313 HA ILE 67 HA ILE 67 4.682 16.967 0.714 314 HB ILE 67 HB ILE 67 5.707 15.726 3.276 315 HG12 ILE 67 1HG1 ILE 67 6.180 15.111 0.354 316 HG13 ILE 67 2HG1 ILE 67 7.373 15.649 1.533 317 HG21 ILE 67 1HG2 ILE 67 3.358 15.136 2.851 318 HG22 ILE 67 2HG2 ILE 67 4.430 13.747 2.658 319 HG23 ILE 67 3HG2 ILE 67 3.801 14.578 1.236 320 HD11 ILE 67 1HD1 ILE 67 7.096 13.540 2.744 321 HD12 ILE 67 2HD1 ILE 67 7.624 13.295 1.080 322 HD13 ILE 67 3HD1 ILE 67 5.942 13.005 1.524 323 HA PRO 68 HA PRO 68 1.504 19.218 2.852 324 HB2 PRO 68 1HB PRO 68 -0.267 17.059 1.856 325 HB3 PRO 68 2HB PRO 68 -0.377 18.804 1.615 326 HG2 PRO 68 1HG PRO 68 0.402 17.197 -0.363 327 HG3 PRO 68 2HG PRO 68 1.132 18.801 -0.130 328 HD2 PRO 68 1HD PRO 68 2.211 16.098 0.573 329 HD3 PRO 68 2HD PRO 68 3.060 17.514 -0.093 330 H SER 69 H SER 69 -0.308 18.772 4.389 331 HA SER 69 HA SER 69 0.712 17.156 6.525 332 HB2 SER 69 1HB SER 69 -1.897 18.679 6.294 333 HB3 SER 69 2HB SER 69 -1.189 18.053 7.784 334 HG SER 69 HG SER 69 -0.596 20.160 7.688 335 HA PRO 70 HA PRO 70 -1.451 13.419 5.526 336 HB2 PRO 70 1HB PRO 70 -1.754 12.421 8.070 337 HB3 PRO 70 2HB PRO 70 -0.265 12.290 7.129 338 HG2 PRO 70 1HG PRO 70 -0.988 14.245 9.272 339 HG3 PRO 70 2HG PRO 70 0.551 13.416 8.987 340 HD2 PRO 70 1HD PRO 70 0.171 15.982 8.263 341 HD3 PRO 70 2HD PRO 70 1.169 14.875 7.293 342 H THR 71 H THR 71 -3.516 13.287 5.018 343 HA THR 71 HA THR 71 -5.588 14.085 6.903 344 HB THR 71 HB THR 71 -6.728 15.368 5.004 345 HG1 THR 71 HG1 THR 71 -4.074 15.621 4.014 346 HG21 THR 71 1HG2 THR 71 -5.823 16.535 6.927 347 HG22 THR 71 2HG2 THR 71 -5.483 17.452 5.459 348 HG23 THR 71 3HG2 THR 71 -4.208 16.499 6.218 349 H THR 72 H THR 72 -7.789 13.836 5.485 350 HA THR 72 HA THR 72 -7.585 11.295 4.044 351 HB THR 72 HB THR 72 -9.745 10.607 5.163 352 HG1 THR 72 HG1 THR 72 -10.392 12.536 6.095 353 HG21 THR 72 1HG2 THR 72 -7.308 10.891 6.918 354 HG22 THR 72 2HG2 THR 72 -7.613 9.591 5.763 355 HG23 THR 72 3HG2 THR 72 -8.643 9.768 7.184 356 H THR 73 H THR 73 -8.583 11.371 2.168 357 HA THR 73 HA THR 73 -10.137 13.608 1.350 358 HB THR 73 HB THR 73 -10.406 12.457 -0.761 359 HG1 THR 73 HG1 THR 73 -10.303 10.341 -0.930 360 HG21 THR 73 1HG2 THR 73 -8.208 13.445 -0.347 361 HG22 THR 73 2HG2 THR 73 -8.073 11.996 -1.346 362 HG23 THR 73 3HG2 THR 73 -7.657 11.928 0.366 363 H ARG 74 H ARG 74 -12.335 12.933 0.121 364 HA ARG 74 HA ARG 74 -14.186 12.573 2.147 365 HB2 ARG 74 1HB ARG 74 -14.753 13.626 0.020 366 HB3 ARG 74 2HB ARG 74 -14.550 12.092 -0.812 367 HG2 ARG 74 1HG ARG 74 -16.904 12.626 -0.463 368 HG3 ARG 74 2HG ARG 74 -16.433 11.159 0.398 369 HD2 ARG 74 1HD ARG 74 -17.856 12.563 1.799 370 HD3 ARG 74 2HD ARG 74 -16.233 12.444 2.474 371 HE ARG 74 HE ARG 74 -16.567 14.747 0.801 372 HH11 ARG 74 1HH1 ARG 74 -17.113 13.479 4.016 373 HH12 ARG 74 2HH1 ARG 74 -17.137 15.042 4.768 374 HH21 ARG 74 1HH2 ARG 74 -16.610 16.810 1.783 375 HH22 ARG 74 2HH2 ARG 74 -16.870 16.941 3.494 376 H TYR 75 H TYR 75 -12.944 10.120 -0.152 377 HA TYR 75 HA TYR 75 -14.586 8.109 1.133 378 HB2 TYR 75 1HB TYR 75 -12.605 7.790 -1.126 379 HB3 TYR 75 2HB TYR 75 -13.828 6.621 -0.620 380 HD1 TYR 75 HD1 TYR 75 -13.140 8.633 -3.198 381 HD2 TYR 75 HD2 TYR 75 -16.254 8.103 -0.353 382 HE1 TYR 75 HE1 TYR 75 -14.734 9.656 -4.762 383 HE2 TYR 75 HE2 TYR 75 -17.860 9.124 -1.911 384 HH TYR 75 HH TYR 75 -17.153 9.639 -5.186 385 H VAL 76 H VAL 76 -11.379 9.293 1.482 386 HA VAL 76 HA VAL 76 -10.298 6.766 2.396 387 HB VAL 76 HB VAL 76 -9.137 9.555 2.407 388 HG11 VAL 76 1HG1 VAL 76 -8.358 8.226 4.373 389 HG12 VAL 76 2HG1 VAL 76 -7.071 8.642 3.243 390 HG13 VAL 76 3HG1 VAL 76 -7.744 7.012 3.251 391 HG21 VAL 76 1HG2 VAL 76 -8.407 7.058 0.879 392 HG22 VAL 76 2HG2 VAL 76 -7.597 8.620 0.756 393 HG23 VAL 76 3HG2 VAL 76 -9.271 8.452 0.228 394 H SER 77 H SER 77 -10.139 6.063 4.422 395 HA SER 77 HA SER 77 -11.812 7.465 6.352 396 HB2 SER 77 1HB SER 77 -12.179 5.038 5.820 397 HB3 SER 77 2HB SER 77 -10.609 4.691 6.552 398 HG SER 77 HG SER 77 -11.477 4.858 8.456 399 H ALA 78 H ALA 78 -8.510 6.243 6.037 400 HA ALA 78 HA ALA 78 -7.492 8.130 7.899 401 HB1 ALA 78 1HB ALA 78 -6.669 6.533 9.583 402 HB2 ALA 78 2HB ALA 78 -7.577 5.247 8.789 403 HB3 ALA 78 3HB ALA 78 -8.430 6.597 9.535 404 H MET 79 H MET 79 -5.289 8.323 7.726 405 HA MET 79 HA MET 79 -3.626 6.264 6.690 406 HB2 MET 79 1HB MET 79 -2.881 7.381 4.639 407 HB3 MET 79 2HB MET 79 -4.588 6.964 4.555 408 HG2 MET 79 1HG MET 79 -5.273 9.165 4.692 409 HG3 MET 79 2HG MET 79 -3.758 9.699 5.418 410 HE1 MET 79 1HE MET 79 -4.111 8.491 0.969 411 HE2 MET 79 2HE MET 79 -5.497 8.508 2.058 412 HE3 MET 79 3HE MET 79 -4.195 7.346 2.308 413 H SER 80 H SER 80 -1.536 6.620 7.172 414 HA SER 80 HA SER 80 -0.749 9.313 8.056 415 HB2 SER 80 1HB SER 80 0.016 6.723 9.437 416 HB3 SER 80 2HB SER 80 0.482 8.350 9.933 417 HG SER 80 HG SER 80 -1.942 8.673 10.009 418 H VAL 81 H VAL 81 1.368 9.896 7.542 419 HA VAL 81 HA VAL 81 2.708 8.055 5.675 420 HB VAL 81 HB VAL 81 3.019 11.059 5.823 421 HG11 VAL 81 1HG1 VAL 81 4.031 10.812 3.599 422 HG12 VAL 81 2HG1 VAL 81 3.866 9.063 3.728 423 HG13 VAL 81 3HG1 VAL 81 4.928 9.933 4.836 424 HG21 VAL 81 1HG2 VAL 81 1.308 9.438 3.949 425 HG22 VAL 81 2HG2 VAL 81 1.623 11.168 3.814 426 HG23 VAL 81 3HG2 VAL 81 0.736 10.538 5.202 427 H ALA 82 H ALA 82 4.567 7.196 6.390 428 HA ALA 82 HA ALA 82 6.220 8.742 8.249 429 HB1 ALA 82 1HB ALA 82 6.572 6.785 9.662 430 HB2 ALA 82 2HB ALA 82 5.463 5.847 8.661 431 HB3 ALA 82 3HB ALA 82 4.859 7.207 9.610 432 H LYS 83 H LYS 83 7.934 9.004 7.144 433 HA LYS 83 HA LYS 83 9.799 8.692 5.774 434 HB2 LYS 83 1HB LYS 83 9.610 5.780 6.582 435 HB3 LYS 83 2HB LYS 83 11.048 6.663 6.092 436 HG2 LYS 83 1HG LYS 83 9.493 7.264 8.595 437 HG3 LYS 83 2HG LYS 83 10.879 6.177 8.538 438 HD2 LYS 83 1HD LYS 83 12.255 8.038 7.683 439 HD3 LYS 83 2HD LYS 83 10.866 9.114 7.842 440 HE2 LYS 83 1HE LYS 83 12.414 9.292 9.745 441 HE3 LYS 83 2HE LYS 83 10.816 8.735 10.235 442 HZ1 LYS 83 1HZ LYS 83 13.134 6.948 9.746 443 HZ2 LYS 83 2HZ LYS 83 11.623 6.501 10.371 444 HZ3 LYS 83 3HZ LYS 83 12.652 7.492 11.273 445 H GLY 84 H GLY 84 7.349 8.639 4.478 446 HA2 GLY 84 1HA GLY 84 6.574 8.211 2.338 447 HA3 GLY 84 2HA GLY 84 7.886 7.055 2.125 448 H VAL 85 H VAL 85 7.081 5.690 4.646 449 HA VAL 85 HA VAL 85 5.285 3.772 3.548 450 HB VAL 85 HB VAL 85 6.055 4.108 6.450 451 HG11 VAL 85 1HG1 VAL 85 4.178 2.615 6.143 452 HG12 VAL 85 2HG1 VAL 85 5.614 1.694 6.592 453 HG13 VAL 85 3HG1 VAL 85 5.066 1.713 4.915 454 HG21 VAL 85 1HG2 VAL 85 7.830 2.454 5.978 455 HG22 VAL 85 2HG2 VAL 85 8.067 3.981 5.130 456 HG23 VAL 85 3HG2 VAL 85 7.449 2.577 4.261 457 H VAL 86 H VAL 86 3.037 3.549 3.811 458 HA VAL 86 HA VAL 86 1.781 5.597 5.471 459 HB VAL 86 HB VAL 86 0.054 5.994 3.769 460 HG11 VAL 86 1HG1 VAL 86 1.931 7.520 3.905 461 HG12 VAL 86 2HG1 VAL 86 1.407 7.340 2.232 462 HG13 VAL 86 3HG1 VAL 86 2.860 6.513 2.795 463 HG21 VAL 86 1HG2 VAL 86 1.807 4.390 1.926 464 HG22 VAL 86 2HG2 VAL 86 0.332 5.248 1.484 465 HG23 VAL 86 3HG2 VAL 86 0.255 3.860 2.572 466 H SER 87 H SER 87 0.554 4.668 6.879 467 HA SER 87 HA SER 87 -0.712 2.104 6.262 468 HB2 SER 87 1HB SER 87 -0.559 3.534 8.925 469 HB3 SER 87 2HB SER 87 -1.049 1.861 8.653 470 HG SER 87 HG SER 87 1.503 2.872 7.937 471 H LEU 88 H LEU 88 -2.760 1.933 5.769 472 HA LEU 88 HA LEU 88 -4.587 4.154 6.439 473 HB2 LEU 88 1HB LEU 88 -4.783 2.210 4.131 474 HB3 LEU 88 2HB LEU 88 -5.935 3.479 4.505 475 HG LEU 88 HG LEU 88 -3.878 5.064 4.188 476 HD11 LEU 88 1HD1 LEU 88 -3.018 2.628 2.636 477 HD12 LEU 88 2HD1 LEU 88 -2.165 3.380 3.984 478 HD13 LEU 88 3HD1 LEU 88 -2.330 4.241 2.455 479 HD21 LEU 88 1HD2 LEU 88 -5.293 3.712 1.897 480 HD22 LEU 88 2HD2 LEU 88 -4.421 5.241 1.796 481 HD23 LEU 88 3HD2 LEU 88 -5.861 5.113 2.808 482 H THR 89 H THR 89 -6.019 3.589 7.966 483 HA THR 89 HA THR 89 -6.519 0.721 8.351 484 HB THR 89 HB THR 89 -6.913 2.935 10.376 485 HG1 THR 89 HG1 THR 89 -4.721 2.781 9.954 486 HG21 THR 89 1HG2 THR 89 -6.939 1.103 12.001 487 HG22 THR 89 2HG2 THR 89 -6.748 -0.071 10.699 488 HG23 THR 89 3HG2 THR 89 -8.221 0.893 10.808 489 H GLY 90 H GLY 90 -8.541 -0.056 8.629 490 HA2 GLY 90 1HA GLY 90 -10.779 -0.286 8.116 491 HA3 GLY 90 2HA GLY 90 -10.933 1.199 9.033 492 H GLN 91 H GLN 91 -9.522 0.563 5.843 493 HA GLN 91 HA GLN 91 -10.923 2.865 4.791 494 HB2 GLN 91 1HB GLN 91 -8.560 2.370 4.228 495 HB3 GLN 91 2HB GLN 91 -9.077 0.889 3.431 496 HG2 GLN 91 1HG GLN 91 -8.585 2.704 1.862 497 HG3 GLN 91 2HG GLN 91 -10.255 2.145 1.758 498 HE21 GLN 91 1HE2 GLN 91 -11.895 3.516 2.268 499 HE22 GLN 91 2HE2 GLN 91 -11.671 5.199 2.595 500 H GLU 92 H GLU 92 -12.843 2.776 3.760 501 HA GLU 92 HA GLU 92 -14.747 1.961 2.833 502 HB2 GLU 92 1HB GLU 92 -12.642 0.244 1.562 503 HB3 GLU 92 2HB GLU 92 -14.338 -0.047 1.220 504 HG2 GLU 92 1HG GLU 92 -12.895 2.546 0.778 505 HG3 GLU 92 2HG GLU 92 -13.317 1.371 -0.463 506 H SER 93 H SER 93 -15.051 -1.006 2.199 507 HA SER 93 HA SER 93 -16.334 -1.815 4.552 508 HB2 SER 93 1HB SER 93 -16.809 -2.650 2.236 509 HB3 SER 93 2HB SER 93 -15.327 -3.600 2.326 510 HG SER 93 HG SER 93 -17.632 -3.829 3.968 511 H LEU 94 H LEU 94 -13.051 -1.707 3.887 512 HA LEU 94 HA LEU 94 -12.271 -4.163 5.173 513 HB2 LEU 94 1HB LEU 94 -10.549 -1.837 4.315 514 HB3 LEU 94 2HB LEU 94 -10.005 -3.460 4.708 515 HG LEU 94 HG LEU 94 -11.731 -2.719 2.339 516 HD11 LEU 94 1HD1 LEU 94 -9.501 -1.886 2.036 517 HD12 LEU 94 2HD1 LEU 94 -9.719 -3.319 1.030 518 HD13 LEU 94 3HD1 LEU 94 -8.812 -3.428 2.539 519 HD21 LEU 94 1HD2 LEU 94 -12.227 -4.959 3.105 520 HD22 LEU 94 2HD2 LEU 94 -10.510 -5.357 3.141 521 HD23 LEU 94 3HD2 LEU 94 -11.305 -5.026 1.603 522 H ASN 95 H ASN 95 -13.821 -2.429 6.799 523 HA ASN 95 HA ASN 95 -12.469 -0.940 8.690 524 HB2 ASN 95 1HB ASN 95 -14.936 -1.237 8.593 525 HB3 ASN 95 2HB ASN 95 -14.739 -2.869 9.225 526 HD21 ASN 95 1HD2 ASN 95 -15.861 -2.534 11.097 527 HD22 ASN 95 2HD2 ASN 95 -15.305 -1.500 12.369 528 H GLY 96 H GLY 96 -11.153 -1.370 10.375 529 HA2 GLY 96 1HA GLY 96 -9.996 -2.629 11.964 530 HA3 GLY 96 2HA GLY 96 -10.740 -4.085 11.315 531 H LEU 97 H LEU 97 -9.869 -3.096 8.564 532 HA LEU 97 HA LEU 97 -7.360 -4.540 8.610 533 HB2 LEU 97 1HB LEU 97 -9.165 -5.019 6.975 534 HB3 LEU 97 2HB LEU 97 -8.961 -3.410 6.315 535 HG LEU 97 HG LEU 97 -6.664 -5.351 6.299 536 HD11 LEU 97 1HD1 LEU 97 -8.622 -6.482 5.301 537 HD12 LEU 97 2HD1 LEU 97 -7.370 -6.123 4.114 538 HD13 LEU 97 3HD1 LEU 97 -8.817 -5.120 4.198 539 HD21 LEU 97 1HD2 LEU 97 -6.214 -3.016 5.736 540 HD22 LEU 97 2HD2 LEU 97 -7.475 -3.065 4.505 541 HD23 LEU 97 3HD2 LEU 97 -6.028 -4.056 4.324 542 H SER 98 H SER 98 -5.403 -3.657 8.380 543 HA SER 98 HA SER 98 -5.249 -0.798 7.701 544 HB2 SER 98 1HB SER 98 -3.266 -2.474 9.264 545 HB3 SER 98 2HB SER 98 -3.135 -0.746 8.940 546 HG SER 98 HG SER 98 -4.691 -0.331 10.360 547 H VAL 99 H VAL 99 -4.541 -0.403 5.730 548 HA VAL 99 HA VAL 99 -2.921 -2.374 4.300 549 HB VAL 99 HB VAL 99 -3.891 0.328 3.338 550 HG11 VAL 99 1HG1 VAL 99 -3.467 -0.586 1.100 551 HG12 VAL 99 2HG1 VAL 99 -2.808 -2.048 1.835 552 HG13 VAL 99 3HG1 VAL 99 -2.001 -0.498 2.076 553 HG21 VAL 99 1HG2 VAL 99 -5.656 -0.872 2.154 554 HG22 VAL 99 2HG2 VAL 99 -5.794 -1.090 3.898 555 HG23 VAL 99 3HG2 VAL 99 -5.132 -2.383 2.895 556 H VAL 100 H VAL 100 -0.711 -2.190 4.148 557 HA VAL 100 HA VAL 100 0.430 0.376 5.020 558 HB VAL 100 HB VAL 100 1.604 -2.366 5.511 559 HG11 VAL 100 1HG1 VAL 100 3.297 -0.632 5.217 560 HG12 VAL 100 2HG1 VAL 100 3.240 -1.186 6.890 561 HG13 VAL 100 3HG1 VAL 100 2.509 0.356 6.445 562 HG21 VAL 100 1HG2 VAL 100 -0.357 -2.003 6.908 563 HG22 VAL 100 2HG2 VAL 100 0.298 -0.458 7.451 564 HG23 VAL 100 3HG2 VAL 100 1.115 -1.962 7.877 565 H MET 101 H MET 101 1.283 1.328 3.323 566 HA MET 101 HA MET 101 2.646 -0.312 1.293 567 HB2 MET 101 1HB MET 101 1.037 1.397 0.466 568 HB3 MET 101 2HB MET 101 2.031 2.649 1.200 569 HG2 MET 101 1HG MET 101 3.932 1.830 -0.217 570 HG3 MET 101 2HG MET 101 2.765 0.823 -1.067 571 HE1 MET 101 1HE MET 101 2.803 4.551 0.306 572 HE2 MET 101 2HE MET 101 3.068 5.407 -1.211 573 HE3 MET 101 3HE MET 101 4.301 4.311 -0.589 574 H THR 102 H THR 102 4.718 -0.658 1.633 575 HA THR 102 HA THR 102 6.302 1.411 2.996 576 HB THR 102 HB THR 102 7.006 -1.505 2.617 577 HG1 THR 102 HG1 THR 102 6.383 -0.558 5.151 578 HG21 THR 102 1HG2 THR 102 8.931 -0.011 2.953 579 HG22 THR 102 2HG2 THR 102 8.693 -1.086 4.330 580 HG23 THR 102 3HG2 THR 102 8.189 0.600 4.432 581 HA PRO 103 HA PRO 103 8.011 1.708 -1.271 582 HB2 PRO 103 1HB PRO 103 8.894 4.277 -0.892 583 HB3 PRO 103 2HB PRO 103 7.293 3.865 -1.526 584 HG2 PRO 103 1HG PRO 103 8.084 4.662 1.246 585 HG3 PRO 103 2HG PRO 103 6.639 5.105 0.316 586 HD2 PRO 103 1HD PRO 103 6.623 3.217 2.260 587 HD3 PRO 103 2HD PRO 103 5.551 3.139 0.842 588 H GLY 104 H GLY 104 9.966 0.976 -1.592 589 HA2 GLY 104 1HA GLY 104 12.351 1.025 -1.410 590 HA3 GLY 104 2HA GLY 104 12.177 1.786 0.171 591 H TRP 105 H TRP 105 13.861 -0.193 0.256 592 HA TRP 105 HA TRP 105 14.387 -2.154 1.265 593 HB2 TRP 105 1HB TRP 105 12.748 -1.607 2.995 594 HB3 TRP 105 2HB TRP 105 11.452 -2.261 2.002 595 HD1 TRP 105 HD1 TRP 105 14.774 -3.617 3.510 596 HE1 TRP 105 HE1 TRP 105 14.327 -6.005 4.360 597 HE3 TRP 105 HE3 TRP 105 9.874 -4.074 2.116 598 HZ2 TRP 105 HZ2 TRP 105 12.185 -7.837 4.429 599 HZ3 TRP 105 HZ3 TRP 105 8.699 -6.177 2.615 600 HH2 TRP 105 HH2 TRP 105 9.833 -8.017 3.748 601 H ASP 106 H ASP 106 11.414 -2.244 -0.641 602 HA ASP 106 HA ASP 106 11.814 -4.904 -1.613 603 HB2 ASP 106 1HB ASP 106 9.938 -4.498 -3.010 604 HB3 ASP 106 2HB ASP 106 9.609 -3.628 -1.521 605 H ASN 107 H ASN 107 13.215 -1.929 -2.216 606 HA ASN 107 HA ASN 107 14.000 -2.023 -4.887 607 HB2 ASN 107 1HB ASN 107 14.368 -0.048 -3.539 608 HB3 ASN 107 2HB ASN 107 15.415 -0.933 -2.444 609 HD21 ASN 107 1HD2 ASN 107 17.086 0.511 -2.740 610 HD22 ASN 107 2HD2 ASN 107 18.023 0.554 -4.190 611 H ALA 108 H ALA 108 15.427 -3.535 -2.031 612 HA ALA 108 HA ALA 108 17.688 -4.606 -3.399 613 HB1 ALA 108 1HB ALA 108 18.062 -5.877 -1.351 614 HB2 ALA 108 2HB ALA 108 16.459 -5.424 -0.770 615 HB3 ALA 108 3HB ALA 108 17.699 -4.189 -0.989 616 H ASN 109 H ASN 109 14.466 -5.372 -3.548 617 HA ASN 109 HA ASN 109 15.001 -8.208 -4.111 618 HB2 ASN 109 1HB ASN 109 12.512 -6.771 -3.215 619 HB3 ASN 109 2HB ASN 109 12.435 -8.381 -3.925 620 HD21 ASN 109 1HD2 ASN 109 14.992 -9.194 -2.749 621 HD22 ASN 109 2HD2 ASN 109 14.675 -9.457 -1.072 622 H GLY 110 H GLY 110 15.170 -5.618 -5.792 623 HA2 GLY 110 1HA GLY 110 15.169 -5.310 -8.065 624 HA3 GLY 110 2HA GLY 110 14.607 -6.959 -8.228 625 H VAL 111 H VAL 111 12.443 -5.348 -6.271 626 HA VAL 111 HA VAL 111 10.717 -4.809 -8.601 627 HB VAL 111 HB VAL 111 8.790 -5.194 -7.081 628 HG11 VAL 111 1HG1 VAL 111 9.566 -6.989 -8.509 629 HG12 VAL 111 2HG1 VAL 111 9.038 -7.643 -6.957 630 HG13 VAL 111 3HG1 VAL 111 10.759 -7.468 -7.302 631 HG21 VAL 111 1HG2 VAL 111 9.133 -6.251 -4.919 632 HG22 VAL 111 2HG2 VAL 111 9.924 -4.675 -4.966 633 HG23 VAL 111 3HG2 VAL 111 10.882 -6.148 -5.127 634 H THR 112 H THR 112 12.651 -3.096 -7.209 635 HA THR 112 HA THR 112 12.136 -1.322 -5.382 636 HB THR 112 HB THR 112 12.930 -0.385 -8.133 637 HG1 THR 112 HG1 THR 112 15.047 -1.034 -6.656 638 HG21 THR 112 1HG2 THR 112 13.745 0.520 -5.368 639 HG22 THR 112 2HG2 THR 112 12.677 1.390 -6.467 640 HG23 THR 112 3HG2 THR 112 14.375 1.159 -6.884 641 H GLY 113 H GLY 113 10.220 -0.520 -4.750 642 HA2 GLY 113 1HA GLY 113 9.251 1.799 -5.950 643 HA3 GLY 113 2HA GLY 113 8.223 0.481 -6.492 644 H TRP 114 H TRP 114 6.724 -0.355 -5.129 645 HA TRP 114 HA TRP 114 6.626 0.745 -2.405 646 HB2 TRP 114 1HB TRP 114 4.246 0.445 -4.247 647 HB3 TRP 114 2HB TRP 114 4.239 1.121 -2.621 648 HD1 TRP 114 HD1 TRP 114 5.470 3.560 -2.338 649 HE1 TRP 114 HE1 TRP 114 5.720 5.496 -4.032 650 HE3 TRP 114 HE3 TRP 114 4.507 0.984 -6.648 651 HZ2 TRP 114 HZ2 TRP 114 5.521 5.862 -6.821 652 HZ3 TRP 114 HZ3 TRP 114 4.554 2.199 -8.784 653 HH2 TRP 114 HH2 TRP 114 5.051 4.589 -8.865 654 H ALA 115 H ALA 115 6.502 -0.846 -0.940 655 HA ALA 115 HA ALA 115 5.634 -3.498 -1.763 656 HB1 ALA 115 1HB ALA 115 6.653 -2.531 0.904 657 HB2 ALA 115 2HB ALA 115 7.641 -3.246 -0.368 658 HB3 ALA 115 3HB ALA 115 6.398 -4.207 0.431 659 H ARG 116 H ARG 116 3.747 -4.448 -1.122 660 HA ARG 116 HA ARG 116 1.859 -2.677 0.277 661 HB2 ARG 116 1HB ARG 116 1.430 -4.644 -1.959 662 HB3 ARG 116 2HB ARG 116 0.100 -4.008 -0.998 663 HG2 ARG 116 1HG ARG 116 2.023 -2.359 -2.622 664 HG3 ARG 116 2HG ARG 116 0.387 -2.805 -3.110 665 HD2 ARG 116 1HD ARG 116 -0.479 -1.635 -1.112 666 HD3 ARG 116 2HD ARG 116 1.162 -1.122 -0.729 667 HE ARG 116 HE ARG 116 0.797 -0.246 -3.271 668 HH11 ARG 116 1HH1 ARG 116 -1.003 0.138 -0.297 669 HH12 ARG 116 2HH1 ARG 116 -1.603 1.712 -0.706 670 HH21 ARG 116 1HH2 ARG 116 0.008 1.830 -3.819 671 HH22 ARG 116 2HH2 ARG 116 -1.025 2.672 -2.711 672 H ASN 117 H ASN 117 0.639 -3.430 1.909 673 HA ASN 117 HA ASN 117 0.489 -6.295 2.411 674 HB2 ASN 117 1HB ASN 117 2.405 -5.578 3.759 675 HB3 ASN 117 2HB ASN 117 1.436 -4.298 4.482 676 HD21 ASN 117 1HD2 ASN 117 1.949 -7.753 4.305 677 HD22 ASN 117 2HD2 ASN 117 1.083 -8.140 5.753 678 H CYS 118 H CYS 118 -1.480 -6.890 3.174 679 HA CYS 118 HA CYS 118 -3.264 -4.766 4.167 680 HB2 CYS 118 1HB CYS 118 -3.977 -7.404 2.850 681 HB3 CYS 118 2HB CYS 118 -5.139 -6.240 3.484 682 H ASN 119 H ASN 119 -3.485 -4.851 6.336 683 HA ASN 119 HA ASN 119 -3.098 -7.467 7.629 684 HB2 ASN 119 1HB ASN 119 -1.420 -5.903 8.326 685 HB3 ASN 119 2HB ASN 119 -2.626 -4.661 8.641 686 HD21 ASN 119 1HD2 ASN 119 -1.925 -4.411 10.753 687 HD22 ASN 119 2HD2 ASN 119 -2.264 -5.579 11.984 688 H ILE 120 H ILE 120 -5.057 -8.329 7.828 689 HA ILE 120 HA ILE 120 -6.862 -6.977 9.680 690 HB ILE 120 HB ILE 120 -7.884 -6.593 7.546 691 HG12 ILE 120 1HG1 ILE 120 -10.008 -7.928 7.759 692 HG13 ILE 120 2HG1 ILE 120 -9.233 -8.816 9.062 693 HG21 ILE 120 1HG2 ILE 120 -6.771 -8.223 6.202 694 HG22 ILE 120 2HG2 ILE 120 -8.514 -8.439 6.036 695 HG23 ILE 120 3HG2 ILE 120 -7.584 -9.540 7.050 696 HD11 ILE 120 1HD1 ILE 120 -9.005 -6.737 10.327 697 HD12 ILE 120 2HD1 ILE 120 -10.684 -7.075 9.918 698 HD13 ILE 120 3HD1 ILE 120 -9.784 -5.862 9.012 699 H GLN 121 H GLN 121 -6.541 -8.296 11.440 700 HA GLN 121 HA GLN 121 -5.565 -10.963 10.981 701 HB2 GLN 121 1HB GLN 121 -5.277 -11.050 13.432 702 HB3 GLN 121 2HB GLN 121 -4.506 -9.656 12.690 703 HG2 GLN 121 1HG GLN 121 -6.482 -8.299 13.372 704 HG3 GLN 121 2HG GLN 121 -7.069 -9.703 14.263 705 HE21 GLN 121 1HE2 GLN 121 -4.667 -7.214 14.087 706 HE22 GLN 121 2HE2 GLN 121 -4.033 -7.429 15.683 707 H SER 122 H SER 122 -8.641 -9.608 11.858 708 HA SER 122 HA SER 122 -9.566 -12.214 12.828 709 HB2 SER 122 1HB SER 122 -11.585 -10.932 13.581 710 HB3 SER 122 2HB SER 122 -10.070 -10.363 14.289 711 HG SER 122 HG SER 122 -11.586 -9.196 12.187 712 H ASP 123 H ASP 123 -9.565 -10.578 9.906 713 HA ASP 123 HA ASP 123 -12.009 -11.933 9.029 714 HB2 ASP 123 1HB ASP 123 -11.456 -8.984 8.672 715 HB3 ASP 123 2HB ASP 123 -12.695 -9.857 7.783 716 H SER 124 H SER 124 -10.592 -13.358 7.905 717 HA SER 124 HA SER 124 -8.642 -12.548 6.058 718 HB2 SER 124 1HB SER 124 -10.304 -15.075 5.971 719 HB3 SER 124 2HB SER 124 -8.743 -14.819 5.196 720 HG SER 124 HG SER 124 -8.306 -14.209 7.658 721 H ALA 125 H ALA 125 -12.115 -12.690 5.763 722 HA ALA 125 HA ALA 125 -12.316 -12.834 2.959 723 HB1 ALA 125 1HB ALA 125 -14.209 -11.508 4.892 724 HB2 ALA 125 2HB ALA 125 -14.211 -13.220 4.463 725 HB3 ALA 125 3HB ALA 125 -14.580 -12.002 3.241 726 H LEU 126 H LEU 126 -11.977 -10.095 5.161 727 HA LEU 126 HA LEU 126 -12.217 -8.088 3.169 728 HB2 LEU 126 1HB LEU 126 -10.834 -8.013 5.850 729 HB3 LEU 126 2HB LEU 126 -11.156 -6.608 4.855 730 HG LEU 126 HG LEU 126 -13.228 -8.389 6.144 731 HD11 LEU 126 1HD1 LEU 126 -12.398 -5.551 6.722 732 HD12 LEU 126 2HD1 LEU 126 -12.093 -6.960 7.739 733 HD13 LEU 126 3HD1 LEU 126 -13.744 -6.403 7.476 734 HD21 LEU 126 1HD2 LEU 126 -13.563 -5.920 4.445 735 HD22 LEU 126 2HD2 LEU 126 -14.848 -6.733 5.335 736 HD23 LEU 126 3HD2 LEU 126 -14.036 -7.562 4.011 737 H GLN 127 H GLN 127 -9.557 -9.911 4.535 738 HA GLN 127 HA GLN 127 -7.438 -8.573 3.273 739 HB2 GLN 127 1HB GLN 127 -7.028 -10.153 5.069 740 HB3 GLN 127 2HB GLN 127 -7.704 -11.463 4.113 741 HG2 GLN 127 1HG GLN 127 -5.883 -11.237 2.508 742 HG3 GLN 127 2HG GLN 127 -5.199 -9.923 3.466 743 HE21 GLN 127 1HE2 GLN 127 -4.221 -10.394 5.441 744 HE22 GLN 127 2HE2 GLN 127 -3.757 -12.001 5.874 745 H GLN 128 H GLN 128 -9.481 -11.260 2.267 746 HA GLN 128 HA GLN 128 -8.167 -12.062 -0.030 747 HB2 GLN 128 1HB GLN 128 -10.147 -13.165 1.051 748 HB3 GLN 128 2HB GLN 128 -11.165 -11.928 0.327 749 HG2 GLN 128 1HG GLN 128 -10.273 -12.669 -1.905 750 HG3 GLN 128 2HG GLN 128 -9.555 -14.041 -1.067 751 HE21 GLN 128 1HE2 GLN 128 -10.909 -15.605 -0.154 752 HE22 GLN 128 2HE2 GLN 128 -12.561 -15.771 -0.643 753 H ALA 129 H ALA 129 -10.532 -9.467 0.381 754 HA ALA 129 HA ALA 129 -10.575 -8.779 -2.390 755 HB1 ALA 129 1HB ALA 129 -11.864 -6.825 -1.670 756 HB2 ALA 129 2HB ALA 129 -11.513 -7.219 0.014 757 HB3 ALA 129 3HB ALA 129 -12.488 -8.316 -0.965 758 H CYS 130 H CYS 130 -9.010 -7.456 0.494 759 HA CYS 130 HA CYS 130 -7.855 -5.214 -0.769 760 HB2 CYS 130 1HB CYS 130 -8.131 -5.451 1.683 761 HB3 CYS 130 2HB CYS 130 -6.878 -6.690 1.685 762 H GLU 131 H GLU 131 -6.586 -8.449 -0.073 763 HA GLU 131 HA GLU 131 -3.971 -8.005 -0.962 764 HB2 GLU 131 1HB GLU 131 -3.662 -10.371 -0.958 765 HB3 GLU 131 2HB GLU 131 -4.705 -9.967 0.401 766 HG2 GLU 131 1HG GLU 131 -6.608 -10.828 -0.657 767 HG3 GLU 131 2HG GLU 131 -5.811 -10.877 -2.231 768 H ASP 132 H ASP 132 -6.885 -8.458 -2.737 769 HA ASP 132 HA ASP 132 -5.726 -9.443 -5.132 770 HB2 ASP 132 1HB ASP 132 -8.134 -9.600 -4.691 771 HB3 ASP 132 2HB ASP 132 -8.264 -7.845 -4.721 772 H VAL 133 H VAL 133 -6.718 -6.147 -4.176 773 HA VAL 133 HA VAL 133 -5.463 -5.025 -6.533 774 HB VAL 133 HB VAL 133 -6.829 -3.664 -4.203 775 HG11 VAL 133 1HG1 VAL 133 -5.966 -2.525 -6.861 776 HG12 VAL 133 2HG1 VAL 133 -5.217 -2.183 -5.301 777 HG13 VAL 133 3HG1 VAL 133 -6.876 -1.672 -5.613 778 HG21 VAL 133 1HG2 VAL 133 -8.355 -5.045 -5.485 779 HG22 VAL 133 2HG2 VAL 133 -7.797 -4.306 -6.985 780 HG23 VAL 133 3HG2 VAL 133 -8.674 -3.339 -5.801 781 H PHE 134 H PHE 134 -5.006 -4.909 -3.052 782 HA PHE 134 HA PHE 134 -2.558 -3.367 -3.282 783 HB2 PHE 134 1HB PHE 134 -4.120 -4.274 -0.859 784 HB3 PHE 134 2HB PHE 134 -2.638 -3.327 -0.791 785 HD1 PHE 134 HD1 PHE 134 -6.210 -3.240 -1.297 786 HD2 PHE 134 HD2 PHE 134 -2.600 -1.036 -1.791 787 HE1 PHE 134 HE1 PHE 134 -7.510 -1.169 -1.548 788 HE2 PHE 134 HE2 PHE 134 -3.898 1.040 -2.039 789 HZ PHE 134 HZ PHE 134 -6.356 0.974 -1.922 790 H ARG 135 H ARG 135 -2.706 -6.062 -4.265 791 HA ARG 135 HA ARG 135 -1.938 -8.127 -2.690 792 HB2 ARG 135 1HB ARG 135 -0.834 -9.073 -4.730 793 HB3 ARG 135 2HB ARG 135 -2.462 -8.463 -5.005 794 HG2 ARG 135 1HG ARG 135 -1.596 -6.465 -6.023 795 HG3 ARG 135 2HG ARG 135 0.057 -6.937 -5.629 796 HD2 ARG 135 1HD ARG 135 -1.797 -8.466 -7.454 797 HD3 ARG 135 2HD ARG 135 -0.536 -7.358 -7.991 798 HE ARG 135 HE ARG 135 0.258 -9.604 -6.299 799 HH11 ARG 135 1HH1 ARG 135 0.117 -8.175 -9.491 800 HH12 ARG 135 2HH1 ARG 135 1.329 -9.223 -10.154 801 HH21 ARG 135 1HH2 ARG 135 1.861 -10.974 -7.162 802 HH22 ARG 135 2HH2 ARG 135 2.321 -10.817 -8.829 803 H PHE 136 H PHE 136 -0.210 -8.917 -1.786 804 HA PHE 136 HA PHE 136 2.050 -7.189 -1.364 805 HB2 PHE 136 1HB PHE 136 2.741 -9.329 0.052 806 HB3 PHE 136 2HB PHE 136 1.545 -8.178 0.642 807 HD1 PHE 136 HD1 PHE 136 1.878 -11.415 -1.171 808 HD2 PHE 136 HD2 PHE 136 -0.595 -8.897 1.217 809 HE1 PHE 136 HE1 PHE 136 0.241 -13.238 -0.944 810 HE2 PHE 136 HE2 PHE 136 -2.236 -10.718 1.438 811 HZ PHE 136 HZ PHE 136 -1.817 -12.891 0.359 812 H ASP 137 H ASP 137 3.945 -7.328 -2.285 813 HA ASP 137 HA ASP 137 4.475 -9.244 -4.354 814 HB2 ASP 137 1HB ASP 137 5.272 -6.861 -4.416 815 HB3 ASP 137 2HB ASP 137 6.374 -7.241 -3.100 816 H ASP 138 H ASP 138 6.345 -10.677 -4.343 817 HA ASP 138 HA ASP 138 6.496 -12.298 -2.070 818 HB2 ASP 138 1HB ASP 138 8.226 -12.094 -4.523 819 HB3 ASP 138 2HB ASP 138 8.592 -13.237 -3.237 820 H ALA 139 H ALA 139 8.048 -9.366 -2.772 821 HA ALA 139 HA ALA 139 10.370 -9.566 -1.200 822 HB1 ALA 139 1HB ALA 139 8.655 -7.133 -1.690 823 HB2 ALA 139 2HB ALA 139 9.930 -7.715 -2.759 824 HB3 ALA 139 3HB ALA 139 10.330 -7.134 -1.142 825 H ASN 140 H ASN 140 7.021 -8.918 -0.390 826 HA ASN 140 HA ASN 140 7.697 -8.401 2.405 827 HB2 ASN 140 1HB ASN 140 5.141 -8.148 0.818 828 HB3 ASN 140 2HB ASN 140 5.160 -8.043 2.576 829 HD21 ASN 140 1HD2 ASN 140 4.468 -5.922 2.569 830 HD22 ASN 140 2HD2 ASN 140 5.501 -4.619 2.104 831 H LEU 141 H LEU 141 7.624 -11.038 0.776 832 HA LEU 141 HA LEU 141 6.127 -12.559 2.797 833 HB2 LEU 141 1HB LEU 141 6.672 -13.293 -0.084 834 HB3 LEU 141 2HB LEU 141 5.883 -14.334 1.084 835 HG LEU 141 HG LEU 141 4.813 -11.709 0.042 836 HD11 LEU 141 1HD1 LEU 141 4.721 -13.532 -1.588 837 HD12 LEU 141 2HD1 LEU 141 3.114 -13.077 -1.027 838 HD13 LEU 141 3HD1 LEU 141 3.880 -14.539 -0.411 839 HD21 LEU 141 1HD2 LEU 141 2.758 -12.348 1.271 840 HD22 LEU 141 2HD2 LEU 141 4.122 -11.997 2.329 841 HD23 LEU 141 3HD2 LEU 141 3.655 -13.670 2.019 842 H VAL 142 H VAL 142 7.046 -14.694 3.254 843 HA VAL 142 HA VAL 142 9.973 -14.592 3.154 844 HB VAL 142 HB VAL 142 9.024 -14.757 5.409 845 HG11 VAL 142 1HG1 VAL 142 7.867 -16.792 6.147 846 HG12 VAL 142 2HG1 VAL 142 7.830 -17.361 4.478 847 HG13 VAL 142 3HG1 VAL 142 6.949 -15.904 4.933 848 HG21 VAL 142 1HG2 VAL 142 10.299 -16.695 6.197 849 HG22 VAL 142 2HG2 VAL 142 11.195 -15.761 4.998 850 HG23 VAL 142 3HG2 VAL 142 10.424 -17.279 4.537 851 HA PRO 143 HA PRO 143 9.859 -17.793 0.038 852 HB2 PRO 143 1HB PRO 143 12.564 -18.396 1.086 853 HB3 PRO 143 2HB PRO 143 12.058 -18.026 -0.562 854 HG2 PRO 143 1HG PRO 143 13.405 -16.246 0.922 855 HG3 PRO 143 2HG PRO 143 12.148 -15.747 -0.227 856 HD2 PRO 143 1HD PRO 143 12.030 -15.927 2.754 857 HD3 PRO 143 2HD PRO 143 11.259 -14.764 1.655 858 H ARG 144 H ARG 144 9.169 -19.850 0.195 859 HA ARG 144 HA ARG 144 9.516 -21.168 2.806 860 HB2 ARG 144 1HB ARG 144 7.152 -21.501 0.949 861 HB3 ARG 144 2HB ARG 144 7.320 -22.140 2.575 862 HG2 ARG 144 1HG ARG 144 7.368 -19.809 3.429 863 HG3 ARG 144 2HG ARG 144 7.041 -19.246 1.792 864 HD2 ARG 144 1HD ARG 144 4.967 -19.309 2.981 865 HD3 ARG 144 2HD ARG 144 4.963 -20.630 1.812 866 HE ARG 144 HE ARG 144 5.942 -21.690 4.174 867 HH11 ARG 144 1HH1 ARG 144 2.967 -20.147 3.136 868 HH12 ARG 144 2HH1 ARG 144 1.976 -21.026 4.260 869 HH21 ARG 144 1HH2 ARG 144 4.644 -22.840 5.640 870 HH22 ARG 144 2HH2 ARG 144 2.924 -22.564 5.671 871 H GLY 145 H GLY 145 10.833 -22.861 2.635 872 HA2 GLY 145 1HA GLY 145 11.614 -24.019 0.178 873 HA3 GLY 145 2HA GLY 145 11.915 -24.704 1.770 874 H SER 146 H SER 146 11.281 -26.243 -0.518 875 HA SER 146 HA SER 146 8.450 -26.903 -0.244 876 HB2 SER 146 1HB SER 146 9.137 -28.651 -2.058 877 HB3 SER 146 2HB SER 146 9.052 -26.947 -2.501 878 HG SER 146 HG SER 146 11.096 -27.008 -2.941 879 H GLY 147 H GLY 147 7.859 -28.206 1.311 880 HA2 GLY 147 1HA GLY 147 7.695 -30.155 2.541 881 HA3 GLY 147 2HA GLY 147 9.103 -30.778 1.696 882 H LEU 148 H LEU 148 10.850 -28.614 2.307 883 HA LEU 148 HA LEU 148 11.256 -29.032 5.183 884 HB2 LEU 148 1HB LEU 148 13.207 -28.058 3.091 885 HB3 LEU 148 2HB LEU 148 13.581 -28.382 4.773 886 HG LEU 148 HG LEU 148 12.739 -30.447 2.732 887 HD11 LEU 148 1HD1 LEU 148 15.419 -29.916 4.004 888 HD12 LEU 148 2HD1 LEU 148 14.982 -29.563 2.334 889 HD13 LEU 148 3HD1 LEU 148 15.035 -31.232 2.896 890 HD21 LEU 148 1HD2 LEU 148 11.988 -31.104 4.922 891 HD22 LEU 148 2HD2 LEU 148 13.558 -30.710 5.623 892 HD23 LEU 148 3HD2 LEU 148 13.407 -32.058 4.496 893 H GLU 149 H GLU 149 9.807 -27.390 5.902 894 HA GLU 149 HA GLU 149 10.772 -24.673 5.328 895 HB2 GLU 149 1HB GLU 149 8.432 -24.812 4.827 896 HB3 GLU 149 2HB GLU 149 8.093 -25.627 6.349 897 HG2 GLU 149 1HG GLU 149 8.470 -23.662 7.600 898 HG3 GLU 149 2HG GLU 149 9.185 -22.834 6.220 899 H HIS 150 H HIS 150 9.668 -26.774 7.956 900 HA HIS 150 HA HIS 150 11.320 -25.175 9.790 901 HB2 HIS 150 1HB HIS 150 8.894 -26.871 10.420 902 HB3 HIS 150 2HB HIS 150 9.884 -26.045 11.616 903 HD1 HIS 150 HD1 HIS 150 6.748 -25.638 10.301 904 HD2 HIS 150 HD2 HIS 150 10.014 -23.074 10.511 905 HE1 HIS 150 HE1 HIS 150 5.804 -23.315 10.092 906 HE2 HIS 150 HE2 HIS 150 7.805 -21.790 10.102 907 H HIS 151 H HIS 151 13.239 -26.220 9.743 908 HA HIS 151 HA HIS 151 13.283 -29.122 9.804 909 HB2 HIS 151 1HB HIS 151 15.730 -28.907 9.602 910 HB3 HIS 151 2HB HIS 151 14.888 -28.025 8.337 911 HD1 HIS 151 HD1 HIS 151 15.218 -25.488 8.247 912 HD2 HIS 151 HD2 HIS 151 17.114 -27.299 11.473 913 HE1 HIS 151 HE1 HIS 151 16.756 -23.744 9.195 914 HE2 HIS 151 HE2 HIS 151 18.018 -24.918 11.026 915 H HIS 152 H HIS 152 13.678 -30.340 11.531 916 HA HIS 152 HA HIS 152 14.278 -28.949 14.061 917 HB2 HIS 152 1HB HIS 152 11.921 -29.733 13.889 918 HB3 HIS 152 2HB HIS 152 12.508 -31.376 13.680 919 HD1 HIS 152 HD1 HIS 152 12.327 -32.669 15.766 920 HD2 HIS 152 HD2 HIS 152 13.109 -28.657 16.515 921 HE1 HIS 152 HE1 HIS 152 12.402 -32.454 18.270 922 HE2 HIS 152 HE2 HIS 152 12.724 -29.992 18.697 923 H HIS 153 H HIS 153 14.280 -32.176 12.554 924 HA HIS 153 HA HIS 153 16.966 -32.653 13.543 925 HB2 HIS 153 1HB HIS 153 15.432 -33.361 15.391 926 HB3 HIS 153 2HB HIS 153 14.688 -34.503 14.283 927 HD1 HIS 153 HD1 HIS 153 15.691 -36.775 14.209 928 HD2 HIS 153 HD2 HIS 153 18.254 -33.973 15.901 929 HE1 HIS 153 HE1 HIS 153 17.657 -38.088 15.067 930 HE2 HIS 153 HE2 HIS 153 19.242 -36.363 15.998 931 H HIS 154 H HIS 154 18.048 -34.251 12.380 932 HA HIS 154 HA HIS 154 18.536 -35.672 10.689 933 HB2 HIS 154 1HB HIS 154 16.637 -37.041 11.399 934 HB3 HIS 154 2HB HIS 154 15.544 -36.041 10.452 935 HD1 HIS 154 HD1 HIS 154 15.325 -36.557 7.987 936 HD2 HIS 154 HD2 HIS 154 18.338 -38.739 9.841 937 HE1 HIS 154 HE1 HIS 154 16.032 -38.292 6.309 938 HE2 HIS 154 HE2 HIS 154 17.823 -39.631 7.465 939 H HIS 155 H HIS 155 19.467 -34.209 9.377 940 HA HIS 155 HA HIS 155 17.908 -32.575 7.588 941 HB2 HIS 155 1HB HIS 155 20.887 -33.095 7.722 942 HB3 HIS 155 2HB HIS 155 20.123 -31.929 6.649 943 HD1 HIS 155 HD1 HIS 155 21.259 -32.412 10.133 944 HD2 HIS 155 HD2 HIS 155 19.070 -29.627 7.965 945 HE1 HIS 155 HE1 HIS 155 21.149 -30.367 11.586 946 HE2 HIS 155 HE2 HIS 155 20.020 -28.628 10.155 Start of MODEL 9 1 H1 MET 24 1H MET 24 -17.302 -15.052 -2.306 2 H2 MET 24 2H MET 24 -15.922 -14.227 -1.764 3 H3 MET 24 3H MET 24 -15.812 -15.855 -2.205 4 HA MET 24 HA MET 24 -14.890 -14.407 -3.907 5 HB2 MET 24 1HB MET 24 -15.920 -16.578 -4.511 6 HB3 MET 24 2HB MET 24 -17.461 -15.766 -4.734 7 HG2 MET 24 1HG MET 24 -16.446 -14.407 -6.525 8 HG3 MET 24 2HG MET 24 -14.952 -15.321 -6.333 9 HE1 MET 24 1HE MET 24 -18.939 -17.063 -7.864 10 HE2 MET 24 2HE MET 24 -18.687 -15.380 -7.401 11 HE3 MET 24 3HE MET 24 -18.697 -16.642 -6.169 12 H GLU 25 H GLU 25 -17.946 -13.507 -2.674 13 HA GLU 25 HA GLU 25 -18.689 -11.694 -4.760 14 HB2 GLU 25 1HB GLU 25 -19.757 -11.597 -1.951 15 HB3 GLU 25 2HB GLU 25 -20.581 -11.208 -3.453 16 HG2 GLU 25 1HG GLU 25 -21.546 -13.211 -2.983 17 HG3 GLU 25 2HG GLU 25 -20.180 -13.761 -3.950 18 H ASN 26 H ASN 26 -16.384 -10.777 -4.587 19 HA ASN 26 HA ASN 26 -16.448 -8.448 -2.774 20 HB2 ASN 26 1HB ASN 26 -14.052 -10.023 -3.748 21 HB3 ASN 26 2HB ASN 26 -13.941 -8.493 -2.889 22 HD21 ASN 26 1HD2 ASN 26 -12.957 -11.172 -2.206 23 HD22 ASN 26 2HD2 ASN 26 -13.628 -11.534 -0.654 24 H TYR 27 H TYR 27 -17.315 -8.986 -5.654 25 HA TYR 27 HA TYR 27 -15.445 -7.950 -7.466 26 HB2 TYR 27 1HB TYR 27 -18.458 -8.084 -7.619 27 HB3 TYR 27 2HB TYR 27 -17.427 -7.632 -8.972 28 HD1 TYR 27 HD1 TYR 27 -16.396 -9.291 -10.309 29 HD2 TYR 27 HD2 TYR 27 -18.215 -10.394 -6.624 30 HE1 TYR 27 HE1 TYR 27 -16.144 -11.664 -10.900 31 HE2 TYR 27 HE2 TYR 27 -17.970 -12.768 -7.210 32 HH TYR 27 HH TYR 27 -16.023 -13.843 -9.762 33 H LEU 28 H LEU 28 -18.210 -6.348 -5.918 34 HA LEU 28 HA LEU 28 -17.710 -3.828 -7.121 35 HB2 LEU 28 1HB LEU 28 -19.261 -4.495 -4.617 36 HB3 LEU 28 2HB LEU 28 -19.324 -2.963 -5.467 37 HG LEU 28 HG LEU 28 -20.232 -5.626 -6.573 38 HD11 LEU 28 1HD1 LEU 28 -22.473 -4.665 -6.414 39 HD12 LEU 28 2HD1 LEU 28 -21.803 -3.227 -5.644 40 HD13 LEU 28 3HD1 LEU 28 -21.707 -4.789 -4.831 41 HD21 LEU 28 1HD2 LEU 28 -21.140 -4.279 -8.420 42 HD22 LEU 28 2HD2 LEU 28 -19.381 -4.194 -8.336 43 HD23 LEU 28 3HD2 LEU 28 -20.359 -2.848 -7.745 44 H ARG 29 H ARG 29 -16.815 -5.268 -4.038 45 HA ARG 29 HA ARG 29 -15.608 -2.965 -2.941 46 HB2 ARG 29 1HB ARG 29 -16.198 -4.754 -1.480 47 HB3 ARG 29 2HB ARG 29 -15.251 -5.911 -2.404 48 HG2 ARG 29 1HG ARG 29 -13.256 -5.180 -1.526 49 HG3 ARG 29 2HG ARG 29 -13.896 -3.590 -1.111 50 HD2 ARG 29 1HD ARG 29 -13.489 -5.053 0.860 51 HD3 ARG 29 2HD ARG 29 -15.158 -4.505 0.708 52 HE ARG 29 HE ARG 29 -14.447 -7.148 -0.332 53 HH11 ARG 29 1HH1 ARG 29 -16.119 -5.196 2.049 54 HH12 ARG 29 2HH1 ARG 29 -17.094 -6.504 2.626 55 HH21 ARG 29 1HH2 ARG 29 -15.740 -8.881 0.432 56 HH22 ARG 29 2HH2 ARG 29 -16.874 -8.591 1.714 57 H LYS 30 H LYS 30 -14.453 -5.480 -5.102 58 HA LYS 30 HA LYS 30 -11.724 -4.904 -5.063 59 HB2 LYS 30 1HB LYS 30 -13.513 -5.917 -7.265 60 HB3 LYS 30 2HB LYS 30 -11.791 -5.670 -7.511 61 HG2 LYS 30 1HG LYS 30 -11.324 -7.266 -5.700 62 HG3 LYS 30 2HG LYS 30 -13.060 -7.542 -5.525 63 HD2 LYS 30 1HD LYS 30 -13.143 -8.261 -7.891 64 HD3 LYS 30 2HD LYS 30 -11.392 -8.069 -7.982 65 HE2 LYS 30 1HE LYS 30 -12.867 -9.944 -6.140 66 HE3 LYS 30 2HE LYS 30 -12.034 -10.404 -7.624 67 HZ1 LYS 30 1HZ LYS 30 -10.580 -10.869 -5.854 68 HZ2 LYS 30 2HZ LYS 30 -10.845 -9.373 -5.121 69 HZ3 LYS 30 3HZ LYS 30 -9.976 -9.457 -6.575 70 H ALA 31 H ALA 31 -14.286 -3.519 -7.180 71 HA ALA 31 HA ALA 31 -12.605 -1.737 -8.506 72 HB1 ALA 31 1HB ALA 31 -14.847 -2.381 -9.279 73 HB2 ALA 31 2HB ALA 31 -14.628 -0.631 -9.230 74 HB3 ALA 31 3HB ALA 31 -15.552 -1.441 -7.964 75 H ALA 32 H ALA 32 -14.425 -1.394 -5.496 76 HA ALA 32 HA ALA 32 -14.008 1.366 -5.130 77 HB1 ALA 32 1HB ALA 32 -14.287 -0.775 -3.019 78 HB2 ALA 32 2HB ALA 32 -15.619 0.073 -3.804 79 HB3 ALA 32 3HB ALA 32 -14.496 0.958 -2.773 80 H LEU 33 H LEU 33 -12.140 -1.459 -4.205 81 HA LEU 33 HA LEU 33 -10.042 -0.060 -2.892 82 HB2 LEU 33 1HB LEU 33 -10.407 -2.818 -3.999 83 HB3 LEU 33 2HB LEU 33 -8.797 -2.285 -3.552 84 HG LEU 33 HG LEU 33 -9.273 -2.283 -1.288 85 HD11 LEU 33 1HD1 LEU 33 -11.496 -2.183 -0.302 86 HD12 LEU 33 2HD1 LEU 33 -12.221 -2.147 -1.908 87 HD13 LEU 33 3HD1 LEU 33 -11.222 -0.802 -1.362 88 HD21 LEU 33 1HD2 LEU 33 -10.422 -4.355 -0.785 89 HD22 LEU 33 2HD2 LEU 33 -9.411 -4.548 -2.217 90 HD23 LEU 33 3HD2 LEU 33 -11.158 -4.358 -2.387 91 H THR 34 H THR 34 -10.541 -1.200 -6.186 92 HA THR 34 HA THR 34 -8.005 -0.532 -7.206 93 HB THR 34 HB THR 34 -10.647 -0.607 -8.678 94 HG1 THR 34 HG1 THR 34 -10.232 -2.592 -7.665 95 HG21 THR 34 1HG2 THR 34 -7.806 -0.876 -9.680 96 HG22 THR 34 2HG2 THR 34 -8.880 0.495 -9.963 97 HG23 THR 34 3HG2 THR 34 -9.263 -1.082 -10.654 98 H ASP 35 H ASP 35 -10.999 1.300 -6.875 99 HA ASP 35 HA ASP 35 -10.089 3.560 -8.362 100 HB2 ASP 35 1HB ASP 35 -12.508 2.985 -7.936 101 HB3 ASP 35 2HB ASP 35 -12.273 3.522 -6.274 102 H MET 36 H MET 36 -10.120 2.629 -4.971 103 HA MET 36 HA MET 36 -9.025 5.015 -3.935 104 HB2 MET 36 1HB MET 36 -9.937 3.474 -2.363 105 HB3 MET 36 2HB MET 36 -8.917 2.163 -2.944 106 HG2 MET 36 1HG MET 36 -8.152 3.035 -0.795 107 HG3 MET 36 2HG MET 36 -6.949 3.259 -2.067 108 HE1 MET 36 1HE MET 36 -6.102 6.485 -0.223 109 HE2 MET 36 2HE MET 36 -5.496 5.137 -1.184 110 HE3 MET 36 3HE MET 36 -6.280 4.832 0.365 111 H LEU 37 H LEU 37 -7.516 2.051 -5.165 112 HA LEU 37 HA LEU 37 -4.845 2.795 -4.772 113 HB2 LEU 37 1HB LEU 37 -5.576 0.528 -5.399 114 HB3 LEU 37 2HB LEU 37 -6.040 1.125 -6.989 115 HG LEU 37 HG LEU 37 -3.598 1.752 -7.326 116 HD11 LEU 37 1HD1 LEU 37 -3.262 -0.026 -4.912 117 HD12 LEU 37 2HD1 LEU 37 -2.900 1.698 -4.990 118 HD13 LEU 37 3HD1 LEU 37 -1.965 0.557 -5.954 119 HD21 LEU 37 1HD2 LEU 37 -4.667 -0.194 -8.362 120 HD22 LEU 37 2HD2 LEU 37 -4.264 -1.162 -6.944 121 HD23 LEU 37 3HD2 LEU 37 -2.979 -0.507 -7.958 122 H GLN 38 H GLN 38 -7.097 3.471 -7.395 123 HA GLN 38 HA GLN 38 -5.265 4.843 -9.064 124 HB2 GLN 38 1HB GLN 38 -8.274 5.031 -8.861 125 HB3 GLN 38 2HB GLN 38 -7.319 5.795 -10.123 126 HG2 GLN 38 1HG GLN 38 -7.555 2.840 -9.601 127 HG3 GLN 38 2HG GLN 38 -8.307 3.737 -10.917 128 HE21 GLN 38 1HE2 GLN 38 -5.379 2.352 -9.702 129 HE22 GLN 38 2HE2 GLN 38 -4.440 2.550 -11.143 130 H THR 39 H THR 39 -7.210 5.795 -6.329 131 HA THR 39 HA THR 39 -6.798 8.615 -6.641 132 HB THR 39 HB THR 39 -7.533 7.104 -4.120 133 HG1 THR 39 HG1 THR 39 -8.981 6.670 -5.889 134 HG21 THR 39 1HG2 THR 39 -8.044 9.965 -4.957 135 HG22 THR 39 2HG2 THR 39 -6.863 9.438 -3.759 136 HG23 THR 39 3HG2 THR 39 -8.587 9.214 -3.455 137 H PHE 40 H PHE 40 -5.128 5.978 -5.088 138 HA PHE 40 HA PHE 40 -3.331 7.508 -3.537 139 HB2 PHE 40 1HB PHE 40 -3.683 5.118 -3.127 140 HB3 PHE 40 2HB PHE 40 -2.986 4.738 -4.699 141 HD1 PHE 40 HD1 PHE 40 -1.870 7.038 -1.974 142 HD2 PHE 40 HD2 PHE 40 -1.012 3.627 -4.373 143 HE1 PHE 40 HE1 PHE 40 0.372 6.909 -0.976 144 HE2 PHE 40 HE2 PHE 40 1.233 3.487 -3.378 145 HZ PHE 40 HZ PHE 40 1.931 5.132 -1.677 146 H VAL 41 H VAL 41 -3.337 6.506 -6.889 147 HA VAL 41 HA VAL 41 -0.725 6.797 -7.629 148 HB VAL 41 HB VAL 41 -3.182 7.524 -9.209 149 HG11 VAL 41 1HG1 VAL 41 -1.779 7.407 -11.203 150 HG12 VAL 41 2HG1 VAL 41 -0.352 7.200 -10.187 151 HG13 VAL 41 3HG1 VAL 41 -1.261 8.709 -10.133 152 HG21 VAL 41 1HG2 VAL 41 -3.019 5.192 -8.530 153 HG22 VAL 41 2HG2 VAL 41 -1.404 5.096 -9.232 154 HG23 VAL 41 3HG2 VAL 41 -2.804 5.363 -10.272 155 HA PRO 42 HA PRO 42 -1.284 11.649 -8.307 156 HB2 PRO 42 1HB PRO 42 -3.387 12.099 -6.257 157 HB3 PRO 42 2HB PRO 42 -3.116 12.927 -7.795 158 HG2 PRO 42 1HG PRO 42 -5.095 11.161 -7.516 159 HG3 PRO 42 2HG PRO 42 -4.170 11.279 -9.023 160 HD2 PRO 42 1HD PRO 42 -4.022 9.233 -6.859 161 HD3 PRO 42 2HD PRO 42 -3.824 9.048 -8.610 162 H TYR 43 H TYR 43 -1.670 9.902 -5.262 163 HA TYR 43 HA TYR 43 -0.396 11.982 -3.697 164 HB2 TYR 43 1HB TYR 43 -1.251 9.150 -3.061 165 HB3 TYR 43 2HB TYR 43 -0.332 10.134 -1.924 166 HD1 TYR 43 HD1 TYR 43 -3.595 9.585 -3.472 167 HD2 TYR 43 HD2 TYR 43 -1.355 12.107 -0.878 168 HE1 TYR 43 HE1 TYR 43 -5.683 10.566 -2.632 169 HE2 TYR 43 HE2 TYR 43 -3.443 13.093 -0.030 170 HH TYR 43 HH TYR 43 -5.794 13.401 -0.829 171 H ARG 44 H ARG 44 0.426 9.048 -5.367 172 HA ARG 44 HA ARG 44 2.947 8.536 -4.276 173 HB2 ARG 44 1HB ARG 44 2.090 8.055 -7.130 174 HB3 ARG 44 2HB ARG 44 3.420 7.269 -6.295 175 HG2 ARG 44 1HG ARG 44 1.798 6.269 -4.730 176 HG3 ARG 44 2HG ARG 44 0.491 6.988 -5.675 177 HD2 ARG 44 1HD ARG 44 2.470 4.881 -6.528 178 HD3 ARG 44 2HD ARG 44 0.714 4.744 -6.442 179 HE ARG 44 HE ARG 44 1.578 6.775 -8.269 180 HH11 ARG 44 1HH1 ARG 44 0.999 3.337 -7.918 181 HH12 ARG 44 2HH1 ARG 44 0.811 3.071 -9.621 182 HH21 ARG 44 1HH2 ARG 44 1.358 6.415 -10.502 183 HH22 ARG 44 2HH2 ARG 44 1.033 4.812 -11.089 184 H THR 45 H THR 45 1.964 10.577 -6.988 185 HA THR 45 HA THR 45 4.404 11.437 -7.900 186 HB THR 45 HB THR 45 1.985 13.206 -7.538 187 HG1 THR 45 HG1 THR 45 2.623 11.216 -9.477 188 HG21 THR 45 1HG2 THR 45 2.816 14.316 -9.560 189 HG22 THR 45 2HG2 THR 45 4.213 13.242 -9.579 190 HG23 THR 45 3HG2 THR 45 4.002 14.391 -8.258 191 H ALA 46 H ALA 46 2.644 12.595 -5.055 192 HA ALA 46 HA ALA 46 4.504 14.641 -4.369 193 HB1 ALA 46 1HB ALA 46 2.525 13.148 -2.644 194 HB2 ALA 46 2HB ALA 46 2.234 14.664 -3.497 195 HB3 ALA 46 3HB ALA 46 3.395 14.608 -2.169 196 H VAL 47 H VAL 47 4.086 11.285 -3.510 197 HA VAL 47 HA VAL 47 6.184 11.024 -1.651 198 HB VAL 47 HB VAL 47 5.097 8.935 -3.550 199 HG11 VAL 47 1HG1 VAL 47 6.708 8.581 -1.021 200 HG12 VAL 47 2HG1 VAL 47 7.292 8.309 -2.663 201 HG13 VAL 47 3HG1 VAL 47 6.015 7.287 -1.999 202 HG21 VAL 47 1HG2 VAL 47 3.358 9.838 -2.126 203 HG22 VAL 47 2HG2 VAL 47 4.365 9.596 -0.697 204 HG23 VAL 47 3HG2 VAL 47 3.768 8.206 -1.602 205 H GLU 48 H GLU 48 6.146 10.766 -5.175 206 HA GLU 48 HA GLU 48 8.762 9.870 -5.597 207 HB2 GLU 48 1HB GLU 48 7.214 11.836 -7.311 208 HB3 GLU 48 2HB GLU 48 8.579 10.862 -7.831 209 HG2 GLU 48 1HG GLU 48 6.057 9.605 -6.818 210 HG3 GLU 48 2HG GLU 48 6.232 10.115 -8.494 211 H LEU 49 H LEU 49 7.461 13.085 -5.060 212 HA LEU 49 HA LEU 49 9.802 14.551 -5.640 213 HB2 LEU 49 1HB LEU 49 7.492 15.252 -3.826 214 HB3 LEU 49 2HB LEU 49 8.680 16.390 -4.438 215 HG LEU 49 HG LEU 49 6.714 14.837 -6.127 216 HD11 LEU 49 1HD1 LEU 49 6.751 17.734 -5.302 217 HD12 LEU 49 2HD1 LEU 49 5.601 16.509 -4.770 218 HD13 LEU 49 3HD1 LEU 49 5.636 17.012 -6.459 219 HD21 LEU 49 1HD2 LEU 49 8.732 15.290 -7.365 220 HD22 LEU 49 2HD2 LEU 49 8.716 16.973 -6.839 221 HD23 LEU 49 3HD2 LEU 49 7.456 16.374 -7.918 222 H CYS 50 H CYS 50 8.451 13.332 -2.589 223 HA CYS 50 HA CYS 50 10.596 14.453 -1.048 224 HB2 CYS 50 1HB CYS 50 9.546 13.197 0.835 225 HB3 CYS 50 2HB CYS 50 8.443 14.272 -0.014 226 H ALA 51 H ALA 51 10.031 11.467 -2.694 227 HA ALA 51 HA ALA 51 11.917 9.875 -1.253 228 HB1 ALA 51 1HB ALA 51 11.727 8.307 -3.098 229 HB2 ALA 51 2HB ALA 51 10.903 9.522 -4.075 230 HB3 ALA 51 3HB ALA 51 10.129 8.882 -2.625 231 H LEU 52 H LEU 52 12.039 11.814 -4.205 232 HA LEU 52 HA LEU 52 14.748 11.014 -4.790 233 HB2 LEU 52 1HB LEU 52 12.981 13.109 -6.061 234 HB3 LEU 52 2HB LEU 52 14.553 12.635 -6.668 235 HG LEU 52 HG LEU 52 12.125 10.841 -6.494 236 HD11 LEU 52 1HD1 LEU 52 11.915 12.557 -8.211 237 HD12 LEU 52 2HD1 LEU 52 12.126 10.958 -8.924 238 HD13 LEU 52 3HD1 LEU 52 13.479 12.089 -8.879 239 HD21 LEU 52 1HD2 LEU 52 14.898 10.338 -7.562 240 HD22 LEU 52 2HD2 LEU 52 13.510 9.287 -7.842 241 HD23 LEU 52 3HD2 LEU 52 14.116 9.526 -6.205 242 H GLU 53 H GLU 53 13.285 13.383 -2.877 243 HA GLU 53 HA GLU 53 15.058 15.537 -3.099 244 HB2 GLU 53 1HB GLU 53 12.849 15.571 -1.931 245 HB3 GLU 53 2HB GLU 53 13.565 14.637 -0.626 246 HG2 GLU 53 1HG GLU 53 13.458 16.958 -0.017 247 HG3 GLU 53 2HG GLU 53 15.141 16.470 -0.202 248 H HIS 54 H HIS 54 15.115 12.689 -1.006 249 HA HIS 54 HA HIS 54 17.877 13.390 -0.226 250 HB2 HIS 54 1HB HIS 54 16.286 13.196 1.652 251 HB3 HIS 54 2HB HIS 54 15.908 11.553 1.167 252 HD1 HIS 54 HD1 HIS 54 18.611 13.615 2.778 253 HD2 HIS 54 HD2 HIS 54 17.704 9.625 2.030 254 HE1 HIS 54 HE1 HIS 54 20.230 12.282 4.163 255 HE2 HIS 54 HE2 HIS 54 19.747 9.874 3.598 256 H GLY 55 H GLY 55 16.007 11.307 -2.113 257 HA2 GLY 55 1HA GLY 55 16.666 9.630 -3.548 258 HA3 GLY 55 2HA GLY 55 18.242 9.590 -2.761 259 H GLY 56 H GLY 56 17.136 9.332 -0.073 260 HA2 GLY 56 1HA GLY 56 15.492 6.913 -0.268 261 HA3 GLY 56 2HA GLY 56 16.361 7.444 1.166 262 H LEU 57 H LEU 57 13.710 6.684 1.277 263 HA LEU 57 HA LEU 57 11.917 8.898 1.017 264 HB2 LEU 57 1HB LEU 57 11.635 6.239 2.410 265 HB3 LEU 57 2HB LEU 57 10.340 7.410 2.251 266 HG LEU 57 HG LEU 57 11.736 6.193 -0.127 267 HD11 LEU 57 1HD1 LEU 57 9.928 4.623 -0.292 268 HD12 LEU 57 2HD1 LEU 57 9.143 5.309 1.129 269 HD13 LEU 57 3HD1 LEU 57 10.678 4.456 1.295 270 HD21 LEU 57 1HD2 LEU 57 10.551 8.267 -0.577 271 HD22 LEU 57 2HD2 LEU 57 9.104 7.631 0.197 272 HD23 LEU 57 3HD2 LEU 57 9.696 6.903 -1.295 273 H ASP 58 H ASP 58 14.299 8.334 3.201 274 HA ASP 58 HA ASP 58 13.260 8.607 5.716 275 HB2 ASP 58 1HB ASP 58 15.603 8.193 5.429 276 HB3 ASP 58 2HB ASP 58 15.829 9.748 4.630 277 H THR 59 H THR 59 13.753 11.179 3.360 278 HA THR 59 HA THR 59 13.093 13.211 5.311 279 HB THR 59 HB THR 59 13.324 14.746 3.302 280 HG1 THR 59 HG1 THR 59 13.047 13.355 1.595 281 HG21 THR 59 1HG2 THR 59 15.664 12.985 4.042 282 HG22 THR 59 2HG2 THR 59 15.132 14.425 4.911 283 HG23 THR 59 3HG2 THR 59 15.772 14.568 3.275 284 H CYS 60 H CYS 60 11.131 11.097 4.146 285 HA CYS 60 HA CYS 60 9.117 13.042 3.246 286 HB2 CYS 60 1HB CYS 60 9.831 11.367 1.539 287 HB3 CYS 60 2HB CYS 60 9.209 10.097 2.581 288 H ASP 61 H ASP 61 8.799 13.327 5.610 289 HA ASP 61 HA ASP 61 6.792 11.372 6.526 290 HB2 ASP 61 1HB ASP 61 8.631 13.097 8.205 291 HB3 ASP 61 2HB ASP 61 7.283 12.166 8.850 292 H GLY 62 H GLY 62 4.816 12.177 7.092 293 HA2 GLY 62 1HA GLY 62 4.048 14.653 5.971 294 HA3 GLY 62 2HA GLY 62 3.052 13.644 7.013 295 H GLY 63 H GLY 63 4.682 16.564 6.738 296 HA2 GLY 63 1HA GLY 63 4.216 18.257 8.413 297 HA3 GLY 63 2HA GLY 63 4.406 17.012 9.640 298 H SER 64 H SER 64 6.762 16.512 7.366 299 HA SER 64 HA SER 64 8.664 18.291 8.734 300 HB2 SER 64 1HB SER 64 10.336 16.485 8.665 301 HB3 SER 64 2HB SER 64 8.916 15.989 9.580 302 HG SER 64 HG SER 64 8.218 15.092 7.423 303 H ASN 65 H ASN 65 10.622 18.753 7.437 304 HA ASN 65 HA ASN 65 11.544 19.638 5.566 305 HB2 ASN 65 1HB ASN 65 10.558 16.983 4.552 306 HB3 ASN 65 2HB ASN 65 11.422 18.098 3.500 307 HD21 ASN 65 1HD2 ASN 65 11.675 15.918 6.195 308 HD22 ASN 65 2HD2 ASN 65 13.406 15.941 6.305 309 H GLY 66 H GLY 66 8.793 20.429 6.112 310 HA2 GLY 66 1HA GLY 66 7.311 21.884 5.128 311 HA3 GLY 66 2HA GLY 66 8.323 21.854 3.690 312 H ILE 67 H ILE 67 7.448 18.749 4.629 313 HA ILE 67 HA ILE 67 5.746 18.436 2.349 314 HB ILE 67 HB ILE 67 6.599 16.521 4.520 315 HG12 ILE 67 1HG1 ILE 67 7.361 16.748 1.603 316 HG13 ILE 67 2HG1 ILE 67 8.348 17.290 2.957 317 HG21 ILE 67 1HG2 ILE 67 5.671 14.721 3.153 318 HG22 ILE 67 2HG2 ILE 67 5.033 15.907 2.015 319 HG23 ILE 67 3HG2 ILE 67 4.409 15.843 3.665 320 HD11 ILE 67 1HD1 ILE 67 7.513 14.454 2.421 321 HD12 ILE 67 2HD1 ILE 67 8.532 15.009 3.750 322 HD13 ILE 67 3HD1 ILE 67 9.099 15.151 2.087 323 HA PRO 68 HA PRO 68 1.934 19.505 4.342 324 HB2 PRO 68 1HB PRO 68 0.755 17.648 2.349 325 HB3 PRO 68 2HB PRO 68 0.381 19.345 2.664 326 HG2 PRO 68 1HG PRO 68 1.751 18.629 0.496 327 HG3 PRO 68 2HG PRO 68 2.150 20.113 1.391 328 HD2 PRO 68 1HD PRO 68 3.531 17.455 1.400 329 HD3 PRO 68 2HD PRO 68 4.231 19.092 1.433 330 H SER 69 H SER 69 -0.051 18.364 5.166 331 HA SER 69 HA SER 69 0.841 16.003 6.630 332 HB2 SER 69 1HB SER 69 -0.057 17.877 7.949 333 HB3 SER 69 2HB SER 69 -1.555 17.825 7.022 334 HG SER 69 HG SER 69 -0.682 16.223 9.089 335 HA PRO 70 HA PRO 70 -1.370 13.272 3.979 336 HB2 PRO 70 1HB PRO 70 -2.255 11.487 5.931 337 HB3 PRO 70 2HB PRO 70 -0.702 11.409 5.096 338 HG2 PRO 70 1HG PRO 70 -1.359 12.513 7.784 339 HG3 PRO 70 2HG PRO 70 0.085 11.634 7.251 340 HD2 PRO 70 1HD PRO 70 0.128 14.291 7.604 341 HD3 PRO 70 2HD PRO 70 1.034 13.521 6.283 342 H THR 71 H THR 71 -3.265 13.623 3.152 343 HA THR 71 HA THR 71 -5.483 14.418 4.907 344 HB THR 71 HB THR 71 -4.653 16.174 3.325 345 HG1 THR 71 HG1 THR 71 -6.718 16.541 3.849 346 HG21 THR 71 1HG2 THR 71 -5.686 14.268 1.227 347 HG22 THR 71 2HG2 THR 71 -4.010 14.767 1.457 348 HG23 THR 71 3HG2 THR 71 -5.216 15.941 0.936 349 H THR 72 H THR 72 -7.668 13.960 3.807 350 HA THR 72 HA THR 72 -7.571 11.383 2.415 351 HB THR 72 HB THR 72 -9.509 10.596 3.750 352 HG1 THR 72 HG1 THR 72 -9.327 13.138 4.758 353 HG21 THR 72 1HG2 THR 72 -7.237 9.899 4.360 354 HG22 THR 72 2HG2 THR 72 -8.280 10.027 5.775 355 HG23 THR 72 3HG2 THR 72 -7.100 11.294 5.432 356 H THR 73 H THR 73 -8.696 11.495 0.581 357 HA THR 73 HA THR 73 -10.659 13.535 0.143 358 HB THR 73 HB THR 73 -11.023 12.287 -2.034 359 HG1 THR 73 HG1 THR 73 -8.660 10.900 -1.714 360 HG21 THR 73 1HG2 THR 73 -8.199 13.121 -1.372 361 HG22 THR 73 2HG2 THR 73 -9.501 14.186 -1.907 362 HG23 THR 73 3HG2 THR 73 -8.863 12.953 -2.998 363 H ARG 74 H ARG 74 -12.811 12.460 -0.987 364 HA ARG 74 HA ARG 74 -14.326 11.769 1.222 365 HB2 ARG 74 1HB ARG 74 -15.448 12.693 -0.647 366 HB3 ARG 74 2HB ARG 74 -14.839 11.449 -1.727 367 HG2 ARG 74 1HG ARG 74 -17.175 11.078 -1.305 368 HG3 ARG 74 2HG ARG 74 -16.230 9.788 -0.565 369 HD2 ARG 74 1HD ARG 74 -16.390 10.981 1.606 370 HD3 ARG 74 2HD ARG 74 -17.451 12.165 0.840 371 HE ARG 74 HE ARG 74 -18.769 9.941 0.292 372 HH11 ARG 74 1HH1 ARG 74 -17.274 10.980 3.285 373 HH12 ARG 74 2HH1 ARG 74 -18.347 10.060 4.290 374 HH21 ARG 74 1HH2 ARG 74 -20.178 8.729 1.622 375 HH22 ARG 74 2HH2 ARG 74 -20.000 8.788 3.347 376 H TYR 75 H TYR 75 -13.010 9.546 -1.284 377 HA TYR 75 HA TYR 75 -14.156 7.292 0.072 378 HB2 TYR 75 1HB TYR 75 -12.180 7.359 -2.213 379 HB3 TYR 75 2HB TYR 75 -13.140 5.969 -1.694 380 HD1 TYR 75 HD1 TYR 75 -12.916 8.190 -4.226 381 HD2 TYR 75 HD2 TYR 75 -15.800 6.837 -1.410 382 HE1 TYR 75 HE1 TYR 75 -14.717 8.881 -5.749 383 HE2 TYR 75 HE2 TYR 75 -17.608 7.523 -2.926 384 HH TYR 75 HH TYR 75 -17.030 8.435 -6.194 385 H VAL 76 H VAL 76 -11.405 9.077 0.724 386 HA VAL 76 HA VAL 76 -9.857 6.743 1.579 387 HB VAL 76 HB VAL 76 -9.094 9.668 1.670 388 HG11 VAL 76 1HG1 VAL 76 -7.341 7.242 2.054 389 HG12 VAL 76 2HG1 VAL 76 -7.996 8.203 3.379 390 HG13 VAL 76 3HG1 VAL 76 -6.875 8.934 2.229 391 HG21 VAL 76 1HG2 VAL 76 -7.594 9.092 -0.200 392 HG22 VAL 76 2HG2 VAL 76 -9.296 8.879 -0.615 393 HG23 VAL 76 3HG2 VAL 76 -8.297 7.474 -0.240 394 H SER 77 H SER 77 -10.071 5.985 3.540 395 HA SER 77 HA SER 77 -11.635 7.370 5.499 396 HB2 SER 77 1HB SER 77 -10.119 4.762 5.768 397 HB3 SER 77 2HB SER 77 -11.439 5.327 6.798 398 HG SER 77 HG SER 77 -12.539 5.431 4.537 399 H ALA 78 H ALA 78 -8.225 6.355 5.284 400 HA ALA 78 HA ALA 78 -7.335 8.448 6.989 401 HB1 ALA 78 1HB ALA 78 -8.350 6.993 8.694 402 HB2 ALA 78 2HB ALA 78 -6.604 7.113 8.888 403 HB3 ALA 78 3HB ALA 78 -7.312 5.670 8.166 404 H MET 79 H MET 79 -5.053 8.526 7.145 405 HA MET 79 HA MET 79 -3.336 6.465 6.304 406 HB2 MET 79 1HB MET 79 -2.485 7.462 4.204 407 HB3 MET 79 2HB MET 79 -4.144 6.899 4.065 408 HG2 MET 79 1HG MET 79 -4.976 9.151 4.207 409 HG3 MET 79 2HG MET 79 -3.352 9.770 4.508 410 HE1 MET 79 1HE MET 79 -1.578 9.136 1.077 411 HE2 MET 79 2HE MET 79 -1.599 8.024 2.444 412 HE3 MET 79 3HE MET 79 -1.410 9.755 2.722 413 H SER 80 H SER 80 -1.257 6.909 6.858 414 HA SER 80 HA SER 80 -0.566 9.689 7.547 415 HB2 SER 80 1HB SER 80 0.184 7.233 9.163 416 HB3 SER 80 2HB SER 80 0.598 8.903 9.550 417 HG SER 80 HG SER 80 -1.903 9.083 9.377 418 H VAL 81 H VAL 81 1.514 10.323 6.999 419 HA VAL 81 HA VAL 81 2.951 8.458 5.262 420 HB VAL 81 HB VAL 81 3.341 11.441 5.595 421 HG11 VAL 81 1HG1 VAL 81 4.396 9.532 3.509 422 HG12 VAL 81 2HG1 VAL 81 5.339 10.331 4.767 423 HG13 VAL 81 3HG1 VAL 81 4.589 11.285 3.487 424 HG21 VAL 81 1HG2 VAL 81 1.878 9.944 3.430 425 HG22 VAL 81 2HG2 VAL 81 2.158 11.683 3.487 426 HG23 VAL 81 3HG2 VAL 81 1.131 10.916 4.697 427 H ALA 82 H ALA 82 4.576 7.368 6.137 428 HA ALA 82 HA ALA 82 6.349 8.749 8.029 429 HB1 ALA 82 1HB ALA 82 5.405 5.897 8.304 430 HB2 ALA 82 2HB ALA 82 4.853 7.253 9.289 431 HB3 ALA 82 3HB ALA 82 6.536 6.731 9.369 432 H LYS 83 H LYS 83 8.148 8.913 7.047 433 HA LYS 83 HA LYS 83 9.901 8.621 5.546 434 HB2 LYS 83 1HB LYS 83 9.602 5.723 6.390 435 HB3 LYS 83 2HB LYS 83 11.038 6.460 5.690 436 HG2 LYS 83 1HG LYS 83 9.841 7.283 8.324 437 HG3 LYS 83 2HG LYS 83 11.145 6.108 8.152 438 HD2 LYS 83 1HD LYS 83 12.586 7.760 7.196 439 HD3 LYS 83 2HD LYS 83 11.276 8.941 7.131 440 HE2 LYS 83 1HE LYS 83 11.157 8.844 9.612 441 HE3 LYS 83 2HE LYS 83 12.564 7.780 9.597 442 HZ1 LYS 83 1HZ LYS 83 13.862 9.518 8.578 443 HZ2 LYS 83 2HZ LYS 83 13.148 10.112 9.997 444 HZ3 LYS 83 3HZ LYS 83 12.506 10.533 8.491 445 H GLY 84 H GLY 84 7.560 8.820 4.237 446 HA2 GLY 84 1HA GLY 84 6.727 8.577 2.100 447 HA3 GLY 84 2HA GLY 84 8.003 7.412 1.775 448 H VAL 85 H VAL 85 7.230 5.804 4.062 449 HA VAL 85 HA VAL 85 5.269 4.093 2.955 450 HB VAL 85 HB VAL 85 6.106 4.287 5.854 451 HG11 VAL 85 1HG1 VAL 85 4.854 2.018 4.317 452 HG12 VAL 85 2HG1 VAL 85 4.079 2.990 5.571 453 HG13 VAL 85 3HG1 VAL 85 5.430 1.935 5.982 454 HG21 VAL 85 1HG2 VAL 85 7.285 2.753 3.553 455 HG22 VAL 85 2HG2 VAL 85 7.657 2.418 5.242 456 HG23 VAL 85 3HG2 VAL 85 8.069 3.984 4.544 457 H VAL 86 H VAL 86 3.002 3.877 3.421 458 HA VAL 86 HA VAL 86 1.928 5.998 5.103 459 HB VAL 86 HB VAL 86 0.051 6.360 3.529 460 HG11 VAL 86 1HG1 VAL 86 2.790 6.946 2.414 461 HG12 VAL 86 2HG1 VAL 86 1.893 7.928 3.573 462 HG13 VAL 86 3HG1 VAL 86 1.296 7.744 1.924 463 HG21 VAL 86 1HG2 VAL 86 1.721 4.816 1.557 464 HG22 VAL 86 2HG2 VAL 86 0.205 5.650 1.224 465 HG23 VAL 86 3HG2 VAL 86 0.221 4.247 2.291 466 H SER 87 H SER 87 0.898 5.072 6.641 467 HA SER 87 HA SER 87 -0.336 2.465 6.226 468 HB2 SER 87 1HB SER 87 -0.016 3.970 8.826 469 HB3 SER 87 2HB SER 87 -0.338 2.246 8.619 470 HG SER 87 HG SER 87 1.888 3.051 7.275 471 H LEU 88 H LEU 88 -2.388 2.154 5.978 472 HA LEU 88 HA LEU 88 -4.255 4.359 6.569 473 HB2 LEU 88 1HB LEU 88 -4.550 2.185 4.488 474 HB3 LEU 88 2HB LEU 88 -5.639 3.535 4.748 475 HG LEU 88 HG LEU 88 -3.493 4.969 4.200 476 HD11 LEU 88 1HD1 LEU 88 -1.918 3.140 4.069 477 HD12 LEU 88 2HD1 LEU 88 -2.096 3.900 2.489 478 HD13 LEU 88 3HD1 LEU 88 -2.888 2.360 2.818 479 HD21 LEU 88 1HD2 LEU 88 -5.549 5.022 2.924 480 HD22 LEU 88 2HD2 LEU 88 -5.108 3.520 2.112 481 HD23 LEU 88 3HD2 LEU 88 -4.157 4.979 1.841 482 H THR 89 H THR 89 -6.310 3.768 7.445 483 HA THR 89 HA THR 89 -6.419 1.034 8.515 484 HB THR 89 HB THR 89 -7.124 3.489 10.121 485 HG1 THR 89 HG1 THR 89 -4.843 3.328 9.625 486 HG21 THR 89 1HG2 THR 89 -6.679 0.607 10.922 487 HG22 THR 89 2HG2 THR 89 -8.243 1.414 10.808 488 HG23 THR 89 3HG2 THR 89 -7.068 1.935 12.014 489 H GLY 90 H GLY 90 -8.273 0.061 8.240 490 HA2 GLY 90 1HA GLY 90 -10.464 -0.345 7.662 491 HA3 GLY 90 2HA GLY 90 -10.820 1.097 8.597 492 H GLN 91 H GLN 91 -9.114 0.631 5.522 493 HA GLN 91 HA GLN 91 -10.258 2.997 4.435 494 HB2 GLN 91 1HB GLN 91 -8.018 2.131 3.821 495 HB3 GLN 91 2HB GLN 91 -8.785 0.758 3.028 496 HG2 GLN 91 1HG GLN 91 -8.120 2.412 1.405 497 HG3 GLN 91 2HG GLN 91 -9.880 2.277 1.459 498 HE21 GLN 91 1HE2 GLN 91 -7.132 4.278 2.200 499 HE22 GLN 91 2HE2 GLN 91 -8.021 5.733 2.470 500 H GLU 92 H GLU 92 -12.136 3.252 3.411 501 HA GLU 92 HA GLU 92 -14.215 2.793 2.625 502 HB2 GLU 92 1HB GLU 92 -12.439 0.978 1.029 503 HB3 GLU 92 2HB GLU 92 -14.178 0.976 0.763 504 HG2 GLU 92 1HG GLU 92 -12.530 3.475 0.646 505 HG3 GLU 92 2HG GLU 92 -12.814 2.443 -0.750 506 H SER 93 H SER 93 -14.261 -0.333 1.692 507 HA SER 93 HA SER 93 -16.013 -1.136 3.790 508 HB2 SER 93 1HB SER 93 -14.806 -2.852 1.626 509 HB3 SER 93 2HB SER 93 -16.330 -3.112 2.476 510 HG SER 93 HG SER 93 -16.861 -0.920 1.533 511 H LEU 94 H LEU 94 -12.680 -1.146 3.544 512 HA LEU 94 HA LEU 94 -12.195 -3.773 4.656 513 HB2 LEU 94 1HB LEU 94 -10.254 -1.544 4.047 514 HB3 LEU 94 2HB LEU 94 -9.839 -3.208 4.430 515 HG LEU 94 HG LEU 94 -11.337 -2.300 1.967 516 HD11 LEU 94 1HD1 LEU 94 -9.037 -1.619 1.847 517 HD12 LEU 94 2HD1 LEU 94 -9.281 -3.010 0.790 518 HD13 LEU 94 3HD1 LEU 94 -8.496 -3.218 2.355 519 HD21 LEU 94 1HD2 LEU 94 -11.026 -4.609 1.203 520 HD22 LEU 94 2HD2 LEU 94 -12.027 -4.522 2.650 521 HD23 LEU 94 3HD2 LEU 94 -10.343 -5.031 2.771 522 H ASN 95 H ASN 95 -13.729 -2.143 6.324 523 HA ASN 95 HA ASN 95 -12.366 -0.803 8.354 524 HB2 ASN 95 1HB ASN 95 -14.832 -0.831 8.099 525 HB3 ASN 95 2HB ASN 95 -14.849 -2.515 8.608 526 HD21 ASN 95 1HD2 ASN 95 -16.088 -2.188 10.407 527 HD22 ASN 95 2HD2 ASN 95 -15.523 -1.333 11.804 528 H GLY 96 H GLY 96 -11.301 -1.453 10.183 529 HA2 GLY 96 1HA GLY 96 -10.353 -2.918 11.726 530 HA3 GLY 96 2HA GLY 96 -11.211 -4.242 10.944 531 H LEU 97 H LEU 97 -9.944 -2.970 8.377 532 HA LEU 97 HA LEU 97 -7.547 -4.638 8.510 533 HB2 LEU 97 1HB LEU 97 -9.281 -5.068 6.780 534 HB3 LEU 97 2HB LEU 97 -9.010 -3.459 6.146 535 HG LEU 97 HG LEU 97 -6.778 -5.474 6.221 536 HD11 LEU 97 1HD1 LEU 97 -7.384 -6.123 3.954 537 HD12 LEU 97 2HD1 LEU 97 -8.816 -5.101 4.030 538 HD13 LEU 97 3HD1 LEU 97 -8.685 -6.514 5.075 539 HD21 LEU 97 1HD2 LEU 97 -5.972 -4.156 4.322 540 HD22 LEU 97 2HD2 LEU 97 -6.194 -3.149 5.752 541 HD23 LEU 97 3HD2 LEU 97 -7.382 -3.106 4.452 542 H SER 98 H SER 98 -5.576 -3.762 8.440 543 HA SER 98 HA SER 98 -5.376 -0.884 7.853 544 HB2 SER 98 1HB SER 98 -4.736 -1.564 10.168 545 HB3 SER 98 2HB SER 98 -3.470 -2.582 9.483 546 HG SER 98 HG SER 98 -3.648 0.191 8.930 547 H VAL 99 H VAL 99 -4.217 -0.258 6.160 548 HA VAL 99 HA VAL 99 -2.727 -2.312 4.670 549 HB VAL 99 HB VAL 99 -3.694 0.363 3.644 550 HG11 VAL 99 1HG1 VAL 99 -1.809 -0.541 2.409 551 HG12 VAL 99 2HG1 VAL 99 -3.277 -0.596 1.434 552 HG13 VAL 99 3HG1 VAL 99 -2.667 -2.068 2.190 553 HG21 VAL 99 1HG2 VAL 99 -4.970 -2.344 3.292 554 HG22 VAL 99 2HG2 VAL 99 -5.471 -0.858 2.487 555 HG23 VAL 99 3HG2 VAL 99 -5.617 -1.005 4.239 556 H VAL 100 H VAL 100 -0.560 -2.130 4.521 557 HA VAL 100 HA VAL 100 0.626 0.449 5.304 558 HB VAL 100 HB VAL 100 1.879 -2.291 5.553 559 HG11 VAL 100 1HG1 VAL 100 3.640 -1.128 6.802 560 HG12 VAL 100 2HG1 VAL 100 2.854 0.414 6.463 561 HG13 VAL 100 3HG1 VAL 100 3.524 -0.545 5.142 562 HG21 VAL 100 1HG2 VAL 100 1.639 -1.971 7.975 563 HG22 VAL 100 2HG2 VAL 100 0.072 -1.996 7.164 564 HG23 VAL 100 3HG2 VAL 100 0.772 -0.462 7.683 565 H MET 101 H MET 101 1.027 1.466 3.445 566 HA MET 101 HA MET 101 2.095 -0.034 1.167 567 HB2 MET 101 1HB MET 101 0.261 1.555 0.749 568 HB3 MET 101 2HB MET 101 1.242 2.859 1.395 569 HG2 MET 101 1HG MET 101 1.437 3.106 -0.895 570 HG3 MET 101 2HG MET 101 2.917 2.268 -0.437 571 HE1 MET 101 1HE MET 101 -0.577 2.031 -2.104 572 HE2 MET 101 2HE MET 101 -0.766 0.816 -0.839 573 HE3 MET 101 3HE MET 101 -0.704 0.326 -2.533 574 H THR 102 H THR 102 4.215 -0.293 1.125 575 HA THR 102 HA THR 102 5.938 1.883 2.116 576 HB THR 102 HB THR 102 6.540 -1.076 1.918 577 HG1 THR 102 HG1 THR 102 5.090 -0.094 3.656 578 HG21 THR 102 1HG2 THR 102 8.612 -0.560 3.103 579 HG22 THR 102 2HG2 THR 102 8.214 1.156 3.079 580 HG23 THR 102 3HG2 THR 102 8.544 0.309 1.569 581 HA PRO 103 HA PRO 103 6.833 2.128 -2.384 582 HB2 PRO 103 1HB PRO 103 8.262 4.506 -1.335 583 HB3 PRO 103 2HB PRO 103 7.140 4.379 -2.698 584 HG2 PRO 103 1HG PRO 103 6.402 5.526 -0.385 585 HG3 PRO 103 2HG PRO 103 5.269 4.557 -1.350 586 HD2 PRO 103 1HD PRO 103 6.724 3.844 1.163 587 HD3 PRO 103 2HD PRO 103 5.083 3.395 0.639 588 H GLY 104 H GLY 104 8.614 1.292 -3.329 589 HA2 GLY 104 1HA GLY 104 10.878 0.722 -1.544 590 HA3 GLY 104 2HA GLY 104 10.456 -0.191 -2.985 591 H TRP 105 H TRP 105 12.351 2.302 -1.694 592 HA TRP 105 HA TRP 105 13.051 3.529 -4.192 593 HB2 TRP 105 1HB TRP 105 14.753 4.705 -2.933 594 HB3 TRP 105 2HB TRP 105 13.272 4.690 -1.985 595 HD1 TRP 105 HD1 TRP 105 16.872 3.578 -1.907 596 HE1 TRP 105 HE1 TRP 105 17.403 2.509 0.367 597 HE3 TRP 105 HE3 TRP 105 12.122 3.250 -0.043 598 HZ2 TRP 105 HZ2 TRP 105 15.993 1.641 2.655 599 HZ3 TRP 105 HZ3 TRP 105 11.801 2.286 2.196 600 HH2 TRP 105 HH2 TRP 105 13.695 1.498 3.517 601 H ASP 106 H ASP 106 15.051 3.245 -5.316 602 HA ASP 106 HA ASP 106 16.633 0.892 -4.623 603 HB2 ASP 106 1HB ASP 106 14.718 0.138 -6.084 604 HB3 ASP 106 2HB ASP 106 15.363 1.173 -7.355 605 H ASN 107 H ASN 107 18.726 1.046 -5.302 606 HA ASN 107 HA ASN 107 19.653 3.647 -5.980 607 HB2 ASN 107 1HB ASN 107 20.854 1.911 -4.558 608 HB3 ASN 107 2HB ASN 107 21.272 1.098 -6.060 609 HD21 ASN 107 1HD2 ASN 107 22.954 2.344 -4.011 610 HD22 ASN 107 2HD2 ASN 107 23.917 3.520 -4.838 611 H ALA 108 H ALA 108 19.363 0.616 -7.786 612 HA ALA 108 HA ALA 108 20.650 1.767 -10.113 613 HB1 ALA 108 1HB ALA 108 20.388 -0.440 -11.101 614 HB2 ALA 108 2HB ALA 108 19.391 -0.945 -9.737 615 HB3 ALA 108 3HB ALA 108 21.093 -0.557 -9.489 616 H ASN 109 H ASN 109 17.434 0.979 -9.013 617 HA ASN 109 HA ASN 109 16.341 1.479 -11.695 618 HB2 ASN 109 1HB ASN 109 15.116 0.165 -9.262 619 HB3 ASN 109 2HB ASN 109 14.264 0.430 -10.778 620 HD21 ASN 109 1HD2 ASN 109 16.810 -1.342 -9.184 621 HD22 ASN 109 2HD2 ASN 109 16.968 -2.575 -10.392 622 H GLY 110 H GLY 110 16.900 3.225 -8.946 623 HA2 GLY 110 1HA GLY 110 16.041 5.227 -8.189 624 HA3 GLY 110 2HA GLY 110 14.902 5.196 -9.531 625 H VAL 111 H VAL 111 13.258 3.329 -9.276 626 HA VAL 111 HA VAL 111 12.431 2.922 -6.508 627 HB VAL 111 HB VAL 111 11.194 4.904 -7.138 628 HG11 VAL 111 1HG1 VAL 111 11.373 4.713 -9.554 629 HG12 VAL 111 2HG1 VAL 111 9.698 4.959 -9.068 630 HG13 VAL 111 3HG1 VAL 111 10.250 3.354 -9.543 631 HG21 VAL 111 1HG2 VAL 111 9.983 3.273 -5.804 632 HG22 VAL 111 2HG2 VAL 111 9.421 2.468 -7.269 633 HG23 VAL 111 3HG2 VAL 111 8.887 4.110 -6.905 634 H THR 112 H THR 112 11.697 0.893 -6.198 635 HA THR 112 HA THR 112 11.665 -0.850 -8.539 636 HB THR 112 HB THR 112 13.080 -1.552 -6.680 637 HG1 THR 112 HG1 THR 112 10.884 -3.085 -7.489 638 HG21 THR 112 1HG2 THR 112 12.119 -2.256 -4.539 639 HG22 THR 112 2HG2 THR 112 10.532 -1.695 -5.065 640 HG23 THR 112 3HG2 THR 112 11.844 -0.540 -4.834 641 H GLY 113 H GLY 113 9.476 0.701 -6.454 642 HA2 GLY 113 1HA GLY 113 7.170 0.460 -7.595 643 HA3 GLY 113 2HA GLY 113 7.348 -1.216 -7.100 644 H TRP 114 H TRP 114 5.417 -0.970 -5.858 645 HA TRP 114 HA TRP 114 5.894 0.407 -3.303 646 HB2 TRP 114 1HB TRP 114 3.273 0.179 -4.804 647 HB3 TRP 114 2HB TRP 114 3.457 0.856 -3.185 648 HD1 TRP 114 HD1 TRP 114 4.440 3.306 -2.987 649 HE1 TRP 114 HE1 TRP 114 4.907 5.167 -4.713 650 HE3 TRP 114 HE3 TRP 114 3.980 0.567 -7.278 651 HZ2 TRP 114 HZ2 TRP 114 5.039 5.430 -7.519 652 HZ3 TRP 114 HZ3 TRP 114 4.287 1.696 -9.440 653 HH2 TRP 114 HH2 TRP 114 4.803 4.080 -9.557 654 H ALA 115 H ALA 115 5.900 -0.929 -1.628 655 HA ALA 115 HA ALA 115 4.881 -3.637 -1.942 656 HB1 ALA 115 1HB ALA 115 5.921 -3.987 0.291 657 HB2 ALA 115 2HB ALA 115 6.431 -2.301 0.272 658 HB3 ALA 115 3HB ALA 115 7.055 -3.425 -0.935 659 H ARG 116 H ARG 116 2.920 -4.177 -1.301 660 HA ARG 116 HA ARG 116 1.536 -2.376 0.569 661 HB2 ARG 116 1HB ARG 116 0.261 -4.332 -1.350 662 HB3 ARG 116 2HB ARG 116 -0.561 -3.131 -0.363 663 HG2 ARG 116 1HG ARG 116 -0.563 -2.033 -2.341 664 HG3 ARG 116 2HG ARG 116 0.995 -1.479 -1.727 665 HD2 ARG 116 1HD ARG 116 2.131 -3.204 -3.028 666 HD3 ARG 116 2HD ARG 116 0.576 -3.795 -3.615 667 HE ARG 116 HE ARG 116 1.313 -1.014 -4.151 668 HH11 ARG 116 1HH1 ARG 116 0.808 -4.271 -5.359 669 HH12 ARG 116 2HH1 ARG 116 0.758 -3.770 -7.021 670 HH21 ARG 116 1HH2 ARG 116 1.251 -0.373 -6.347 671 HH22 ARG 116 2HH2 ARG 116 1.007 -1.567 -7.581 672 H ASN 117 H ASN 117 0.311 -3.268 2.254 673 HA ASN 117 HA ASN 117 0.456 -6.150 2.656 674 HB2 ASN 117 1HB ASN 117 2.446 -4.935 3.777 675 HB3 ASN 117 2HB ASN 117 1.247 -4.309 4.903 676 HD21 ASN 117 1HD2 ASN 117 2.955 -7.108 3.797 677 HD22 ASN 117 2HD2 ASN 117 2.517 -8.148 5.108 678 H CYS 118 H CYS 118 -1.558 -6.775 3.098 679 HA CYS 118 HA CYS 118 -3.405 -4.834 4.296 680 HB2 CYS 118 1HB CYS 118 -3.976 -7.424 2.826 681 HB3 CYS 118 2HB CYS 118 -5.193 -6.301 3.431 682 H ASN 119 H ASN 119 -3.748 -5.035 6.427 683 HA ASN 119 HA ASN 119 -3.420 -7.710 7.626 684 HB2 ASN 119 1HB ASN 119 -3.179 -4.974 8.903 685 HB3 ASN 119 2HB ASN 119 -3.008 -6.504 9.755 686 HD21 ASN 119 1HD2 ASN 119 -1.574 -4.323 7.454 687 HD22 ASN 119 2HD2 ASN 119 0.007 -5.027 7.475 688 H ILE 120 H ILE 120 -5.420 -8.569 7.597 689 HA ILE 120 HA ILE 120 -7.341 -7.283 9.383 690 HB ILE 120 HB ILE 120 -8.220 -6.816 7.205 691 HG12 ILE 120 1HG1 ILE 120 -10.369 -8.124 7.272 692 HG13 ILE 120 2HG1 ILE 120 -9.668 -9.082 8.568 693 HG21 ILE 120 1HG2 ILE 120 -8.763 -8.580 5.586 694 HG22 ILE 120 2HG2 ILE 120 -7.952 -9.753 6.624 695 HG23 ILE 120 3HG2 ILE 120 -7.031 -8.438 5.891 696 HD11 ILE 120 1HD1 ILE 120 -10.205 -6.124 8.611 697 HD12 ILE 120 2HD1 ILE 120 -9.424 -7.029 9.905 698 HD13 ILE 120 3HD1 ILE 120 -11.099 -7.372 9.475 699 H GLN 121 H GLN 121 -7.074 -8.632 11.089 700 HA GLN 121 HA GLN 121 -6.282 -11.351 10.716 701 HB2 GLN 121 1HB GLN 121 -5.388 -10.076 12.562 702 HB3 GLN 121 2HB GLN 121 -7.001 -9.794 13.202 703 HG2 GLN 121 1HG GLN 121 -7.252 -12.118 13.746 704 HG3 GLN 121 2HG GLN 121 -5.724 -12.508 12.957 705 HE21 GLN 121 1HE2 GLN 121 -3.805 -12.002 13.967 706 HE22 GLN 121 2HE2 GLN 121 -3.719 -11.554 15.635 707 H SER 122 H SER 122 -9.334 -9.779 11.504 708 HA SER 122 HA SER 122 -10.467 -12.364 12.261 709 HB2 SER 122 1HB SER 122 -11.626 -9.590 12.579 710 HB3 SER 122 2HB SER 122 -12.287 -11.079 13.258 711 HG SER 122 HG SER 122 -9.909 -9.710 13.940 712 H ASP 123 H ASP 123 -10.070 -11.197 9.368 713 HA ASP 123 HA ASP 123 -12.506 -12.333 8.386 714 HB2 ASP 123 1HB ASP 123 -13.237 -10.014 8.958 715 HB3 ASP 123 2HB ASP 123 -12.079 -9.410 7.774 716 H SER 124 H SER 124 -11.373 -13.695 7.120 717 HA SER 124 HA SER 124 -9.153 -13.046 5.541 718 HB2 SER 124 1HB SER 124 -11.181 -15.234 5.029 719 HB3 SER 124 2HB SER 124 -9.508 -15.190 4.470 720 HG SER 124 HG SER 124 -9.850 -16.475 6.391 721 H ALA 125 H ALA 125 -12.540 -12.508 4.968 722 HA ALA 125 HA ALA 125 -12.512 -12.552 2.144 723 HB1 ALA 125 1HB ALA 125 -14.564 -12.775 3.469 724 HB2 ALA 125 2HB ALA 125 -14.684 -11.490 2.266 725 HB3 ALA 125 3HB ALA 125 -14.415 -11.089 3.963 726 H LEU 126 H LEU 126 -12.297 -9.865 4.471 727 HA LEU 126 HA LEU 126 -12.091 -7.805 2.586 728 HB2 LEU 126 1HB LEU 126 -10.871 -7.991 5.338 729 HB3 LEU 126 2HB LEU 126 -10.961 -6.521 4.390 730 HG LEU 126 HG LEU 126 -13.300 -8.085 5.487 731 HD11 LEU 126 1HD1 LEU 126 -12.193 -5.376 6.206 732 HD12 LEU 126 2HD1 LEU 126 -12.106 -6.837 7.190 733 HD13 LEU 126 3HD1 LEU 126 -13.669 -6.092 6.856 734 HD21 LEU 126 1HD2 LEU 126 -13.880 -7.115 3.340 735 HD22 LEU 126 2HD2 LEU 126 -13.256 -5.549 3.858 736 HD23 LEU 126 3HD2 LEU 126 -14.676 -6.235 4.644 737 H GLN 127 H GLN 127 -9.668 -9.966 3.937 738 HA GLN 127 HA GLN 127 -7.435 -8.684 2.755 739 HB2 GLN 127 1HB GLN 127 -6.987 -10.177 4.548 740 HB3 GLN 127 2HB GLN 127 -7.849 -11.491 3.760 741 HG2 GLN 127 1HG GLN 127 -6.144 -11.835 2.199 742 HG3 GLN 127 2HG GLN 127 -5.398 -10.270 2.533 743 HE21 GLN 127 1HE2 GLN 127 -3.411 -11.363 2.845 744 HE22 GLN 127 2HE2 GLN 127 -3.081 -12.197 4.327 745 H GLN 128 H GLN 128 -9.566 -11.299 1.688 746 HA GLN 128 HA GLN 128 -8.223 -12.066 -0.615 747 HB2 GLN 128 1HB GLN 128 -11.189 -11.890 -0.084 748 HB3 GLN 128 2HB GLN 128 -10.505 -12.654 -1.513 749 HG2 GLN 128 1HG GLN 128 -9.988 -13.481 1.334 750 HG3 GLN 128 2HG GLN 128 -11.093 -14.276 0.217 751 HE21 GLN 128 1HE2 GLN 128 -9.370 -13.991 -2.086 752 HE22 GLN 128 2HE2 GLN 128 -8.074 -15.116 -1.870 753 H ALA 129 H ALA 129 -10.504 -9.421 -0.143 754 HA ALA 129 HA ALA 129 -10.404 -8.540 -2.854 755 HB1 ALA 129 1HB ALA 129 -11.316 -7.033 -0.410 756 HB2 ALA 129 2HB ALA 129 -12.323 -8.116 -1.368 757 HB3 ALA 129 3HB ALA 129 -11.683 -6.638 -2.089 758 H CYS 130 H CYS 130 -8.909 -7.425 0.170 759 HA CYS 130 HA CYS 130 -7.678 -5.139 -0.938 760 HB2 CYS 130 1HB CYS 130 -8.085 -5.495 1.492 761 HB3 CYS 130 2HB CYS 130 -6.812 -6.714 1.497 762 H GLU 131 H GLU 131 -6.408 -8.364 -0.210 763 HA GLU 131 HA GLU 131 -3.758 -7.870 -0.995 764 HB2 GLU 131 1HB GLU 131 -4.632 -9.780 0.419 765 HB3 GLU 131 2HB GLU 131 -5.209 -10.521 -1.066 766 HG2 GLU 131 1HG GLU 131 -2.894 -10.583 -1.906 767 HG3 GLU 131 2HG GLU 131 -2.346 -9.916 -0.365 768 H ASP 132 H ASP 132 -6.626 -8.584 -2.779 769 HA ASP 132 HA ASP 132 -5.394 -9.566 -5.146 770 HB2 ASP 132 1HB ASP 132 -7.763 -9.984 -4.565 771 HB3 ASP 132 2HB ASP 132 -8.106 -8.276 -4.796 772 H VAL 133 H VAL 133 -6.720 -6.366 -4.290 773 HA VAL 133 HA VAL 133 -5.793 -5.204 -6.771 774 HB VAL 133 HB VAL 133 -6.997 -3.903 -4.318 775 HG11 VAL 133 1HG1 VAL 133 -6.540 -2.739 -7.065 776 HG12 VAL 133 2HG1 VAL 133 -5.615 -2.340 -5.616 777 HG13 VAL 133 3HG1 VAL 133 -7.329 -1.939 -5.705 778 HG21 VAL 133 1HG2 VAL 133 -8.215 -4.653 -6.974 779 HG22 VAL 133 2HG2 VAL 133 -9.027 -3.746 -5.699 780 HG23 VAL 133 3HG2 VAL 133 -8.542 -5.418 -5.419 781 H PHE 134 H PHE 134 -4.927 -5.073 -3.377 782 HA PHE 134 HA PHE 134 -2.666 -3.334 -3.857 783 HB2 PHE 134 1HB PHE 134 -3.788 -4.534 -1.322 784 HB3 PHE 134 2HB PHE 134 -2.343 -3.532 -1.370 785 HD1 PHE 134 HD1 PHE 134 -5.958 -3.566 -1.448 786 HD2 PHE 134 HD2 PHE 134 -2.508 -1.158 -2.088 787 HE1 PHE 134 HE1 PHE 134 -7.352 -1.540 -1.349 788 HE2 PHE 134 HE2 PHE 134 -3.895 0.869 -1.986 789 HZ PHE 134 HZ PHE 134 -6.322 0.680 -1.621 790 H ARG 135 H ARG 135 -2.755 -5.948 -5.052 791 HA ARG 135 HA ARG 135 -1.504 -8.011 -3.727 792 HB2 ARG 135 1HB ARG 135 -2.581 -8.294 -5.875 793 HB3 ARG 135 2HB ARG 135 -1.427 -7.219 -6.643 794 HG2 ARG 135 1HG ARG 135 -0.958 -9.515 -7.207 795 HG3 ARG 135 2HG ARG 135 0.354 -8.848 -6.237 796 HD2 ARG 135 1HD ARG 135 -0.167 -11.096 -5.503 797 HD3 ARG 135 2HD ARG 135 -0.593 -9.935 -4.248 798 HE ARG 135 HE ARG 135 -2.821 -10.521 -5.916 799 HH11 ARG 135 1HH1 ARG 135 -0.890 -11.825 -3.308 800 HH12 ARG 135 2HH1 ARG 135 -2.200 -12.738 -2.618 801 HH21 ARG 135 1HH2 ARG 135 -4.532 -11.757 -5.046 802 HH22 ARG 135 2HH2 ARG 135 -4.261 -12.730 -3.638 803 H PHE 136 H PHE 136 0.555 -8.672 -3.460 804 HA PHE 136 HA PHE 136 2.643 -6.677 -3.951 805 HB2 PHE 136 1HB PHE 136 3.562 -7.424 -1.634 806 HB3 PHE 136 2HB PHE 136 2.270 -6.233 -1.716 807 HD1 PHE 136 HD1 PHE 136 -0.003 -6.813 -1.039 808 HD2 PHE 136 HD2 PHE 136 3.181 -9.625 -0.719 809 HE1 PHE 136 HE1 PHE 136 -1.368 -8.182 0.481 810 HE2 PHE 136 HE2 PHE 136 1.816 -10.997 0.798 811 HZ PHE 136 HZ PHE 136 -0.459 -10.277 1.399 812 H ASP 137 H ASP 137 4.379 -7.435 -4.885 813 HA ASP 137 HA ASP 137 4.652 -10.277 -5.341 814 HB2 ASP 137 1HB ASP 137 5.115 -8.657 -7.159 815 HB3 ASP 137 2HB ASP 137 6.455 -8.003 -6.218 816 H ASP 138 H ASP 138 6.305 -11.563 -4.695 817 HA ASP 138 HA ASP 138 7.077 -11.315 -2.044 818 HB2 ASP 138 1HB ASP 138 6.885 -13.475 -3.148 819 HB3 ASP 138 2HB ASP 138 8.230 -13.077 -4.212 820 H ALA 139 H ALA 139 8.711 -10.236 -4.919 821 HA ALA 139 HA ALA 139 11.262 -9.949 -3.580 822 HB1 ALA 139 1HB ALA 139 10.396 -8.995 -6.305 823 HB2 ALA 139 2HB ALA 139 11.159 -10.546 -5.955 824 HB3 ALA 139 3HB ALA 139 12.050 -9.047 -5.696 825 H ASN 140 H ASN 140 8.490 -7.987 -4.285 826 HA ASN 140 HA ASN 140 9.987 -5.522 -3.802 827 HB2 ASN 140 1HB ASN 140 8.482 -5.679 -5.780 828 HB3 ASN 140 2HB ASN 140 7.112 -5.860 -4.690 829 HD21 ASN 140 1HD2 ASN 140 6.090 -4.018 -5.339 830 HD22 ASN 140 2HD2 ASN 140 6.689 -2.433 -5.007 831 H LEU 141 H LEU 141 7.612 -7.578 -2.302 832 HA LEU 141 HA LEU 141 6.517 -5.662 -0.551 833 HB2 LEU 141 1HB LEU 141 5.678 -7.560 0.768 834 HB3 LEU 141 2HB LEU 141 5.320 -7.702 -0.935 835 HG LEU 141 HG LEU 141 7.327 -9.297 -1.063 836 HD11 LEU 141 1HD1 LEU 141 6.877 -9.351 1.919 837 HD12 LEU 141 2HD1 LEU 141 8.325 -8.754 1.105 838 HD13 LEU 141 3HD1 LEU 141 7.893 -10.463 1.002 839 HD21 LEU 141 1HD2 LEU 141 4.831 -10.003 0.464 840 HD22 LEU 141 2HD2 LEU 141 5.955 -11.182 -0.206 841 HD23 LEU 141 3HD2 LEU 141 5.079 -10.091 -1.281 842 H VAL 142 H VAL 142 6.950 -5.148 1.581 843 HA VAL 142 HA VAL 142 9.645 -5.684 2.470 844 HB VAL 142 HB VAL 142 8.908 -3.403 2.677 845 HG11 VAL 142 1HG1 VAL 142 6.517 -3.692 2.792 846 HG12 VAL 142 2HG1 VAL 142 7.063 -2.751 4.180 847 HG13 VAL 142 3HG1 VAL 142 6.653 -4.454 4.377 848 HG21 VAL 142 1HG2 VAL 142 9.018 -4.680 5.405 849 HG22 VAL 142 2HG2 VAL 142 9.355 -2.989 5.029 850 HG23 VAL 142 3HG2 VAL 142 10.409 -4.259 4.408 851 HA PRO 143 HA PRO 143 8.183 -9.191 4.812 852 HB2 PRO 143 1HB PRO 143 10.887 -9.088 5.970 853 HB3 PRO 143 2HB PRO 143 10.089 -10.394 5.096 854 HG2 PRO 143 1HG PRO 143 12.075 -8.961 3.995 855 HG3 PRO 143 2HG PRO 143 10.723 -9.589 3.036 856 HD2 PRO 143 1HD PRO 143 11.213 -6.810 4.030 857 HD3 PRO 143 2HD PRO 143 10.529 -7.360 2.487 858 H ARG 144 H ARG 144 7.264 -9.333 6.744 859 HA ARG 144 HA ARG 144 8.127 -7.515 8.889 860 HB2 ARG 144 1HB ARG 144 5.259 -8.198 8.186 861 HB3 ARG 144 2HB ARG 144 5.780 -7.184 9.523 862 HG2 ARG 144 1HG ARG 144 6.583 -5.503 8.025 863 HG3 ARG 144 2HG ARG 144 6.301 -6.546 6.629 864 HD2 ARG 144 1HD ARG 144 4.531 -4.909 6.804 865 HD3 ARG 144 2HD ARG 144 3.890 -6.516 7.127 866 HE ARG 144 HE ARG 144 4.572 -4.637 9.297 867 HH11 ARG 144 1HH1 ARG 144 2.352 -6.874 7.767 868 HH12 ARG 144 2HH1 ARG 144 1.155 -6.743 9.016 869 HH21 ARG 144 1HH2 ARG 144 2.993 -4.473 10.951 870 HH22 ARG 144 2HH2 ARG 144 1.524 -5.387 10.826 871 H GLY 145 H GLY 145 7.996 -8.413 10.996 872 HA2 GLY 145 1HA GLY 145 6.908 -11.038 11.387 873 HA3 GLY 145 2HA GLY 145 8.659 -11.057 11.261 874 H SER 146 H SER 146 7.957 -11.990 13.516 875 HA SER 146 HA SER 146 7.388 -9.958 15.502 876 HB2 SER 146 1HB SER 146 7.680 -12.033 17.043 877 HB3 SER 146 2HB SER 146 6.287 -11.973 15.963 878 HG SER 146 HG SER 146 8.005 -13.888 16.095 879 H GLY 147 H GLY 147 8.916 -8.797 16.449 880 HA2 GLY 147 1HA GLY 147 10.884 -8.406 17.643 881 HA3 GLY 147 2HA GLY 147 11.427 -10.026 17.230 882 H LEU 148 H LEU 148 10.477 -8.927 14.374 883 HA LEU 148 HA LEU 148 13.203 -8.324 13.616 884 HB2 LEU 148 1HB LEU 148 10.720 -8.596 11.916 885 HB3 LEU 148 2HB LEU 148 12.355 -8.436 11.306 886 HG LEU 148 HG LEU 148 11.254 -10.767 12.878 887 HD11 LEU 148 1HD1 LEU 148 11.571 -12.008 10.820 888 HD12 LEU 148 2HD1 LEU 148 12.170 -10.560 10.014 889 HD13 LEU 148 3HD1 LEU 148 10.494 -10.639 10.551 890 HD21 LEU 148 1HD2 LEU 148 14.021 -10.270 11.784 891 HD22 LEU 148 2HD2 LEU 148 13.438 -11.826 12.372 892 HD23 LEU 148 3HD2 LEU 148 13.566 -10.461 13.478 893 H GLU 149 H GLU 149 13.476 -6.298 14.542 894 HA GLU 149 HA GLU 149 11.908 -4.048 13.686 895 HB2 GLU 149 1HB GLU 149 13.128 -4.112 15.859 896 HB3 GLU 149 2HB GLU 149 14.649 -4.167 14.986 897 HG2 GLU 149 1HG GLU 149 12.730 -1.887 14.664 898 HG3 GLU 149 2HG GLU 149 13.905 -1.945 15.971 899 H HIS 150 H HIS 150 15.079 -5.403 12.965 900 HA HIS 150 HA HIS 150 15.087 -3.915 10.426 901 HB2 HIS 150 1HB HIS 150 17.489 -4.103 10.386 902 HB3 HIS 150 2HB HIS 150 17.032 -3.480 11.963 903 HD1 HIS 150 HD1 HIS 150 18.579 -6.428 10.279 904 HD2 HIS 150 HD2 HIS 150 17.562 -5.205 14.123 905 HE1 HIS 150 HE1 HIS 150 19.715 -8.047 11.830 906 HE2 HIS 150 HE2 HIS 150 19.026 -7.340 14.148 907 H HIS 151 H HIS 151 16.392 -5.256 8.707 908 HA HIS 151 HA HIS 151 15.015 -7.847 8.647 909 HB2 HIS 151 1HB HIS 151 16.095 -6.122 6.413 910 HB3 HIS 151 2HB HIS 151 15.451 -7.744 6.170 911 HD1 HIS 151 HD1 HIS 151 14.429 -4.232 6.583 912 HD2 HIS 151 HD2 HIS 151 12.644 -7.980 6.733 913 HE1 HIS 151 HE1 HIS 151 11.953 -3.805 6.467 914 HE2 HIS 151 HE2 HIS 151 10.898 -6.073 6.792 915 H HIS 152 H HIS 152 16.132 -9.679 7.700 916 HA HIS 152 HA HIS 152 19.037 -9.576 7.722 917 HB2 HIS 152 1HB HIS 152 18.358 -9.979 10.093 918 HB3 HIS 152 2HB HIS 152 17.516 -11.433 9.572 919 HD1 HIS 152 HD1 HIS 152 18.865 -13.534 9.418 920 HD2 HIS 152 HD2 HIS 152 21.246 -10.150 9.777 921 HE1 HIS 152 HE1 HIS 152 21.202 -14.386 9.737 922 HE2 HIS 152 HE2 HIS 152 22.648 -12.327 9.689 923 H HIS 153 H HIS 153 18.436 -9.976 5.450 924 HA HIS 153 HA HIS 153 17.448 -12.653 4.852 925 HB2 HIS 153 1HB HIS 153 18.244 -10.334 3.090 926 HB3 HIS 153 2HB HIS 153 17.792 -11.910 2.453 927 HD1 HIS 153 HD1 HIS 153 16.292 -8.936 2.385 928 HD2 HIS 153 HD2 HIS 153 15.140 -12.449 4.279 929 HE1 HIS 153 HE1 HIS 153 13.797 -8.780 2.647 930 HE2 HIS 153 HE2 HIS 153 13.111 -11.003 3.608 931 H HIS 154 H HIS 154 20.386 -11.028 5.304 932 HA HIS 154 HA HIS 154 21.868 -13.255 4.078 933 HB2 HIS 154 1HB HIS 154 22.837 -10.444 4.655 934 HB3 HIS 154 2HB HIS 154 23.778 -11.724 3.894 935 HD1 HIS 154 HD1 HIS 154 21.383 -9.040 3.164 936 HD2 HIS 154 HD2 HIS 154 22.838 -12.436 1.259 937 HE1 HIS 154 HE1 HIS 154 20.719 -8.799 0.753 938 HE2 HIS 154 HE2 HIS 154 21.443 -10.951 -0.335 939 H HIS 155 H HIS 155 23.435 -14.278 5.308 940 HA HIS 155 HA HIS 155 22.819 -14.467 8.052 941 HB2 HIS 155 1HB HIS 155 23.710 -16.329 6.645 942 HB3 HIS 155 2HB HIS 155 25.279 -15.530 6.652 943 HD1 HIS 155 HD1 HIS 155 23.009 -17.591 8.747 944 HD2 HIS 155 HD2 HIS 155 26.657 -15.638 9.125 945 HE1 HIS 155 HE1 HIS 155 24.016 -18.446 10.885 946 HE2 HIS 155 HE2 HIS 155 26.282 -17.353 11.020 Start of MODEL 10 1 H1 MET 24 1H MET 24 -18.860 -15.088 -1.663 2 H2 MET 24 2H MET 24 -18.677 -14.999 -3.342 3 H3 MET 24 3H MET 24 -19.240 -13.658 -2.481 4 HA MET 24 HA MET 24 -17.148 -13.445 -1.344 5 HB2 MET 24 1HB MET 24 -15.243 -14.817 -1.953 6 HB3 MET 24 2HB MET 24 -16.557 -15.844 -1.397 7 HG2 MET 24 1HG MET 24 -17.117 -16.388 -3.702 8 HG3 MET 24 2HG MET 24 -15.819 -15.343 -4.271 9 HE1 MET 24 1HE MET 24 -16.143 -18.354 -5.184 10 HE2 MET 24 2HE MET 24 -14.484 -18.939 -5.073 11 HE3 MET 24 3HE MET 24 -14.810 -17.333 -5.726 12 H GLU 25 H GLU 25 -18.491 -13.367 -4.385 13 HA GLU 25 HA GLU 25 -16.194 -12.119 -5.665 14 HB2 GLU 25 1HB GLU 25 -18.943 -12.727 -6.761 15 HB3 GLU 25 2HB GLU 25 -17.582 -12.119 -7.694 16 HG2 GLU 25 1HG GLU 25 -16.332 -14.170 -7.165 17 HG3 GLU 25 2HG GLU 25 -17.737 -14.780 -6.293 18 H ASN 26 H ASN 26 -16.202 -10.303 -4.187 19 HA ASN 26 HA ASN 26 -18.396 -8.407 -4.466 20 HB2 ASN 26 1HB ASN 26 -15.841 -8.252 -2.838 21 HB3 ASN 26 2HB ASN 26 -17.108 -7.030 -2.835 22 HD21 ASN 26 1HD2 ASN 26 -19.069 -7.469 -1.818 23 HD22 ASN 26 2HD2 ASN 26 -19.252 -8.790 -0.713 24 H TYR 27 H TYR 27 -17.850 -8.370 -6.815 25 HA TYR 27 HA TYR 27 -15.435 -7.359 -7.808 26 HB2 TYR 27 1HB TYR 27 -16.625 -7.039 -9.919 27 HB3 TYR 27 2HB TYR 27 -17.030 -8.590 -9.201 28 HD1 TYR 27 HD1 TYR 27 -19.252 -8.703 -7.855 29 HD2 TYR 27 HD2 TYR 27 -18.310 -5.588 -10.601 30 HE1 TYR 27 HE1 TYR 27 -21.640 -8.153 -8.047 31 HE2 TYR 27 HE2 TYR 27 -20.697 -5.033 -10.794 32 HH TYR 27 HH TYR 27 -23.052 -6.288 -8.661 33 H LEU 28 H LEU 28 -18.359 -5.722 -6.755 34 HA LEU 28 HA LEU 28 -17.678 -3.154 -7.729 35 HB2 LEU 28 1HB LEU 28 -19.465 -3.997 -5.446 36 HB3 LEU 28 2HB LEU 28 -19.322 -2.344 -6.008 37 HG LEU 28 HG LEU 28 -20.254 -4.622 -7.759 38 HD11 LEU 28 1HD1 LEU 28 -21.898 -2.563 -6.293 39 HD12 LEU 28 2HD1 LEU 28 -21.804 -4.277 -5.890 40 HD13 LEU 28 3HD1 LEU 28 -22.505 -3.769 -7.426 41 HD21 LEU 28 1HD2 LEU 28 -20.397 -1.626 -8.084 42 HD22 LEU 28 2HD2 LEU 28 -21.048 -2.824 -9.204 43 HD23 LEU 28 3HD2 LEU 28 -19.308 -2.708 -8.951 44 H ARG 29 H ARG 29 -17.212 -4.723 -4.581 45 HA ARG 29 HA ARG 29 -15.878 -2.554 -3.375 46 HB2 ARG 29 1HB ARG 29 -16.790 -4.349 -2.019 47 HB3 ARG 29 2HB ARG 29 -15.717 -5.515 -2.779 48 HG2 ARG 29 1HG ARG 29 -13.821 -4.619 -1.727 49 HG3 ARG 29 2HG ARG 29 -14.682 -3.160 -1.238 50 HD2 ARG 29 1HD ARG 29 -14.416 -4.543 0.689 51 HD3 ARG 29 2HD ARG 29 -16.115 -4.577 0.223 52 HE ARG 29 HE ARG 29 -14.589 -6.755 -0.865 53 HH11 ARG 29 1HH1 ARG 29 -16.477 -5.630 1.851 54 HH12 ARG 29 2HH1 ARG 29 -16.727 -7.211 2.511 55 HH21 ARG 29 1HH2 ARG 29 -14.918 -8.871 0.010 56 HH22 ARG 29 2HH2 ARG 29 -15.847 -9.055 1.463 57 H LYS 30 H LYS 30 -14.763 -5.258 -5.330 58 HA LYS 30 HA LYS 30 -12.007 -4.901 -5.048 59 HB2 LYS 30 1HB LYS 30 -13.645 -5.887 -7.384 60 HB3 LYS 30 2HB LYS 30 -11.889 -5.870 -7.402 61 HG2 LYS 30 1HG LYS 30 -13.576 -7.368 -5.404 62 HG3 LYS 30 2HG LYS 30 -12.834 -8.074 -6.839 63 HD2 LYS 30 1HD LYS 30 -10.617 -7.343 -5.963 64 HD3 LYS 30 2HD LYS 30 -11.424 -6.841 -4.477 65 HE2 LYS 30 1HE LYS 30 -10.492 -9.027 -4.135 66 HE3 LYS 30 2HE LYS 30 -12.247 -9.171 -4.200 67 HZ1 LYS 30 1HZ LYS 30 -12.012 -9.856 -6.544 68 HZ2 LYS 30 2HZ LYS 30 -11.255 -10.919 -5.472 69 HZ3 LYS 30 3HZ LYS 30 -10.324 -9.831 -6.375 70 H ALA 31 H ALA 31 -14.182 -3.528 -7.575 71 HA ALA 31 HA ALA 31 -12.305 -1.826 -8.693 72 HB1 ALA 31 1HB ALA 31 -14.189 -0.656 -9.663 73 HB2 ALA 31 2HB ALA 31 -15.282 -1.416 -8.504 74 HB3 ALA 31 3HB ALA 31 -14.457 -2.398 -9.714 75 H ALA 32 H ALA 32 -14.347 -1.371 -5.861 76 HA ALA 32 HA ALA 32 -14.011 1.415 -5.597 77 HB1 ALA 32 1HB ALA 32 -14.414 -0.598 -3.386 78 HB2 ALA 32 2HB ALA 32 -15.703 0.111 -4.358 79 HB3 ALA 32 3HB ALA 32 -14.730 1.134 -3.302 80 H LEU 33 H LEU 33 -12.232 -1.313 -4.244 81 HA LEU 33 HA LEU 33 -10.280 0.217 -2.885 82 HB2 LEU 33 1HB LEU 33 -10.036 -2.583 -3.999 83 HB3 LEU 33 2HB LEU 33 -9.043 -1.874 -2.733 84 HG LEU 33 HG LEU 33 -12.005 -2.438 -2.519 85 HD11 LEU 33 1HD1 LEU 33 -10.724 -4.486 -2.591 86 HD12 LEU 33 2HD1 LEU 33 -11.343 -4.199 -0.964 87 HD13 LEU 33 3HD1 LEU 33 -9.648 -3.882 -1.330 88 HD21 LEU 33 1HD2 LEU 33 -10.036 -1.489 -0.444 89 HD22 LEU 33 2HD2 LEU 33 -11.719 -1.926 -0.151 90 HD23 LEU 33 3HD2 LEU 33 -11.332 -0.534 -1.163 91 H THR 34 H THR 34 -10.558 -1.052 -6.134 92 HA THR 34 HA THR 34 -7.979 -0.465 -7.067 93 HB THR 34 HB THR 34 -10.612 -0.508 -8.550 94 HG1 THR 34 HG1 THR 34 -10.064 -2.523 -7.665 95 HG21 THR 34 1HG2 THR 34 -7.791 -0.512 -9.624 96 HG22 THR 34 2HG2 THR 34 -8.991 0.763 -9.830 97 HG23 THR 34 3HG2 THR 34 -9.240 -0.812 -10.582 98 H ASP 35 H ASP 35 -10.948 1.471 -6.972 99 HA ASP 35 HA ASP 35 -9.924 3.724 -8.325 100 HB2 ASP 35 1HB ASP 35 -12.264 3.224 -6.538 101 HB3 ASP 35 2HB ASP 35 -11.791 4.892 -6.840 102 H MET 36 H MET 36 -10.008 2.816 -4.925 103 HA MET 36 HA MET 36 -8.966 5.263 -3.948 104 HB2 MET 36 1HB MET 36 -8.857 2.504 -2.722 105 HB3 MET 36 2HB MET 36 -8.450 3.993 -1.888 106 HG2 MET 36 1HG MET 36 -11.151 3.333 -3.040 107 HG3 MET 36 2HG MET 36 -10.698 3.180 -1.344 108 HE1 MET 36 1HE MET 36 -10.677 5.895 -4.303 109 HE2 MET 36 2HE MET 36 -11.852 6.995 -3.589 110 HE3 MET 36 3HE MET 36 -12.310 5.334 -3.964 111 H LEU 37 H LEU 37 -7.432 2.213 -4.904 112 HA LEU 37 HA LEU 37 -4.790 2.973 -4.308 113 HB2 LEU 37 1HB LEU 37 -5.400 0.665 -4.795 114 HB3 LEU 37 2HB LEU 37 -5.838 1.108 -6.441 115 HG LEU 37 HG LEU 37 -3.409 1.784 -6.772 116 HD11 LEU 37 1HD1 LEU 37 -2.773 1.950 -4.423 117 HD12 LEU 37 2HD1 LEU 37 -1.769 0.775 -5.272 118 HD13 LEU 37 3HD1 LEU 37 -3.070 0.224 -4.214 119 HD21 LEU 37 1HD2 LEU 37 -2.705 -0.475 -7.232 120 HD22 LEU 37 2HD2 LEU 37 -4.414 -0.297 -7.635 121 HD23 LEU 37 3HD2 LEU 37 -3.939 -1.114 -6.147 122 H GLN 38 H GLN 38 -6.756 3.355 -7.229 123 HA GLN 38 HA GLN 38 -4.726 4.505 -8.822 124 HB2 GLN 38 1HB GLN 38 -7.731 4.728 -9.019 125 HB3 GLN 38 2HB GLN 38 -6.616 5.329 -10.238 126 HG2 GLN 38 1HG GLN 38 -7.031 2.469 -9.406 127 HG3 GLN 38 2HG GLN 38 -7.478 3.214 -10.939 128 HE21 GLN 38 1HE2 GLN 38 -4.903 1.913 -9.030 129 HE22 GLN 38 2HE2 GLN 38 -3.708 1.893 -10.280 130 H THR 39 H THR 39 -6.987 5.845 -6.516 131 HA THR 39 HA THR 39 -6.427 8.582 -7.164 132 HB THR 39 HB THR 39 -7.625 7.456 -4.622 133 HG1 THR 39 HG1 THR 39 -8.852 6.841 -6.447 134 HG21 THR 39 1HG2 THR 39 -7.803 10.210 -5.856 135 HG22 THR 39 2HG2 THR 39 -6.884 9.785 -4.412 136 HG23 THR 39 3HG2 THR 39 -8.645 9.677 -4.401 137 H PHE 40 H PHE 40 -5.049 6.172 -5.059 138 HA PHE 40 HA PHE 40 -3.451 7.960 -3.532 139 HB2 PHE 40 1HB PHE 40 -3.962 5.660 -2.773 140 HB3 PHE 40 2HB PHE 40 -2.986 5.024 -4.096 141 HD1 PHE 40 HD1 PHE 40 -1.072 4.088 -3.267 142 HD2 PHE 40 HD2 PHE 40 -2.426 7.779 -1.635 143 HE1 PHE 40 HE1 PHE 40 0.955 4.219 -1.888 144 HE2 PHE 40 HE2 PHE 40 -0.402 7.914 -0.248 145 HZ PHE 40 HZ PHE 40 1.297 6.134 -0.375 146 H VAL 41 H VAL 41 -3.046 6.328 -6.600 147 HA VAL 41 HA VAL 41 -0.357 6.476 -7.047 148 HB VAL 41 HB VAL 41 -2.576 6.917 -9.033 149 HG11 VAL 41 1HG1 VAL 41 -0.509 7.885 -9.898 150 HG12 VAL 41 2HG1 VAL 41 -0.943 6.417 -10.776 151 HG13 VAL 41 3HG1 VAL 41 0.338 6.374 -9.564 152 HG21 VAL 41 1HG2 VAL 41 -2.576 4.748 -7.916 153 HG22 VAL 41 2HG2 VAL 41 -0.893 4.505 -8.386 154 HG23 VAL 41 3HG2 VAL 41 -2.149 4.590 -9.620 155 HA PRO 42 HA PRO 42 -0.729 11.117 -8.658 156 HB2 PRO 42 1HB PRO 42 -2.998 11.962 -6.935 157 HB3 PRO 42 2HB PRO 42 -2.570 12.478 -8.572 158 HG2 PRO 42 1HG PRO 42 -4.609 10.816 -8.155 159 HG3 PRO 42 2HG PRO 42 -3.539 10.624 -9.556 160 HD2 PRO 42 1HD PRO 42 -3.636 9.063 -7.012 161 HD3 PRO 42 2HD PRO 42 -3.312 8.513 -8.665 162 H TYR 43 H TYR 43 -1.555 10.054 -5.359 163 HA TYR 43 HA TYR 43 -0.163 12.234 -4.111 164 HB2 TYR 43 1HB TYR 43 -1.239 9.608 -3.054 165 HB3 TYR 43 2HB TYR 43 -0.397 10.785 -2.040 166 HD1 TYR 43 HD1 TYR 43 -1.563 12.576 -1.084 167 HD2 TYR 43 HD2 TYR 43 -3.365 10.387 -4.254 168 HE1 TYR 43 HE1 TYR 43 -3.670 13.790 -0.720 169 HE2 TYR 43 HE2 TYR 43 -5.473 11.590 -3.895 170 HH TYR 43 HH TYR 43 -6.620 12.871 -2.317 171 H ARG 44 H ARG 44 0.584 9.001 -5.188 172 HA ARG 44 HA ARG 44 3.019 8.633 -3.855 173 HB2 ARG 44 1HB ARG 44 2.243 7.626 -6.592 174 HB3 ARG 44 2HB ARG 44 3.587 7.032 -5.629 175 HG2 ARG 44 1HG ARG 44 1.934 6.375 -3.878 176 HG3 ARG 44 2HG ARG 44 0.655 6.785 -5.026 177 HD2 ARG 44 1HD ARG 44 2.757 4.637 -5.263 178 HD3 ARG 44 2HD ARG 44 1.004 4.439 -5.235 179 HE ARG 44 HE ARG 44 1.904 6.031 -7.439 180 HH11 ARG 44 1HH1 ARG 44 1.439 2.744 -6.329 181 HH12 ARG 44 2HH1 ARG 44 1.357 2.086 -7.930 182 HH21 ARG 44 1HH2 ARG 44 1.804 5.168 -9.541 183 HH22 ARG 44 2HH2 ARG 44 1.547 3.465 -9.760 184 H THR 45 H THR 45 2.289 10.188 -6.973 185 HA THR 45 HA THR 45 4.732 11.012 -7.771 186 HB THR 45 HB THR 45 2.416 12.937 -7.621 187 HG1 THR 45 HG1 THR 45 2.795 10.677 -9.316 188 HG21 THR 45 1HG2 THR 45 4.503 13.812 -8.555 189 HG22 THR 45 2HG2 THR 45 3.262 13.674 -9.801 190 HG23 THR 45 3HG2 THR 45 4.555 12.476 -9.705 191 H ALA 46 H ALA 46 2.789 12.592 -5.227 192 HA ALA 46 HA ALA 46 4.654 14.622 -4.615 193 HB1 ALA 46 1HB ALA 46 2.574 13.344 -2.838 194 HB2 ALA 46 2HB ALA 46 2.323 14.734 -3.894 195 HB3 ALA 46 3HB ALA 46 3.411 14.863 -2.512 196 H VAL 47 H VAL 47 4.276 11.334 -3.621 197 HA VAL 47 HA VAL 47 6.183 11.322 -1.500 198 HB VAL 47 HB VAL 47 5.244 9.017 -3.223 199 HG11 VAL 47 1HG1 VAL 47 6.708 8.982 -0.580 200 HG12 VAL 47 2HG1 VAL 47 7.375 8.510 -2.143 201 HG13 VAL 47 3HG1 VAL 47 6.067 7.570 -1.422 202 HG21 VAL 47 1HG2 VAL 47 3.413 10.054 -2.017 203 HG22 VAL 47 2HG2 VAL 47 4.324 9.965 -0.510 204 HG23 VAL 47 3HG2 VAL 47 3.792 8.485 -1.308 205 H GLU 48 H GLU 48 6.370 10.433 -4.941 206 HA GLU 48 HA GLU 48 9.127 9.798 -4.915 207 HB2 GLU 48 1HB GLU 48 7.419 10.730 -7.238 208 HB3 GLU 48 2HB GLU 48 9.020 10.024 -7.375 209 HG2 GLU 48 1HG GLU 48 8.077 7.971 -6.249 210 HG3 GLU 48 2HG GLU 48 6.484 8.697 -6.471 211 H LEU 49 H LEU 49 7.365 12.794 -5.509 212 HA LEU 49 HA LEU 49 9.497 14.419 -6.299 213 HB2 LEU 49 1HB LEU 49 6.835 14.826 -5.107 214 HB3 LEU 49 2HB LEU 49 7.980 16.112 -4.781 215 HG LEU 49 HG LEU 49 6.548 16.554 -6.748 216 HD11 LEU 49 1HD1 LEU 49 8.751 17.589 -6.547 217 HD12 LEU 49 2HD1 LEU 49 8.326 17.279 -8.230 218 HD13 LEU 49 3HD1 LEU 49 9.470 16.223 -7.402 219 HD21 LEU 49 1HD2 LEU 49 6.900 15.326 -8.815 220 HD22 LEU 49 2HD2 LEU 49 6.319 14.248 -7.545 221 HD23 LEU 49 3HD2 LEU 49 8.025 14.241 -7.998 222 H CYS 50 H CYS 50 8.299 13.588 -3.089 223 HA CYS 50 HA CYS 50 10.215 15.073 -1.643 224 HB2 CYS 50 1HB CYS 50 8.280 14.381 -0.473 225 HB3 CYS 50 2HB CYS 50 8.484 12.704 -0.959 226 H ALA 51 H ALA 51 10.069 11.557 -2.241 227 HA ALA 51 HA ALA 51 12.508 10.893 -1.128 228 HB1 ALA 51 1HB ALA 51 10.798 9.261 -1.746 229 HB2 ALA 51 2HB ALA 51 12.380 8.819 -2.383 230 HB3 ALA 51 3HB ALA 51 11.166 9.523 -3.452 231 H LEU 52 H LEU 52 11.896 12.043 -4.413 232 HA LEU 52 HA LEU 52 14.590 11.438 -5.246 233 HB2 LEU 52 1HB LEU 52 12.179 12.583 -6.562 234 HB3 LEU 52 2HB LEU 52 13.739 12.945 -7.265 235 HG LEU 52 HG LEU 52 12.666 11.031 -8.356 236 HD11 LEU 52 1HD1 LEU 52 15.096 11.133 -8.313 237 HD12 LEU 52 2HD1 LEU 52 14.534 9.464 -8.232 238 HD13 LEU 52 3HD1 LEU 52 15.118 10.267 -6.777 239 HD21 LEU 52 1HD2 LEU 52 11.383 10.158 -6.493 240 HD22 LEU 52 2HD2 LEU 52 12.867 9.702 -5.659 241 HD23 LEU 52 3HD2 LEU 52 12.422 8.902 -7.166 242 H GLU 53 H GLU 53 12.750 14.431 -4.629 243 HA GLU 53 HA GLU 53 14.997 16.089 -5.278 244 HB2 GLU 53 1HB GLU 53 12.700 16.872 -5.608 245 HB3 GLU 53 2HB GLU 53 12.408 16.778 -3.878 246 HG2 GLU 53 1HG GLU 53 14.092 18.510 -3.502 247 HG3 GLU 53 2HG GLU 53 14.372 18.608 -5.238 248 H HIS 54 H HIS 54 13.511 14.933 -2.309 249 HA HIS 54 HA HIS 54 15.395 16.455 -0.681 250 HB2 HIS 54 1HB HIS 54 13.125 14.615 0.098 251 HB3 HIS 54 2HB HIS 54 14.163 15.443 1.250 252 HD1 HIS 54 HD1 HIS 54 13.245 17.577 2.085 253 HD2 HIS 54 HD2 HIS 54 11.734 16.616 -1.666 254 HE1 HIS 54 HE1 HIS 54 11.545 19.354 1.566 255 HE2 HIS 54 HE2 HIS 54 10.514 18.641 -0.621 256 H GLY 55 H GLY 55 15.411 13.589 -2.304 257 HA2 GLY 55 1HA GLY 55 16.654 11.666 -2.219 258 HA3 GLY 55 2HA GLY 55 17.826 12.650 -1.362 259 H GLY 56 H GLY 56 14.620 11.924 -0.063 260 HA2 GLY 56 1HA GLY 56 15.872 10.198 1.898 261 HA3 GLY 56 2HA GLY 56 15.219 11.710 2.520 262 H LEU 57 H LEU 57 14.414 8.641 2.580 263 HA LEU 57 HA LEU 57 11.602 8.965 2.041 264 HB2 LEU 57 1HB LEU 57 13.074 6.936 3.739 265 HB3 LEU 57 2HB LEU 57 11.345 6.908 3.436 266 HG LEU 57 HG LEU 57 13.479 6.640 1.315 267 HD11 LEU 57 1HD1 LEU 57 13.397 4.705 2.812 268 HD12 LEU 57 2HD1 LEU 57 12.804 4.308 1.201 269 HD13 LEU 57 3HD1 LEU 57 11.663 4.558 2.522 270 HD21 LEU 57 1HD2 LEU 57 10.475 6.410 1.178 271 HD22 LEU 57 2HD2 LEU 57 11.580 5.949 -0.116 272 HD23 LEU 57 3HD2 LEU 57 11.479 7.632 0.397 273 H ASP 58 H ASP 58 13.826 9.526 4.604 274 HA ASP 58 HA ASP 58 12.127 9.681 6.805 275 HB2 ASP 58 1HB ASP 58 14.771 10.987 6.213 276 HB3 ASP 58 2HB ASP 58 13.943 11.205 7.752 277 H THR 59 H THR 59 12.763 11.994 4.288 278 HA THR 59 HA THR 59 11.628 14.201 5.731 279 HB THR 59 HB THR 59 11.814 15.328 3.459 280 HG1 THR 59 HG1 THR 59 11.784 13.293 2.263 281 HG21 THR 59 1HG2 THR 59 14.297 14.064 4.627 282 HG22 THR 59 2HG2 THR 59 13.552 15.572 5.159 283 HG23 THR 59 3HG2 THR 59 14.267 15.461 3.551 284 H CYS 60 H CYS 60 10.333 11.557 4.146 285 HA CYS 60 HA CYS 60 8.152 13.022 2.901 286 HB2 CYS 60 1HB CYS 60 8.751 10.060 2.895 287 HB3 CYS 60 2HB CYS 60 7.533 10.870 1.916 288 H ASP 61 H ASP 61 7.753 13.594 5.319 289 HA ASP 61 HA ASP 61 5.938 11.648 6.542 290 HB2 ASP 61 1HB ASP 61 7.488 12.634 8.090 291 HB3 ASP 61 2HB ASP 61 7.114 14.257 7.519 292 H GLY 62 H GLY 62 3.772 12.009 6.788 293 HA2 GLY 62 1HA GLY 62 2.569 13.794 4.881 294 HA3 GLY 62 2HA GLY 62 1.719 12.722 5.987 295 H GLY 63 H GLY 63 2.938 15.900 5.452 296 HA2 GLY 63 1HA GLY 63 1.579 17.638 6.639 297 HA3 GLY 63 2HA GLY 63 1.936 16.725 8.100 298 H SER 64 H SER 64 4.632 16.490 6.241 299 HA SER 64 HA SER 64 5.794 19.006 7.196 300 HB2 SER 64 1HB SER 64 7.166 16.327 7.514 301 HB3 SER 64 2HB SER 64 7.694 17.885 8.150 302 HG SER 64 HG SER 64 5.760 16.122 9.089 303 H ASN 65 H ASN 65 8.042 19.317 6.201 304 HA ASN 65 HA ASN 65 9.288 19.670 4.338 305 HB2 ASN 65 1HB ASN 65 8.651 16.752 4.130 306 HB3 ASN 65 2HB ASN 65 9.535 17.546 2.834 307 HD21 ASN 65 1HD2 ASN 65 9.632 16.548 6.177 308 HD22 ASN 65 2HD2 ASN 65 11.339 16.765 6.394 309 H GLY 66 H GLY 66 6.525 20.425 4.109 310 HA2 GLY 66 1HA GLY 66 5.416 21.513 2.377 311 HA3 GLY 66 2HA GLY 66 6.470 20.700 1.226 312 H ILE 67 H ILE 67 5.592 18.161 2.886 313 HA ILE 67 HA ILE 67 3.531 17.420 1.031 314 HB ILE 67 HB ILE 67 4.651 15.898 3.392 315 HG12 ILE 67 1HG1 ILE 67 5.296 15.740 0.440 316 HG13 ILE 67 2HG1 ILE 67 6.358 16.367 1.699 317 HG21 ILE 67 1HG2 ILE 67 2.426 15.110 2.755 318 HG22 ILE 67 2HG2 ILE 67 3.663 13.920 2.347 319 HG23 ILE 67 3HG2 ILE 67 2.963 14.931 1.084 320 HD11 ILE 67 1HD1 ILE 67 7.016 14.133 1.059 321 HD12 ILE 67 2HD1 ILE 67 5.402 13.528 1.436 322 HD13 ILE 67 3HD1 ILE 67 6.433 14.150 2.722 323 HA PRO 68 HA PRO 68 0.352 18.981 3.748 324 HB2 PRO 68 1HB PRO 68 -1.550 17.610 1.998 325 HB3 PRO 68 2HB PRO 68 -1.355 19.337 2.298 326 HG2 PRO 68 1HG PRO 68 -0.687 18.195 -0.057 327 HG3 PRO 68 2HG PRO 68 0.176 19.598 0.607 328 HD2 PRO 68 1HD PRO 68 0.960 16.703 0.618 329 HD3 PRO 68 2HD PRO 68 1.967 18.146 0.343 330 H SER 69 H SER 69 -0.660 18.175 5.465 331 HA SER 69 HA SER 69 -0.585 15.671 6.467 332 HB2 SER 69 1HB SER 69 -2.936 17.557 6.727 333 HB3 SER 69 2HB SER 69 -2.497 16.276 7.857 334 HG SER 69 HG SER 69 -1.424 18.795 7.532 335 HA PRO 70 HA PRO 70 -2.642 13.097 3.582 336 HB2 PRO 70 1HB PRO 70 -3.294 11.049 5.320 337 HB3 PRO 70 2HB PRO 70 -1.725 11.249 4.536 338 HG2 PRO 70 1HG PRO 70 -2.584 12.022 7.291 339 HG3 PRO 70 2HG PRO 70 -1.048 11.318 6.747 340 HD2 PRO 70 1HD PRO 70 -1.253 13.928 7.311 341 HD3 PRO 70 2HD PRO 70 -0.245 13.354 5.966 342 H THR 71 H THR 71 -4.598 13.262 2.801 343 HA THR 71 HA THR 71 -6.817 13.913 4.583 344 HB THR 71 HB THR 71 -6.370 15.396 2.627 345 HG1 THR 71 HG1 THR 71 -8.676 15.068 1.759 346 HG21 THR 71 1HG2 THR 71 -6.976 14.616 0.377 347 HG22 THR 71 2HG2 THR 71 -7.202 12.986 1.010 348 HG23 THR 71 3HG2 THR 71 -5.601 13.725 1.027 349 H THR 72 H THR 72 -8.984 12.960 3.839 350 HA THR 72 HA THR 72 -8.600 10.137 3.115 351 HB THR 72 HB THR 72 -10.474 9.590 4.706 352 HG1 THR 72 HG1 THR 72 -9.869 12.197 5.710 353 HG21 THR 72 1HG2 THR 72 -9.043 9.582 6.701 354 HG22 THR 72 2HG2 THR 72 -7.938 10.705 5.904 355 HG23 THR 72 3HG2 THR 72 -8.162 9.079 5.260 356 H THR 73 H THR 73 -9.786 9.545 1.443 357 HA THR 73 HA THR 73 -11.762 11.216 0.293 358 HB THR 73 HB THR 73 -12.046 9.421 -1.336 359 HG1 THR 73 HG1 THR 73 -11.064 7.421 -1.028 360 HG21 THR 73 1HG2 THR 73 -10.076 10.879 -1.571 361 HG22 THR 73 2HG2 THR 73 -9.758 9.249 -2.166 362 HG23 THR 73 3HG2 THR 73 -9.137 9.750 -0.593 363 H ARG 74 H ARG 74 -13.925 9.979 -0.395 364 HA ARG 74 HA ARG 74 -15.515 9.724 1.868 365 HB2 ARG 74 1HB ARG 74 -16.444 10.167 -0.342 366 HB3 ARG 74 2HB ARG 74 -15.949 8.575 -0.894 367 HG2 ARG 74 1HG ARG 74 -18.329 8.642 -0.429 368 HG3 ARG 74 2HG ARG 74 -17.499 7.540 0.669 369 HD2 ARG 74 1HD ARG 74 -17.570 9.156 2.441 370 HD3 ARG 74 2HD ARG 74 -18.210 10.389 1.354 371 HE ARG 74 HE ARG 74 -20.045 8.396 1.211 372 HH11 ARG 74 1HH1 ARG 74 -18.607 10.165 3.870 373 HH12 ARG 74 2HH1 ARG 74 -20.013 10.037 4.879 374 HH21 ARG 74 1HH2 ARG 74 -21.902 8.246 2.535 375 HH22 ARG 74 2HH2 ARG 74 -21.877 8.941 4.125 376 H TYR 75 H TYR 75 -13.750 7.232 0.066 377 HA TYR 75 HA TYR 75 -14.914 5.161 1.737 378 HB2 TYR 75 1HB TYR 75 -12.952 4.956 -0.550 379 HB3 TYR 75 2HB TYR 75 -13.697 3.593 0.286 380 HD1 TYR 75 HD1 TYR 75 -16.486 4.517 0.562 381 HD2 TYR 75 HD2 TYR 75 -13.798 4.849 -2.715 382 HE1 TYR 75 HE1 TYR 75 -18.392 4.604 -0.983 383 HE2 TYR 75 HE2 TYR 75 -15.698 4.941 -4.272 384 HH TYR 75 HH TYR 75 -18.059 4.241 -4.335 385 H VAL 76 H VAL 76 -11.925 6.959 1.533 386 HA VAL 76 HA VAL 76 -10.503 5.020 3.155 387 HB VAL 76 HB VAL 76 -9.694 7.802 2.281 388 HG11 VAL 76 1HG1 VAL 76 -7.478 7.279 3.115 389 HG12 VAL 76 2HG1 VAL 76 -8.020 5.682 3.633 390 HG13 VAL 76 3HG1 VAL 76 -8.651 7.125 4.425 391 HG21 VAL 76 1HG2 VAL 76 -9.842 6.178 0.454 392 HG22 VAL 76 2HG2 VAL 76 -8.787 5.079 1.345 393 HG23 VAL 76 3HG2 VAL 76 -8.166 6.628 0.775 394 H SER 77 H SER 77 -10.735 4.886 5.267 395 HA SER 77 HA SER 77 -12.159 6.944 6.699 396 HB2 SER 77 1HB SER 77 -10.982 4.337 7.700 397 HB3 SER 77 2HB SER 77 -12.115 5.371 8.579 398 HG SER 77 HG SER 77 -12.639 3.455 6.780 399 H ALA 78 H ALA 78 -8.874 5.665 6.570 400 HA ALA 78 HA ALA 78 -7.841 8.042 7.791 401 HB1 ALA 78 1HB ALA 78 -6.792 6.963 9.711 402 HB2 ALA 78 2HB ALA 78 -7.579 5.443 9.295 403 HB3 ALA 78 3HB ALA 78 -8.547 6.828 9.792 404 H MET 79 H MET 79 -5.649 8.275 7.492 405 HA MET 79 HA MET 79 -3.972 6.117 6.662 406 HB2 MET 79 1HB MET 79 -3.343 7.050 4.469 407 HB3 MET 79 2HB MET 79 -5.029 6.549 4.507 408 HG2 MET 79 1HG MET 79 -5.819 8.698 4.387 409 HG3 MET 79 2HG MET 79 -4.356 9.390 5.085 410 HE1 MET 79 1HE MET 79 -6.037 7.948 1.817 411 HE2 MET 79 2HE MET 79 -4.735 6.806 2.148 412 HE3 MET 79 3HE MET 79 -4.649 7.857 0.736 413 H SER 80 H SER 80 -1.857 6.591 7.013 414 HA SER 80 HA SER 80 -1.139 9.384 7.563 415 HB2 SER 80 1HB SER 80 -1.663 8.251 9.724 416 HB3 SER 80 2HB SER 80 -0.420 7.054 9.369 417 HG SER 80 HG SER 80 -0.177 9.644 10.277 418 H VAL 81 H VAL 81 0.995 9.908 7.142 419 HA VAL 81 HA VAL 81 2.439 7.903 5.538 420 HB VAL 81 HB VAL 81 2.706 10.904 5.340 421 HG11 VAL 81 1HG1 VAL 81 3.625 8.682 3.526 422 HG12 VAL 81 2HG1 VAL 81 4.641 9.718 4.528 423 HG13 VAL 81 3HG1 VAL 81 3.754 10.404 3.169 424 HG21 VAL 81 1HG2 VAL 81 0.441 10.319 4.737 425 HG22 VAL 81 2HG2 VAL 81 1.027 9.065 3.648 426 HG23 VAL 81 3HG2 VAL 81 1.352 10.761 3.293 427 H ALA 82 H ALA 82 4.311 7.201 6.386 428 HA ALA 82 HA ALA 82 5.814 8.978 8.167 429 HB1 ALA 82 1HB ALA 82 4.475 7.517 9.606 430 HB2 ALA 82 2HB ALA 82 6.195 7.150 9.744 431 HB3 ALA 82 3HB ALA 82 5.142 6.101 8.792 432 H LYS 83 H LYS 83 7.624 9.213 7.213 433 HA LYS 83 HA LYS 83 9.570 8.886 5.986 434 HB2 LYS 83 1HB LYS 83 9.329 5.968 6.753 435 HB3 LYS 83 2HB LYS 83 10.792 6.847 6.339 436 HG2 LYS 83 1HG LYS 83 9.144 7.484 8.769 437 HG3 LYS 83 2HG LYS 83 10.454 6.305 8.780 438 HD2 LYS 83 1HD LYS 83 11.992 8.080 7.999 439 HD3 LYS 83 2HD LYS 83 10.668 9.241 8.135 440 HE2 LYS 83 1HE LYS 83 10.484 8.796 10.510 441 HE3 LYS 83 2HE LYS 83 11.736 7.559 10.400 442 HZ1 LYS 83 1HZ LYS 83 13.291 9.308 9.684 443 HZ2 LYS 83 2HZ LYS 83 12.681 9.571 11.241 444 HZ3 LYS 83 3HZ LYS 83 12.083 10.471 9.938 445 H GLY 84 H GLY 84 7.216 8.878 4.553 446 HA2 GLY 84 1HA GLY 84 6.473 8.430 2.414 447 HA3 GLY 84 2HA GLY 84 7.843 7.343 2.209 448 H VAL 85 H VAL 85 7.007 5.872 4.680 449 HA VAL 85 HA VAL 85 5.358 3.896 3.472 450 HB VAL 85 HB VAL 85 5.918 4.245 6.421 451 HG11 VAL 85 1HG1 VAL 85 5.163 1.812 4.811 452 HG12 VAL 85 2HG1 VAL 85 4.139 2.662 5.971 453 HG13 VAL 85 3HG1 VAL 85 5.584 1.815 6.524 454 HG21 VAL 85 1HG2 VAL 85 7.804 2.701 6.077 455 HG22 VAL 85 2HG2 VAL 85 8.015 4.224 5.215 456 HG23 VAL 85 3HG2 VAL 85 7.526 2.776 4.338 457 H VAL 86 H VAL 86 3.081 3.510 3.718 458 HA VAL 86 HA VAL 86 1.709 5.647 5.154 459 HB VAL 86 HB VAL 86 0.009 5.760 3.367 460 HG11 VAL 86 1HG1 VAL 86 1.875 7.363 3.465 461 HG12 VAL 86 2HG1 VAL 86 1.303 7.095 1.819 462 HG13 VAL 86 3HG1 VAL 86 2.796 6.332 2.372 463 HG21 VAL 86 1HG2 VAL 86 1.938 4.136 1.722 464 HG22 VAL 86 2HG2 VAL 86 0.395 4.803 1.193 465 HG23 VAL 86 3HG2 VAL 86 0.433 3.519 2.402 466 H SER 87 H SER 87 0.552 4.784 6.670 467 HA SER 87 HA SER 87 -0.612 2.133 6.278 468 HB2 SER 87 1HB SER 87 -0.989 2.227 8.756 469 HB3 SER 87 2HB SER 87 0.703 2.349 8.281 470 HG SER 87 HG SER 87 -0.908 4.176 9.547 471 H LEU 88 H LEU 88 -2.667 1.870 5.837 472 HA LEU 88 HA LEU 88 -4.511 4.124 6.295 473 HB2 LEU 88 1HB LEU 88 -4.699 1.919 4.236 474 HB3 LEU 88 2HB LEU 88 -5.892 3.178 4.486 475 HG LEU 88 HG LEU 88 -3.927 4.802 3.943 476 HD11 LEU 88 1HD1 LEU 88 -2.128 3.190 3.947 477 HD12 LEU 88 2HD1 LEU 88 -2.326 3.864 2.330 478 HD13 LEU 88 3HD1 LEU 88 -2.932 2.247 2.692 479 HD21 LEU 88 1HD2 LEU 88 -5.255 3.098 1.843 480 HD22 LEU 88 2HD2 LEU 88 -4.475 4.652 1.555 481 HD23 LEU 88 3HD2 LEU 88 -5.908 4.563 2.577 482 H THR 89 H THR 89 -6.371 3.738 7.418 483 HA THR 89 HA THR 89 -6.632 1.015 8.509 484 HB THR 89 HB THR 89 -7.401 3.582 9.906 485 HG1 THR 89 HG1 THR 89 -4.975 2.288 9.636 486 HG21 THR 89 1HG2 THR 89 -7.500 2.173 11.901 487 HG22 THR 89 2HG2 THR 89 -7.069 0.760 10.939 488 HG23 THR 89 3HG2 THR 89 -8.607 1.579 10.665 489 H GLY 90 H GLY 90 -8.524 0.039 8.405 490 HA2 GLY 90 1HA GLY 90 -10.690 -0.427 7.749 491 HA3 GLY 90 2HA GLY 90 -11.056 1.072 8.582 492 H GLN 91 H GLN 91 -9.363 0.404 5.535 493 HA GLN 91 HA GLN 91 -10.636 2.637 4.275 494 HB2 GLN 91 1HB GLN 91 -8.298 1.527 3.864 495 HB3 GLN 91 2HB GLN 91 -9.193 0.451 2.801 496 HG2 GLN 91 1HG GLN 91 -9.267 3.435 2.513 497 HG3 GLN 91 2HG GLN 91 -8.030 2.437 1.752 498 HE21 GLN 91 1HE2 GLN 91 -11.333 3.440 1.704 499 HE22 GLN 91 2HE2 GLN 91 -11.755 2.687 0.209 500 H GLU 92 H GLU 92 -12.575 2.634 3.289 501 HA GLU 92 HA GLU 92 -14.578 1.941 2.482 502 HB2 GLU 92 1HB GLU 92 -12.634 0.878 0.869 503 HB3 GLU 92 2HB GLU 92 -13.551 -0.554 1.308 504 HG2 GLU 92 1HG GLU 92 -14.646 1.937 0.020 505 HG3 GLU 92 2HG GLU 92 -14.346 0.399 -0.773 506 H SER 93 H SER 93 -15.076 -1.045 2.001 507 HA SER 93 HA SER 93 -16.360 -1.664 4.413 508 HB2 SER 93 1HB SER 93 -15.532 -3.480 2.145 509 HB3 SER 93 2HB SER 93 -16.681 -3.901 3.416 510 HG SER 93 HG SER 93 -16.940 -1.849 1.454 511 H LEU 94 H LEU 94 -13.080 -1.775 3.751 512 HA LEU 94 HA LEU 94 -12.431 -4.263 5.047 513 HB2 LEU 94 1HB LEU 94 -10.567 -2.024 4.274 514 HB3 LEU 94 2HB LEU 94 -10.131 -3.687 4.630 515 HG LEU 94 HG LEU 94 -11.754 -2.783 2.245 516 HD11 LEU 94 1HD1 LEU 94 -9.732 -3.439 0.973 517 HD12 LEU 94 2HD1 LEU 94 -8.875 -3.622 2.505 518 HD13 LEU 94 3HD1 LEU 94 -9.489 -2.041 2.022 519 HD21 LEU 94 1HD2 LEU 94 -10.707 -5.492 3.047 520 HD22 LEU 94 2HD2 LEU 94 -11.330 -5.098 1.446 521 HD23 LEU 94 3HD2 LEU 94 -12.392 -5.008 2.849 522 H ASN 95 H ASN 95 -13.918 -2.583 6.702 523 HA ASN 95 HA ASN 95 -12.555 -1.025 8.540 524 HB2 ASN 95 1HB ASN 95 -15.036 -1.344 8.400 525 HB3 ASN 95 2HB ASN 95 -14.830 -2.920 9.154 526 HD21 ASN 95 1HD2 ASN 95 -13.073 0.025 9.956 527 HD22 ASN 95 2HD2 ASN 95 -13.693 0.165 11.563 528 H GLY 96 H GLY 96 -11.257 -1.413 10.254 529 HA2 GLY 96 1HA GLY 96 -10.125 -2.636 11.888 530 HA3 GLY 96 2HA GLY 96 -10.888 -4.101 11.281 531 H LEU 97 H LEU 97 -9.967 -3.215 8.502 532 HA LEU 97 HA LEU 97 -7.513 -4.726 8.611 533 HB2 LEU 97 1HB LEU 97 -9.247 -5.113 6.896 534 HB3 LEU 97 2HB LEU 97 -8.992 -3.489 6.287 535 HG LEU 97 HG LEU 97 -6.704 -5.429 6.305 536 HD11 LEU 97 1HD1 LEU 97 -8.829 -5.250 4.170 537 HD12 LEU 97 2HD1 LEU 97 -8.621 -6.601 5.282 538 HD13 LEU 97 3HD1 LEU 97 -7.361 -6.223 4.110 539 HD21 LEU 97 1HD2 LEU 97 -6.035 -4.138 4.348 540 HD22 LEU 97 2HD2 LEU 97 -6.294 -3.081 5.736 541 HD23 LEU 97 3HD2 LEU 97 -7.511 -3.179 4.464 542 H SER 98 H SER 98 -5.497 -3.970 8.353 543 HA SER 98 HA SER 98 -5.178 -1.076 7.915 544 HB2 SER 98 1HB SER 98 -3.289 -2.981 9.323 545 HB3 SER 98 2HB SER 98 -3.091 -1.233 9.175 546 HG SER 98 HG SER 98 -5.331 -2.447 10.422 547 H VAL 99 H VAL 99 -4.247 -0.488 6.072 548 HA VAL 99 HA VAL 99 -2.734 -2.495 4.537 549 HB VAL 99 HB VAL 99 -3.671 0.222 3.595 550 HG11 VAL 99 1HG1 VAL 99 -2.686 -2.178 2.064 551 HG12 VAL 99 2HG1 VAL 99 -1.797 -0.678 2.340 552 HG13 VAL 99 3HG1 VAL 99 -3.262 -0.666 1.361 553 HG21 VAL 99 1HG2 VAL 99 -5.463 -0.941 2.400 554 HG22 VAL 99 2HG2 VAL 99 -5.616 -1.126 4.147 555 HG23 VAL 99 3HG2 VAL 99 -4.988 -2.454 3.171 556 H VAL 100 H VAL 100 -0.524 -2.301 4.385 557 HA VAL 100 HA VAL 100 0.619 0.274 5.221 558 HB VAL 100 HB VAL 100 1.775 -2.454 5.823 559 HG11 VAL 100 1HG1 VAL 100 3.489 -0.766 5.495 560 HG12 VAL 100 2HG1 VAL 100 3.385 -1.208 7.201 561 HG13 VAL 100 3HG1 VAL 100 2.678 0.306 6.638 562 HG21 VAL 100 1HG2 VAL 100 -0.202 -2.038 7.183 563 HG22 VAL 100 2HG2 VAL 100 0.450 -0.474 7.678 564 HG23 VAL 100 3HG2 VAL 100 1.258 -1.963 8.169 565 H MET 101 H MET 101 1.305 1.122 3.364 566 HA MET 101 HA MET 101 2.720 -0.623 1.463 567 HB2 MET 101 1HB MET 101 0.855 0.819 0.611 568 HB3 MET 101 2HB MET 101 1.807 2.231 1.042 569 HG2 MET 101 1HG MET 101 3.543 1.561 -0.510 570 HG3 MET 101 2HG MET 101 2.636 0.112 -0.918 571 HE1 MET 101 1HE MET 101 -0.375 1.294 -0.966 572 HE2 MET 101 2HE MET 101 0.262 0.155 -2.151 573 HE3 MET 101 3HE MET 101 -0.528 1.635 -2.691 574 H THR 102 H THR 102 4.851 -0.660 1.506 575 HA THR 102 HA THR 102 6.256 1.530 2.889 576 HB THR 102 HB THR 102 7.166 -1.332 2.565 577 HG1 THR 102 HG1 THR 102 5.324 -1.218 3.901 578 HG21 THR 102 1HG2 THR 102 8.170 0.855 4.391 579 HG22 THR 102 2HG2 THR 102 8.971 0.320 2.914 580 HG23 THR 102 3HG2 THR 102 8.800 -0.787 4.278 581 HA PRO 103 HA PRO 103 8.256 1.973 -1.205 582 HB2 PRO 103 1HB PRO 103 9.052 4.525 -0.785 583 HB3 PRO 103 2HB PRO 103 7.418 4.123 -1.342 584 HG2 PRO 103 1HG PRO 103 8.365 4.767 1.432 585 HG3 PRO 103 2HG PRO 103 6.913 5.341 0.582 586 HD2 PRO 103 1HD PRO 103 6.851 3.326 2.394 587 HD3 PRO 103 2HD PRO 103 5.746 3.385 1.002 588 H GLY 104 H GLY 104 10.268 1.331 -1.468 589 HA2 GLY 104 1HA GLY 104 12.657 1.726 -1.108 590 HA3 GLY 104 2HA GLY 104 12.287 2.033 0.584 591 H TRP 105 H TRP 105 10.326 -0.330 0.236 592 HA TRP 105 HA TRP 105 12.162 -2.325 1.201 593 HB2 TRP 105 1HB TRP 105 9.851 -1.965 2.129 594 HB3 TRP 105 2HB TRP 105 9.207 -2.613 0.627 595 HD1 TRP 105 HD1 TRP 105 8.992 -5.195 0.453 596 HE1 TRP 105 HE1 TRP 105 9.633 -7.171 1.974 597 HE3 TRP 105 HE3 TRP 105 11.763 -2.667 3.924 598 HZ2 TRP 105 HZ2 TRP 105 11.113 -7.589 4.342 599 HZ3 TRP 105 HZ3 TRP 105 12.753 -3.928 5.788 600 HH2 TRP 105 HH2 TRP 105 12.436 -6.340 5.993 601 H ASP 106 H ASP 106 10.989 -1.369 -1.800 602 HA ASP 106 HA ASP 106 10.829 -3.811 -3.191 603 HB2 ASP 106 1HB ASP 106 9.939 -1.764 -4.147 604 HB3 ASP 106 2HB ASP 106 11.543 -1.041 -4.171 605 H ASN 107 H ASN 107 12.335 -5.190 -3.764 606 HA ASN 107 HA ASN 107 15.029 -4.832 -2.937 607 HB2 ASN 107 1HB ASN 107 13.614 -7.007 -4.462 608 HB3 ASN 107 2HB ASN 107 15.345 -7.064 -4.169 609 HD21 ASN 107 1HD2 ASN 107 13.047 -5.740 -1.869 610 HD22 ASN 107 2HD2 ASN 107 13.230 -6.995 -0.692 611 H ALA 108 H ALA 108 13.393 -4.218 -5.921 612 HA ALA 108 HA ALA 108 15.710 -4.655 -7.570 613 HB1 ALA 108 1HB ALA 108 13.450 -5.105 -8.397 614 HB2 ALA 108 2HB ALA 108 14.311 -3.946 -9.410 615 HB3 ALA 108 3HB ALA 108 13.077 -3.386 -8.282 616 H ASN 109 H ASN 109 13.768 -1.756 -6.769 617 HA ASN 109 HA ASN 109 16.081 -0.142 -7.644 618 HB2 ASN 109 1HB ASN 109 13.139 0.502 -7.489 619 HB3 ASN 109 2HB ASN 109 14.360 1.752 -7.687 620 HD21 ASN 109 1HD2 ASN 109 13.570 2.356 -9.678 621 HD22 ASN 109 2HD2 ASN 109 13.775 1.386 -11.096 622 H GLY 110 H GLY 110 13.926 -0.763 -4.987 623 HA2 GLY 110 1HA GLY 110 14.535 -0.415 -2.725 624 HA3 GLY 110 2HA GLY 110 15.725 0.766 -3.257 625 H VAL 111 H VAL 111 15.240 2.821 -2.941 626 HA VAL 111 HA VAL 111 12.966 3.698 -1.637 627 HB VAL 111 HB VAL 111 13.611 6.013 -2.394 628 HG11 VAL 111 1HG1 VAL 111 14.477 5.056 -0.335 629 HG12 VAL 111 2HG1 VAL 111 15.715 6.031 -1.128 630 HG13 VAL 111 3HG1 VAL 111 15.780 4.272 -1.228 631 HG21 VAL 111 1HG2 VAL 111 14.561 5.470 -4.565 632 HG22 VAL 111 2HG2 VAL 111 15.824 4.509 -3.795 633 HG23 VAL 111 3HG2 VAL 111 15.772 6.255 -3.553 634 H THR 112 H THR 112 13.573 3.570 -5.110 635 HA THR 112 HA THR 112 10.985 4.740 -5.680 636 HB THR 112 HB THR 112 11.788 4.058 -8.102 637 HG1 THR 112 HG1 THR 112 14.263 4.402 -7.872 638 HG21 THR 112 1HG2 THR 112 12.962 6.209 -8.267 639 HG22 THR 112 2HG2 THR 112 13.058 6.290 -6.508 640 HG23 THR 112 3HG2 THR 112 11.489 6.354 -7.310 641 H GLY 113 H GLY 113 10.225 2.781 -4.297 642 HA2 GLY 113 1HA GLY 113 8.829 1.056 -6.077 643 HA3 GLY 113 2HA GLY 113 10.119 0.190 -5.258 644 H TRP 114 H TRP 114 6.957 0.548 -5.131 645 HA TRP 114 HA TRP 114 6.742 0.942 -2.233 646 HB2 TRP 114 1HB TRP 114 4.605 0.835 -4.373 647 HB3 TRP 114 2HB TRP 114 4.297 1.076 -2.656 648 HD1 TRP 114 HD1 TRP 114 5.008 3.449 -1.608 649 HE1 TRP 114 HE1 TRP 114 5.377 5.748 -2.706 650 HE3 TRP 114 HE3 TRP 114 5.436 1.967 -6.479 651 HZ2 TRP 114 HZ2 TRP 114 5.795 6.794 -5.288 652 HZ3 TRP 114 HZ3 TRP 114 5.818 3.679 -8.203 653 HH2 TRP 114 HH2 TRP 114 5.992 6.042 -7.617 654 H ALA 115 H ALA 115 6.477 -0.735 -0.910 655 HA ALA 115 HA ALA 115 5.705 -3.336 -2.014 656 HB1 ALA 115 1HB ALA 115 6.721 -2.599 0.734 657 HB2 ALA 115 2HB ALA 115 7.687 -3.262 -0.584 658 HB3 ALA 115 3HB ALA 115 6.413 -4.234 0.149 659 H ARG 116 H ARG 116 3.920 -4.512 -1.111 660 HA ARG 116 HA ARG 116 1.930 -2.715 0.121 661 HB2 ARG 116 1HB ARG 116 1.537 -4.729 -2.089 662 HB3 ARG 116 2HB ARG 116 0.219 -3.920 -1.247 663 HG2 ARG 116 1HG ARG 116 0.941 -1.783 -2.054 664 HG3 ARG 116 2HG ARG 116 2.396 -2.489 -2.753 665 HD2 ARG 116 1HD ARG 116 -0.401 -3.233 -3.579 666 HD3 ARG 116 2HD ARG 116 0.567 -2.004 -4.391 667 HE ARG 116 HE ARG 116 2.054 -4.391 -4.262 668 HH11 ARG 116 1HH1 ARG 116 -0.801 -3.101 -5.826 669 HH12 ARG 116 2HH1 ARG 116 -0.621 -4.072 -7.250 670 HH21 ARG 116 1HH2 ARG 116 2.299 -5.676 -6.133 671 HH22 ARG 116 2HH2 ARG 116 1.129 -5.554 -7.415 672 H ASN 117 H ASN 117 0.704 -3.478 1.753 673 HA ASN 117 HA ASN 117 0.706 -6.329 2.369 674 HB2 ASN 117 1HB ASN 117 2.660 -5.424 3.572 675 HB3 ASN 117 2HB ASN 117 1.630 -4.222 4.337 676 HD21 ASN 117 1HD2 ASN 117 2.555 -7.561 4.247 677 HD22 ASN 117 2HD2 ASN 117 1.778 -8.027 5.717 678 H CYS 118 H CYS 118 -1.225 -6.975 3.113 679 HA CYS 118 HA CYS 118 -3.074 -4.962 4.221 680 HB2 CYS 118 1HB CYS 118 -3.711 -7.535 2.743 681 HB3 CYS 118 2HB CYS 118 -4.909 -6.475 3.481 682 H ASN 119 H ASN 119 -3.326 -5.191 6.384 683 HA ASN 119 HA ASN 119 -3.094 -7.917 7.489 684 HB2 ASN 119 1HB ASN 119 -2.457 -5.233 8.685 685 HB3 ASN 119 2HB ASN 119 -2.755 -6.636 9.705 686 HD21 ASN 119 1HD2 ASN 119 -1.525 -8.506 7.824 687 HD22 ASN 119 2HD2 ASN 119 0.175 -8.241 7.931 688 H ILE 120 H ILE 120 -5.104 -8.702 7.553 689 HA ILE 120 HA ILE 120 -6.891 -7.366 9.436 690 HB ILE 120 HB ILE 120 -7.826 -6.881 7.268 691 HG12 ILE 120 1HG1 ILE 120 -10.038 -7.994 7.480 692 HG13 ILE 120 2HG1 ILE 120 -9.349 -9.045 8.709 693 HG21 ILE 120 1HG2 ILE 120 -8.565 -8.672 5.743 694 HG22 ILE 120 2HG2 ILE 120 -7.728 -9.842 6.765 695 HG23 ILE 120 3HG2 ILE 120 -6.813 -8.587 5.929 696 HD11 ILE 120 1HD1 ILE 120 -9.622 -6.052 8.863 697 HD12 ILE 120 2HD1 ILE 120 -8.883 -7.073 10.094 698 HD13 ILE 120 3HD1 ILE 120 -10.595 -7.245 9.722 699 H GLN 121 H GLN 121 -6.883 -8.717 11.154 700 HA GLN 121 HA GLN 121 -5.968 -11.420 10.814 701 HB2 GLN 121 1HB GLN 121 -5.267 -9.964 12.706 702 HB3 GLN 121 2HB GLN 121 -6.904 -10.046 13.338 703 HG2 GLN 121 1HG GLN 121 -5.446 -11.591 14.501 704 HG3 GLN 121 2HG GLN 121 -6.693 -12.457 13.605 705 HE21 GLN 121 1HE2 GLN 121 -5.493 -14.343 13.546 706 HE22 GLN 121 2HE2 GLN 121 -4.102 -14.526 12.537 707 H SER 122 H SER 122 -9.072 -9.910 11.589 708 HA SER 122 HA SER 122 -10.160 -12.570 12.179 709 HB2 SER 122 1HB SER 122 -11.247 -9.844 12.901 710 HB3 SER 122 2HB SER 122 -11.928 -11.391 13.405 711 HG SER 122 HG SER 122 -10.342 -11.665 14.798 712 H ASP 123 H ASP 123 -9.947 -10.927 9.477 713 HA ASP 123 HA ASP 123 -12.602 -11.730 8.573 714 HB2 ASP 123 1HB ASP 123 -11.525 -8.928 8.342 715 HB3 ASP 123 2HB ASP 123 -12.756 -9.540 7.253 716 H SER 124 H SER 124 -11.558 -13.380 7.434 717 HA SER 124 HA SER 124 -9.370 -13.038 5.712 718 HB2 SER 124 1HB SER 124 -10.236 -15.197 4.672 719 HB3 SER 124 2HB SER 124 -9.906 -15.247 6.404 720 HG SER 124 HG SER 124 -11.883 -15.959 6.508 721 H ALA 125 H ALA 125 -12.826 -12.671 5.179 722 HA ALA 125 HA ALA 125 -12.817 -12.554 2.377 723 HB1 ALA 125 1HB ALA 125 -14.855 -12.825 3.693 724 HB2 ALA 125 2HB ALA 125 -14.984 -11.461 2.582 725 HB3 ALA 125 3HB ALA 125 -14.687 -11.177 4.297 726 H LEU 126 H LEU 126 -12.331 -10.042 4.807 727 HA LEU 126 HA LEU 126 -12.225 -7.892 2.963 728 HB2 LEU 126 1HB LEU 126 -11.059 -8.126 5.734 729 HB3 LEU 126 2HB LEU 126 -11.165 -6.638 4.818 730 HG LEU 126 HG LEU 126 -13.477 -8.274 5.863 731 HD11 LEU 126 1HD1 LEU 126 -12.358 -6.989 7.583 732 HD12 LEU 126 2HD1 LEU 126 -13.928 -6.275 7.212 733 HD13 LEU 126 3HD1 LEU 126 -12.453 -5.536 6.590 734 HD21 LEU 126 1HD2 LEU 126 -13.491 -5.749 4.221 735 HD22 LEU 126 2HD2 LEU 126 -14.897 -6.465 5.001 736 HD23 LEU 126 3HD2 LEU 126 -14.067 -7.335 3.711 737 H GLN 127 H GLN 127 -9.847 -10.120 4.284 738 HA GLN 127 HA GLN 127 -7.554 -8.912 3.191 739 HB2 GLN 127 1HB GLN 127 -7.259 -10.677 4.792 740 HB3 GLN 127 2HB GLN 127 -8.168 -11.808 3.796 741 HG2 GLN 127 1HG GLN 127 -6.424 -11.782 2.118 742 HG3 GLN 127 2HG GLN 127 -5.523 -10.575 3.038 743 HE21 GLN 127 1HE2 GLN 127 -3.739 -11.948 3.146 744 HE22 GLN 127 2HE2 GLN 127 -3.692 -13.309 4.209 745 H GLN 128 H GLN 128 -9.795 -11.330 1.918 746 HA GLN 128 HA GLN 128 -8.559 -11.937 -0.477 747 HB2 GLN 128 1HB GLN 128 -11.501 -11.700 0.157 748 HB3 GLN 128 2HB GLN 128 -10.879 -12.400 -1.333 749 HG2 GLN 128 1HG GLN 128 -10.444 -13.421 1.462 750 HG3 GLN 128 2HG GLN 128 -11.452 -14.143 0.213 751 HE21 GLN 128 1HE2 GLN 128 -10.456 -15.094 -1.590 752 HE22 GLN 128 2HE2 GLN 128 -8.809 -15.623 -1.535 753 H ALA 129 H ALA 129 -10.721 -9.258 0.277 754 HA ALA 129 HA ALA 129 -10.785 -8.236 -2.375 755 HB1 ALA 129 1HB ALA 129 -12.584 -7.805 -0.791 756 HB2 ALA 129 2HB ALA 129 -11.886 -6.299 -1.388 757 HB3 ALA 129 3HB ALA 129 -11.474 -6.884 0.225 758 H CYS 130 H CYS 130 -8.966 -7.395 0.545 759 HA CYS 130 HA CYS 130 -7.711 -5.115 -0.583 760 HB2 CYS 130 1HB CYS 130 -7.975 -5.565 1.872 761 HB3 CYS 130 2HB CYS 130 -6.715 -6.789 1.729 762 H GLU 131 H GLU 131 -6.617 -8.459 -0.067 763 HA GLU 131 HA GLU 131 -4.013 -8.069 -1.034 764 HB2 GLU 131 1HB GLU 131 -3.790 -10.453 -1.128 765 HB3 GLU 131 2HB GLU 131 -4.707 -10.035 0.312 766 HG2 GLU 131 1HG GLU 131 -6.676 -10.884 -0.527 767 HG3 GLU 131 2HG GLU 131 -6.131 -10.770 -2.202 768 H ASP 132 H ASP 132 -7.005 -8.407 -2.717 769 HA ASP 132 HA ASP 132 -5.945 -9.307 -5.192 770 HB2 ASP 132 1HB ASP 132 -8.381 -9.304 -4.539 771 HB3 ASP 132 2HB ASP 132 -8.379 -7.563 -4.768 772 H VAL 133 H VAL 133 -6.780 -6.051 -4.008 773 HA VAL 133 HA VAL 133 -5.608 -4.815 -6.354 774 HB VAL 133 HB VAL 133 -6.872 -3.593 -3.894 775 HG11 VAL 133 1HG1 VAL 133 -6.044 -2.290 -6.486 776 HG12 VAL 133 2HG1 VAL 133 -5.303 -2.033 -4.906 777 HG13 VAL 133 3HG1 VAL 133 -6.963 -1.515 -5.196 778 HG21 VAL 133 1HG2 VAL 133 -7.927 -4.068 -6.676 779 HG22 VAL 133 2HG2 VAL 133 -8.751 -3.129 -5.435 780 HG23 VAL 133 3HG2 VAL 133 -8.466 -4.852 -5.192 781 H PHE 134 H PHE 134 -4.946 -5.017 -2.915 782 HA PHE 134 HA PHE 134 -2.500 -3.450 -3.178 783 HB2 PHE 134 1HB PHE 134 -4.023 -4.370 -0.734 784 HB3 PHE 134 2HB PHE 134 -2.498 -3.493 -0.676 785 HD1 PHE 134 HD1 PHE 134 -6.074 -3.239 -1.106 786 HD2 PHE 134 HD2 PHE 134 -2.384 -1.162 -1.560 787 HE1 PHE 134 HE1 PHE 134 -7.292 -1.106 -1.237 788 HE2 PHE 134 HE2 PHE 134 -3.598 0.977 -1.685 789 HZ PHE 134 HZ PHE 134 -6.056 1.003 -1.526 790 H ARG 135 H ARG 135 -2.688 -6.104 -4.236 791 HA ARG 135 HA ARG 135 -2.095 -8.256 -2.698 792 HB2 ARG 135 1HB ARG 135 -2.578 -8.256 -5.135 793 HB3 ARG 135 2HB ARG 135 -0.949 -7.671 -5.435 794 HG2 ARG 135 1HG ARG 135 -0.055 -9.747 -4.437 795 HG3 ARG 135 2HG ARG 135 -1.708 -10.332 -4.247 796 HD2 ARG 135 1HD ARG 135 -2.011 -10.085 -6.703 797 HD3 ARG 135 2HD ARG 135 -0.304 -9.664 -6.829 798 HE ARG 135 HE ARG 135 -0.873 -12.193 -5.536 799 HH11 ARG 135 1HH1 ARG 135 -0.030 -10.539 -8.497 800 HH12 ARG 135 2HH1 ARG 135 0.506 -11.977 -9.301 801 HH21 ARG 135 1HH2 ARG 135 -0.162 -14.096 -6.593 802 HH22 ARG 135 2HH2 ARG 135 0.423 -14.001 -8.223 803 H PHE 136 H PHE 136 -0.408 -9.163 -1.761 804 HA PHE 136 HA PHE 136 1.850 -7.608 -1.042 805 HB2 PHE 136 1HB PHE 136 1.682 -10.612 -0.778 806 HB3 PHE 136 2HB PHE 136 2.563 -9.483 0.237 807 HD1 PHE 136 HD1 PHE 136 1.541 -8.462 2.118 808 HD2 PHE 136 HD2 PHE 136 -0.796 -10.755 -0.606 809 HE1 PHE 136 HE1 PHE 136 -0.326 -8.455 3.716 810 HE2 PHE 136 HE2 PHE 136 -2.668 -10.744 0.991 811 HZ PHE 136 HZ PHE 136 -2.433 -9.596 3.152 812 H ASP 137 H ASP 137 3.636 -7.318 -2.202 813 HA ASP 137 HA ASP 137 4.087 -8.869 -4.581 814 HB2 ASP 137 1HB ASP 137 5.685 -6.613 -3.339 815 HB3 ASP 137 2HB ASP 137 6.002 -7.326 -4.916 816 H ASP 138 H ASP 138 6.279 -9.840 -4.978 817 HA ASP 138 HA ASP 138 6.686 -11.938 -3.270 818 HB2 ASP 138 1HB ASP 138 7.572 -11.776 -5.594 819 HB3 ASP 138 2HB ASP 138 8.838 -10.707 -5.001 820 H ALA 139 H ALA 139 8.212 -8.777 -3.140 821 HA ALA 139 HA ALA 139 10.204 -9.391 -1.234 822 HB1 ALA 139 1HB ALA 139 8.882 -6.746 -1.819 823 HB2 ALA 139 2HB ALA 139 10.300 -7.403 -2.637 824 HB3 ALA 139 3HB ALA 139 10.388 -6.973 -0.929 825 H ASN 140 H ASN 140 6.814 -8.785 -0.915 826 HA ASN 140 HA ASN 140 6.993 -8.257 1.947 827 HB2 ASN 140 1HB ASN 140 4.614 -8.420 0.082 828 HB3 ASN 140 2HB ASN 140 4.501 -8.084 1.805 829 HD21 ASN 140 1HD2 ASN 140 5.210 -6.111 2.595 830 HD22 ASN 140 2HD2 ASN 140 5.457 -4.749 1.560 831 H LEU 141 H LEU 141 7.025 -10.920 0.018 832 HA LEU 141 HA LEU 141 5.331 -12.539 1.755 833 HB2 LEU 141 1HB LEU 141 6.764 -13.252 -0.809 834 HB3 LEU 141 2HB LEU 141 5.725 -14.338 0.096 835 HG LEU 141 HG LEU 141 4.862 -11.790 -1.285 836 HD11 LEU 141 1HD1 LEU 141 4.267 -14.679 -1.908 837 HD12 LEU 141 2HD1 LEU 141 5.362 -13.634 -2.813 838 HD13 LEU 141 3HD1 LEU 141 3.638 -13.273 -2.765 839 HD21 LEU 141 1HD2 LEU 141 3.281 -13.801 0.312 840 HD22 LEU 141 2HD2 LEU 141 2.575 -12.552 -0.710 841 HD23 LEU 141 3HD2 LEU 141 3.533 -12.098 0.697 842 H VAL 142 H VAL 142 6.080 -14.131 3.037 843 HA VAL 142 HA VAL 142 8.925 -14.058 3.653 844 HB VAL 142 HB VAL 142 7.358 -13.906 5.533 845 HG11 VAL 142 1HG1 VAL 142 6.046 -15.892 6.216 846 HG12 VAL 142 2HG1 VAL 142 6.430 -16.637 4.664 847 HG13 VAL 142 3HG1 VAL 142 5.481 -15.152 4.722 848 HG21 VAL 142 1HG2 VAL 142 8.314 -15.670 6.948 849 HG22 VAL 142 2HG2 VAL 142 9.532 -14.879 5.949 850 HG23 VAL 142 3HG2 VAL 142 8.930 -16.477 5.506 851 HA PRO 143 HA PRO 143 9.770 -17.672 1.193 852 HB2 PRO 143 1HB PRO 143 11.912 -18.091 3.202 853 HB3 PRO 143 2HB PRO 143 12.022 -18.004 1.443 854 HG2 PRO 143 1HG PRO 143 12.850 -15.980 2.978 855 HG3 PRO 143 2HG PRO 143 12.053 -15.693 1.421 856 HD2 PRO 143 1HD PRO 143 10.964 -15.412 4.188 857 HD3 PRO 143 2HD PRO 143 10.632 -14.449 2.735 858 H ARG 144 H ARG 144 8.954 -19.643 1.303 859 HA ARG 144 HA ARG 144 8.635 -20.924 3.929 860 HB2 ARG 144 1HB ARG 144 6.470 -20.021 3.061 861 HB3 ARG 144 2HB ARG 144 6.660 -21.031 1.635 862 HG2 ARG 144 1HG ARG 144 5.156 -22.155 3.046 863 HG3 ARG 144 2HG ARG 144 6.688 -23.015 3.181 864 HD2 ARG 144 1HD ARG 144 5.644 -22.740 5.367 865 HD3 ARG 144 2HD ARG 144 7.160 -21.846 5.280 866 HE ARG 144 HE ARG 144 5.168 -20.068 4.564 867 HH11 ARG 144 1HH1 ARG 144 5.965 -21.990 7.381 868 HH12 ARG 144 2HH1 ARG 144 5.288 -20.854 8.503 869 HH21 ARG 144 1HH2 ARG 144 4.269 -18.580 6.019 870 HH22 ARG 144 2HH2 ARG 144 4.313 -18.904 7.724 871 H GLY 145 H GLY 145 10.017 -22.621 3.901 872 HA2 GLY 145 1HA GLY 145 10.503 -24.841 3.154 873 HA3 GLY 145 2HA GLY 145 9.953 -24.379 1.546 874 H SER 146 H SER 146 12.624 -24.969 3.406 875 HA SER 146 HA SER 146 14.337 -22.946 2.209 876 HB2 SER 146 1HB SER 146 16.078 -24.047 3.708 877 HB3 SER 146 2HB SER 146 14.712 -23.293 4.533 878 HG SER 146 HG SER 146 15.424 -25.964 4.331 879 H GLY 147 H GLY 147 15.510 -23.282 0.443 880 HA2 GLY 147 1HA GLY 147 16.952 -24.374 -1.008 881 HA3 GLY 147 2HA GLY 147 16.737 -25.844 -0.074 882 H LEU 148 H LEU 148 13.822 -25.774 -0.289 883 HA LEU 148 HA LEU 148 13.677 -26.969 -2.944 884 HB2 LEU 148 1HB LEU 148 11.671 -27.055 -0.686 885 HB3 LEU 148 2HB LEU 148 11.604 -27.996 -2.161 886 HG LEU 148 HG LEU 148 13.671 -28.268 0.027 887 HD11 LEU 148 1HD1 LEU 148 12.638 -30.452 0.393 888 HD12 LEU 148 2HD1 LEU 148 11.428 -30.088 -0.837 889 HD13 LEU 148 3HD1 LEU 148 11.486 -29.142 0.651 890 HD21 LEU 148 1HD2 LEU 148 14.397 -30.266 -1.248 891 HD22 LEU 148 2HD2 LEU 148 14.706 -28.750 -2.091 892 HD23 LEU 148 3HD2 LEU 148 13.346 -29.764 -2.572 893 H GLU 149 H GLU 149 13.517 -25.134 -4.233 894 HA GLU 149 HA GLU 149 11.558 -23.113 -3.856 895 HB2 GLU 149 1HB GLU 149 13.631 -22.947 -5.312 896 HB3 GLU 149 2HB GLU 149 12.805 -23.970 -6.478 897 HG2 GLU 149 1HG GLU 149 12.672 -21.583 -7.030 898 HG3 GLU 149 2HG GLU 149 11.088 -22.320 -6.787 899 H HIS 150 H HIS 150 11.731 -26.006 -5.884 900 HA HIS 150 HA HIS 150 8.868 -25.856 -6.413 901 HB2 HIS 150 1HB HIS 150 10.520 -26.529 -8.203 902 HB3 HIS 150 2HB HIS 150 10.833 -27.992 -7.278 903 HD1 HIS 150 HD1 HIS 150 9.364 -29.937 -7.792 904 HD2 HIS 150 HD2 HIS 150 7.722 -26.347 -9.081 905 HE1 HIS 150 HE1 HIS 150 7.278 -30.559 -9.048 906 HE2 HIS 150 HE2 HIS 150 6.216 -28.362 -9.668 907 H HIS 151 H HIS 151 7.536 -26.670 -4.932 908 HA HIS 151 HA HIS 151 8.639 -28.204 -2.750 909 HB2 HIS 151 1HB HIS 151 5.838 -27.185 -3.261 910 HB3 HIS 151 2HB HIS 151 6.338 -28.021 -1.795 911 HD1 HIS 151 HD1 HIS 151 7.588 -26.670 -0.042 912 HD2 HIS 151 HD2 HIS 151 6.961 -24.579 -3.576 913 HE1 HIS 151 HE1 HIS 151 8.209 -24.294 0.461 914 HE2 HIS 151 HE2 HIS 151 8.038 -23.104 -1.752 915 H HIS 152 H HIS 152 8.805 -30.298 -2.763 916 HA HIS 152 HA HIS 152 8.480 -32.500 -3.153 917 HB2 HIS 152 1HB HIS 152 6.185 -32.205 -2.387 918 HB3 HIS 152 2HB HIS 152 5.699 -31.646 -3.983 919 HD1 HIS 152 HD1 HIS 152 5.322 -33.419 -5.800 920 HD2 HIS 152 HD2 HIS 152 6.535 -34.991 -2.147 921 HE1 HIS 152 HE1 HIS 152 4.975 -35.903 -5.984 922 HE2 HIS 152 HE2 HIS 152 5.584 -36.813 -3.716 923 H HIS 153 H HIS 153 9.684 -33.295 -4.751 924 HA HIS 153 HA HIS 153 9.087 -32.491 -7.491 925 HB2 HIS 153 1HB HIS 153 11.170 -33.513 -8.153 926 HB3 HIS 153 2HB HIS 153 11.464 -32.495 -6.755 927 HD1 HIS 153 HD1 HIS 153 12.078 -35.827 -8.057 928 HD2 HIS 153 HD2 HIS 153 11.768 -34.088 -4.287 929 HE1 HIS 153 HE1 HIS 153 13.188 -37.425 -6.472 930 HE2 HIS 153 HE2 HIS 153 13.051 -36.328 -4.213 931 H HIS 154 H HIS 154 7.840 -33.659 -8.766 932 HA HIS 154 HA HIS 154 7.041 -36.316 -7.885 933 HB2 HIS 154 1HB HIS 154 5.287 -36.199 -9.552 934 HB3 HIS 154 2HB HIS 154 5.297 -34.713 -8.618 935 HD1 HIS 154 HD1 HIS 154 5.933 -36.057 -12.044 936 HD2 HIS 154 HD2 HIS 154 5.927 -32.398 -10.071 937 HE1 HIS 154 HE1 HIS 154 6.021 -34.313 -13.851 938 HE2 HIS 154 HE2 HIS 154 5.815 -32.115 -12.639 939 H HIS 155 H HIS 155 9.508 -35.128 -9.594 940 HA HIS 155 HA HIS 155 9.633 -37.325 -11.510 941 HB2 HIS 155 1HB HIS 155 11.503 -35.004 -10.983 942 HB3 HIS 155 2HB HIS 155 11.826 -36.274 -12.154 943 HD1 HIS 155 HD1 HIS 155 10.950 -32.985 -12.296 944 HD2 HIS 155 HD2 HIS 155 9.104 -36.384 -13.812 945 HE1 HIS 155 HE1 HIS 155 9.508 -32.184 -14.186 946 HE2 HIS 155 HE2 HIS 155 8.572 -34.281 -15.217 Start of MODEL 11 1 H1 MET 24 1H MET 24 -21.970 -14.273 -3.952 2 H2 MET 24 2H MET 24 -22.628 -12.933 -3.159 3 H3 MET 24 3H MET 24 -22.442 -14.401 -2.332 4 HA MET 24 HA MET 24 -20.755 -12.798 -1.699 5 HB2 MET 24 1HB MET 24 -18.745 -14.269 -2.266 6 HB3 MET 24 2HB MET 24 -20.073 -15.035 -1.413 7 HG2 MET 24 1HG MET 24 -19.413 -16.581 -3.030 8 HG3 MET 24 2HG MET 24 -20.874 -15.845 -3.677 9 HE1 MET 24 1HE MET 24 -18.918 -17.565 -5.449 10 HE2 MET 24 2HE MET 24 -18.782 -16.573 -6.901 11 HE3 MET 24 3HE MET 24 -20.346 -16.767 -6.109 12 H GLU 25 H GLU 25 -21.827 -11.774 -4.181 13 HA GLU 25 HA GLU 25 -19.664 -11.304 -5.991 14 HB2 GLU 25 1HB GLU 25 -21.287 -9.607 -6.965 15 HB3 GLU 25 2HB GLU 25 -21.820 -11.279 -6.962 16 HG2 GLU 25 1HG GLU 25 -22.610 -9.390 -4.773 17 HG3 GLU 25 2HG GLU 25 -23.492 -9.454 -6.295 18 H ASN 26 H ASN 26 -18.027 -10.029 -5.550 19 HA ASN 26 HA ASN 26 -18.493 -7.626 -3.917 20 HB2 ASN 26 1HB ASN 26 -16.263 -9.649 -3.703 21 HB3 ASN 26 2HB ASN 26 -16.158 -8.046 -2.985 22 HD21 ASN 26 1HD2 ASN 26 -16.352 -10.885 -1.936 23 HD22 ASN 26 2HD2 ASN 26 -17.595 -10.802 -0.737 24 H TYR 27 H TYR 27 -18.456 -7.795 -6.747 25 HA TYR 27 HA TYR 27 -15.859 -7.139 -7.756 26 HB2 TYR 27 1HB TYR 27 -18.604 -6.963 -9.005 27 HB3 TYR 27 2HB TYR 27 -17.110 -6.610 -9.867 28 HD1 TYR 27 HD1 TYR 27 -15.587 -8.390 -10.498 29 HD2 TYR 27 HD2 TYR 27 -19.176 -9.250 -8.375 30 HE1 TYR 27 HE1 TYR 27 -15.332 -10.772 -11.039 31 HE2 TYR 27 HE2 TYR 27 -18.927 -11.635 -8.914 32 HH TYR 27 HH TYR 27 -16.049 -12.940 -10.192 33 H LEU 28 H LEU 28 -18.662 -5.328 -6.690 34 HA LEU 28 HA LEU 28 -17.678 -2.810 -7.638 35 HB2 LEU 28 1HB LEU 28 -19.884 -3.621 -5.774 36 HB3 LEU 28 2HB LEU 28 -19.397 -1.944 -5.880 37 HG LEU 28 HG LEU 28 -21.344 -2.352 -7.267 38 HD11 LEU 28 1HD1 LEU 28 -19.699 -0.688 -7.997 39 HD12 LEU 28 2HD1 LEU 28 -20.545 -1.430 -9.355 40 HD13 LEU 28 3HD1 LEU 28 -18.896 -1.919 -8.969 41 HD21 LEU 28 1HD2 LEU 28 -21.057 -4.708 -7.741 42 HD22 LEU 28 2HD2 LEU 28 -19.631 -4.363 -8.719 43 HD23 LEU 28 3HD2 LEU 28 -21.219 -3.803 -9.245 44 H ARG 29 H ARG 29 -17.500 -4.654 -4.661 45 HA ARG 29 HA ARG 29 -16.135 -2.807 -3.064 46 HB2 ARG 29 1HB ARG 29 -16.887 -4.850 -2.066 47 HB3 ARG 29 2HB ARG 29 -15.976 -5.823 -3.215 48 HG2 ARG 29 1HG ARG 29 -13.892 -4.787 -2.231 49 HG3 ARG 29 2HG ARG 29 -14.925 -4.157 -0.952 50 HD2 ARG 29 1HD ARG 29 -14.690 -7.077 -1.668 51 HD3 ARG 29 2HD ARG 29 -13.768 -6.295 -0.389 52 HE ARG 29 HE ARG 29 -16.397 -5.751 0.182 53 HH11 ARG 29 1HH1 ARG 29 -14.479 -8.649 -0.278 54 HH12 ARG 29 2HH1 ARG 29 -15.411 -9.592 0.838 55 HH21 ARG 29 1HH2 ARG 29 -17.609 -6.985 1.663 56 HH22 ARG 29 2HH2 ARG 29 -17.191 -8.644 1.948 57 H LYS 30 H LYS 30 -14.977 -5.103 -5.480 58 HA LYS 30 HA LYS 30 -12.228 -4.664 -5.164 59 HB2 LYS 30 1HB LYS 30 -13.807 -5.490 -7.602 60 HB3 LYS 30 2HB LYS 30 -12.053 -5.485 -7.537 61 HG2 LYS 30 1HG LYS 30 -13.881 -7.154 -5.817 62 HG3 LYS 30 2HG LYS 30 -12.959 -7.719 -7.212 63 HD2 LYS 30 1HD LYS 30 -10.895 -6.893 -5.953 64 HD3 LYS 30 2HD LYS 30 -11.945 -6.802 -4.536 65 HE2 LYS 30 1HE LYS 30 -11.331 -9.246 -6.190 66 HE3 LYS 30 2HE LYS 30 -10.796 -8.922 -4.544 67 HZ1 LYS 30 1HZ LYS 30 -12.663 -10.457 -4.607 68 HZ2 LYS 30 2HZ LYS 30 -13.619 -9.302 -5.390 69 HZ3 LYS 30 3HZ LYS 30 -13.088 -9.030 -3.809 70 H ALA 31 H ALA 31 -14.520 -3.205 -7.501 71 HA ALA 31 HA ALA 31 -12.735 -1.443 -8.681 72 HB1 ALA 31 1HB ALA 31 -14.977 -2.000 -9.539 73 HB2 ALA 31 2HB ALA 31 -14.676 -0.264 -9.490 74 HB3 ALA 31 3HB ALA 31 -15.687 -1.018 -8.258 75 H ALA 32 H ALA 32 -14.592 -1.110 -5.714 76 HA ALA 32 HA ALA 32 -14.159 1.669 -5.370 77 HB1 ALA 32 1HB ALA 32 -14.746 -0.465 -3.321 78 HB2 ALA 32 2HB ALA 32 -15.935 0.506 -4.189 79 HB3 ALA 32 3HB ALA 32 -14.839 1.273 -3.040 80 H LEU 33 H LEU 33 -12.504 -1.205 -4.152 81 HA LEU 33 HA LEU 33 -10.479 0.105 -2.704 82 HB2 LEU 33 1HB LEU 33 -10.399 -2.565 -4.126 83 HB3 LEU 33 2HB LEU 33 -9.240 -2.024 -2.924 84 HG LEU 33 HG LEU 33 -12.180 -2.465 -2.391 85 HD11 LEU 33 1HD1 LEU 33 -11.457 -4.476 -1.192 86 HD12 LEU 33 2HD1 LEU 33 -9.808 -4.213 -1.760 87 HD13 LEU 33 3HD1 LEU 33 -11.094 -4.565 -2.914 88 HD21 LEU 33 1HD2 LEU 33 -11.166 -0.820 -0.911 89 HD22 LEU 33 2HD2 LEU 33 -9.869 -1.950 -0.525 90 HD23 LEU 33 3HD2 LEU 33 -11.526 -2.312 -0.042 91 H THR 34 H THR 34 -10.758 -0.873 -6.065 92 HA THR 34 HA THR 34 -8.130 -0.233 -6.867 93 HB THR 34 HB THR 34 -10.619 -0.126 -8.579 94 HG1 THR 34 HG1 THR 34 -10.332 -2.158 -7.430 95 HG21 THR 34 1HG2 THR 34 -8.616 0.842 -9.606 96 HG22 THR 34 2HG2 THR 34 -9.071 -0.664 -10.399 97 HG23 THR 34 3HG2 THR 34 -7.722 -0.639 -9.265 98 H ASP 35 H ASP 35 -11.094 1.621 -6.609 99 HA ASP 35 HA ASP 35 -10.203 3.944 -7.949 100 HB2 ASP 35 1HB ASP 35 -12.585 3.435 -7.498 101 HB3 ASP 35 2HB ASP 35 -12.300 3.689 -5.779 102 H MET 36 H MET 36 -10.119 2.909 -4.576 103 HA MET 36 HA MET 36 -9.019 5.296 -3.524 104 HB2 MET 36 1HB MET 36 -10.014 3.540 -2.098 105 HB3 MET 36 2HB MET 36 -8.678 2.467 -2.495 106 HG2 MET 36 1HG MET 36 -8.329 3.451 -0.328 107 HG3 MET 36 2HG MET 36 -7.118 4.049 -1.465 108 HE1 MET 36 1HE MET 36 -7.605 7.174 0.813 109 HE2 MET 36 2HE MET 36 -6.447 6.063 0.083 110 HE3 MET 36 3HE MET 36 -7.575 5.482 1.306 111 H LEU 37 H LEU 37 -7.545 2.346 -4.815 112 HA LEU 37 HA LEU 37 -4.857 3.079 -4.439 113 HB2 LEU 37 1HB LEU 37 -5.558 0.814 -5.061 114 HB3 LEU 37 2HB LEU 37 -6.098 1.408 -6.630 115 HG LEU 37 HG LEU 37 -3.630 2.151 -6.942 116 HD11 LEU 37 1HD1 LEU 37 -2.910 1.777 -4.645 117 HD12 LEU 37 2HD1 LEU 37 -2.005 0.759 -5.765 118 HD13 LEU 37 3HD1 LEU 37 -3.301 0.063 -4.790 119 HD21 LEU 37 1HD2 LEU 37 -4.715 0.412 -8.247 120 HD22 LEU 37 2HD2 LEU 37 -4.410 -0.762 -6.966 121 HD23 LEU 37 3HD2 LEU 37 -3.060 -0.047 -7.849 122 H GLN 38 H GLN 38 -7.135 3.724 -7.061 123 HA GLN 38 HA GLN 38 -5.338 4.995 -8.811 124 HB2 GLN 38 1HB GLN 38 -8.324 5.283 -8.487 125 HB3 GLN 38 2HB GLN 38 -7.412 6.049 -9.779 126 HG2 GLN 38 1HG GLN 38 -7.615 3.090 -9.278 127 HG3 GLN 38 2HG GLN 38 -8.476 3.993 -10.522 128 HE21 GLN 38 1HE2 GLN 38 -6.586 1.773 -10.761 129 HE22 GLN 38 2HE2 GLN 38 -5.309 2.342 -11.784 130 H THR 39 H THR 39 -6.954 6.096 -5.948 131 HA THR 39 HA THR 39 -6.485 8.889 -6.397 132 HB THR 39 HB THR 39 -6.929 7.487 -3.751 133 HG1 THR 39 HG1 THR 39 -8.550 7.581 -5.844 134 HG21 THR 39 1HG2 THR 39 -7.863 9.642 -3.056 135 HG22 THR 39 2HG2 THR 39 -7.503 10.318 -4.645 136 HG23 THR 39 3HG2 THR 39 -6.187 9.825 -3.578 137 H PHE 40 H PHE 40 -4.769 6.247 -4.843 138 HA PHE 40 HA PHE 40 -2.710 7.848 -3.704 139 HB2 PHE 40 1HB PHE 40 -3.218 5.584 -2.865 140 HB3 PHE 40 2HB PHE 40 -2.671 4.902 -4.395 141 HD1 PHE 40 HD1 PHE 40 -0.596 3.960 -4.363 142 HD2 PHE 40 HD2 PHE 40 -1.358 7.312 -1.851 143 HE1 PHE 40 HE1 PHE 40 1.714 3.852 -3.523 144 HE2 PHE 40 HE2 PHE 40 0.947 7.207 -1.004 145 HZ PHE 40 HZ PHE 40 2.491 5.478 -1.841 146 H VAL 41 H VAL 41 -3.182 6.300 -6.804 147 HA VAL 41 HA VAL 41 -0.655 6.149 -7.817 148 HB VAL 41 HB VAL 41 -3.193 6.855 -9.270 149 HG11 VAL 41 1HG1 VAL 41 -1.283 7.679 -10.560 150 HG12 VAL 41 2HG1 VAL 41 -2.038 6.289 -11.342 151 HG13 VAL 41 3HG1 VAL 41 -0.527 6.090 -10.451 152 HG21 VAL 41 1HG2 VAL 41 -1.616 4.298 -9.047 153 HG22 VAL 41 2HG2 VAL 41 -3.102 4.521 -9.971 154 HG23 VAL 41 3HG2 VAL 41 -3.127 4.656 -8.211 155 HA PRO 42 HA PRO 42 -0.704 10.776 -9.347 156 HB2 PRO 42 1HB PRO 42 -2.560 12.013 -7.406 157 HB3 PRO 42 2HB PRO 42 -2.369 12.318 -9.135 158 HG2 PRO 42 1HG PRO 42 -4.485 10.990 -8.187 159 HG3 PRO 42 2HG PRO 42 -3.739 10.565 -9.738 160 HD2 PRO 42 1HD PRO 42 -3.501 9.211 -7.082 161 HD3 PRO 42 2HD PRO 42 -3.619 8.506 -8.704 162 H TYR 43 H TYR 43 -1.240 9.932 -5.935 163 HA TYR 43 HA TYR 43 0.470 11.972 -4.922 164 HB2 TYR 43 1HB TYR 43 -0.765 9.492 -3.751 165 HB3 TYR 43 2HB TYR 43 0.459 10.391 -2.851 166 HD1 TYR 43 HD1 TYR 43 -2.930 10.631 -4.350 167 HD2 TYR 43 HD2 TYR 43 -0.060 12.425 -1.765 168 HE1 TYR 43 HE1 TYR 43 -4.644 12.193 -3.534 169 HE2 TYR 43 HE2 TYR 43 -1.768 13.987 -0.946 170 HH TYR 43 HH TYR 43 -5.086 13.596 -1.560 171 H ARG 44 H ARG 44 0.994 8.790 -6.198 172 HA ARG 44 HA ARG 44 3.428 8.117 -5.033 173 HB2 ARG 44 1HB ARG 44 2.609 7.636 -7.897 174 HB3 ARG 44 2HB ARG 44 3.901 6.804 -7.046 175 HG2 ARG 44 1HG ARG 44 2.271 5.841 -5.507 176 HG3 ARG 44 2HG ARG 44 0.971 6.677 -6.371 177 HD2 ARG 44 1HD ARG 44 2.793 4.503 -7.400 178 HD3 ARG 44 2HD ARG 44 1.037 4.448 -7.231 179 HE ARG 44 HE ARG 44 1.311 6.460 -8.952 180 HH11 ARG 44 1HH1 ARG 44 2.803 3.295 -8.909 181 HH12 ARG 44 2HH1 ARG 44 3.069 3.254 -10.622 182 HH21 ARG 44 1HH2 ARG 44 1.639 6.402 -11.212 183 HH22 ARG 44 2HH2 ARG 44 2.392 5.019 -11.934 184 H THR 45 H THR 45 2.844 9.956 -8.009 185 HA THR 45 HA THR 45 5.397 10.646 -8.684 186 HB THR 45 HB THR 45 3.004 12.483 -8.799 187 HG1 THR 45 HG1 THR 45 3.540 11.271 -11.120 188 HG21 THR 45 1HG2 THR 45 5.098 13.638 -9.274 189 HG22 THR 45 2HG2 THR 45 4.149 13.451 -10.749 190 HG23 THR 45 3HG2 THR 45 5.530 12.397 -10.449 191 H ALA 46 H ALA 46 3.311 12.384 -6.371 192 HA ALA 46 HA ALA 46 5.170 14.370 -5.662 193 HB1 ALA 46 1HB ALA 46 3.796 14.681 -3.655 194 HB2 ALA 46 2HB ALA 46 2.957 13.168 -3.995 195 HB3 ALA 46 3HB ALA 46 2.799 14.532 -5.102 196 H VAL 47 H VAL 47 4.545 11.155 -4.454 197 HA VAL 47 HA VAL 47 6.354 11.152 -2.287 198 HB VAL 47 HB VAL 47 5.303 8.865 -3.964 199 HG11 VAL 47 1HG1 VAL 47 6.820 8.723 -1.363 200 HG12 VAL 47 2HG1 VAL 47 7.429 8.219 -2.939 201 HG13 VAL 47 3HG1 VAL 47 6.074 7.364 -2.202 202 HG21 VAL 47 1HG2 VAL 47 4.545 9.874 -1.225 203 HG22 VAL 47 2HG2 VAL 47 3.877 8.441 -2.008 204 HG23 VAL 47 3HG2 VAL 47 3.593 10.038 -2.702 205 H GLU 48 H GLU 48 6.751 10.190 -5.688 206 HA GLU 48 HA GLU 48 9.385 9.201 -5.407 207 HB2 GLU 48 1HB GLU 48 8.077 10.338 -7.891 208 HB3 GLU 48 2HB GLU 48 9.514 9.331 -7.850 209 HG2 GLU 48 1HG GLU 48 8.183 7.483 -6.941 210 HG3 GLU 48 2HG GLU 48 6.741 8.498 -7.026 211 H LEU 49 H LEU 49 8.116 12.364 -6.355 212 HA LEU 49 HA LEU 49 10.636 13.536 -6.881 213 HB2 LEU 49 1HB LEU 49 7.883 14.570 -6.399 214 HB3 LEU 49 2HB LEU 49 9.221 15.701 -6.314 215 HG LEU 49 HG LEU 49 8.197 15.760 -8.517 216 HD11 LEU 49 1HD1 LEU 49 10.610 16.142 -8.349 217 HD12 LEU 49 2HD1 LEU 49 10.151 15.431 -9.894 218 HD13 LEU 49 3HD1 LEU 49 10.893 14.429 -8.649 219 HD21 LEU 49 1HD2 LEU 49 8.262 13.846 -10.023 220 HD22 LEU 49 2HD2 LEU 49 7.292 13.498 -8.591 221 HD23 LEU 49 3HD2 LEU 49 8.925 12.846 -8.732 222 H CYS 50 H CYS 50 8.593 13.441 -3.986 223 HA CYS 50 HA CYS 50 10.304 15.020 -2.374 224 HB2 CYS 50 1HB CYS 50 7.942 14.546 -1.803 225 HB3 CYS 50 2HB CYS 50 8.357 12.860 -1.527 226 H ALA 51 H ALA 51 10.311 11.669 -3.320 227 HA ALA 51 HA ALA 51 12.023 10.716 -1.230 228 HB1 ALA 51 1HB ALA 51 10.535 9.196 -2.454 229 HB2 ALA 51 2HB ALA 51 12.220 8.693 -2.577 230 HB3 ALA 51 3HB ALA 51 11.441 9.507 -3.935 231 H LEU 52 H LEU 52 12.437 12.192 -4.341 232 HA LEU 52 HA LEU 52 15.205 11.423 -4.603 233 HB2 LEU 52 1HB LEU 52 13.745 11.715 -6.575 234 HB3 LEU 52 2HB LEU 52 13.550 13.411 -6.172 235 HG LEU 52 HG LEU 52 15.994 13.729 -6.528 236 HD11 LEU 52 1HD1 LEU 52 16.760 11.470 -6.129 237 HD12 LEU 52 2HD1 LEU 52 17.223 11.986 -7.750 238 HD13 LEU 52 3HD1 LEU 52 15.859 10.890 -7.529 239 HD21 LEU 52 1HD2 LEU 52 15.883 13.657 -8.958 240 HD22 LEU 52 2HD2 LEU 52 14.368 14.246 -8.279 241 HD23 LEU 52 3HD2 LEU 52 14.483 12.590 -8.875 242 H GLU 53 H GLU 53 13.477 13.918 -3.057 243 HA GLU 53 HA GLU 53 15.356 16.025 -3.392 244 HB2 GLU 53 1HB GLU 53 12.866 16.167 -2.735 245 HB3 GLU 53 2HB GLU 53 13.419 15.829 -1.099 246 HG2 GLU 53 1HG GLU 53 13.139 18.225 -1.511 247 HG3 GLU 53 2HG GLU 53 14.807 17.807 -1.122 248 H HIS 54 H HIS 54 14.741 13.711 -0.782 249 HA HIS 54 HA HIS 54 17.279 14.551 0.471 250 HB2 HIS 54 1HB HIS 54 15.279 14.748 1.912 251 HB3 HIS 54 2HB HIS 54 14.948 13.038 1.688 252 HD1 HIS 54 HD1 HIS 54 17.321 15.381 3.432 253 HD2 HIS 54 HD2 HIS 54 16.389 11.329 3.330 254 HE1 HIS 54 HE1 HIS 54 18.518 14.360 5.393 255 HE2 HIS 54 HE2 HIS 54 18.032 11.891 5.246 256 H GLY 55 H GLY 55 15.818 12.176 -1.368 257 HA2 GLY 55 1HA GLY 55 16.694 10.259 -2.305 258 HA3 GLY 55 2HA GLY 55 18.067 10.370 -1.209 259 H GLY 56 H GLY 56 16.398 10.563 1.179 260 HA2 GLY 56 1HA GLY 56 14.848 8.077 1.048 261 HA3 GLY 56 2HA GLY 56 15.477 8.798 2.521 262 H LEU 57 H LEU 57 12.774 7.934 1.836 263 HA LEU 57 HA LEU 57 11.116 10.233 1.490 264 HB2 LEU 57 1HB LEU 57 10.592 7.398 2.342 265 HB3 LEU 57 2HB LEU 57 9.327 8.611 2.338 266 HG LEU 57 HG LEU 57 10.928 7.968 -0.126 267 HD11 LEU 57 1HD1 LEU 57 9.061 6.549 -0.820 268 HD12 LEU 57 2HD1 LEU 57 8.313 6.754 0.761 269 HD13 LEU 57 3HD1 LEU 57 9.855 5.911 0.619 270 HD21 LEU 57 1HD2 LEU 57 8.938 8.930 -1.233 271 HD22 LEU 57 2HD2 LEU 57 9.763 10.081 -0.185 272 HD23 LEU 57 3HD2 LEU 57 8.271 9.310 0.353 273 H ASP 58 H ASP 58 13.001 9.376 3.999 274 HA ASP 58 HA ASP 58 11.552 9.411 6.311 275 HB2 ASP 58 1HB ASP 58 14.272 10.525 5.696 276 HB3 ASP 58 2HB ASP 58 13.609 10.542 7.327 277 H THR 59 H THR 59 12.302 12.186 4.286 278 HA THR 59 HA THR 59 11.292 14.021 6.309 279 HB THR 59 HB THR 59 11.867 15.759 4.563 280 HG1 THR 59 HG1 THR 59 11.827 14.462 2.709 281 HG21 THR 59 1HG2 THR 59 14.058 13.882 5.462 282 HG22 THR 59 2HG2 THR 59 13.394 15.226 6.391 283 HG23 THR 59 3HG2 THR 59 14.295 15.539 4.908 284 H CYS 60 H CYS 60 9.853 12.055 4.168 285 HA CYS 60 HA CYS 60 7.968 14.005 3.077 286 HB2 CYS 60 1HB CYS 60 8.279 11.055 2.485 287 HB3 CYS 60 2HB CYS 60 7.270 12.191 1.597 288 H ASP 61 H ASP 61 7.114 14.315 5.277 289 HA ASP 61 HA ASP 61 5.408 12.112 6.216 290 HB2 ASP 61 1HB ASP 61 7.043 13.288 7.784 291 HB3 ASP 61 2HB ASP 61 6.002 14.705 7.656 292 H GLY 62 H GLY 62 3.216 12.607 6.860 293 HA2 GLY 62 1HA GLY 62 1.824 14.137 4.907 294 HA3 GLY 62 2HA GLY 62 1.114 13.376 6.326 295 H GLY 63 H GLY 63 1.930 16.282 4.867 296 HA2 GLY 63 1HA GLY 63 1.078 18.331 5.866 297 HA3 GLY 63 2HA GLY 63 1.627 17.724 7.425 298 H SER 64 H SER 64 3.845 16.969 5.027 299 HA SER 64 HA SER 64 5.328 19.475 5.323 300 HB2 SER 64 1HB SER 64 6.505 16.736 5.860 301 HB3 SER 64 2HB SER 64 7.375 18.269 5.910 302 HG SER 64 HG SER 64 5.162 17.601 7.569 303 H ASN 65 H ASN 65 6.928 19.804 3.698 304 HA ASN 65 HA ASN 65 7.854 19.713 1.636 305 HB2 ASN 65 1HB ASN 65 7.457 16.763 2.111 306 HB3 ASN 65 2HB ASN 65 8.219 17.386 0.652 307 HD21 ASN 65 1HD2 ASN 65 10.212 16.438 1.122 308 HD22 ASN 65 2HD2 ASN 65 11.239 17.033 2.386 309 H GLY 66 H GLY 66 5.027 20.196 1.789 310 HA2 GLY 66 1HA GLY 66 3.463 20.707 0.157 311 HA3 GLY 66 2HA GLY 66 4.456 19.848 -1.015 312 H ILE 67 H ILE 67 4.074 17.819 1.537 313 HA ILE 67 HA ILE 67 1.968 16.339 0.194 314 HB ILE 67 HB ILE 67 3.685 15.593 2.575 315 HG12 ILE 67 1HG1 ILE 67 3.836 14.755 -0.330 316 HG13 ILE 67 2HG1 ILE 67 4.966 15.830 0.489 317 HG21 ILE 67 1HG2 ILE 67 1.805 13.898 0.930 318 HG22 ILE 67 2HG2 ILE 67 1.542 14.420 2.594 319 HG23 ILE 67 3HG2 ILE 67 2.864 13.314 2.214 320 HD11 ILE 67 1HD1 ILE 67 4.502 12.931 1.144 321 HD12 ILE 67 2HD1 ILE 67 5.647 14.007 1.948 322 HD13 ILE 67 3HD1 ILE 67 5.871 13.591 0.247 323 HA PRO 68 HA PRO 68 -1.099 18.198 2.810 324 HB2 PRO 68 1HB PRO 68 -2.616 15.717 2.210 325 HB3 PRO 68 2HB PRO 68 -3.082 17.404 1.979 326 HG2 PRO 68 1HG PRO 68 -2.411 15.885 -0.099 327 HG3 PRO 68 2HG PRO 68 -1.924 17.593 -0.015 328 HD2 PRO 68 1HD PRO 68 -0.303 15.126 0.499 329 HD3 PRO 68 2HD PRO 68 0.166 16.634 -0.322 330 H SER 69 H SER 69 -2.277 17.767 4.748 331 HA SER 69 HA SER 69 -0.781 16.098 6.567 332 HB2 SER 69 1HB SER 69 -2.477 17.111 8.225 333 HB3 SER 69 2HB SER 69 -1.352 18.224 7.446 334 HG SER 69 HG SER 69 -3.762 18.703 7.506 335 HA PRO 70 HA PRO 70 -3.151 12.509 6.098 336 HB2 PRO 70 1HB PRO 70 -3.301 11.602 8.707 337 HB3 PRO 70 2HB PRO 70 -1.924 11.360 7.629 338 HG2 PRO 70 1HG PRO 70 -2.322 13.403 9.771 339 HG3 PRO 70 2HG PRO 70 -0.857 12.505 9.333 340 HD2 PRO 70 1HD PRO 70 -1.208 15.065 8.595 341 HD3 PRO 70 2HD PRO 70 -0.393 13.898 7.534 342 H THR 71 H THR 71 -5.202 12.396 5.692 343 HA THR 71 HA THR 71 -7.159 13.216 7.709 344 HB THR 71 HB THR 71 -6.797 15.108 6.101 345 HG1 THR 71 HG1 THR 71 -9.331 14.624 5.405 346 HG21 THR 71 1HG2 THR 71 -6.325 13.812 4.085 347 HG22 THR 71 2HG2 THR 71 -7.687 14.902 3.825 348 HG23 THR 71 3HG2 THR 71 -7.972 13.183 4.094 349 H THR 72 H THR 72 -9.430 12.578 6.827 350 HA THR 72 HA THR 72 -9.191 9.916 5.608 351 HB THR 72 HB THR 72 -11.152 9.284 7.118 352 HG1 THR 72 HG1 THR 72 -10.186 11.276 8.868 353 HG21 THR 72 1HG2 THR 72 -9.686 8.708 8.988 354 HG22 THR 72 2HG2 THR 72 -8.478 9.851 8.397 355 HG23 THR 72 3HG2 THR 72 -8.885 8.425 7.443 356 H THR 73 H THR 73 -10.389 9.710 3.838 357 HA THR 73 HA THR 73 -12.469 11.581 3.219 358 HB THR 73 HB THR 73 -12.802 10.156 1.190 359 HG1 THR 73 HG1 THR 73 -11.315 8.453 0.853 360 HG21 THR 73 1HG2 THR 73 -10.617 10.660 0.165 361 HG22 THR 73 2HG2 THR 73 -9.956 10.986 1.766 362 HG23 THR 73 3HG2 THR 73 -11.231 12.013 1.113 363 H ARG 74 H ARG 74 -14.593 10.330 2.293 364 HA ARG 74 HA ARG 74 -16.000 9.789 4.619 365 HB2 ARG 74 1HB ARG 74 -17.060 10.565 2.563 366 HB3 ARG 74 2HB ARG 74 -16.717 9.026 1.788 367 HG2 ARG 74 1HG ARG 74 -18.216 7.883 3.250 368 HG3 ARG 74 2HG ARG 74 -18.453 9.334 4.224 369 HD2 ARG 74 1HD ARG 74 -20.353 9.057 2.767 370 HD3 ARG 74 2HD ARG 74 -19.421 10.451 2.225 371 HE ARG 74 HE ARG 74 -19.495 7.819 0.907 372 HH11 ARG 74 1HH1 ARG 74 -18.766 11.247 0.824 373 HH12 ARG 74 2HH1 ARG 74 -18.566 11.289 -0.895 374 HH21 ARG 74 1HH2 ARG 74 -19.248 7.877 -1.365 375 HH22 ARG 74 2HH2 ARG 74 -18.843 9.379 -2.142 376 H TYR 75 H TYR 75 -14.524 7.488 2.356 377 HA TYR 75 HA TYR 75 -15.673 5.266 3.838 378 HB2 TYR 75 1HB TYR 75 -13.860 5.225 1.424 379 HB3 TYR 75 2HB TYR 75 -14.721 3.848 2.111 380 HD1 TYR 75 HD1 TYR 75 -14.776 5.394 -0.722 381 HD2 TYR 75 HD2 TYR 75 -17.378 5.090 2.628 382 HE1 TYR 75 HE1 TYR 75 -16.699 5.860 -2.179 383 HE2 TYR 75 HE2 TYR 75 -19.305 5.550 1.180 384 HH TYR 75 HH TYR 75 -19.139 5.444 -2.197 385 H VAL 76 H VAL 76 -12.909 7.130 4.131 386 HA VAL 76 HA VAL 76 -11.254 4.895 5.040 387 HB VAL 76 HB VAL 76 -10.565 7.833 4.835 388 HG11 VAL 76 1HG1 VAL 76 -9.299 6.655 6.586 389 HG12 VAL 76 2HG1 VAL 76 -8.269 7.139 5.238 390 HG13 VAL 76 3HG1 VAL 76 -8.786 5.460 5.395 391 HG21 VAL 76 1HG2 VAL 76 -10.895 6.798 2.650 392 HG22 VAL 76 2HG2 VAL 76 -9.784 5.500 3.089 393 HG23 VAL 76 3HG2 VAL 76 -9.188 7.152 2.925 394 H SER 77 H SER 77 -11.065 4.371 7.117 395 HA SER 77 HA SER 77 -12.425 6.000 9.096 396 HB2 SER 77 1HB SER 77 -12.701 3.509 9.053 397 HB3 SER 77 2HB SER 77 -10.991 3.353 9.470 398 HG SER 77 HG SER 77 -12.749 4.894 11.058 399 H ALA 78 H ALA 78 -9.154 4.905 8.322 400 HA ALA 78 HA ALA 78 -8.030 7.162 9.690 401 HB1 ALA 78 1HB ALA 78 -6.622 5.893 11.229 402 HB2 ALA 78 2HB ALA 78 -7.410 4.399 10.724 403 HB3 ALA 78 3HB ALA 78 -8.330 5.635 11.579 404 H MET 79 H MET 79 -5.965 7.613 9.019 405 HA MET 79 HA MET 79 -4.257 5.724 7.788 406 HB2 MET 79 1HB MET 79 -4.171 6.696 5.529 407 HB3 MET 79 2HB MET 79 -5.734 5.973 5.872 408 HG2 MET 79 1HG MET 79 -6.694 8.165 6.257 409 HG3 MET 79 2HG MET 79 -5.122 8.917 5.999 410 HE1 MET 79 1HE MET 79 -4.482 8.265 2.205 411 HE2 MET 79 2HE MET 79 -3.952 7.241 3.538 412 HE3 MET 79 3HE MET 79 -3.875 8.996 3.689 413 H SER 80 H SER 80 -2.195 6.457 7.727 414 HA SER 80 HA SER 80 -1.751 9.313 8.238 415 HB2 SER 80 1HB SER 80 -0.024 8.647 9.950 416 HB3 SER 80 2HB SER 80 -1.687 8.298 10.423 417 HG SER 80 HG SER 80 -1.245 6.243 10.433 418 H VAL 81 H VAL 81 0.273 10.104 7.593 419 HA VAL 81 HA VAL 81 1.705 8.360 5.711 420 HB VAL 81 HB VAL 81 1.764 11.378 5.803 421 HG11 VAL 81 1HG1 VAL 81 3.698 10.413 4.725 422 HG12 VAL 81 2HG1 VAL 81 2.659 11.172 3.519 423 HG13 VAL 81 3HG1 VAL 81 2.663 9.418 3.700 424 HG21 VAL 81 1HG2 VAL 81 0.072 9.599 4.061 425 HG22 VAL 81 2HG2 VAL 81 0.251 11.341 3.868 426 HG23 VAL 81 3HG2 VAL 81 -0.503 10.688 5.323 427 H ALA 82 H ALA 82 3.621 7.654 6.437 428 HA ALA 82 HA ALA 82 5.133 9.366 8.275 429 HB1 ALA 82 1HB ALA 82 5.692 7.443 9.657 430 HB2 ALA 82 2HB ALA 82 4.679 6.410 8.649 431 HB3 ALA 82 3HB ALA 82 3.947 7.691 9.616 432 H LYS 83 H LYS 83 6.853 9.812 7.247 433 HA LYS 83 HA LYS 83 8.757 9.715 5.928 434 HB2 LYS 83 1HB LYS 83 8.869 6.762 6.536 435 HB3 LYS 83 2HB LYS 83 10.206 7.873 6.290 436 HG2 LYS 83 1HG LYS 83 8.359 7.922 8.669 437 HG3 LYS 83 2HG LYS 83 9.932 7.129 8.636 438 HD2 LYS 83 1HD LYS 83 10.988 9.299 8.168 439 HD3 LYS 83 2HD LYS 83 9.409 10.077 8.252 440 HE2 LYS 83 1HE LYS 83 9.182 9.282 10.581 441 HE3 LYS 83 2HE LYS 83 10.799 8.589 10.478 442 HZ1 LYS 83 1HZ LYS 83 10.154 11.469 10.166 443 HZ2 LYS 83 2HZ LYS 83 11.700 10.786 10.129 444 HZ3 LYS 83 3HZ LYS 83 10.799 10.757 11.558 445 H GLY 84 H GLY 84 6.412 9.544 4.502 446 HA2 GLY 84 1HA GLY 84 5.751 9.148 2.326 447 HA3 GLY 84 2HA GLY 84 7.189 8.161 2.105 448 H VAL 85 H VAL 85 6.471 6.511 4.440 449 HA VAL 85 HA VAL 85 4.808 4.560 3.214 450 HB VAL 85 HB VAL 85 5.513 4.758 6.145 451 HG11 VAL 85 1HG1 VAL 85 3.783 3.128 5.694 452 HG12 VAL 85 2HG1 VAL 85 5.290 2.306 6.099 453 HG13 VAL 85 3HG1 VAL 85 4.763 2.405 4.419 454 HG21 VAL 85 1HG2 VAL 85 7.554 4.906 4.890 455 HG22 VAL 85 2HG2 VAL 85 7.074 3.549 3.872 456 HG23 VAL 85 3HG2 VAL 85 7.430 3.287 5.579 457 H VAL 86 H VAL 86 2.575 4.012 3.662 458 HA VAL 86 HA VAL 86 1.204 5.925 5.384 459 HB VAL 86 HB VAL 86 -0.657 6.135 3.774 460 HG11 VAL 86 1HG1 VAL 86 1.034 7.876 3.891 461 HG12 VAL 86 2HG1 VAL 86 0.444 7.691 2.239 462 HG13 VAL 86 3HG1 VAL 86 2.014 7.027 2.696 463 HG21 VAL 86 1HG2 VAL 86 -0.280 4.096 2.482 464 HG22 VAL 86 2HG2 VAL 86 1.202 4.793 1.819 465 HG23 VAL 86 3HG2 VAL 86 -0.360 5.517 1.440 466 H SER 87 H SER 87 0.265 4.800 6.890 467 HA SER 87 HA SER 87 -0.802 2.143 6.261 468 HB2 SER 87 1HB SER 87 -0.311 3.454 8.948 469 HB3 SER 87 2HB SER 87 -0.849 1.791 8.703 470 HG SER 87 HG SER 87 1.335 2.247 7.223 471 H LEU 88 H LEU 88 -2.877 1.772 6.065 472 HA LEU 88 HA LEU 88 -4.771 3.836 6.989 473 HB2 LEU 88 1HB LEU 88 -5.102 1.908 4.684 474 HB3 LEU 88 2HB LEU 88 -6.263 3.123 5.190 475 HG LEU 88 HG LEU 88 -4.316 4.798 4.672 476 HD11 LEU 88 1HD1 LEU 88 -2.565 3.196 4.272 477 HD12 LEU 88 2HD1 LEU 88 -2.931 4.048 2.773 478 HD13 LEU 88 3HD1 LEU 88 -3.525 2.405 3.022 479 HD21 LEU 88 1HD2 LEU 88 -6.437 4.762 3.509 480 HD22 LEU 88 2HD2 LEU 88 -5.901 3.401 2.524 481 HD23 LEU 88 3HD2 LEU 88 -5.117 4.972 2.358 482 H THR 89 H THR 89 -6.651 3.131 8.028 483 HA THR 89 HA THR 89 -6.784 0.254 8.621 484 HB THR 89 HB THR 89 -7.167 2.425 10.694 485 HG1 THR 89 HG1 THR 89 -4.902 1.179 9.746 486 HG21 THR 89 1HG2 THR 89 -7.053 0.559 12.288 487 HG22 THR 89 2HG2 THR 89 -6.917 -0.577 10.947 488 HG23 THR 89 3HG2 THR 89 -8.394 0.361 11.161 489 H GLY 90 H GLY 90 -8.809 -0.566 8.941 490 HA2 GLY 90 1HA GLY 90 -11.055 -0.792 8.421 491 HA3 GLY 90 2HA GLY 90 -11.212 0.693 9.345 492 H GLN 91 H GLN 91 -9.789 0.012 6.163 493 HA GLN 91 HA GLN 91 -11.078 2.424 5.174 494 HB2 GLN 91 1HB GLN 91 -8.595 1.426 4.814 495 HB3 GLN 91 2HB GLN 91 -9.388 0.752 3.397 496 HG2 GLN 91 1HG GLN 91 -9.409 3.676 4.086 497 HG3 GLN 91 2HG GLN 91 -8.192 2.921 3.059 498 HE21 GLN 91 1HE2 GLN 91 -11.486 3.977 3.303 499 HE22 GLN 91 2HE2 GLN 91 -11.877 3.789 1.631 500 H GLU 92 H GLU 92 -12.897 2.380 4.026 501 HA GLU 92 HA GLU 92 -14.764 1.628 2.995 502 HB2 GLU 92 1HB GLU 92 -12.739 -0.070 1.545 503 HB3 GLU 92 2HB GLU 92 -14.411 0.130 1.045 504 HG2 GLU 92 1HG GLU 92 -13.770 2.669 1.104 505 HG3 GLU 92 2HG GLU 92 -12.149 2.022 0.891 506 H SER 93 H SER 93 -14.416 -1.318 1.861 507 HA SER 93 HA SER 93 -16.057 -2.567 3.817 508 HB2 SER 93 1HB SER 93 -16.073 -3.005 1.320 509 HB3 SER 93 2HB SER 93 -14.566 -3.890 1.543 510 HG SER 93 HG SER 93 -16.117 -4.924 3.314 511 H LEU 94 H LEU 94 -12.743 -2.089 3.603 512 HA LEU 94 HA LEU 94 -11.904 -4.622 4.710 513 HB2 LEU 94 1HB LEU 94 -10.289 -2.102 4.321 514 HB3 LEU 94 2HB LEU 94 -9.668 -3.720 4.599 515 HG LEU 94 HG LEU 94 -11.142 -2.803 2.127 516 HD11 LEU 94 1HD1 LEU 94 -8.240 -3.449 2.600 517 HD12 LEU 94 2HD1 LEU 94 -8.922 -1.864 2.242 518 HD13 LEU 94 3HD1 LEU 94 -8.970 -3.140 1.026 519 HD21 LEU 94 1HD2 LEU 94 -10.531 -4.991 1.208 520 HD22 LEU 94 2HD2 LEU 94 -11.598 -5.144 2.603 521 HD23 LEU 94 3HD2 LEU 94 -9.872 -5.463 2.773 522 H ASN 95 H ASN 95 -13.779 -3.278 6.240 523 HA ASN 95 HA ASN 95 -12.863 -1.774 8.387 524 HB2 ASN 95 1HB ASN 95 -15.249 -2.246 7.869 525 HB3 ASN 95 2HB ASN 95 -15.016 -3.901 8.418 526 HD21 ASN 95 1HD2 ASN 95 -15.282 -0.577 9.371 527 HD22 ASN 95 2HD2 ASN 95 -15.495 -0.872 11.064 528 H GLY 96 H GLY 96 -11.699 -2.221 10.167 529 HA2 GLY 96 1HA GLY 96 -10.666 -3.499 11.820 530 HA3 GLY 96 2HA GLY 96 -11.270 -4.952 11.038 531 H LEU 97 H LEU 97 -10.063 -3.644 8.474 532 HA LEU 97 HA LEU 97 -7.572 -5.113 8.745 533 HB2 LEU 97 1HB LEU 97 -9.034 -5.605 6.865 534 HB3 LEU 97 2HB LEU 97 -8.997 -3.926 6.367 535 HG LEU 97 HG LEU 97 -6.425 -5.459 6.436 536 HD11 LEU 97 1HD1 LEU 97 -6.856 -6.167 4.101 537 HD12 LEU 97 2HD1 LEU 97 -8.529 -5.639 4.282 538 HD13 LEU 97 3HD1 LEU 97 -7.911 -6.963 5.268 539 HD21 LEU 97 1HD2 LEU 97 -7.534 -3.307 4.631 540 HD22 LEU 97 2HD2 LEU 97 -5.916 -4.003 4.534 541 HD23 LEU 97 3HD2 LEU 97 -6.390 -3.065 5.950 542 H SER 98 H SER 98 -5.590 -4.249 8.654 543 HA SER 98 HA SER 98 -5.361 -1.354 8.174 544 HB2 SER 98 1HB SER 98 -4.681 -2.037 10.457 545 HB3 SER 98 2HB SER 98 -3.512 -3.160 9.763 546 HG SER 98 HG SER 98 -2.972 -0.775 10.417 547 H VAL 99 H VAL 99 -4.447 -0.848 6.304 548 HA VAL 99 HA VAL 99 -2.729 -2.864 5.023 549 HB VAL 99 HB VAL 99 -4.719 -2.533 3.700 550 HG11 VAL 99 1HG1 VAL 99 -4.039 0.396 3.730 551 HG12 VAL 99 2HG1 VAL 99 -5.449 -0.376 4.459 552 HG13 VAL 99 3HG1 VAL 99 -5.267 -0.344 2.705 553 HG21 VAL 99 1HG2 VAL 99 -2.648 -2.879 2.478 554 HG22 VAL 99 2HG2 VAL 99 -2.364 -1.138 2.441 555 HG23 VAL 99 3HG2 VAL 99 -3.738 -1.826 1.575 556 H VAL 100 H VAL 100 -0.687 -2.332 4.576 557 HA VAL 100 HA VAL 100 0.084 0.454 5.120 558 HB VAL 100 HB VAL 100 1.780 -2.017 5.499 559 HG11 VAL 100 1HG1 VAL 100 2.280 0.862 6.247 560 HG12 VAL 100 2HG1 VAL 100 3.095 -0.042 4.972 561 HG13 VAL 100 3HG1 VAL 100 3.320 -0.501 6.659 562 HG21 VAL 100 1HG2 VAL 100 0.339 -0.317 7.528 563 HG22 VAL 100 2HG2 VAL 100 1.533 -1.551 7.917 564 HG23 VAL 100 3HG2 VAL 100 0.016 -2.006 7.144 565 H MET 101 H MET 101 0.521 1.466 3.309 566 HA MET 101 HA MET 101 1.801 0.040 1.088 567 HB2 MET 101 1HB MET 101 -0.077 1.518 0.520 568 HB3 MET 101 2HB MET 101 0.743 2.872 1.281 569 HG2 MET 101 1HG MET 101 1.096 3.168 -0.999 570 HG3 MET 101 2HG MET 101 2.606 2.498 -0.392 571 HE1 MET 101 1HE MET 101 -0.526 0.211 -2.883 572 HE2 MET 101 2HE MET 101 -0.601 1.929 -2.495 573 HE3 MET 101 3HE MET 101 -0.846 0.726 -1.229 574 H THR 102 H THR 102 3.951 -0.102 1.224 575 HA THR 102 HA THR 102 5.414 2.131 2.473 576 HB THR 102 HB THR 102 6.427 -0.693 2.200 577 HG1 THR 102 HG1 THR 102 4.592 -0.830 3.482 578 HG21 THR 102 1HG2 THR 102 8.082 1.085 2.632 579 HG22 THR 102 2HG2 THR 102 7.949 -0.048 3.976 580 HG23 THR 102 3HG2 THR 102 7.188 1.537 4.082 581 HA PRO 103 HA PRO 103 6.861 2.410 -1.887 582 HB2 PRO 103 1HB PRO 103 7.627 5.078 -0.882 583 HB3 PRO 103 2HB PRO 103 6.697 4.646 -2.322 584 HG2 PRO 103 1HG PRO 103 5.532 5.763 -0.170 585 HG3 PRO 103 2HG PRO 103 4.699 4.553 -1.169 586 HD2 PRO 103 1HD PRO 103 6.022 4.233 1.498 587 HD3 PRO 103 2HD PRO 103 4.522 3.495 0.880 588 H GLY 104 H GLY 104 8.869 1.773 -2.408 589 HA2 GLY 104 1HA GLY 104 11.173 1.648 -2.396 590 HA3 GLY 104 2HA GLY 104 11.195 2.868 -1.131 591 H TRP 105 H TRP 105 12.985 1.359 -0.497 592 HA TRP 105 HA TRP 105 12.243 -0.096 1.794 593 HB2 TRP 105 1HB TRP 105 12.869 -2.359 1.160 594 HB3 TRP 105 2HB TRP 105 11.573 -1.803 0.110 595 HD1 TRP 105 HD1 TRP 105 12.331 -1.112 -2.454 596 HE1 TRP 105 HE1 TRP 105 14.217 -2.075 -3.918 597 HE3 TRP 105 HE3 TRP 105 15.134 -3.341 1.194 598 HZ2 TRP 105 HZ2 TRP 105 16.578 -3.580 -3.571 599 HZ3 TRP 105 HZ3 TRP 105 17.192 -4.524 0.544 600 HH2 TRP 105 HH2 TRP 105 17.896 -4.641 -1.790 601 H ASP 106 H ASP 106 14.499 0.907 -0.580 602 HA ASP 106 HA ASP 106 16.585 1.060 1.460 603 HB2 ASP 106 1HB ASP 106 17.128 -0.921 0.131 604 HB3 ASP 106 2HB ASP 106 16.968 0.007 -1.356 605 H ASN 107 H ASN 107 17.680 2.963 1.404 606 HA ASN 107 HA ASN 107 16.393 5.110 0.094 607 HB2 ASN 107 1HB ASN 107 19.024 5.053 1.578 608 HB3 ASN 107 2HB ASN 107 18.196 6.518 1.065 609 HD21 ASN 107 1HD2 ASN 107 18.921 5.726 3.718 610 HD22 ASN 107 2HD2 ASN 107 17.456 5.648 4.631 611 H ALA 108 H ALA 108 19.144 3.179 -0.788 612 HA ALA 108 HA ALA 108 20.104 5.124 -2.705 613 HB1 ALA 108 1HB ALA 108 20.965 2.279 -2.211 614 HB2 ALA 108 2HB ALA 108 21.714 3.726 -1.539 615 HB3 ALA 108 3HB ALA 108 21.775 3.429 -3.274 616 H ASN 109 H ASN 109 18.116 2.260 -2.633 617 HA ASN 109 HA ASN 109 17.926 2.104 -5.521 618 HB2 ASN 109 1HB ASN 109 16.617 0.602 -3.262 619 HB3 ASN 109 2HB ASN 109 16.039 0.430 -4.915 620 HD21 ASN 109 1HD2 ASN 109 16.608 -1.744 -4.955 621 HD22 ASN 109 2HD2 ASN 109 18.252 -2.265 -5.076 622 H GLY 110 H GLY 110 16.683 4.095 -3.228 623 HA2 GLY 110 1HA GLY 110 15.125 5.758 -3.319 624 HA3 GLY 110 2HA GLY 110 14.982 5.417 -5.032 625 H VAL 111 H VAL 111 13.014 4.934 -5.654 626 HA VAL 111 HA VAL 111 11.237 3.489 -3.821 627 HB VAL 111 HB VAL 111 10.876 5.904 -3.498 628 HG11 VAL 111 1HG1 VAL 111 11.496 6.725 -5.680 629 HG12 VAL 111 2HG1 VAL 111 9.867 7.262 -5.265 630 HG13 VAL 111 3HG1 VAL 111 10.094 5.934 -6.402 631 HG21 VAL 111 1HG2 VAL 111 8.440 5.924 -3.797 632 HG22 VAL 111 2HG2 VAL 111 9.017 4.399 -3.122 633 HG23 VAL 111 3HG2 VAL 111 8.567 4.496 -4.825 634 H THR 112 H THR 112 12.493 2.338 -5.955 635 HA THR 112 HA THR 112 10.748 2.370 -8.260 636 HB THR 112 HB THR 112 12.294 0.549 -9.080 637 HG1 THR 112 HG1 THR 112 13.205 -0.325 -7.306 638 HG21 THR 112 1HG2 THR 112 14.187 2.070 -9.455 639 HG22 THR 112 2HG2 THR 112 13.565 3.148 -8.205 640 HG23 THR 112 3HG2 THR 112 12.644 2.892 -9.687 641 H GLY 113 H GLY 113 9.505 1.557 -5.801 642 HA2 GLY 113 1HA GLY 113 8.030 -0.645 -6.635 643 HA3 GLY 113 2HA GLY 113 9.304 -1.255 -5.587 644 H TRP 114 H TRP 114 6.542 -1.448 -5.031 645 HA TRP 114 HA TRP 114 6.408 0.205 -2.600 646 HB2 TRP 114 1HB TRP 114 4.145 -0.521 -4.474 647 HB3 TRP 114 2HB TRP 114 3.900 0.141 -2.860 648 HD1 TRP 114 HD1 TRP 114 4.202 2.730 -2.546 649 HE1 TRP 114 HE1 TRP 114 4.600 4.683 -4.176 650 HE3 TRP 114 HE3 TRP 114 5.364 0.064 -6.755 651 HZ2 TRP 114 HZ2 TRP 114 5.306 5.047 -6.884 652 HZ3 TRP 114 HZ3 TRP 114 5.881 1.291 -8.823 653 HH2 TRP 114 HH2 TRP 114 5.853 3.732 -8.884 654 H ALA 115 H ALA 115 6.405 -1.006 -0.821 655 HA ALA 115 HA ALA 115 5.704 -3.833 -1.028 656 HB1 ALA 115 1HB ALA 115 6.886 -2.300 1.282 657 HB2 ALA 115 2HB ALA 115 7.788 -3.264 0.119 658 HB3 ALA 115 3HB ALA 115 6.647 -4.043 1.214 659 H ARG 116 H ARG 116 3.723 -4.392 -0.697 660 HA ARG 116 HA ARG 116 1.984 -2.642 0.911 661 HB2 ARG 116 1HB ARG 116 1.221 -4.568 -1.290 662 HB3 ARG 116 2HB ARG 116 0.133 -3.468 -0.447 663 HG2 ARG 116 1HG ARG 116 1.097 -1.571 -1.435 664 HG3 ARG 116 2HG ARG 116 2.524 -2.464 -1.956 665 HD2 ARG 116 1HD ARG 116 1.204 -3.683 -3.585 666 HD3 ARG 116 2HD ARG 116 -0.266 -2.892 -3.015 667 HE ARG 116 HE ARG 116 1.119 -0.772 -3.733 668 HH11 ARG 116 1HH1 ARG 116 0.882 -3.855 -5.394 669 HH12 ARG 116 2HH1 ARG 116 1.079 -3.155 -6.973 670 HH21 ARG 116 1HH2 ARG 116 1.361 0.135 -5.816 671 HH22 ARG 116 2HH2 ARG 116 1.351 -0.896 -7.210 672 H ASN 117 H ASN 117 0.849 -3.434 2.591 673 HA ASN 117 HA ASN 117 0.960 -6.325 3.090 674 HB2 ASN 117 1HB ASN 117 1.596 -4.169 5.113 675 HB3 ASN 117 2HB ASN 117 1.433 -5.875 5.483 676 HD21 ASN 117 1HD2 ASN 117 3.019 -7.322 4.768 677 HD22 ASN 117 2HD2 ASN 117 4.594 -6.774 4.305 678 H CYS 118 H CYS 118 -0.902 -7.180 3.757 679 HA CYS 118 HA CYS 118 -3.022 -5.351 4.676 680 HB2 CYS 118 1HB CYS 118 -3.109 -7.936 3.146 681 HB3 CYS 118 2HB CYS 118 -4.503 -7.400 4.080 682 H ASN 119 H ASN 119 -3.315 -5.423 6.828 683 HA ASN 119 HA ASN 119 -2.955 -8.041 8.143 684 HB2 ASN 119 1HB ASN 119 -1.380 -6.381 8.981 685 HB3 ASN 119 2HB ASN 119 -2.696 -5.252 9.288 686 HD21 ASN 119 1HD2 ASN 119 -1.099 -8.147 10.346 687 HD22 ASN 119 2HD2 ASN 119 -1.851 -8.230 11.899 688 H ILE 120 H ILE 120 -4.930 -8.909 8.126 689 HA ILE 120 HA ILE 120 -6.957 -7.534 9.709 690 HB ILE 120 HB ILE 120 -7.716 -7.142 7.481 691 HG12 ILE 120 1HG1 ILE 120 -9.849 -8.397 7.407 692 HG13 ILE 120 2HG1 ILE 120 -9.236 -9.472 8.654 693 HG21 ILE 120 1HG2 ILE 120 -6.407 -8.736 6.268 694 HG22 ILE 120 2HG2 ILE 120 -8.109 -8.970 5.867 695 HG23 ILE 120 3HG2 ILE 120 -7.304 -10.077 6.977 696 HD11 ILE 120 1HD1 ILE 120 -9.170 -7.650 10.235 697 HD12 ILE 120 2HD1 ILE 120 -10.774 -7.766 9.517 698 HD13 ILE 120 3HD1 ILE 120 -9.658 -6.511 8.981 699 H GLN 121 H GLN 121 -7.035 -8.797 11.477 700 HA GLN 121 HA GLN 121 -6.012 -11.466 11.362 701 HB2 GLN 121 1HB GLN 121 -6.238 -11.497 13.773 702 HB3 GLN 121 2HB GLN 121 -5.521 -9.979 13.263 703 HG2 GLN 121 1HG GLN 121 -8.415 -10.349 14.021 704 HG3 GLN 121 2HG GLN 121 -7.159 -9.738 15.092 705 HE21 GLN 121 1HE2 GLN 121 -6.285 -7.684 14.700 706 HE22 GLN 121 2HE2 GLN 121 -7.101 -6.527 13.710 707 H SER 122 H SER 122 -9.243 -10.074 11.692 708 HA SER 122 HA SER 122 -10.327 -12.681 12.404 709 HB2 SER 122 1HB SER 122 -12.466 -11.330 12.659 710 HB3 SER 122 2HB SER 122 -11.139 -10.876 13.734 711 HG SER 122 HG SER 122 -12.076 -9.550 11.407 712 H ASP 123 H ASP 123 -9.845 -10.940 9.534 713 HA ASP 123 HA ASP 123 -12.014 -12.392 8.210 714 HB2 ASP 123 1HB ASP 123 -11.610 -9.403 8.009 715 HB3 ASP 123 2HB ASP 123 -12.695 -10.337 6.986 716 H SER 124 H SER 124 -10.199 -13.632 7.358 717 HA SER 124 HA SER 124 -8.192 -12.543 5.735 718 HB2 SER 124 1HB SER 124 -9.500 -15.270 5.625 719 HB3 SER 124 2HB SER 124 -8.023 -14.833 4.767 720 HG SER 124 HG SER 124 -6.931 -14.967 6.564 721 H ALA 125 H ALA 125 -11.562 -13.052 5.088 722 HA ALA 125 HA ALA 125 -11.527 -13.132 2.286 723 HB1 ALA 125 1HB ALA 125 -13.845 -12.380 2.399 724 HB2 ALA 125 2HB ALA 125 -13.627 -11.949 4.094 725 HB3 ALA 125 3HB ALA 125 -13.522 -13.635 3.592 726 H LEU 126 H LEU 126 -11.379 -10.441 4.540 727 HA LEU 126 HA LEU 126 -11.647 -8.417 2.551 728 HB2 LEU 126 1HB LEU 126 -10.491 -8.275 5.335 729 HB3 LEU 126 2HB LEU 126 -10.853 -6.889 4.325 730 HG LEU 126 HG LEU 126 -12.865 -8.860 5.414 731 HD11 LEU 126 1HD1 LEU 126 -12.336 -5.978 6.112 732 HD12 LEU 126 2HD1 LEU 126 -11.981 -7.376 7.124 733 HD13 LEU 126 3HD1 LEU 126 -13.653 -6.965 6.741 734 HD21 LEU 126 1HD2 LEU 126 -13.563 -8.062 3.241 735 HD22 LEU 126 2HD2 LEU 126 -13.241 -6.395 3.719 736 HD23 LEU 126 3HD2 LEU 126 -14.538 -7.300 4.497 737 H GLN 127 H GLN 127 -9.013 -10.220 3.941 738 HA GLN 127 HA GLN 127 -6.902 -8.682 2.843 739 HB2 GLN 127 1HB GLN 127 -6.452 -10.251 4.628 740 HB3 GLN 127 2HB GLN 127 -7.039 -11.590 3.651 741 HG2 GLN 127 1HG GLN 127 -5.183 -11.407 2.165 742 HG3 GLN 127 2HG GLN 127 -4.640 -9.921 2.941 743 HE21 GLN 127 1HE2 GLN 127 -3.591 -10.033 4.922 744 HE22 GLN 127 2HE2 GLN 127 -3.000 -11.516 5.579 745 H GLN 128 H GLN 128 -8.727 -11.485 1.709 746 HA GLN 128 HA GLN 128 -7.465 -11.901 -0.742 747 HB2 GLN 128 1HB GLN 128 -10.330 -12.255 0.129 748 HB3 GLN 128 2HB GLN 128 -9.783 -12.703 -1.479 749 HG2 GLN 128 1HG GLN 128 -8.545 -13.787 1.031 750 HG3 GLN 128 2HG GLN 128 -9.903 -14.555 0.214 751 HE21 GLN 128 1HE2 GLN 128 -6.521 -13.788 0.040 752 HE22 GLN 128 2HE2 GLN 128 -6.140 -14.847 -1.272 753 H ALA 129 H ALA 129 -9.879 -9.557 0.228 754 HA ALA 129 HA ALA 129 -10.418 -8.593 -2.401 755 HB1 ALA 129 1HB ALA 129 -10.961 -7.294 0.262 756 HB2 ALA 129 2HB ALA 129 -12.043 -8.404 -0.578 757 HB3 ALA 129 3HB ALA 129 -11.666 -6.834 -1.289 758 H CYS 130 H CYS 130 -8.468 -7.396 0.323 759 HA CYS 130 HA CYS 130 -7.744 -5.001 -1.011 760 HB2 CYS 130 1HB CYS 130 -6.196 -4.641 0.831 761 HB3 CYS 130 2HB CYS 130 -7.741 -5.214 1.452 762 H GLU 131 H GLU 131 -6.077 -8.116 -0.542 763 HA GLU 131 HA GLU 131 -3.659 -7.302 -1.717 764 HB2 GLU 131 1HB GLU 131 -3.001 -9.572 -1.779 765 HB3 GLU 131 2HB GLU 131 -3.978 -9.374 -0.332 766 HG2 GLU 131 1HG GLU 131 -5.826 -10.477 -1.322 767 HG3 GLU 131 2HG GLU 131 -5.063 -10.461 -2.916 768 H ASP 132 H ASP 132 -6.680 -8.146 -3.156 769 HA ASP 132 HA ASP 132 -5.760 -8.854 -5.728 770 HB2 ASP 132 1HB ASP 132 -8.132 -9.092 -4.914 771 HB3 ASP 132 2HB ASP 132 -8.308 -7.350 -5.087 772 H VAL 133 H VAL 133 -6.747 -5.705 -4.405 773 HA VAL 133 HA VAL 133 -5.820 -4.303 -6.765 774 HB VAL 133 HB VAL 133 -6.908 -3.274 -4.138 775 HG11 VAL 133 1HG1 VAL 133 -7.137 -1.123 -5.247 776 HG12 VAL 133 2HG1 VAL 133 -6.393 -1.779 -6.706 777 HG13 VAL 133 3HG1 VAL 133 -5.448 -1.630 -5.224 778 HG21 VAL 133 1HG2 VAL 133 -8.176 -3.627 -6.849 779 HG22 VAL 133 2HG2 VAL 133 -8.921 -2.786 -5.492 780 HG23 VAL 133 3HG2 VAL 133 -8.567 -4.510 -5.372 781 H PHE 134 H PHE 134 -4.931 -4.550 -3.380 782 HA PHE 134 HA PHE 134 -2.588 -2.885 -3.676 783 HB2 PHE 134 1HB PHE 134 -3.748 -4.304 -1.274 784 HB3 PHE 134 2HB PHE 134 -2.304 -3.296 -1.229 785 HD1 PHE 134 HD1 PHE 134 -2.490 -0.864 -1.821 786 HD2 PHE 134 HD2 PHE 134 -5.907 -3.337 -1.222 787 HE1 PHE 134 HE1 PHE 134 -3.889 1.141 -1.537 788 HE2 PHE 134 HE2 PHE 134 -7.307 -1.333 -0.937 789 HZ PHE 134 HZ PHE 134 -6.301 0.907 -1.098 790 H ARG 135 H ARG 135 -2.748 -5.362 -5.105 791 HA ARG 135 HA ARG 135 -1.563 -7.591 -4.006 792 HB2 ARG 135 1HB ARG 135 -0.908 -8.148 -6.344 793 HB3 ARG 135 2HB ARG 135 -2.577 -7.599 -6.208 794 HG2 ARG 135 1HG ARG 135 -1.919 -5.378 -6.961 795 HG3 ARG 135 2HG ARG 135 -0.244 -5.912 -7.087 796 HD2 ARG 135 1HD ARG 135 -0.877 -7.516 -8.809 797 HD3 ARG 135 2HD ARG 135 -2.567 -7.027 -8.659 798 HE ARG 135 HE ARG 135 -0.988 -4.762 -9.181 799 HH11 ARG 135 1HH1 ARG 135 -2.139 -7.652 -10.785 800 HH12 ARG 135 2HH1 ARG 135 -2.130 -6.929 -12.361 801 HH21 ARG 135 1HH2 ARG 135 -0.970 -3.815 -11.236 802 HH22 ARG 135 2HH2 ARG 135 -1.460 -4.738 -12.617 803 H PHE 136 H PHE 136 0.484 -8.353 -3.817 804 HA PHE 136 HA PHE 136 2.694 -6.491 -4.259 805 HB2 PHE 136 1HB PHE 136 3.593 -7.266 -1.987 806 HB3 PHE 136 2HB PHE 136 2.272 -6.102 -1.975 807 HD1 PHE 136 HD1 PHE 136 -0.002 -6.812 -1.335 808 HD2 PHE 136 HD2 PHE 136 3.311 -9.482 -1.128 809 HE1 PHE 136 HE1 PHE 136 -1.311 -8.322 0.106 810 HE2 PHE 136 HE2 PHE 136 2.005 -10.989 0.306 811 HZ PHE 136 HZ PHE 136 -0.304 -10.412 0.924 812 H ASP 137 H ASP 137 4.386 -7.441 -5.190 813 HA ASP 137 HA ASP 137 4.463 -10.244 -5.642 814 HB2 ASP 137 1HB ASP 137 6.574 -9.866 -6.739 815 HB3 ASP 137 2HB ASP 137 5.505 -8.538 -7.170 816 H ASP 138 H ASP 138 5.501 -11.813 -4.558 817 HA ASP 138 HA ASP 138 6.564 -11.103 -1.946 818 HB2 ASP 138 1HB ASP 138 5.794 -13.738 -3.194 819 HB3 ASP 138 2HB ASP 138 6.628 -13.636 -1.649 820 H ALA 139 H ALA 139 7.933 -10.784 -4.638 821 HA ALA 139 HA ALA 139 10.272 -12.471 -4.373 822 HB1 ALA 139 1HB ALA 139 9.697 -10.211 -6.285 823 HB2 ALA 139 2HB ALA 139 9.451 -11.926 -6.604 824 HB3 ALA 139 3HB ALA 139 11.081 -11.300 -6.365 825 H ASN 140 H ASN 140 9.492 -9.009 -4.170 826 HA ASN 140 HA ASN 140 12.087 -8.331 -3.123 827 HB2 ASN 140 1HB ASN 140 9.525 -6.756 -3.421 828 HB3 ASN 140 2HB ASN 140 10.979 -6.080 -2.696 829 HD21 ASN 140 1HD2 ASN 140 9.465 -7.159 -5.618 830 HD22 ASN 140 2HD2 ASN 140 10.653 -6.510 -6.704 831 H LEU 141 H LEU 141 9.459 -9.809 -1.822 832 HA LEU 141 HA LEU 141 9.938 -8.763 0.876 833 HB2 LEU 141 1HB LEU 141 7.681 -10.509 -0.114 834 HB3 LEU 141 2HB LEU 141 7.826 -9.826 1.492 835 HG LEU 141 HG LEU 141 7.402 -8.259 -1.059 836 HD11 LEU 141 1HD1 LEU 141 5.199 -7.777 -0.104 837 HD12 LEU 141 2HD1 LEU 141 5.550 -8.855 1.246 838 HD13 LEU 141 3HD1 LEU 141 5.425 -9.502 -0.390 839 HD21 LEU 141 1HD2 LEU 141 8.722 -6.985 0.537 840 HD22 LEU 141 2HD2 LEU 141 7.560 -7.343 1.814 841 HD23 LEU 141 3HD2 LEU 141 7.084 -6.339 0.445 842 H VAL 142 H VAL 142 11.076 -9.993 2.257 843 HA VAL 142 HA VAL 142 12.205 -12.433 1.745 844 HB VAL 142 HB VAL 142 12.927 -11.083 3.616 845 HG11 VAL 142 1HG1 VAL 142 11.626 -10.931 5.696 846 HG12 VAL 142 2HG1 VAL 142 10.282 -11.749 4.899 847 HG13 VAL 142 3HG1 VAL 142 10.808 -10.163 4.336 848 HG21 VAL 142 1HG2 VAL 142 13.135 -12.802 5.355 849 HG22 VAL 142 2HG2 VAL 142 13.441 -13.445 3.743 850 HG23 VAL 142 3HG2 VAL 142 11.900 -13.762 4.541 851 HA PRO 143 HA PRO 143 8.664 -15.041 1.557 852 HB2 PRO 143 1HB PRO 143 9.940 -17.400 1.209 853 HB3 PRO 143 2HB PRO 143 9.833 -16.181 -0.059 854 HG2 PRO 143 1HG PRO 143 12.095 -16.793 1.792 855 HG3 PRO 143 2HG PRO 143 12.133 -16.420 0.058 856 HD2 PRO 143 1HD PRO 143 12.706 -14.588 1.995 857 HD3 PRO 143 2HD PRO 143 12.020 -14.155 0.418 858 H ARG 144 H ARG 144 7.416 -15.915 3.051 859 HA ARG 144 HA ARG 144 8.575 -17.482 5.234 860 HB2 ARG 144 1HB ARG 144 6.578 -15.245 5.676 861 HB3 ARG 144 2HB ARG 144 7.198 -16.332 6.904 862 HG2 ARG 144 1HG ARG 144 8.829 -14.323 5.369 863 HG3 ARG 144 2HG ARG 144 8.229 -14.120 7.014 864 HD2 ARG 144 1HD ARG 144 10.208 -16.187 6.054 865 HD3 ARG 144 2HD ARG 144 10.551 -14.786 7.064 866 HE ARG 144 HE ARG 144 8.662 -16.186 8.457 867 HH11 ARG 144 1HH1 ARG 144 11.800 -16.947 7.109 868 HH12 ARG 144 2HH1 ARG 144 12.192 -18.106 8.338 869 HH21 ARG 144 1HH2 ARG 144 9.165 -17.700 10.082 870 HH22 ARG 144 2HH2 ARG 144 10.683 -18.538 10.035 871 H GLY 145 H GLY 145 7.646 -19.387 4.483 872 HA2 GLY 145 1HA GLY 145 5.156 -19.782 3.411 873 HA3 GLY 145 2HA GLY 145 6.001 -20.981 4.376 874 H SER 146 H SER 146 3.227 -19.254 4.087 875 HA SER 146 HA SER 146 2.658 -19.111 6.944 876 HB2 SER 146 1HB SER 146 0.430 -18.166 6.049 877 HB3 SER 146 2HB SER 146 1.880 -17.193 5.808 878 HG SER 146 HG SER 146 0.238 -18.382 3.967 879 H GLY 147 H GLY 147 0.944 -20.243 7.919 880 HA2 GLY 147 1HA GLY 147 -0.877 -21.821 7.821 881 HA3 GLY 147 2HA GLY 147 -0.174 -22.474 6.348 882 H LEU 148 H LEU 148 1.838 -21.706 9.054 883 HA LEU 148 HA LEU 148 2.370 -24.561 9.439 884 HB2 LEU 148 1HB LEU 148 3.959 -22.193 10.438 885 HB3 LEU 148 2HB LEU 148 4.450 -23.873 10.488 886 HG LEU 148 HG LEU 148 4.113 -22.206 7.988 887 HD11 LEU 148 1HD1 LEU 148 6.584 -23.238 9.376 888 HD12 LEU 148 2HD1 LEU 148 6.052 -21.557 9.309 889 HD13 LEU 148 3HD1 LEU 148 6.546 -22.386 7.832 890 HD21 LEU 148 1HD2 LEU 148 3.591 -24.523 7.540 891 HD22 LEU 148 2HD2 LEU 148 5.058 -25.045 8.364 892 HD23 LEU 148 3HD2 LEU 148 5.168 -24.127 6.862 893 H GLU 149 H GLU 149 0.605 -25.058 10.798 894 HA GLU 149 HA GLU 149 0.489 -23.546 13.310 895 HB2 GLU 149 1HB GLU 149 -1.585 -23.942 11.807 896 HB3 GLU 149 2HB GLU 149 -1.557 -25.578 12.456 897 HG2 GLU 149 1HG GLU 149 -3.093 -24.142 13.690 898 HG3 GLU 149 2HG GLU 149 -1.777 -24.717 14.712 899 H HIS 150 H HIS 150 1.687 -26.408 12.026 900 HA HIS 150 HA HIS 150 1.443 -28.070 14.332 901 HB2 HIS 150 1HB HIS 150 3.271 -28.117 11.940 902 HB3 HIS 150 2HB HIS 150 3.499 -29.232 13.281 903 HD1 HIS 150 HD1 HIS 150 2.560 -31.429 12.701 904 HD2 HIS 150 HD2 HIS 150 0.251 -28.328 11.182 905 HE1 HIS 150 HE1 HIS 150 0.650 -32.534 11.496 906 HE2 HIS 150 HE2 HIS 150 -0.661 -30.640 10.478 907 H HIS 151 H HIS 151 2.146 -27.335 16.211 908 HA HIS 151 HA HIS 151 4.247 -25.376 16.323 909 HB2 HIS 151 1HB HIS 151 2.706 -26.712 18.554 910 HB3 HIS 151 2HB HIS 151 3.806 -25.354 18.757 911 HD1 HIS 151 HD1 HIS 151 0.479 -25.722 19.017 912 HD2 HIS 151 HD2 HIS 151 2.721 -23.394 16.411 913 HE1 HIS 151 HE1 HIS 151 -1.063 -23.903 18.242 914 HE2 HIS 151 HE2 HIS 151 0.223 -22.716 16.439 915 H HIS 152 H HIS 152 6.203 -26.138 15.900 916 HA HIS 152 HA HIS 152 7.330 -27.958 17.911 917 HB2 HIS 152 1HB HIS 152 7.149 -29.114 15.694 918 HB3 HIS 152 2HB HIS 152 8.160 -27.859 14.993 919 HD1 HIS 152 HD1 HIS 152 10.393 -28.837 14.587 920 HD2 HIS 152 HD2 HIS 152 8.790 -30.099 18.206 921 HE1 HIS 152 HE1 HIS 152 12.178 -30.237 15.669 922 HE2 HIS 152 HE2 HIS 152 11.134 -31.103 17.788 923 H HIS 153 H HIS 153 6.995 -25.035 17.450 924 HA HIS 153 HA HIS 153 9.592 -24.246 18.330 925 HB2 HIS 153 1HB HIS 153 9.972 -22.509 16.633 926 HB3 HIS 153 2HB HIS 153 9.980 -24.109 15.915 927 HD1 HIS 153 HD1 HIS 153 8.253 -24.593 14.108 928 HD2 HIS 153 HD2 HIS 153 7.753 -20.878 15.908 929 HE1 HIS 153 HE1 HIS 153 6.586 -23.370 12.684 930 HE2 HIS 153 HE2 HIS 153 6.171 -21.201 13.886 931 H HIS 154 H HIS 154 9.352 -22.670 19.799 932 HA HIS 154 HA HIS 154 6.816 -21.183 19.811 933 HB2 HIS 154 1HB HIS 154 6.589 -23.054 21.355 934 HB3 HIS 154 2HB HIS 154 8.090 -22.608 22.154 935 HD1 HIS 154 HD1 HIS 154 7.814 -21.268 24.197 936 HD2 HIS 154 HD2 HIS 154 4.556 -20.882 21.650 937 HE1 HIS 154 HE1 HIS 154 6.158 -19.837 25.431 938 HE2 HIS 154 HE2 HIS 154 4.297 -19.445 23.784 939 H HIS 155 H HIS 155 7.154 -19.077 19.892 940 HA HIS 155 HA HIS 155 9.669 -18.068 21.022 941 HB2 HIS 155 1HB HIS 155 7.635 -16.708 19.238 942 HB3 HIS 155 2HB HIS 155 9.087 -15.940 19.868 943 HD1 HIS 155 HD1 HIS 155 7.996 -17.125 16.840 944 HD2 HIS 155 HD2 HIS 155 11.398 -17.951 19.076 945 HE1 HIS 155 HE1 HIS 155 9.682 -18.005 15.201 946 HE2 HIS 155 HE2 HIS 155 11.652 -18.687 16.612 Start of MODEL 12 1 H1 MET 24 1H MET 24 -19.618 -10.638 -2.527 2 H2 MET 24 2H MET 24 -20.639 -10.992 -1.225 3 H3 MET 24 3H MET 24 -20.298 -9.384 -1.615 4 HA MET 24 HA MET 24 -21.793 -11.297 -3.307 5 HB2 MET 24 1HB MET 24 -23.067 -10.529 -1.342 6 HB3 MET 24 2HB MET 24 -22.722 -8.859 -1.768 7 HG2 MET 24 1HG MET 24 -23.962 -9.166 -3.872 8 HG3 MET 24 2HG MET 24 -24.355 -10.811 -3.374 9 HE1 MET 24 1HE MET 24 -26.560 -8.680 -4.243 10 HE2 MET 24 2HE MET 24 -27.788 -8.959 -3.009 11 HE3 MET 24 3HE MET 24 -26.940 -10.325 -3.735 12 H GLU 25 H GLU 25 -21.226 -10.903 -5.343 13 HA GLU 25 HA GLU 25 -20.583 -9.846 -7.249 14 HB2 GLU 25 1HB GLU 25 -22.203 -7.566 -6.090 15 HB3 GLU 25 2HB GLU 25 -21.689 -7.705 -7.766 16 HG2 GLU 25 1HG GLU 25 -23.588 -9.529 -6.311 17 HG3 GLU 25 2HG GLU 25 -24.001 -8.345 -7.549 18 H ASN 26 H ASN 26 -18.514 -9.970 -5.855 19 HA ASN 26 HA ASN 26 -17.562 -7.707 -4.486 20 HB2 ASN 26 1HB ASN 26 -16.127 -10.132 -5.558 21 HB3 ASN 26 2HB ASN 26 -15.324 -8.884 -4.611 22 HD21 ASN 26 1HD2 ASN 26 -14.826 -10.265 -2.942 23 HD22 ASN 26 2HD2 ASN 26 -16.017 -10.907 -1.860 24 H TYR 27 H TYR 27 -17.937 -8.020 -7.751 25 HA TYR 27 HA TYR 27 -15.601 -6.851 -8.796 26 HB2 TYR 27 1HB TYR 27 -18.456 -6.704 -9.792 27 HB3 TYR 27 2HB TYR 27 -17.051 -6.178 -10.710 28 HD1 TYR 27 HD1 TYR 27 -18.698 -9.133 -9.204 29 HD2 TYR 27 HD2 TYR 27 -15.718 -7.738 -11.907 30 HE1 TYR 27 HE1 TYR 27 -18.419 -11.416 -10.074 31 HE2 TYR 27 HE2 TYR 27 -15.436 -10.020 -12.780 32 HH TYR 27 HH TYR 27 -17.623 -12.550 -12.052 33 H LEU 28 H LEU 28 -18.395 -5.505 -7.189 34 HA LEU 28 HA LEU 28 -17.757 -2.785 -7.912 35 HB2 LEU 28 1HB LEU 28 -19.676 -3.839 -5.827 36 HB3 LEU 28 2HB LEU 28 -19.572 -2.176 -6.366 37 HG LEU 28 HG LEU 28 -20.477 -4.549 -8.003 38 HD11 LEU 28 1HD1 LEU 28 -22.614 -3.378 -8.052 39 HD12 LEU 28 2HD1 LEU 28 -21.944 -2.097 -7.042 40 HD13 LEU 28 3HD1 LEU 28 -22.119 -3.727 -6.395 41 HD21 LEU 28 1HD2 LEU 28 -20.951 -2.882 -9.767 42 HD22 LEU 28 2HD2 LEU 28 -19.229 -3.060 -9.438 43 HD23 LEU 28 3HD2 LEU 28 -20.107 -1.666 -8.809 44 H ARG 29 H ARG 29 -17.450 -4.858 -5.077 45 HA ARG 29 HA ARG 29 -16.162 -3.080 -3.353 46 HB2 ARG 29 1HB ARG 29 -16.824 -5.137 -2.423 47 HB3 ARG 29 2HB ARG 29 -16.080 -6.066 -3.713 48 HG2 ARG 29 1HG ARG 29 -13.884 -5.591 -2.852 49 HG3 ARG 29 2HG ARG 29 -14.565 -4.529 -1.618 50 HD2 ARG 29 1HD ARG 29 -15.162 -7.475 -1.870 51 HD3 ARG 29 2HD ARG 29 -13.979 -6.784 -0.759 52 HE ARG 29 HE ARG 29 -15.970 -5.495 0.154 53 HH11 ARG 29 1HH1 ARG 29 -16.228 -8.724 -1.203 54 HH12 ARG 29 2HH1 ARG 29 -17.633 -9.130 -0.275 55 HH21 ARG 29 1HH2 ARG 29 -17.813 -6.036 1.356 56 HH22 ARG 29 2HH2 ARG 29 -18.536 -7.603 1.179 57 H LYS 30 H LYS 30 -14.910 -5.199 -5.865 58 HA LYS 30 HA LYS 30 -12.190 -4.643 -5.515 59 HB2 LYS 30 1HB LYS 30 -13.313 -6.477 -6.929 60 HB3 LYS 30 2HB LYS 30 -13.467 -5.251 -8.179 61 HG2 LYS 30 1HG LYS 30 -11.514 -6.489 -8.662 62 HG3 LYS 30 2HG LYS 30 -10.981 -4.931 -8.026 63 HD2 LYS 30 1HD LYS 30 -9.628 -6.545 -6.966 64 HD3 LYS 30 2HD LYS 30 -10.825 -6.072 -5.763 65 HE2 LYS 30 1HE LYS 30 -10.596 -8.457 -5.698 66 HE3 LYS 30 2HE LYS 30 -12.163 -8.073 -6.405 67 HZ1 LYS 30 1HZ LYS 30 -9.722 -8.756 -7.953 68 HZ2 LYS 30 2HZ LYS 30 -11.269 -8.487 -8.589 69 HZ3 LYS 30 3HZ LYS 30 -10.985 -9.833 -7.611 70 H ALA 31 H ALA 31 -14.590 -3.179 -7.730 71 HA ALA 31 HA ALA 31 -12.960 -1.253 -8.853 72 HB1 ALA 31 1HB ALA 31 -15.896 -1.010 -8.221 73 HB2 ALA 31 2HB ALA 31 -15.214 -1.788 -9.648 74 HB3 ALA 31 3HB ALA 31 -14.999 -0.056 -9.402 75 H ALA 32 H ALA 32 -14.725 -1.168 -5.791 76 HA ALA 32 HA ALA 32 -14.307 1.567 -5.232 77 HB1 ALA 32 1HB ALA 32 -15.945 0.205 -4.022 78 HB2 ALA 32 2HB ALA 32 -14.819 0.994 -2.915 79 HB3 ALA 32 3HB ALA 32 -14.633 -0.719 -3.289 80 H LEU 33 H LEU 33 -12.463 -1.334 -4.466 81 HA LEU 33 HA LEU 33 -10.402 -0.010 -3.030 82 HB2 LEU 33 1HB LEU 33 -10.288 -2.630 -4.533 83 HB3 LEU 33 2HB LEU 33 -9.166 -2.098 -3.291 84 HG LEU 33 HG LEU 33 -12.094 -2.715 -2.873 85 HD11 LEU 33 1HD1 LEU 33 -11.272 -4.630 -1.594 86 HD12 LEU 33 2HD1 LEU 33 -9.621 -4.236 -2.074 87 HD13 LEU 33 3HD1 LEU 33 -10.804 -4.715 -3.292 88 HD21 LEU 33 1HD2 LEU 33 -9.950 -1.941 -0.900 89 HD22 LEU 33 2HD2 LEU 33 -11.578 -2.478 -0.487 90 HD23 LEU 33 3HD2 LEU 33 -11.345 -0.968 -1.368 91 H THR 34 H THR 34 -10.878 -0.889 -6.398 92 HA THR 34 HA THR 34 -8.300 -0.196 -7.319 93 HB THR 34 HB THR 34 -10.900 -0.195 -8.866 94 HG1 THR 34 HG1 THR 34 -10.402 -2.223 -7.849 95 HG21 THR 34 1HG2 THR 34 -8.037 -0.428 -9.804 96 HG22 THR 34 2HG2 THR 34 -9.093 0.966 -10.037 97 HG23 THR 34 3HG2 THR 34 -9.469 -0.567 -10.825 98 H ASP 35 H ASP 35 -11.299 1.617 -6.947 99 HA ASP 35 HA ASP 35 -10.402 3.978 -8.241 100 HB2 ASP 35 1HB ASP 35 -12.808 3.413 -7.785 101 HB3 ASP 35 2HB ASP 35 -12.510 3.756 -6.081 102 H MET 36 H MET 36 -10.390 2.843 -4.905 103 HA MET 36 HA MET 36 -9.280 5.166 -3.751 104 HB2 MET 36 1HB MET 36 -10.263 3.457 -2.335 105 HB3 MET 36 2HB MET 36 -9.072 2.277 -2.868 106 HG2 MET 36 1HG MET 36 -8.556 3.138 -0.651 107 HG3 MET 36 2HG MET 36 -7.302 3.554 -1.822 108 HE1 MET 36 1HE MET 36 -7.288 5.029 0.906 109 HE2 MET 36 2HE MET 36 -7.095 6.702 0.384 110 HE3 MET 36 3HE MET 36 -6.213 5.417 -0.439 111 H LEU 37 H LEU 37 -7.796 2.263 -5.138 112 HA LEU 37 HA LEU 37 -5.118 2.939 -4.680 113 HB2 LEU 37 1HB LEU 37 -5.830 0.730 -5.460 114 HB3 LEU 37 2HB LEU 37 -6.333 1.428 -6.997 115 HG LEU 37 HG LEU 37 -3.869 2.139 -7.262 116 HD11 LEU 37 1HD1 LEU 37 -2.258 0.709 -6.093 117 HD12 LEU 37 2HD1 LEU 37 -3.570 0.028 -5.130 118 HD13 LEU 37 3HD1 LEU 37 -3.157 1.734 -4.977 119 HD21 LEU 37 1HD2 LEU 37 -4.929 0.417 -8.608 120 HD22 LEU 37 2HD2 LEU 37 -4.638 -0.774 -7.342 121 HD23 LEU 37 3HD2 LEU 37 -3.278 -0.045 -8.194 122 H GLN 38 H GLN 38 -7.270 3.699 -7.389 123 HA GLN 38 HA GLN 38 -5.343 5.110 -8.904 124 HB2 GLN 38 1HB GLN 38 -8.357 5.133 -8.951 125 HB3 GLN 38 2HB GLN 38 -7.377 6.058 -10.081 126 HG2 GLN 38 1HG GLN 38 -7.354 3.063 -9.752 127 HG3 GLN 38 2HG GLN 38 -8.116 3.963 -11.062 128 HE21 GLN 38 1HE2 GLN 38 -6.022 1.928 -11.175 129 HE22 GLN 38 2HE2 GLN 38 -4.675 2.674 -11.968 130 H THR 39 H THR 39 -7.367 6.029 -6.240 131 HA THR 39 HA THR 39 -6.903 8.854 -6.506 132 HB THR 39 HB THR 39 -7.673 7.308 -4.017 133 HG1 THR 39 HG1 THR 39 -9.186 6.930 -5.686 134 HG21 THR 39 1HG2 THR 39 -6.918 9.608 -3.592 135 HG22 THR 39 2HG2 THR 39 -8.647 9.434 -3.288 136 HG23 THR 39 3HG2 THR 39 -8.086 10.207 -4.771 137 H PHE 40 H PHE 40 -5.353 6.157 -4.905 138 HA PHE 40 HA PHE 40 -3.530 7.662 -3.328 139 HB2 PHE 40 1HB PHE 40 -4.218 5.322 -2.850 140 HB3 PHE 40 2HB PHE 40 -3.328 4.799 -4.273 141 HD1 PHE 40 HD1 PHE 40 -1.718 3.406 -3.376 142 HD2 PHE 40 HD2 PHE 40 -2.263 7.293 -1.725 143 HE1 PHE 40 HE1 PHE 40 0.299 3.100 -2.014 144 HE2 PHE 40 HE2 PHE 40 -0.237 7.000 -0.362 145 HZ PHE 40 HZ PHE 40 1.050 4.901 -0.504 146 H VAL 41 H VAL 41 -3.417 6.308 -6.566 147 HA VAL 41 HA VAL 41 -0.714 6.331 -7.088 148 HB VAL 41 HB VAL 41 -2.986 6.885 -8.992 149 HG11 VAL 41 1HG1 VAL 41 -0.105 6.262 -9.628 150 HG12 VAL 41 2HG1 VAL 41 -0.917 7.804 -9.905 151 HG13 VAL 41 3HG1 VAL 41 -1.422 6.369 -10.797 152 HG21 VAL 41 1HG2 VAL 41 -3.050 4.693 -7.955 153 HG22 VAL 41 2HG2 VAL 41 -1.371 4.409 -8.409 154 HG23 VAL 41 3HG2 VAL 41 -2.608 4.550 -9.656 155 HA PRO 42 HA PRO 42 -1.083 11.029 -8.614 156 HB2 PRO 42 1HB PRO 42 -3.121 11.825 -6.593 157 HB3 PRO 42 2HB PRO 42 -2.845 12.450 -8.224 158 HG2 PRO 42 1HG PRO 42 -4.877 10.801 -7.705 159 HG3 PRO 42 2HG PRO 42 -3.980 10.714 -9.232 160 HD2 PRO 42 1HD PRO 42 -3.887 8.911 -6.865 161 HD3 PRO 42 2HD PRO 42 -3.671 8.536 -8.585 162 H TYR 43 H TYR 43 -1.837 10.187 -5.176 163 HA TYR 43 HA TYR 43 -0.013 12.071 -4.123 164 HB2 TYR 43 1HB TYR 43 -1.199 9.550 -2.936 165 HB3 TYR 43 2HB TYR 43 -0.228 10.706 -2.023 166 HD1 TYR 43 HD1 TYR 43 -3.520 9.861 -3.148 167 HD2 TYR 43 HD2 TYR 43 -1.091 13.132 -1.905 168 HE1 TYR 43 HE1 TYR 43 -5.538 11.176 -2.668 169 HE2 TYR 43 HE2 TYR 43 -3.105 14.449 -1.423 170 HH TYR 43 HH TYR 43 -5.525 14.467 -2.232 171 H ARG 44 H ARG 44 0.275 8.753 -5.169 172 HA ARG 44 HA ARG 44 2.735 8.059 -4.077 173 HB2 ARG 44 1HB ARG 44 1.469 7.311 -6.714 174 HB3 ARG 44 2HB ARG 44 2.976 6.606 -6.147 175 HG2 ARG 44 1HG ARG 44 0.640 6.536 -4.320 176 HG3 ARG 44 2HG ARG 44 0.635 5.462 -5.722 177 HD2 ARG 44 1HD ARG 44 1.594 4.411 -3.679 178 HD3 ARG 44 2HD ARG 44 2.706 4.454 -5.041 179 HE ARG 44 HE ARG 44 2.850 6.203 -2.676 180 HH11 ARG 44 1HH1 ARG 44 4.341 4.630 -5.425 181 HH12 ARG 44 2HH1 ARG 44 5.939 5.218 -5.061 182 HH21 ARG 44 1HH2 ARG 44 4.971 6.941 -2.170 183 HH22 ARG 44 2HH2 ARG 44 6.296 6.538 -3.229 184 H THR 45 H THR 45 2.144 9.450 -7.316 185 HA THR 45 HA THR 45 4.699 9.986 -8.062 186 HB THR 45 HB THR 45 2.387 11.877 -8.501 187 HG1 THR 45 HG1 THR 45 2.125 10.478 -10.431 188 HG21 THR 45 1HG2 THR 45 4.530 12.742 -9.284 189 HG22 THR 45 2HG2 THR 45 3.503 12.311 -10.650 190 HG23 THR 45 3HG2 THR 45 4.823 11.247 -10.173 191 H ALA 46 H ALA 46 2.692 12.036 -5.950 192 HA ALA 46 HA ALA 46 4.551 14.153 -5.702 193 HB1 ALA 46 1HB ALA 46 3.234 14.837 -3.763 194 HB2 ALA 46 2HB ALA 46 2.416 13.274 -3.757 195 HB3 ALA 46 3HB ALA 46 2.188 14.386 -5.107 196 H VAL 47 H VAL 47 4.068 11.180 -3.987 197 HA VAL 47 HA VAL 47 5.934 11.697 -1.874 198 HB VAL 47 HB VAL 47 4.855 9.047 -2.862 199 HG11 VAL 47 1HG1 VAL 47 6.366 9.690 -0.329 200 HG12 VAL 47 2HG1 VAL 47 6.979 8.754 -1.692 201 HG13 VAL 47 3HG1 VAL 47 5.638 8.134 -0.727 202 HG21 VAL 47 1HG2 VAL 47 3.424 9.170 -0.861 203 HG22 VAL 47 2HG2 VAL 47 3.111 10.491 -1.989 204 HG23 VAL 47 3HG2 VAL 47 4.054 10.783 -0.527 205 H GLU 48 H GLU 48 6.128 10.059 -5.000 206 HA GLU 48 HA GLU 48 8.798 9.145 -4.684 207 HB2 GLU 48 1HB GLU 48 7.440 9.764 -7.312 208 HB3 GLU 48 2HB GLU 48 8.761 8.643 -7.032 209 HG2 GLU 48 1HG GLU 48 5.956 8.323 -5.992 210 HG3 GLU 48 2HG GLU 48 6.623 7.521 -7.407 211 H LEU 49 H LEU 49 7.359 12.048 -6.101 212 HA LEU 49 HA LEU 49 9.729 13.234 -7.041 213 HB2 LEU 49 1HB LEU 49 6.998 14.153 -6.381 214 HB3 LEU 49 2HB LEU 49 8.240 15.392 -6.352 215 HG LEU 49 HG LEU 49 7.062 15.273 -8.515 216 HD11 LEU 49 1HD1 LEU 49 9.036 15.275 -9.931 217 HD12 LEU 49 2HD1 LEU 49 9.962 14.475 -8.664 218 HD13 LEU 49 3HD1 LEU 49 9.350 16.109 -8.411 219 HD21 LEU 49 1HD2 LEU 49 6.597 12.874 -8.554 220 HD22 LEU 49 2HD2 LEU 49 8.319 12.543 -8.750 221 HD23 LEU 49 3HD2 LEU 49 7.435 13.394 -10.017 222 H CYS 50 H CYS 50 8.128 13.327 -3.913 223 HA CYS 50 HA CYS 50 9.925 15.043 -2.605 224 HB2 CYS 50 1HB CYS 50 7.915 14.600 -1.476 225 HB3 CYS 50 2HB CYS 50 8.062 12.862 -1.700 226 H ALA 51 H ALA 51 9.819 11.483 -2.653 227 HA ALA 51 HA ALA 51 12.174 10.904 -1.392 228 HB1 ALA 51 1HB ALA 51 10.533 9.231 -2.147 229 HB2 ALA 51 2HB ALA 51 12.187 8.791 -2.564 230 HB3 ALA 51 3HB ALA 51 11.109 9.438 -3.800 231 H LEU 52 H LEU 52 11.795 11.999 -4.712 232 HA LEU 52 HA LEU 52 14.455 11.309 -5.502 233 HB2 LEU 52 1HB LEU 52 12.388 13.117 -6.748 234 HB3 LEU 52 2HB LEU 52 13.947 12.798 -7.478 235 HG LEU 52 HG LEU 52 11.820 10.724 -6.915 236 HD11 LEU 52 1HD1 LEU 52 11.579 10.625 -9.337 237 HD12 LEU 52 2HD1 LEU 52 12.750 11.930 -9.516 238 HD13 LEU 52 3HD1 LEU 52 11.203 12.235 -8.726 239 HD21 LEU 52 1HD2 LEU 52 13.278 9.262 -8.297 240 HD22 LEU 52 2HD2 LEU 52 13.988 9.710 -6.750 241 HD23 LEU 52 3HD2 LEU 52 14.524 10.507 -8.229 242 H GLU 53 H GLU 53 13.091 13.996 -3.841 243 HA GLU 53 HA GLU 53 15.074 15.914 -4.582 244 HB2 GLU 53 1HB GLU 53 12.855 16.597 -3.788 245 HB3 GLU 53 2HB GLU 53 13.190 15.885 -2.216 246 HG2 GLU 53 1HG GLU 53 15.025 17.490 -1.900 247 HG3 GLU 53 2HG GLU 53 14.631 18.220 -3.454 248 H HIS 54 H HIS 54 14.751 13.575 -2.001 249 HA HIS 54 HA HIS 54 17.319 14.522 -0.878 250 HB2 HIS 54 1HB HIS 54 15.373 14.572 0.691 251 HB3 HIS 54 2HB HIS 54 15.237 12.827 0.525 252 HD1 HIS 54 HD1 HIS 54 16.460 11.522 2.247 253 HD2 HIS 54 HD2 HIS 54 18.037 15.338 1.785 254 HE1 HIS 54 HE1 HIS 54 18.250 11.727 3.998 255 HE2 HIS 54 HE2 HIS 54 19.276 13.996 3.609 256 H GLY 55 H GLY 55 15.832 12.077 -2.625 257 HA2 GLY 55 1HA GLY 55 16.704 10.218 -3.625 258 HA3 GLY 55 2HA GLY 55 18.189 10.443 -2.713 259 H GLY 56 H GLY 56 16.829 10.466 -0.091 260 HA2 GLY 56 1HA GLY 56 15.464 7.868 -0.123 261 HA3 GLY 56 2HA GLY 56 16.195 8.613 1.292 262 H LEU 57 H LEU 57 13.572 7.533 1.096 263 HA LEU 57 HA LEU 57 11.614 9.583 0.766 264 HB2 LEU 57 1HB LEU 57 11.527 6.840 2.005 265 HB3 LEU 57 2HB LEU 57 10.125 7.889 1.912 266 HG LEU 57 HG LEU 57 11.536 7.415 -0.642 267 HD11 LEU 57 1HD1 LEU 57 9.964 5.256 0.750 268 HD12 LEU 57 2HD1 LEU 57 11.671 5.194 0.309 269 HD13 LEU 57 3HD1 LEU 57 10.436 5.235 -0.949 270 HD21 LEU 57 1HD2 LEU 57 9.476 8.751 -0.440 271 HD22 LEU 57 2HD2 LEU 57 8.633 7.323 0.160 272 HD23 LEU 57 3HD2 LEU 57 9.269 7.344 -1.483 273 H ASP 58 H ASP 58 13.866 9.191 3.106 274 HA ASP 58 HA ASP 58 12.682 9.430 5.562 275 HB2 ASP 58 1HB ASP 58 15.121 10.927 4.590 276 HB3 ASP 58 2HB ASP 58 14.693 10.655 6.274 277 H THR 59 H THR 59 13.167 11.977 3.174 278 HA THR 59 HA THR 59 12.232 14.076 4.880 279 HB THR 59 HB THR 59 13.840 14.446 3.016 280 HG1 THR 59 HG1 THR 59 12.622 16.218 3.817 281 HG21 THR 59 1HG2 THR 59 12.973 14.644 0.719 282 HG22 THR 59 2HG2 THR 59 11.427 13.995 1.265 283 HG23 THR 59 3HG2 THR 59 12.876 12.994 1.331 284 H CYS 60 H CYS 60 10.593 11.613 3.405 285 HA CYS 60 HA CYS 60 8.280 13.235 2.647 286 HB2 CYS 60 1HB CYS 60 8.773 10.278 2.253 287 HB3 CYS 60 2HB CYS 60 7.448 11.215 1.566 288 H ASP 61 H ASP 61 8.344 13.540 5.161 289 HA ASP 61 HA ASP 61 6.749 11.406 6.413 290 HB2 ASP 61 1HB ASP 61 8.996 12.156 7.428 291 HB3 ASP 61 2HB ASP 61 8.146 13.632 7.885 292 H GLY 62 H GLY 62 4.737 11.835 7.148 293 HA2 GLY 62 1HA GLY 62 3.442 14.189 6.182 294 HA3 GLY 62 2HA GLY 62 2.706 12.922 7.154 295 H GLY 63 H GLY 63 3.771 16.098 7.110 296 HA2 GLY 63 1HA GLY 63 3.074 17.492 8.987 297 HA3 GLY 63 2HA GLY 63 3.635 16.212 10.056 298 H SER 64 H SER 64 5.809 16.408 7.567 299 HA SER 64 HA SER 64 7.361 18.577 8.747 300 HB2 SER 64 1HB SER 64 8.450 15.771 8.405 301 HB3 SER 64 2HB SER 64 9.360 17.174 8.965 302 HG SER 64 HG SER 64 7.024 16.285 10.288 303 H ASN 65 H ASN 65 9.185 19.207 7.424 304 HA ASN 65 HA ASN 65 10.339 19.636 5.502 305 HB2 ASN 65 1HB ASN 65 9.296 16.932 4.627 306 HB3 ASN 65 2HB ASN 65 10.538 17.856 3.793 307 HD21 ASN 65 1HD2 ASN 65 9.806 15.855 6.520 308 HD22 ASN 65 2HD2 ASN 65 11.430 15.673 7.094 309 H GLY 66 H GLY 66 7.632 20.565 5.790 310 HA2 GLY 66 1HA GLY 66 6.358 21.953 4.431 311 HA3 GLY 66 2HA GLY 66 7.206 21.315 3.028 312 H ILE 67 H ILE 67 6.304 18.651 4.636 313 HA ILE 67 HA ILE 67 3.942 18.301 2.981 314 HB ILE 67 HB ILE 67 5.434 16.296 4.684 315 HG12 ILE 67 1HG1 ILE 67 5.478 16.797 1.699 316 HG13 ILE 67 2HG1 ILE 67 6.795 17.120 2.824 317 HG21 ILE 67 1HG2 ILE 67 3.102 15.667 4.369 318 HG22 ILE 67 2HG2 ILE 67 4.162 14.606 3.437 319 HG23 ILE 67 3HG2 ILE 67 3.263 15.889 2.627 320 HD11 ILE 67 1HD1 ILE 67 7.190 15.084 1.570 321 HD12 ILE 67 2HD1 ILE 67 5.666 14.413 2.152 322 HD13 ILE 67 3HD1 ILE 67 6.979 14.732 3.285 323 HA PRO 68 HA PRO 68 1.421 19.351 6.502 324 HB2 PRO 68 1HB PRO 68 -0.782 18.149 4.973 325 HB3 PRO 68 2HB PRO 68 -0.584 19.810 5.535 326 HG2 PRO 68 1HG PRO 68 -0.381 19.160 2.936 327 HG3 PRO 68 2HG PRO 68 0.602 20.447 3.671 328 HD2 PRO 68 1HD PRO 68 1.366 17.630 2.977 329 HD3 PRO 68 2HD PRO 68 2.301 19.134 2.787 330 H SER 69 H SER 69 0.650 18.314 8.252 331 HA SER 69 HA SER 69 0.982 15.684 8.871 332 HB2 SER 69 1HB SER 69 -1.298 17.432 9.828 333 HB3 SER 69 2HB SER 69 -0.607 16.050 10.679 334 HG SER 69 HG SER 69 1.016 17.245 11.324 335 HA PRO 70 HA PRO 70 -1.458 13.267 6.226 336 HB2 PRO 70 1HB PRO 70 -2.326 11.361 8.091 337 HB3 PRO 70 2HB PRO 70 -0.848 11.294 7.131 338 HG2 PRO 70 1HG PRO 70 -1.245 12.175 9.945 339 HG3 PRO 70 2HG PRO 70 0.130 11.328 9.215 340 HD2 PRO 70 1HD PRO 70 0.264 13.936 9.810 341 HD3 PRO 70 2HD PRO 70 1.034 13.286 8.346 342 H THR 71 H THR 71 -3.380 13.637 5.446 343 HA THR 71 HA THR 71 -5.601 14.178 7.296 344 HB THR 71 HB THR 71 -4.856 16.198 6.062 345 HG1 THR 71 HG1 THR 71 -6.956 16.722 5.231 346 HG21 THR 71 1HG2 THR 71 -4.013 15.165 4.035 347 HG22 THR 71 2HG2 THR 71 -5.263 16.342 3.632 348 HG23 THR 71 3HG2 THR 71 -5.634 14.618 3.610 349 H THR 72 H THR 72 -7.718 14.067 5.718 350 HA THR 72 HA THR 72 -7.594 11.524 4.269 351 HB THR 72 HB THR 72 -9.804 10.908 5.372 352 HG1 THR 72 HG1 THR 72 -8.969 12.539 7.521 353 HG21 THR 72 1HG2 THR 72 -7.366 10.989 7.151 354 HG22 THR 72 2HG2 THR 72 -7.673 9.790 5.895 355 HG23 THR 72 3HG2 THR 72 -8.735 9.885 7.300 356 H THR 73 H THR 73 -8.996 11.375 2.584 357 HA THR 73 HA THR 73 -10.426 13.768 1.796 358 HB THR 73 HB THR 73 -10.821 12.684 -0.315 359 HG1 THR 73 HG1 THR 73 -10.837 10.567 -0.543 360 HG21 THR 73 1HG2 THR 73 -8.548 12.106 -1.040 361 HG22 THR 73 2HG2 THR 73 -8.045 11.989 0.646 362 HG23 THR 73 3HG2 THR 73 -8.554 13.542 -0.017 363 H ARG 74 H ARG 74 -12.739 13.106 0.737 364 HA ARG 74 HA ARG 74 -14.397 12.748 2.927 365 HB2 ARG 74 1HB ARG 74 -15.179 13.841 0.908 366 HB3 ARG 74 2HB ARG 74 -15.032 12.338 0.004 367 HG2 ARG 74 1HG ARG 74 -16.792 11.333 1.304 368 HG3 ARG 74 2HG ARG 74 -16.892 12.756 2.337 369 HD2 ARG 74 1HD ARG 74 -17.591 14.097 0.398 370 HD3 ARG 74 2HD ARG 74 -17.506 12.660 -0.619 371 HE ARG 74 HE ARG 74 -19.184 12.042 1.500 372 HH11 ARG 74 1HH1 ARG 74 -19.145 14.324 -1.156 373 HH12 ARG 74 2HH1 ARG 74 -20.874 14.395 -1.283 374 HH21 ARG 74 1HH2 ARG 74 -21.461 12.121 1.322 375 HH22 ARG 74 2HH2 ARG 74 -22.191 13.146 0.125 376 H TYR 75 H TYR 75 -13.315 10.279 0.567 377 HA TYR 75 HA TYR 75 -14.936 8.298 1.930 378 HB2 TYR 75 1HB TYR 75 -13.086 7.972 -0.437 379 HB3 TYR 75 2HB TYR 75 -14.256 6.788 0.149 380 HD1 TYR 75 HD1 TYR 75 -13.742 8.899 -2.431 381 HD2 TYR 75 HD2 TYR 75 -16.707 8.123 0.515 382 HE1 TYR 75 HE1 TYR 75 -15.449 9.876 -3.902 383 HE2 TYR 75 HE2 TYR 75 -18.427 9.095 -0.950 384 HH TYR 75 HH TYR 75 -18.540 10.707 -2.832 385 H VAL 76 H VAL 76 -11.764 9.479 2.249 386 HA VAL 76 HA VAL 76 -10.588 6.925 2.939 387 HB VAL 76 HB VAL 76 -9.470 9.725 3.112 388 HG11 VAL 76 1HG1 VAL 76 -8.042 7.115 3.634 389 HG12 VAL 76 2HG1 VAL 76 -8.527 8.264 4.879 390 HG13 VAL 76 3HG1 VAL 76 -7.326 8.729 3.671 391 HG21 VAL 76 1HG2 VAL 76 -9.735 8.874 0.849 392 HG22 VAL 76 2HG2 VAL 76 -8.875 7.399 1.289 393 HG23 VAL 76 3HG2 VAL 76 -8.025 8.946 1.281 394 H SER 77 H SER 77 -10.463 6.045 4.859 395 HA SER 77 HA SER 77 -11.956 7.256 7.006 396 HB2 SER 77 1HB SER 77 -12.225 4.853 6.471 397 HB3 SER 77 2HB SER 77 -10.533 4.579 6.893 398 HG SER 77 HG SER 77 -11.000 4.751 8.967 399 H ALA 78 H ALA 78 -8.611 6.191 6.466 400 HA ALA 78 HA ALA 78 -7.511 8.140 8.186 401 HB1 ALA 78 1HB ALA 78 -6.686 6.685 9.972 402 HB2 ALA 78 2HB ALA 78 -7.590 5.337 9.289 403 HB3 ALA 78 3HB ALA 78 -8.447 6.729 9.944 404 H MET 79 H MET 79 -5.324 8.281 7.933 405 HA MET 79 HA MET 79 -3.754 6.124 6.909 406 HB2 MET 79 1HB MET 79 -3.059 7.274 4.820 407 HB3 MET 79 2HB MET 79 -4.737 6.755 4.798 408 HG2 MET 79 1HG MET 79 -5.467 9.030 5.255 409 HG3 MET 79 2HG MET 79 -3.789 9.566 5.340 410 HE1 MET 79 1HE MET 79 -2.475 7.866 2.937 411 HE2 MET 79 2HE MET 79 -2.135 9.565 3.261 412 HE3 MET 79 3HE MET 79 -2.594 9.052 1.638 413 H SER 80 H SER 80 -1.603 6.451 7.252 414 HA SER 80 HA SER 80 -0.812 9.064 8.366 415 HB2 SER 80 1HB SER 80 0.215 6.374 9.312 416 HB3 SER 80 2HB SER 80 0.491 7.947 10.059 417 HG SER 80 HG SER 80 -1.780 8.022 10.490 418 H VAL 81 H VAL 81 1.412 9.635 8.008 419 HA VAL 81 HA VAL 81 2.735 8.068 5.895 420 HB VAL 81 HB VAL 81 2.758 11.084 6.080 421 HG11 VAL 81 1HG1 VAL 81 4.740 10.186 5.031 422 HG12 VAL 81 2HG1 VAL 81 3.720 10.961 3.818 423 HG13 VAL 81 3HG1 VAL 81 3.754 9.202 3.948 424 HG21 VAL 81 1HG2 VAL 81 1.168 9.339 4.212 425 HG22 VAL 81 2HG2 VAL 81 1.300 11.094 4.118 426 HG23 VAL 81 3HG2 VAL 81 0.519 10.343 5.507 427 H ALA 82 H ALA 82 4.693 7.376 6.555 428 HA ALA 82 HA ALA 82 6.280 9.111 8.286 429 HB1 ALA 82 1HB ALA 82 6.854 7.279 9.775 430 HB2 ALA 82 2HB ALA 82 5.797 6.191 8.874 431 HB3 ALA 82 3HB ALA 82 5.108 7.540 9.779 432 H LYS 83 H LYS 83 7.910 9.462 7.080 433 HA LYS 83 HA LYS 83 9.722 9.245 5.646 434 HB2 LYS 83 1HB LYS 83 9.880 6.424 6.732 435 HB3 LYS 83 2HB LYS 83 11.194 7.384 6.069 436 HG2 LYS 83 1HG LYS 83 9.699 8.062 8.590 437 HG3 LYS 83 2HG LYS 83 11.228 7.185 8.543 438 HD2 LYS 83 1HD LYS 83 12.311 9.102 7.503 439 HD3 LYS 83 2HD LYS 83 10.779 9.977 7.483 440 HE2 LYS 83 1HE LYS 83 10.702 9.955 9.905 441 HE3 LYS 83 2HE LYS 83 12.176 8.990 9.967 442 HZ1 LYS 83 1HZ LYS 83 12.599 11.342 10.381 443 HZ2 LYS 83 2HZ LYS 83 11.982 11.738 8.862 444 HZ3 LYS 83 3HZ LYS 83 13.393 10.816 8.982 445 H GLY 84 H GLY 84 7.336 8.895 4.372 446 HA2 GLY 84 1HA GLY 84 6.640 8.249 2.259 447 HA3 GLY 84 2HA GLY 84 8.008 7.147 2.174 448 H VAL 85 H VAL 85 7.175 5.957 4.796 449 HA VAL 85 HA VAL 85 5.491 3.893 3.767 450 HB VAL 85 HB VAL 85 6.202 4.401 6.656 451 HG11 VAL 85 1HG1 VAL 85 4.393 2.811 6.383 452 HG12 VAL 85 2HG1 VAL 85 5.857 1.980 6.907 453 HG13 VAL 85 3HG1 VAL 85 5.349 1.892 5.221 454 HG21 VAL 85 1HG2 VAL 85 8.236 4.303 5.357 455 HG22 VAL 85 2HG2 VAL 85 7.694 2.823 4.565 456 HG23 VAL 85 3HG2 VAL 85 8.059 2.817 6.290 457 H VAL 86 H VAL 86 3.256 3.542 4.070 458 HA VAL 86 HA VAL 86 1.874 5.632 5.561 459 HB VAL 86 HB VAL 86 0.193 5.875 3.762 460 HG11 VAL 86 1HG1 VAL 86 1.956 7.523 3.993 461 HG12 VAL 86 2HG1 VAL 86 1.554 7.289 2.293 462 HG13 VAL 86 3HG1 VAL 86 3.016 6.564 2.960 463 HG21 VAL 86 1HG2 VAL 86 2.161 4.361 2.060 464 HG22 VAL 86 2HG2 VAL 86 0.670 5.125 1.512 465 HG23 VAL 86 3HG2 VAL 86 0.603 3.749 2.613 466 H SER 87 H SER 87 0.631 4.712 6.970 467 HA SER 87 HA SER 87 -0.568 2.098 6.410 468 HB2 SER 87 1HB SER 87 -0.421 3.617 9.028 469 HB3 SER 87 2HB SER 87 -0.975 1.957 8.819 470 HG SER 87 HG SER 87 1.633 2.898 8.188 471 H LEU 88 H LEU 88 -2.630 1.899 5.917 472 HA LEU 88 HA LEU 88 -4.435 4.180 6.420 473 HB2 LEU 88 1HB LEU 88 -4.631 2.070 4.264 474 HB3 LEU 88 2HB LEU 88 -5.767 3.384 4.518 475 HG LEU 88 HG LEU 88 -3.661 4.901 4.135 476 HD11 LEU 88 1HD1 LEU 88 -2.842 2.347 2.759 477 HD12 LEU 88 2HD1 LEU 88 -1.997 3.154 4.082 478 HD13 LEU 88 3HD1 LEU 88 -2.101 3.927 2.500 479 HD21 LEU 88 1HD2 LEU 88 -4.165 4.954 1.743 480 HD22 LEU 88 2HD2 LEU 88 -5.632 4.878 2.719 481 HD23 LEU 88 3HD2 LEU 88 -5.044 3.433 1.896 482 H THR 89 H THR 89 -6.412 3.767 7.397 483 HA THR 89 HA THR 89 -6.651 1.028 8.465 484 HB THR 89 HB THR 89 -7.424 3.540 9.946 485 HG1 THR 89 HG1 THR 89 -5.061 3.141 9.417 486 HG21 THR 89 1HG2 THR 89 -6.963 0.705 10.890 487 HG22 THR 89 2HG2 THR 89 -8.540 1.462 10.663 488 HG23 THR 89 3HG2 THR 89 -7.437 2.075 11.894 489 H GLY 90 H GLY 90 -8.511 0.052 8.355 490 HA2 GLY 90 1HA GLY 90 -10.662 -0.448 7.661 491 HA3 GLY 90 2HA GLY 90 -11.052 0.965 8.622 492 H GLN 91 H GLN 91 -9.448 0.605 5.464 493 HA GLN 91 HA GLN 91 -10.910 2.920 4.542 494 HB2 GLN 91 1HB GLN 91 -8.507 2.587 4.057 495 HB3 GLN 91 2HB GLN 91 -8.913 1.172 3.092 496 HG2 GLN 91 1HG GLN 91 -8.458 3.127 1.714 497 HG3 GLN 91 2HG GLN 91 -10.118 2.559 1.521 498 HE21 GLN 91 1HE2 GLN 91 -11.793 3.846 2.172 499 HE22 GLN 91 2HE2 GLN 91 -11.596 5.485 2.668 500 H GLU 92 H GLU 92 -12.779 2.851 3.509 501 HA GLU 92 HA GLU 92 -14.575 2.166 2.324 502 HB2 GLU 92 1HB GLU 92 -12.415 0.680 0.837 503 HB3 GLU 92 2HB GLU 92 -14.085 0.760 0.291 504 HG2 GLU 92 1HG GLU 92 -12.293 3.135 0.730 505 HG3 GLU 92 2HG GLU 92 -12.645 2.392 -0.823 506 H SER 93 H SER 93 -13.991 -0.789 1.098 507 HA SER 93 HA SER 93 -15.756 -2.120 2.888 508 HB2 SER 93 1HB SER 93 -15.603 -2.597 0.444 509 HB3 SER 93 2HB SER 93 -14.010 -3.295 0.714 510 HG SER 93 HG SER 93 -15.720 -4.420 2.421 511 H LEU 94 H LEU 94 -12.457 -1.510 3.007 512 HA LEU 94 HA LEU 94 -11.687 -4.033 4.223 513 HB2 LEU 94 1HB LEU 94 -10.022 -1.550 3.800 514 HB3 LEU 94 2HB LEU 94 -9.438 -3.164 4.174 515 HG LEU 94 HG LEU 94 -10.785 -2.338 1.599 516 HD11 LEU 94 1HD1 LEU 94 -8.556 -2.719 0.618 517 HD12 LEU 94 2HD1 LEU 94 -7.905 -2.940 2.243 518 HD13 LEU 94 3HD1 LEU 94 -8.583 -1.383 1.769 519 HD21 LEU 94 1HD2 LEU 94 -9.514 -4.965 2.365 520 HD22 LEU 94 2HD2 LEU 94 -10.186 -4.550 0.789 521 HD23 LEU 94 3HD2 LEU 94 -11.245 -4.671 2.194 522 H ASN 95 H ASN 95 -13.624 -2.524 5.585 523 HA ASN 95 HA ASN 95 -12.615 -0.981 7.704 524 HB2 ASN 95 1HB ASN 95 -15.030 -1.186 6.996 525 HB3 ASN 95 2HB ASN 95 -15.059 -2.757 7.787 526 HD21 ASN 95 1HD2 ASN 95 -13.342 0.084 8.951 527 HD22 ASN 95 2HD2 ASN 95 -14.297 0.299 10.372 528 H GLY 96 H GLY 96 -11.808 -1.510 9.695 529 HA2 GLY 96 1HA GLY 96 -10.989 -2.871 11.396 530 HA3 GLY 96 2HA GLY 96 -11.666 -4.264 10.562 531 H LEU 97 H LEU 97 -10.197 -3.100 8.098 532 HA LEU 97 HA LEU 97 -7.802 -4.692 8.556 533 HB2 LEU 97 1HB LEU 97 -9.322 -5.173 6.655 534 HB3 LEU 97 2HB LEU 97 -8.998 -3.575 6.020 535 HG LEU 97 HG LEU 97 -6.753 -5.540 6.388 536 HD11 LEU 97 1HD1 LEU 97 -8.625 -5.330 4.031 537 HD12 LEU 97 2HD1 LEU 97 -8.454 -6.716 5.107 538 HD13 LEU 97 3HD1 LEU 97 -7.119 -6.242 4.058 539 HD21 LEU 97 1HD2 LEU 97 -5.787 -4.280 4.541 540 HD22 LEU 97 2HD2 LEU 97 -6.203 -3.211 5.880 541 HD23 LEU 97 3HD2 LEU 97 -7.235 -3.279 4.452 542 H SER 98 H SER 98 -5.793 -3.869 8.531 543 HA SER 98 HA SER 98 -5.496 -0.999 7.945 544 HB2 SER 98 1HB SER 98 -5.010 -1.640 10.301 545 HB3 SER 98 2HB SER 98 -3.761 -2.739 9.721 546 HG SER 98 HG SER 98 -2.459 -1.109 9.600 547 H VAL 99 H VAL 99 -4.351 -0.499 6.204 548 HA VAL 99 HA VAL 99 -2.711 -2.586 4.929 549 HB VAL 99 HB VAL 99 -3.615 0.056 3.753 550 HG11 VAL 99 1HG1 VAL 99 -2.961 -0.938 1.610 551 HG12 VAL 99 2HG1 VAL 99 -2.384 -2.372 2.459 552 HG13 VAL 99 3HG1 VAL 99 -1.598 -0.814 2.722 553 HG21 VAL 99 1HG2 VAL 99 -4.776 -2.691 3.320 554 HG22 VAL 99 2HG2 VAL 99 -5.239 -1.226 2.456 555 HG23 VAL 99 3HG2 VAL 99 -5.547 -1.364 4.188 556 H VAL 100 H VAL 100 -0.503 -2.385 4.965 557 HA VAL 100 HA VAL 100 0.542 0.248 5.751 558 HB VAL 100 HB VAL 100 1.817 -2.419 6.382 559 HG11 VAL 100 1HG1 VAL 100 3.274 -1.110 7.844 560 HG12 VAL 100 2HG1 VAL 100 2.469 0.370 7.323 561 HG13 VAL 100 3HG1 VAL 100 3.401 -0.582 6.165 562 HG21 VAL 100 1HG2 VAL 100 -0.239 -2.198 7.655 563 HG22 VAL 100 2HG2 VAL 100 0.244 -0.589 8.191 564 HG23 VAL 100 3HG2 VAL 100 1.156 -2.004 8.714 565 H MET 101 H MET 101 1.186 1.080 3.875 566 HA MET 101 HA MET 101 2.594 -0.594 1.929 567 HB2 MET 101 1HB MET 101 0.870 0.947 1.086 568 HB3 MET 101 2HB MET 101 1.735 2.306 1.784 569 HG2 MET 101 1HG MET 101 2.212 2.294 -0.524 570 HG3 MET 101 2HG MET 101 3.663 1.740 0.304 571 HE1 MET 101 1HE MET 101 0.761 -0.952 -2.062 572 HE2 MET 101 2HE MET 101 0.626 0.801 -1.936 573 HE3 MET 101 3HE MET 101 0.313 -0.211 -0.527 574 H THR 102 H THR 102 4.701 -0.851 2.242 575 HA THR 102 HA THR 102 6.237 1.386 3.389 576 HB THR 102 HB THR 102 7.141 -1.486 3.299 577 HG1 THR 102 HG1 THR 102 6.164 -0.465 5.699 578 HG21 THR 102 1HG2 THR 102 8.854 0.220 3.718 579 HG22 THR 102 2HG2 THR 102 8.597 -0.806 5.129 580 HG23 THR 102 3HG2 THR 102 7.914 0.818 5.085 581 HA PRO 103 HA PRO 103 7.880 1.143 -0.877 582 HB2 PRO 103 1HB PRO 103 8.249 3.800 -1.198 583 HB3 PRO 103 2HB PRO 103 6.679 3.022 -1.457 584 HG2 PRO 103 1HG PRO 103 7.648 4.594 0.890 585 HG3 PRO 103 2HG PRO 103 6.043 4.573 0.136 586 HD2 PRO 103 1HD PRO 103 6.714 3.208 2.435 587 HD3 PRO 103 2HD PRO 103 5.371 2.761 1.358 588 H GLY 104 H GLY 104 9.937 0.764 -1.210 589 HA2 GLY 104 1HA GLY 104 12.216 1.258 -1.315 590 HA3 GLY 104 2HA GLY 104 11.970 2.546 -0.150 591 H TRP 105 H TRP 105 14.078 0.656 -0.182 592 HA TRP 105 HA TRP 105 13.727 -0.439 2.502 593 HB2 TRP 105 1HB TRP 105 13.274 -2.307 0.950 594 HB3 TRP 105 2HB TRP 105 14.827 -2.034 0.169 595 HD1 TRP 105 HD1 TRP 105 16.889 -3.219 1.188 596 HE1 TRP 105 HE1 TRP 105 17.283 -4.714 3.246 597 HE3 TRP 105 HE3 TRP 105 12.368 -2.628 3.498 598 HZ2 TRP 105 HZ2 TRP 105 15.863 -5.536 5.541 599 HZ3 TRP 105 HZ3 TRP 105 11.965 -3.805 5.620 600 HH2 TRP 105 HH2 TRP 105 13.678 -5.229 6.620 601 H ASP 106 H ASP 106 15.851 0.354 -0.191 602 HA ASP 106 HA ASP 106 18.064 0.780 1.700 603 HB2 ASP 106 1HB ASP 106 18.474 -0.802 -0.191 604 HB3 ASP 106 2HB ASP 106 18.186 0.524 -1.313 605 H ASN 107 H ASN 107 18.902 2.762 1.950 606 HA ASN 107 HA ASN 107 17.213 4.938 1.299 607 HB2 ASN 107 1HB ASN 107 18.804 6.313 2.533 608 HB3 ASN 107 2HB ASN 107 18.456 4.831 3.410 609 HD21 ASN 107 1HD2 ASN 107 20.847 6.707 1.798 610 HD22 ASN 107 2HD2 ASN 107 22.204 5.711 2.195 611 H ALA 108 H ALA 108 19.993 3.624 -0.297 612 HA ALA 108 HA ALA 108 20.904 6.092 -1.413 613 HB1 ALA 108 1HB ALA 108 22.420 4.209 -1.065 614 HB2 ALA 108 2HB ALA 108 22.410 4.732 -2.749 615 HB3 ALA 108 3HB ALA 108 21.539 3.277 -2.271 616 H ASN 109 H ASN 109 18.844 3.465 -2.588 617 HA ASN 109 HA ASN 109 18.578 4.871 -5.147 618 HB2 ASN 109 1HB ASN 109 17.848 2.874 -6.104 619 HB3 ASN 109 2HB ASN 109 19.025 2.323 -4.919 620 HD21 ASN 109 1HD2 ASN 109 15.735 2.345 -5.878 621 HD22 ASN 109 2HD2 ASN 109 15.143 1.271 -4.659 622 H GLY 110 H GLY 110 17.153 4.936 -2.232 623 HA2 GLY 110 1HA GLY 110 15.221 5.951 -1.516 624 HA3 GLY 110 2HA GLY 110 14.823 6.265 -3.196 625 H VAL 111 H VAL 111 13.525 4.840 -4.316 626 HA VAL 111 HA VAL 111 11.825 3.269 -2.554 627 HB VAL 111 HB VAL 111 11.375 3.882 -5.476 628 HG11 VAL 111 1HG1 VAL 111 10.041 2.034 -4.632 629 HG12 VAL 111 2HG1 VAL 111 9.018 3.443 -4.921 630 HG13 VAL 111 3HG1 VAL 111 9.497 3.022 -3.275 631 HG21 VAL 111 1HG2 VAL 111 9.948 5.720 -4.725 632 HG22 VAL 111 2HG2 VAL 111 11.620 5.958 -4.213 633 HG23 VAL 111 3HG2 VAL 111 10.413 5.403 -3.055 634 H THR 112 H THR 112 13.483 1.598 -2.309 635 HA THR 112 HA THR 112 14.097 -0.188 -4.444 636 HB THR 112 HB THR 112 14.073 -1.207 -1.661 637 HG1 THR 112 HG1 THR 112 16.026 0.728 -2.380 638 HG21 THR 112 1HG2 THR 112 15.148 -2.429 -3.504 639 HG22 THR 112 2HG2 THR 112 16.324 -1.946 -2.281 640 HG23 THR 112 3HG2 THR 112 16.208 -1.052 -3.796 641 H GLY 113 H GLY 113 11.468 0.099 -4.804 642 HA2 GLY 113 1HA GLY 113 9.749 -1.406 -5.313 643 HA3 GLY 113 2HA GLY 113 10.441 -2.550 -4.172 644 H TRP 114 H TRP 114 8.062 -2.717 -3.688 645 HA TRP 114 HA TRP 114 7.380 -0.844 -1.532 646 HB2 TRP 114 1HB TRP 114 5.516 -1.813 -3.710 647 HB3 TRP 114 2HB TRP 114 4.982 -0.997 -2.246 648 HD1 TRP 114 HD1 TRP 114 5.221 1.612 -2.145 649 HE1 TRP 114 HE1 TRP 114 5.802 3.395 -3.912 650 HE3 TRP 114 HE3 TRP 114 7.029 -1.441 -5.828 651 HZ2 TRP 114 HZ2 TRP 114 6.889 3.492 -6.510 652 HZ3 TRP 114 HZ3 TRP 114 7.818 -0.423 -7.923 653 HH2 TRP 114 HH2 TRP 114 7.747 1.994 -8.256 654 H ALA 115 H ALA 115 6.918 -1.902 0.305 655 HA ALA 115 HA ALA 115 6.216 -4.737 0.149 656 HB1 ALA 115 1HB ALA 115 6.800 -4.926 2.419 657 HB2 ALA 115 2HB ALA 115 6.710 -3.189 2.669 658 HB3 ALA 115 3HB ALA 115 8.025 -3.871 1.714 659 H ARG 116 H ARG 116 4.174 -5.346 0.271 660 HA ARG 116 HA ARG 116 2.212 -3.386 1.269 661 HB2 ARG 116 1HB ARG 116 1.933 -5.599 -0.759 662 HB3 ARG 116 2HB ARG 116 0.546 -4.788 -0.050 663 HG2 ARG 116 1HG ARG 116 0.836 -3.689 -2.061 664 HG3 ARG 116 2HG ARG 116 1.636 -2.624 -0.909 665 HD2 ARG 116 1HD ARG 116 3.793 -3.387 -1.585 666 HD3 ARG 116 2HD ARG 116 3.093 -4.690 -2.548 667 HE ARG 116 HE ARG 116 2.385 -1.959 -3.281 668 HH11 ARG 116 1HH1 ARG 116 4.398 -4.748 -3.921 669 HH12 ARG 116 2HH1 ARG 116 4.708 -4.304 -5.577 670 HH21 ARG 116 1HH2 ARG 116 2.820 -1.352 -5.435 671 HH22 ARG 116 2HH2 ARG 116 3.806 -2.376 -6.431 672 H ASN 117 H ASN 117 0.958 -3.868 2.955 673 HA ASN 117 HA ASN 117 0.784 -6.660 3.829 674 HB2 ASN 117 1HB ASN 117 2.551 -5.643 5.182 675 HB3 ASN 117 2HB ASN 117 1.473 -4.324 5.621 676 HD21 ASN 117 1HD2 ASN 117 2.192 -7.696 6.063 677 HD22 ASN 117 2HD2 ASN 117 1.220 -7.923 7.475 678 H CYS 118 H CYS 118 -1.229 -7.235 4.197 679 HA CYS 118 HA CYS 118 -3.199 -5.176 4.937 680 HB2 CYS 118 1HB CYS 118 -3.472 -7.804 3.489 681 HB3 CYS 118 2HB CYS 118 -4.855 -7.036 4.263 682 H ASN 119 H ASN 119 -3.597 -5.175 7.077 683 HA ASN 119 HA ASN 119 -3.554 -7.782 8.450 684 HB2 ASN 119 1HB ASN 119 -2.020 -6.149 9.427 685 HB3 ASN 119 2HB ASN 119 -3.330 -4.987 9.592 686 HD21 ASN 119 1HD2 ASN 119 -1.885 -7.874 10.854 687 HD22 ASN 119 2HD2 ASN 119 -2.818 -7.949 12.306 688 H ILE 120 H ILE 120 -5.543 -8.572 8.207 689 HA ILE 120 HA ILE 120 -7.661 -7.111 9.592 690 HB ILE 120 HB ILE 120 -8.198 -6.805 7.281 691 HG12 ILE 120 1HG1 ILE 120 -10.356 -8.061 7.094 692 HG13 ILE 120 2HG1 ILE 120 -9.884 -8.976 8.518 693 HG21 ILE 120 1HG2 ILE 120 -8.532 -8.701 5.736 694 HG22 ILE 120 2HG2 ILE 120 -7.860 -9.775 6.963 695 HG23 ILE 120 3HG2 ILE 120 -6.860 -8.504 6.260 696 HD11 ILE 120 1HD1 ILE 120 -11.442 -7.172 9.038 697 HD12 ILE 120 2HD1 ILE 120 -10.287 -5.997 8.411 698 HD13 ILE 120 3HD1 ILE 120 -9.893 -6.944 9.843 699 H GLN 121 H GLN 121 -7.837 -8.313 11.401 700 HA GLN 121 HA GLN 121 -6.940 -11.029 11.417 701 HB2 GLN 121 1HB GLN 121 -6.536 -9.410 13.265 702 HB3 GLN 121 2HB GLN 121 -8.251 -9.461 13.640 703 HG2 GLN 121 1HG GLN 121 -8.084 -11.834 14.143 704 HG3 GLN 121 2HG GLN 121 -6.366 -11.802 13.747 705 HE21 GLN 121 1HE2 GLN 121 -8.801 -10.889 16.039 706 HE22 GLN 121 2HE2 GLN 121 -7.717 -10.449 17.316 707 H SER 122 H SER 122 -10.117 -9.460 11.558 708 HA SER 122 HA SER 122 -11.371 -11.957 12.330 709 HB2 SER 122 1HB SER 122 -12.704 -9.304 11.783 710 HB3 SER 122 2HB SER 122 -13.330 -10.649 12.740 711 HG SER 122 HG SER 122 -11.959 -8.608 13.619 712 H ASP 123 H ASP 123 -10.618 -10.471 9.385 713 HA ASP 123 HA ASP 123 -12.648 -12.042 7.999 714 HB2 ASP 123 1HB ASP 123 -12.381 -9.052 7.754 715 HB3 ASP 123 2HB ASP 123 -13.110 -10.030 6.488 716 H SER 124 H SER 124 -10.903 -13.325 7.290 717 HA SER 124 HA SER 124 -8.624 -12.365 5.961 718 HB2 SER 124 1HB SER 124 -8.987 -14.707 6.863 719 HB3 SER 124 2HB SER 124 -9.968 -15.025 5.434 720 HG SER 124 HG SER 124 -8.169 -14.687 4.147 721 H ALA 125 H ALA 125 -11.892 -12.671 4.887 722 HA ALA 125 HA ALA 125 -11.513 -12.884 2.112 723 HB1 ALA 125 1HB ALA 125 -13.674 -13.253 3.192 724 HB2 ALA 125 2HB ALA 125 -13.794 -12.048 1.911 725 HB3 ALA 125 3HB ALA 125 -13.764 -11.539 3.600 726 H LEU 126 H LEU 126 -11.530 -10.096 4.263 727 HA LEU 126 HA LEU 126 -11.550 -8.152 2.186 728 HB2 LEU 126 1HB LEU 126 -10.631 -7.915 5.050 729 HB3 LEU 126 2HB LEU 126 -10.873 -6.566 3.956 730 HG LEU 126 HG LEU 126 -13.013 -8.437 4.975 731 HD11 LEU 126 1HD1 LEU 126 -12.467 -5.529 5.546 732 HD12 LEU 126 2HD1 LEU 126 -12.235 -6.874 6.664 733 HD13 LEU 126 3HD1 LEU 126 -13.858 -6.448 6.120 734 HD21 LEU 126 1HD2 LEU 126 -13.518 -7.750 2.709 735 HD22 LEU 126 2HD2 LEU 126 -13.209 -6.066 3.127 736 HD23 LEU 126 3HD2 LEU 126 -14.578 -6.914 3.843 737 H GLN 127 H GLN 127 -9.091 -9.939 3.883 738 HA GLN 127 HA GLN 127 -6.819 -8.534 3.013 739 HB2 GLN 127 1HB GLN 127 -6.561 -10.171 4.739 740 HB3 GLN 127 2HB GLN 127 -7.258 -11.432 3.733 741 HG2 GLN 127 1HG GLN 127 -5.320 -11.355 2.264 742 HG3 GLN 127 2HG GLN 127 -4.619 -10.070 3.246 743 HE21 GLN 127 1HE2 GLN 127 -2.797 -11.325 3.688 744 HE22 GLN 127 2HE2 GLN 127 -2.848 -12.645 4.801 745 H GLN 128 H GLN 128 -8.621 -11.217 1.600 746 HA GLN 128 HA GLN 128 -6.980 -11.614 -0.648 747 HB2 GLN 128 1HB GLN 128 -9.941 -12.119 -0.320 748 HB3 GLN 128 2HB GLN 128 -8.948 -12.758 -1.626 749 HG2 GLN 128 1HG GLN 128 -7.590 -13.953 0.062 750 HG3 GLN 128 2HG GLN 128 -8.702 -13.383 1.306 751 HE21 GLN 128 1HE2 GLN 128 -8.269 -15.492 -1.406 752 HE22 GLN 128 2HE2 GLN 128 -9.690 -16.445 -1.153 753 H ALA 129 H ALA 129 -9.535 -9.353 0.026 754 HA ALA 129 HA ALA 129 -9.945 -8.524 -2.671 755 HB1 ALA 129 1HB ALA 129 -11.671 -8.307 -0.934 756 HB2 ALA 129 2HB ALA 129 -11.317 -6.769 -1.720 757 HB3 ALA 129 3HB ALA 129 -10.675 -7.107 -0.113 758 H CYS 130 H CYS 130 -8.206 -7.125 0.113 759 HA CYS 130 HA CYS 130 -7.395 -4.811 -1.321 760 HB2 CYS 130 1HB CYS 130 -5.875 -4.413 0.593 761 HB3 CYS 130 2HB CYS 130 -7.523 -4.769 1.108 762 H GLU 131 H GLU 131 -5.759 -7.868 -0.534 763 HA GLU 131 HA GLU 131 -3.275 -7.171 -1.639 764 HB2 GLU 131 1HB GLU 131 -2.703 -9.498 -1.594 765 HB3 GLU 131 2HB GLU 131 -3.625 -9.120 -0.144 766 HG2 GLU 131 1HG GLU 131 -5.546 -10.210 -0.962 767 HG3 GLU 131 2HG GLU 131 -4.878 -10.323 -2.592 768 H ASP 132 H ASP 132 -6.230 -8.091 -3.162 769 HA ASP 132 HA ASP 132 -5.074 -8.987 -5.608 770 HB2 ASP 132 1HB ASP 132 -7.405 -9.528 -4.884 771 HB3 ASP 132 2HB ASP 132 -7.846 -7.853 -5.200 772 H VAL 133 H VAL 133 -6.452 -5.871 -4.577 773 HA VAL 133 HA VAL 133 -5.771 -4.626 -7.103 774 HB VAL 133 HB VAL 133 -6.909 -3.453 -4.558 775 HG11 VAL 133 1HG1 VAL 133 -5.661 -1.768 -5.827 776 HG12 VAL 133 2HG1 VAL 133 -7.396 -1.458 -5.857 777 HG13 VAL 133 3HG1 VAL 133 -6.602 -2.162 -7.266 778 HG21 VAL 133 1HG2 VAL 133 -8.176 -4.186 -7.191 779 HG22 VAL 133 2HG2 VAL 133 -8.984 -3.315 -5.891 780 HG23 VAL 133 3HG2 VAL 133 -8.440 -4.972 -5.634 781 H PHE 134 H PHE 134 -4.762 -4.322 -3.735 782 HA PHE 134 HA PHE 134 -2.574 -2.545 -4.336 783 HB2 PHE 134 1HB PHE 134 -3.409 -3.910 -1.766 784 HB3 PHE 134 2HB PHE 134 -2.052 -2.798 -1.896 785 HD1 PHE 134 HD1 PHE 134 -5.706 -3.104 -2.009 786 HD2 PHE 134 HD2 PHE 134 -2.395 -0.429 -2.107 787 HE1 PHE 134 HE1 PHE 134 -7.234 -1.206 -1.662 788 HE2 PHE 134 HE2 PHE 134 -3.917 1.471 -1.752 789 HZ PHE 134 HZ PHE 134 -6.339 1.084 -1.534 790 H ARG 135 H ARG 135 -2.590 -5.075 -5.641 791 HA ARG 135 HA ARG 135 -1.452 -7.213 -4.308 792 HB2 ARG 135 1HB ARG 135 -0.976 -8.121 -6.563 793 HB3 ARG 135 2HB ARG 135 -2.610 -7.491 -6.403 794 HG2 ARG 135 1HG ARG 135 -1.913 -5.437 -7.552 795 HG3 ARG 135 2HG ARG 135 -0.293 -6.111 -7.743 796 HD2 ARG 135 1HD ARG 135 -1.216 -7.958 -9.053 797 HD3 ARG 135 2HD ARG 135 -2.836 -7.296 -8.853 798 HE ARG 135 HE ARG 135 -0.927 -5.499 -10.066 799 HH11 ARG 135 1HH1 ARG 135 -3.355 -7.964 -10.599 800 HH12 ARG 135 2HH1 ARG 135 -3.673 -7.481 -12.236 801 HH21 ARG 135 1HH2 ARG 135 -1.343 -4.862 -12.235 802 HH22 ARG 135 2HH2 ARG 135 -2.537 -5.713 -13.162 803 H PHE 136 H PHE 136 0.531 -8.114 -4.240 804 HA PHE 136 HA PHE 136 2.714 -6.171 -4.365 805 HB2 PHE 136 1HB PHE 136 3.741 -8.181 -2.890 806 HB3 PHE 136 2HB PHE 136 2.834 -6.841 -2.200 807 HD1 PHE 136 HD1 PHE 136 0.784 -7.196 -1.098 808 HD2 PHE 136 HD2 PHE 136 2.549 -10.356 -3.340 809 HE1 PHE 136 HE1 PHE 136 -0.848 -8.773 -0.157 810 HE2 PHE 136 HE2 PHE 136 0.914 -11.935 -2.401 811 HZ PHE 136 HZ PHE 136 -0.785 -11.142 -0.809 812 H ASP 137 H ASP 137 4.007 -6.353 -6.012 813 HA ASP 137 HA ASP 137 4.173 -8.536 -7.763 814 HB2 ASP 137 1HB ASP 137 6.500 -6.682 -7.369 815 HB3 ASP 137 2HB ASP 137 5.840 -7.332 -8.864 816 H ASP 138 H ASP 138 5.298 -10.385 -7.648 817 HA ASP 138 HA ASP 138 6.299 -11.241 -5.172 818 HB2 ASP 138 1HB ASP 138 6.487 -12.457 -7.926 819 HB3 ASP 138 2HB ASP 138 7.118 -13.254 -6.488 820 H ALA 139 H ALA 139 7.806 -9.474 -7.641 821 HA ALA 139 HA ALA 139 10.500 -10.204 -7.209 822 HB1 ALA 139 1HB ALA 139 9.372 -7.546 -8.089 823 HB2 ALA 139 2HB ALA 139 9.772 -8.898 -9.149 824 HB3 ALA 139 3HB ALA 139 11.048 -8.067 -8.259 825 H ASN 140 H ASN 140 8.240 -8.443 -5.338 826 HA ASN 140 HA ASN 140 10.320 -7.205 -3.689 827 HB2 ASN 140 1HB ASN 140 7.301 -6.950 -3.550 828 HB3 ASN 140 2HB ASN 140 8.450 -6.041 -2.576 829 HD21 ASN 140 1HD2 ASN 140 7.000 -6.428 -5.679 830 HD22 ASN 140 2HD2 ASN 140 7.614 -4.974 -6.387 831 H LEU 141 H LEU 141 9.013 -10.125 -3.914 832 HA LEU 141 HA LEU 141 8.883 -10.538 -1.004 833 HB2 LEU 141 1HB LEU 141 7.307 -11.997 -3.122 834 HB3 LEU 141 2HB LEU 141 7.267 -12.339 -1.405 835 HG LEU 141 HG LEU 141 6.311 -9.780 -2.694 836 HD11 LEU 141 1HD1 LEU 141 4.081 -10.614 -2.061 837 HD12 LEU 141 2HD1 LEU 141 4.810 -12.141 -1.570 838 HD13 LEU 141 3HD1 LEU 141 4.873 -11.637 -3.259 839 HD21 LEU 141 1HD2 LEU 141 7.120 -9.413 -0.429 840 HD22 LEU 141 2HD2 LEU 141 6.138 -10.756 0.158 841 HD23 LEU 141 3HD2 LEU 141 5.360 -9.307 -0.481 842 H VAL 142 H VAL 142 11.092 -11.166 -0.941 843 HA VAL 142 HA VAL 142 12.167 -13.280 -2.405 844 HB VAL 142 HB VAL 142 13.590 -11.877 -1.052 845 HG11 VAL 142 1HG1 VAL 142 12.184 -13.033 1.345 846 HG12 VAL 142 2HG1 VAL 142 12.085 -11.369 0.775 847 HG13 VAL 142 3HG1 VAL 142 13.609 -11.999 1.397 848 HG21 VAL 142 1HG2 VAL 142 14.399 -14.121 -1.492 849 HG22 VAL 142 2HG2 VAL 142 13.605 -14.710 -0.030 850 HG23 VAL 142 3HG2 VAL 142 14.945 -13.568 0.093 851 HA PRO 143 HA PRO 143 9.503 -16.481 -0.891 852 HB2 PRO 143 1HB PRO 143 10.495 -18.505 -2.356 853 HB3 PRO 143 2HB PRO 143 9.545 -17.206 -3.083 854 HG2 PRO 143 1HG PRO 143 12.512 -17.579 -3.020 855 HG3 PRO 143 2HG PRO 143 11.478 -17.065 -4.365 856 HD2 PRO 143 1HD PRO 143 12.918 -15.328 -2.821 857 HD3 PRO 143 2HD PRO 143 11.406 -14.890 -3.640 858 H ARG 144 H ARG 144 9.552 -18.324 0.383 859 HA ARG 144 HA ARG 144 12.153 -19.274 1.330 860 HB2 ARG 144 1HB ARG 144 11.215 -17.620 2.975 861 HB3 ARG 144 2HB ARG 144 9.817 -18.668 3.162 862 HG2 ARG 144 1HG ARG 144 11.267 -19.067 4.997 863 HG3 ARG 144 2HG ARG 144 11.373 -20.468 3.931 864 HD2 ARG 144 1HD ARG 144 13.447 -19.611 2.991 865 HD3 ARG 144 2HD ARG 144 13.333 -18.176 4.006 866 HE ARG 144 HE ARG 144 13.314 -20.170 5.815 867 HH11 ARG 144 1HH1 ARG 144 15.393 -19.492 3.085 868 HH12 ARG 144 2HH1 ARG 144 16.796 -20.204 3.815 869 HH21 ARG 144 1HH2 ARG 144 15.171 -21.096 6.790 870 HH22 ARG 144 2HH2 ARG 144 16.676 -21.111 5.922 871 H GLY 145 H GLY 145 12.047 -21.248 0.400 872 HA2 GLY 145 1HA GLY 145 11.349 -23.431 0.061 873 HA3 GLY 145 2HA GLY 145 10.115 -23.170 1.285 874 H SER 146 H SER 146 10.634 -23.752 -1.951 875 HA SER 146 HA SER 146 8.600 -22.187 -3.155 876 HB2 SER 146 1HB SER 146 9.784 -24.814 -4.087 877 HB3 SER 146 2HB SER 146 8.903 -23.655 -5.085 878 HG SER 146 HG SER 146 10.573 -22.136 -4.635 879 H GLY 147 H GLY 147 6.469 -22.579 -3.493 880 HA2 GLY 147 1HA GLY 147 4.538 -23.954 -3.685 881 HA3 GLY 147 2HA GLY 147 5.367 -25.202 -2.765 882 H LEU 148 H LEU 148 6.194 -22.796 -0.973 883 HA LEU 148 HA LEU 148 3.921 -23.123 0.818 884 HB2 LEU 148 1HB LEU 148 6.662 -21.936 1.288 885 HB3 LEU 148 2HB LEU 148 5.427 -22.124 2.518 886 HG LEU 148 HG LEU 148 6.757 -24.396 1.031 887 HD11 LEU 148 1HD1 LEU 148 7.129 -23.410 3.855 888 HD12 LEU 148 2HD1 LEU 148 8.299 -23.275 2.543 889 HD13 LEU 148 3HD1 LEU 148 7.851 -24.863 3.166 890 HD21 LEU 148 1HD2 LEU 148 5.665 -25.789 2.771 891 HD22 LEU 148 2HD2 LEU 148 4.522 -25.010 1.681 892 HD23 LEU 148 3HD2 LEU 148 4.772 -24.364 3.303 893 H GLU 149 H GLU 149 2.439 -21.755 -0.135 894 HA GLU 149 HA GLU 149 3.005 -18.942 -0.488 895 HB2 GLU 149 1HB GLU 149 0.351 -20.405 -0.465 896 HB3 GLU 149 2HB GLU 149 0.623 -18.766 -1.035 897 HG2 GLU 149 1HG GLU 149 1.874 -19.532 -2.899 898 HG3 GLU 149 2HG GLU 149 1.930 -21.175 -2.262 899 H HIS 150 H HIS 150 1.625 -21.087 1.840 900 HA HIS 150 HA HIS 150 0.279 -19.311 3.519 901 HB2 HIS 150 1HB HIS 150 0.121 -21.792 3.612 902 HB3 HIS 150 2HB HIS 150 1.754 -21.852 4.259 903 HD1 HIS 150 HD1 HIS 150 1.531 -22.512 6.620 904 HD2 HIS 150 HD2 HIS 150 -1.325 -19.696 5.529 905 HE1 HIS 150 HE1 HIS 150 0.270 -21.978 8.726 906 HE2 HIS 150 HE2 HIS 150 -1.363 -20.177 8.069 907 H HIS 151 H HIS 151 0.953 -17.823 4.913 908 HA HIS 151 HA HIS 151 3.571 -16.920 5.058 909 HB2 HIS 151 1HB HIS 151 1.717 -15.484 5.625 910 HB3 HIS 151 2HB HIS 151 1.252 -16.533 6.957 911 HD1 HIS 151 HD1 HIS 151 1.978 -15.731 9.160 912 HD2 HIS 151 HD2 HIS 151 4.480 -14.365 6.139 913 HE1 HIS 151 HE1 HIS 151 3.630 -14.215 10.292 914 HE2 HIS 151 HE2 HIS 151 5.012 -13.255 8.418 915 H HIS 152 H HIS 152 5.296 -17.678 6.025 916 HA HIS 152 HA HIS 152 5.317 -19.942 7.691 917 HB2 HIS 152 1HB HIS 152 7.400 -17.836 7.115 918 HB3 HIS 152 2HB HIS 152 7.714 -19.209 8.170 919 HD1 HIS 152 HD1 HIS 152 9.194 -20.701 6.871 920 HD2 HIS 152 HD2 HIS 152 6.059 -19.250 4.562 921 HE1 HIS 152 HE1 HIS 152 9.418 -21.833 4.641 922 HE2 HIS 152 HE2 HIS 152 7.651 -20.772 3.203 923 H HIS 153 H HIS 153 5.027 -20.170 9.793 924 HA HIS 153 HA HIS 153 4.114 -17.920 11.301 925 HB2 HIS 153 1HB HIS 153 3.237 -20.317 11.434 926 HB3 HIS 153 2HB HIS 153 4.669 -20.675 12.393 927 HD1 HIS 153 HD1 HIS 153 1.267 -19.455 12.664 928 HD2 HIS 153 HD2 HIS 153 4.768 -19.069 14.871 929 HE1 HIS 153 HE1 HIS 153 0.548 -18.677 14.940 930 HE2 HIS 153 HE2 HIS 153 2.666 -18.572 16.295 931 H HIS 154 H HIS 154 5.565 -16.500 11.977 932 HA HIS 154 HA HIS 154 8.082 -17.438 13.132 933 HB2 HIS 154 1HB HIS 154 7.124 -14.683 12.346 934 HB3 HIS 154 2HB HIS 154 8.638 -14.970 13.194 935 HD1 HIS 154 HD1 HIS 154 7.038 -15.231 9.848 936 HD2 HIS 154 HD2 HIS 154 10.668 -16.161 11.642 937 HE1 HIS 154 HE1 HIS 154 8.622 -15.710 7.956 938 HE2 HIS 154 HE2 HIS 154 10.759 -16.437 9.075 939 H HIS 155 H HIS 155 8.648 -17.044 15.241 940 HA HIS 155 HA HIS 155 6.551 -15.943 16.983 941 HB2 HIS 155 1HB HIS 155 6.539 -18.414 17.099 942 HB3 HIS 155 2HB HIS 155 8.240 -18.396 17.540 943 HD1 HIS 155 HD1 HIS 155 4.823 -17.748 18.912 944 HD2 HIS 155 HD2 HIS 155 8.773 -17.701 20.205 945 HE1 HIS 155 HE1 HIS 155 4.713 -17.607 21.419 946 HE2 HIS 155 HE2 HIS 155 7.114 -17.374 22.157 Start of MODEL 13 1 H1 MET 24 1H MET 24 -23.059 -11.671 -1.250 2 H2 MET 24 2H MET 24 -21.985 -10.820 -0.259 3 H3 MET 24 3H MET 24 -22.764 -12.194 0.329 4 HA MET 24 HA MET 24 -20.441 -12.604 -0.247 5 HB2 MET 24 1HB MET 24 -22.507 -14.038 -1.923 6 HB3 MET 24 2HB MET 24 -20.875 -14.624 -1.629 7 HG2 MET 24 1HG MET 24 -23.049 -14.216 0.411 8 HG3 MET 24 2HG MET 24 -22.412 -15.753 -0.173 9 HE1 MET 24 1HE MET 24 -20.004 -16.675 0.389 10 HE2 MET 24 2HE MET 24 -18.791 -15.766 1.292 11 HE3 MET 24 3HE MET 24 -19.298 -15.218 -0.306 12 H GLU 25 H GLU 25 -20.957 -10.171 -1.666 13 HA GLU 25 HA GLU 25 -19.582 -10.797 -4.183 14 HB2 GLU 25 1HB GLU 25 -21.925 -10.290 -4.701 15 HB3 GLU 25 2HB GLU 25 -21.802 -8.772 -3.822 16 HG2 GLU 25 1HG GLU 25 -21.680 -8.424 -6.226 17 HG3 GLU 25 2HG GLU 25 -20.178 -7.950 -5.433 18 H ASN 26 H ASN 26 -17.661 -9.872 -4.177 19 HA ASN 26 HA ASN 26 -17.339 -7.321 -2.742 20 HB2 ASN 26 1HB ASN 26 -15.481 -9.691 -2.865 21 HB3 ASN 26 2HB ASN 26 -14.894 -8.079 -2.465 22 HD21 ASN 26 1HD2 ASN 26 -16.764 -10.793 -1.409 23 HD22 ASN 26 2HD2 ASN 26 -16.945 -10.288 0.237 24 H TYR 27 H TYR 27 -17.586 -8.455 -5.748 25 HA TYR 27 HA TYR 27 -15.154 -7.709 -6.968 26 HB2 TYR 27 1HB TYR 27 -16.902 -9.176 -8.013 27 HB3 TYR 27 2HB TYR 27 -17.867 -7.731 -8.298 28 HD1 TYR 27 HD1 TYR 27 -14.614 -9.334 -9.102 29 HD2 TYR 27 HD2 TYR 27 -17.469 -6.369 -10.187 30 HE1 TYR 27 HE1 TYR 27 -13.409 -8.947 -11.210 31 HE2 TYR 27 HE2 TYR 27 -16.271 -5.980 -12.293 32 HH TYR 27 HH TYR 27 -13.964 -6.261 -13.170 33 H LEU 28 H LEU 28 -18.097 -5.868 -6.296 34 HA LEU 28 HA LEU 28 -17.195 -3.545 -7.729 35 HB2 LEU 28 1HB LEU 28 -19.386 -3.928 -5.686 36 HB3 LEU 28 2HB LEU 28 -19.053 -2.395 -6.463 37 HG LEU 28 HG LEU 28 -19.899 -4.914 -7.900 38 HD11 LEU 28 1HD1 LEU 28 -22.027 -3.760 -8.223 39 HD12 LEU 28 2HD1 LEU 28 -21.454 -2.418 -7.233 40 HD13 LEU 28 3HD1 LEU 28 -21.688 -4.009 -6.511 41 HD21 LEU 28 1HD2 LEU 28 -19.491 -2.085 -8.866 42 HD22 LEU 28 2HD2 LEU 28 -20.219 -3.383 -9.812 43 HD23 LEU 28 3HD2 LEU 28 -18.533 -3.497 -9.310 44 H ARG 29 H ARG 29 -17.064 -4.763 -4.479 45 HA ARG 29 HA ARG 29 -16.019 -2.483 -3.204 46 HB2 ARG 29 1HB ARG 29 -16.923 -4.286 -1.896 47 HB3 ARG 29 2HB ARG 29 -15.790 -5.433 -2.595 48 HG2 ARG 29 1HG ARG 29 -13.977 -4.532 -1.398 49 HG3 ARG 29 2HG ARG 29 -14.896 -3.094 -0.939 50 HD2 ARG 29 1HD ARG 29 -15.534 -5.911 -0.059 51 HD3 ARG 29 2HD ARG 29 -14.667 -4.718 0.911 52 HE ARG 29 HE ARG 29 -16.832 -3.345 0.520 53 HH11 ARG 29 1HH1 ARG 29 -16.696 -6.823 0.984 54 HH12 ARG 29 2HH1 ARG 29 -18.241 -6.897 1.772 55 HH21 ARG 29 1HH2 ARG 29 -18.868 -3.461 1.543 56 HH22 ARG 29 2HH2 ARG 29 -19.469 -4.994 2.091 57 H LYS 30 H LYS 30 -14.493 -5.210 -4.856 58 HA LYS 30 HA LYS 30 -11.836 -4.405 -4.353 59 HB2 LYS 30 1HB LYS 30 -12.924 -6.075 -6.626 60 HB3 LYS 30 2HB LYS 30 -11.218 -5.894 -6.238 61 HG2 LYS 30 1HG LYS 30 -11.893 -6.786 -3.912 62 HG3 LYS 30 2HG LYS 30 -13.357 -7.332 -4.722 63 HD2 LYS 30 1HD LYS 30 -10.518 -8.119 -5.346 64 HD3 LYS 30 2HD LYS 30 -11.786 -9.139 -4.676 65 HE2 LYS 30 1HE LYS 30 -11.789 -9.796 -6.879 66 HE3 LYS 30 2HE LYS 30 -13.035 -8.551 -6.891 67 HZ1 LYS 30 1HZ LYS 30 -11.529 -7.004 -7.835 68 HZ2 LYS 30 2HZ LYS 30 -11.384 -8.423 -8.744 69 HZ3 LYS 30 3HZ LYS 30 -10.197 -8.024 -7.600 70 H ALA 31 H ALA 31 -14.063 -3.733 -7.082 71 HA ALA 31 HA ALA 31 -12.290 -2.173 -8.562 72 HB1 ALA 31 1HB ALA 31 -14.433 -3.002 -9.418 73 HB2 ALA 31 2HB ALA 31 -14.269 -1.260 -9.637 74 HB3 ALA 31 3HB ALA 31 -15.284 -1.891 -8.342 75 H ALA 32 H ALA 32 -14.311 -1.381 -5.794 76 HA ALA 32 HA ALA 32 -13.928 1.428 -5.897 77 HB1 ALA 32 1HB ALA 32 -14.670 1.423 -3.568 78 HB2 ALA 32 2HB ALA 32 -14.489 -0.329 -3.506 79 HB3 ALA 32 3HB ALA 32 -15.705 0.396 -4.559 80 H LEU 33 H LEU 33 -12.252 -1.211 -4.280 81 HA LEU 33 HA LEU 33 -10.267 0.362 -3.024 82 HB2 LEU 33 1HB LEU 33 -10.187 -2.528 -3.917 83 HB3 LEU 33 2HB LEU 33 -9.034 -1.775 -2.825 84 HG LEU 33 HG LEU 33 -11.988 -2.074 -2.264 85 HD11 LEU 33 1HD1 LEU 33 -9.660 -3.653 -1.195 86 HD12 LEU 33 2HD1 LEU 33 -10.889 -4.243 -2.313 87 HD13 LEU 33 3HD1 LEU 33 -11.336 -3.793 -0.668 88 HD21 LEU 33 1HD2 LEU 33 -11.003 -0.163 -1.134 89 HD22 LEU 33 2HD2 LEU 33 -9.713 -1.185 -0.500 90 HD23 LEU 33 3HD2 LEU 33 -11.378 -1.443 0.018 91 H THR 34 H THR 34 -10.539 -1.096 -6.203 92 HA THR 34 HA THR 34 -7.911 -0.597 -7.096 93 HB THR 34 HB THR 34 -10.448 -0.680 -8.748 94 HG1 THR 34 HG1 THR 34 -9.901 -2.601 -7.418 95 HG21 THR 34 1HG2 THR 34 -8.563 0.306 -9.951 96 HG22 THR 34 2HG2 THR 34 -8.949 -1.292 -10.595 97 HG23 THR 34 3HG2 THR 34 -7.557 -1.081 -9.532 98 H ASP 35 H ASP 35 -10.846 1.356 -7.073 99 HA ASP 35 HA ASP 35 -9.770 3.457 -8.688 100 HB2 ASP 35 1HB ASP 35 -12.210 3.072 -8.470 101 HB3 ASP 35 2HB ASP 35 -12.114 3.536 -6.774 102 H MET 36 H MET 36 -10.133 2.842 -5.245 103 HA MET 36 HA MET 36 -9.084 5.264 -4.282 104 HB2 MET 36 1HB MET 36 -10.190 3.725 -2.775 105 HB3 MET 36 2HB MET 36 -8.981 2.486 -3.087 106 HG2 MET 36 1HG MET 36 -8.600 3.518 -0.941 107 HG3 MET 36 2HG MET 36 -7.277 3.884 -2.048 108 HE1 MET 36 1HE MET 36 -7.346 7.147 0.034 109 HE2 MET 36 2HE MET 36 -6.357 5.840 -0.619 110 HE3 MET 36 3HE MET 36 -7.573 5.495 0.611 111 H LEU 37 H LEU 37 -7.497 2.224 -5.167 112 HA LEU 37 HA LEU 37 -4.871 2.978 -4.520 113 HB2 LEU 37 1HB LEU 37 -5.757 0.670 -5.066 114 HB3 LEU 37 2HB LEU 37 -5.731 1.138 -6.758 115 HG LEU 37 HG LEU 37 -3.822 -0.295 -6.067 116 HD11 LEU 37 1HD1 LEU 37 -3.017 2.459 -6.972 117 HD12 LEU 37 2HD1 LEU 37 -3.606 1.157 -8.006 118 HD13 LEU 37 3HD1 LEU 37 -2.070 0.982 -7.155 119 HD21 LEU 37 1HD2 LEU 37 -2.042 0.591 -4.704 120 HD22 LEU 37 2HD2 LEU 37 -3.552 0.585 -3.796 121 HD23 LEU 37 3HD2 LEU 37 -2.931 2.094 -4.464 122 H GLN 38 H GLN 38 -6.687 3.207 -7.566 123 HA GLN 38 HA GLN 38 -4.564 4.312 -9.063 124 HB2 GLN 38 1HB GLN 38 -7.545 4.404 -9.531 125 HB3 GLN 38 2HB GLN 38 -6.344 4.939 -10.698 126 HG2 GLN 38 1HG GLN 38 -6.678 2.144 -9.630 127 HG3 GLN 38 2HG GLN 38 -7.141 2.716 -11.230 128 HE21 GLN 38 1HE2 GLN 38 -4.717 4.356 -11.519 129 HE22 GLN 38 2HE2 GLN 38 -3.432 3.237 -11.826 130 H THR 39 H THR 39 -7.035 5.769 -7.046 131 HA THR 39 HA THR 39 -6.439 8.463 -7.836 132 HB THR 39 HB THR 39 -7.797 7.470 -5.316 133 HG1 THR 39 HG1 THR 39 -9.138 6.841 -6.905 134 HG21 THR 39 1HG2 THR 39 -7.012 9.788 -5.134 135 HG22 THR 39 2HG2 THR 39 -8.773 9.717 -5.217 136 HG23 THR 39 3HG2 THR 39 -7.840 10.189 -6.639 137 H PHE 40 H PHE 40 -5.249 6.229 -5.433 138 HA PHE 40 HA PHE 40 -3.868 8.152 -3.862 139 HB2 PHE 40 1HB PHE 40 -4.571 5.847 -3.096 140 HB3 PHE 40 2HB PHE 40 -3.234 5.207 -4.046 141 HD1 PHE 40 HD1 PHE 40 -3.398 8.245 -1.898 142 HD2 PHE 40 HD2 PHE 40 -1.715 4.385 -2.520 143 HE1 PHE 40 HE1 PHE 40 -1.872 8.611 -0.007 144 HE2 PHE 40 HE2 PHE 40 -0.187 4.744 -0.632 145 HZ PHE 40 HZ PHE 40 -0.260 6.862 0.628 146 H VAL 41 H VAL 41 -3.005 6.237 -6.676 147 HA VAL 41 HA VAL 41 -0.253 6.454 -6.632 148 HB VAL 41 HB VAL 41 -2.055 6.483 -9.054 149 HG11 VAL 41 1HG1 VAL 41 0.131 7.392 -9.627 150 HG12 VAL 41 2HG1 VAL 41 -0.086 5.788 -10.326 151 HG13 VAL 41 3HG1 VAL 41 0.915 5.995 -8.889 152 HG21 VAL 41 1HG2 VAL 41 -0.554 4.271 -7.664 153 HG22 VAL 41 2HG2 VAL 41 -1.436 4.103 -9.183 154 HG23 VAL 41 3HG2 VAL 41 -2.304 4.495 -7.699 155 HA PRO 42 HA PRO 42 -0.578 10.837 -8.913 156 HB2 PRO 42 1HB PRO 42 -3.164 11.655 -7.690 157 HB3 PRO 42 2HB PRO 42 -2.484 12.063 -9.270 158 HG2 PRO 42 1HG PRO 42 -4.446 10.280 -9.059 159 HG3 PRO 42 2HG PRO 42 -3.120 10.048 -10.212 160 HD2 PRO 42 1HD PRO 42 -3.597 8.718 -7.583 161 HD3 PRO 42 2HD PRO 42 -2.924 8.053 -9.081 162 H TYR 43 H TYR 43 -1.701 9.948 -5.700 163 HA TYR 43 HA TYR 43 -0.753 12.396 -4.461 164 HB2 TYR 43 1HB TYR 43 -1.752 9.754 -3.378 165 HB3 TYR 43 2HB TYR 43 -1.000 10.956 -2.328 166 HD1 TYR 43 HD1 TYR 43 -3.768 10.636 -4.828 167 HD2 TYR 43 HD2 TYR 43 -2.334 12.537 -1.302 168 HE1 TYR 43 HE1 TYR 43 -5.937 11.754 -4.555 169 HE2 TYR 43 HE2 TYR 43 -4.500 13.662 -1.021 170 HH TYR 43 HH TYR 43 -6.418 14.306 -2.301 171 H ARG 44 H ARG 44 0.228 9.076 -4.938 172 HA ARG 44 HA ARG 44 2.610 9.101 -3.473 173 HB2 ARG 44 1HB ARG 44 1.746 7.441 -5.826 174 HB3 ARG 44 2HB ARG 44 3.277 7.195 -5.004 175 HG2 ARG 44 1HG ARG 44 0.529 6.933 -3.813 176 HG3 ARG 44 2HG ARG 44 1.657 5.626 -4.192 177 HD2 ARG 44 1HD ARG 44 1.943 7.753 -2.072 178 HD3 ARG 44 2HD ARG 44 1.805 6.013 -1.839 179 HE ARG 44 HE ARG 44 4.107 6.806 -3.383 180 HH11 ARG 44 1HH1 ARG 44 2.858 6.210 -0.169 181 HH12 ARG 44 2HH1 ARG 44 4.424 6.013 0.548 182 HH21 ARG 44 1HH2 ARG 44 6.167 6.558 -2.473 183 HH22 ARG 44 2HH2 ARG 44 6.317 6.197 -0.775 184 H THR 45 H THR 45 1.956 9.928 -6.854 185 HA THR 45 HA THR 45 4.504 10.245 -7.800 186 HB THR 45 HB THR 45 2.276 12.203 -8.352 187 HG1 THR 45 HG1 THR 45 1.548 10.700 -9.871 188 HG21 THR 45 1HG2 THR 45 3.289 12.325 -10.579 189 HG22 THR 45 2HG2 THR 45 4.548 11.198 -10.069 190 HG23 THR 45 3HG2 THR 45 4.439 12.796 -9.328 191 H ALA 46 H ALA 46 2.649 12.623 -5.920 192 HA ALA 46 HA ALA 46 4.641 14.621 -5.847 193 HB1 ALA 46 1HB ALA 46 3.388 15.503 -3.915 194 HB2 ALA 46 2HB ALA 46 2.432 14.019 -3.879 195 HB3 ALA 46 3HB ALA 46 2.331 15.100 -5.269 196 H VAL 47 H VAL 47 3.905 11.887 -3.813 197 HA VAL 47 HA VAL 47 5.836 12.379 -1.789 198 HB VAL 47 HB VAL 47 4.607 9.743 -2.612 199 HG11 VAL 47 1HG1 VAL 47 5.224 8.956 -0.390 200 HG12 VAL 47 2HG1 VAL 47 6.000 10.503 -0.046 201 HG13 VAL 47 3HG1 VAL 47 6.653 9.448 -1.301 202 HG21 VAL 47 1HG2 VAL 47 3.090 10.127 -0.700 203 HG22 VAL 47 2HG2 VAL 47 2.900 11.331 -1.974 204 HG23 VAL 47 3HG2 VAL 47 3.784 11.736 -0.502 205 H GLU 48 H GLU 48 5.936 10.606 -4.829 206 HA GLU 48 HA GLU 48 8.468 9.396 -4.399 207 HB2 GLU 48 1HB GLU 48 7.107 10.014 -7.033 208 HB3 GLU 48 2HB GLU 48 8.428 8.884 -6.789 209 HG2 GLU 48 1HG GLU 48 5.639 8.631 -5.685 210 HG3 GLU 48 2HG GLU 48 6.328 7.713 -7.022 211 H LEU 49 H LEU 49 7.423 12.369 -6.020 212 HA LEU 49 HA LEU 49 9.998 13.246 -6.787 213 HB2 LEU 49 1HB LEU 49 7.349 14.541 -6.382 214 HB3 LEU 49 2HB LEU 49 8.756 15.585 -6.435 215 HG LEU 49 HG LEU 49 7.672 15.439 -8.619 216 HD11 LEU 49 1HD1 LEU 49 10.104 15.769 -8.489 217 HD12 LEU 49 2HD1 LEU 49 9.612 14.928 -9.958 218 HD13 LEU 49 3HD1 LEU 49 10.331 14.025 -8.626 219 HD21 LEU 49 1HD2 LEU 49 7.683 13.356 -9.896 220 HD22 LEU 49 2HD2 LEU 49 6.705 13.212 -8.434 221 HD23 LEU 49 3HD2 LEU 49 8.317 12.498 -8.491 222 H CYS 50 H CYS 50 8.042 13.805 -3.901 223 HA CYS 50 HA CYS 50 9.796 15.357 -2.409 224 HB2 CYS 50 1HB CYS 50 7.640 15.055 -1.514 225 HB3 CYS 50 2HB CYS 50 7.718 13.308 -1.677 226 H ALA 51 H ALA 51 9.783 11.912 -3.043 227 HA ALA 51 HA ALA 51 11.646 11.211 -0.987 228 HB1 ALA 51 1HB ALA 51 10.077 9.561 -1.835 229 HB2 ALA 51 2HB ALA 51 11.735 9.035 -2.135 230 HB3 ALA 51 3HB ALA 51 10.769 9.703 -3.449 231 H LEU 52 H LEU 52 11.805 11.808 -4.460 232 HA LEU 52 HA LEU 52 14.518 11.038 -4.766 233 HB2 LEU 52 1HB LEU 52 12.785 11.118 -6.580 234 HB3 LEU 52 2HB LEU 52 12.896 12.866 -6.539 235 HG LEU 52 HG LEU 52 15.256 12.727 -7.222 236 HD11 LEU 52 1HD1 LEU 52 16.120 10.566 -8.064 237 HD12 LEU 52 2HD1 LEU 52 14.715 9.767 -7.359 238 HD13 LEU 52 3HD1 LEU 52 15.877 10.587 -6.319 239 HD21 LEU 52 1HD2 LEU 52 14.857 12.031 -9.524 240 HD22 LEU 52 2HD2 LEU 52 13.508 12.984 -8.905 241 HD23 LEU 52 3HD2 LEU 52 13.366 11.231 -9.027 242 H GLU 53 H GLU 53 13.035 13.869 -3.579 243 HA GLU 53 HA GLU 53 14.969 15.809 -4.180 244 HB2 GLU 53 1HB GLU 53 12.674 16.212 -3.219 245 HB3 GLU 53 2HB GLU 53 13.295 15.665 -1.670 246 HG2 GLU 53 1HG GLU 53 13.253 18.082 -1.788 247 HG3 GLU 53 2HG GLU 53 14.910 17.491 -1.662 248 H HIS 54 H HIS 54 14.713 13.482 -1.537 249 HA HIS 54 HA HIS 54 17.429 14.264 -0.672 250 HB2 HIS 54 1HB HIS 54 15.599 14.410 1.051 251 HB3 HIS 54 2HB HIS 54 15.392 12.668 0.911 252 HD1 HIS 54 HD1 HIS 54 16.635 11.387 2.637 253 HD2 HIS 54 HD2 HIS 54 18.433 15.043 1.818 254 HE1 HIS 54 HE1 HIS 54 18.596 11.542 4.198 255 HE2 HIS 54 HE2 HIS 54 19.647 13.777 3.716 256 H GLY 55 H GLY 55 15.604 11.913 -2.251 257 HA2 GLY 55 1HA GLY 55 16.412 10.115 -3.471 258 HA3 GLY 55 2HA GLY 55 17.886 10.135 -2.510 259 H GLY 56 H GLY 56 16.438 10.209 0.028 260 HA2 GLY 56 1HA GLY 56 14.866 7.728 -0.110 261 HA3 GLY 56 2HA GLY 56 15.642 8.340 1.338 262 H LEU 57 H LEU 57 12.912 7.513 1.022 263 HA LEU 57 HA LEU 57 11.208 9.788 0.774 264 HB2 LEU 57 1HB LEU 57 10.614 7.071 1.940 265 HB3 LEU 57 2HB LEU 57 9.428 8.293 1.525 266 HG LEU 57 HG LEU 57 10.801 7.966 -0.832 267 HD11 LEU 57 1HD1 LEU 57 12.013 6.054 -0.028 268 HD12 LEU 57 2HD1 LEU 57 10.830 5.542 -1.229 269 HD13 LEU 57 3HD1 LEU 57 10.515 5.281 0.485 270 HD21 LEU 57 1HD2 LEU 57 8.402 8.213 -0.581 271 HD22 LEU 57 2HD2 LEU 57 8.291 6.580 0.079 272 HD23 LEU 57 3HD2 LEU 57 8.787 6.824 -1.596 273 H ASP 58 H ASP 58 13.289 8.992 3.160 274 HA ASP 58 HA ASP 58 12.027 9.214 5.575 275 HB2 ASP 58 1HB ASP 58 14.426 8.814 5.343 276 HB3 ASP 58 2HB ASP 58 14.659 10.466 4.785 277 H THR 59 H THR 59 12.639 11.786 3.267 278 HA THR 59 HA THR 59 11.926 13.865 5.138 279 HB THR 59 HB THR 59 13.621 14.352 3.456 280 HG1 THR 59 HG1 THR 59 11.176 15.762 3.309 281 HG21 THR 59 1HG2 THR 59 11.432 13.820 1.447 282 HG22 THR 59 2HG2 THR 59 12.916 12.892 1.667 283 HG23 THR 59 3HG2 THR 59 12.993 14.547 1.067 284 H CYS 60 H CYS 60 10.165 11.621 3.578 285 HA CYS 60 HA CYS 60 7.915 13.425 3.002 286 HB2 CYS 60 1HB CYS 60 8.263 10.543 2.159 287 HB3 CYS 60 2HB CYS 60 7.032 11.667 1.595 288 H ASP 61 H ASP 61 7.919 13.404 5.471 289 HA ASP 61 HA ASP 61 6.400 11.082 6.466 290 HB2 ASP 61 1HB ASP 61 8.623 11.160 7.452 291 HB3 ASP 61 2HB ASP 61 8.390 12.844 7.912 292 H GLY 62 H GLY 62 4.519 11.474 7.501 293 HA2 GLY 62 1HA GLY 62 3.304 14.026 7.154 294 HA3 GLY 62 2HA GLY 62 2.604 12.646 7.995 295 H GLY 63 H GLY 63 4.347 15.606 8.297 296 HA2 GLY 63 1HA GLY 63 3.819 16.721 10.487 297 HA3 GLY 63 2HA GLY 63 4.433 15.248 11.223 298 H SER 64 H SER 64 6.290 15.763 8.533 299 HA SER 64 HA SER 64 8.063 17.700 9.779 300 HB2 SER 64 1HB SER 64 10.019 16.169 9.522 301 HB3 SER 64 2HB SER 64 8.852 15.625 10.724 302 HG SER 64 HG SER 64 8.164 14.049 9.385 303 H ASN 65 H ASN 65 9.807 18.382 8.365 304 HA ASN 65 HA ASN 65 10.610 19.226 6.426 305 HB2 ASN 65 1HB ASN 65 9.719 16.556 5.328 306 HB3 ASN 65 2HB ASN 65 10.780 17.686 4.497 307 HD21 ASN 65 1HD2 ASN 65 10.546 15.271 6.941 308 HD22 ASN 65 2HD2 ASN 65 12.230 15.218 7.348 309 H GLY 66 H GLY 66 8.078 20.153 6.998 310 HA2 GLY 66 1HA GLY 66 6.775 21.688 5.823 311 HA3 GLY 66 2HA GLY 66 7.318 20.963 4.315 312 H ILE 67 H ILE 67 6.541 18.270 5.615 313 HA ILE 67 HA ILE 67 3.839 18.323 4.576 314 HB ILE 67 HB ILE 67 5.473 15.988 5.590 315 HG12 ILE 67 1HG1 ILE 67 4.976 17.013 2.786 316 HG13 ILE 67 2HG1 ILE 67 6.517 17.002 3.639 317 HG21 ILE 67 1HG2 ILE 67 3.840 14.579 4.489 318 HG22 ILE 67 2HG2 ILE 67 2.953 15.996 3.929 319 HG23 ILE 67 3HG2 ILE 67 3.027 15.627 5.653 320 HD11 ILE 67 1HD1 ILE 67 4.957 14.597 2.743 321 HD12 ILE 67 2HD1 ILE 67 6.463 14.554 3.656 322 HD13 ILE 67 3HD1 ILE 67 6.441 15.221 2.023 323 HA PRO 68 HA PRO 68 2.326 18.729 8.714 324 HB2 PRO 68 1HB PRO 68 -0.309 18.751 8.182 325 HB3 PRO 68 2HB PRO 68 0.746 20.102 7.749 326 HG2 PRO 68 1HG PRO 68 -0.369 17.937 6.028 327 HG3 PRO 68 2HG PRO 68 -0.120 19.656 5.657 328 HD2 PRO 68 1HD PRO 68 1.565 17.584 4.885 329 HD3 PRO 68 2HD PRO 68 2.034 19.297 4.978 330 H SER 69 H SER 69 1.125 17.588 10.293 331 HA SER 69 HA SER 69 1.193 14.913 10.533 332 HB2 SER 69 1HB SER 69 -1.084 16.664 11.488 333 HB3 SER 69 2HB SER 69 -0.637 15.093 12.156 334 HG SER 69 HG SER 69 1.357 15.984 12.779 335 HA PRO 70 HA PRO 70 -1.029 12.995 7.340 336 HB2 PRO 70 1HB PRO 70 -2.122 10.890 8.838 337 HB3 PRO 70 2HB PRO 70 -0.564 10.893 8.008 338 HG2 PRO 70 1HG PRO 70 -1.188 11.392 10.877 339 HG3 PRO 70 2HG PRO 70 0.226 10.604 10.151 340 HD2 PRO 70 1HD PRO 70 0.365 13.096 11.122 341 HD3 PRO 70 2HD PRO 70 1.253 12.626 9.658 342 H THR 71 H THR 71 -2.879 13.385 6.429 343 HA THR 71 HA THR 71 -5.209 14.019 8.112 344 HB THR 71 HB THR 71 -5.945 15.396 6.113 345 HG1 THR 71 HG1 THR 71 -3.792 14.254 5.032 346 HG21 THR 71 1HG2 THR 71 -3.378 16.173 7.495 347 HG22 THR 71 2HG2 THR 71 -5.016 16.477 8.075 348 HG23 THR 71 3HG2 THR 71 -4.432 17.281 6.619 349 H THR 72 H THR 72 -7.289 13.856 6.673 350 HA THR 72 HA THR 72 -7.179 11.432 5.030 351 HB THR 72 HB THR 72 -9.464 10.855 6.017 352 HG1 THR 72 HG1 THR 72 -9.901 11.709 8.066 353 HG21 THR 72 1HG2 THR 72 -7.065 10.682 7.837 354 HG22 THR 72 2HG2 THR 72 -7.430 9.580 6.510 355 HG23 THR 72 3HG2 THR 72 -8.501 9.661 7.908 356 H THR 73 H THR 73 -8.161 11.692 3.128 357 HA THR 73 HA THR 73 -9.582 14.083 2.514 358 HB THR 73 HB THR 73 -10.019 12.861 0.305 359 HG1 THR 73 HG1 THR 73 -9.588 10.799 0.365 360 HG21 THR 73 1HG2 THR 73 -7.689 13.126 -0.440 361 HG22 THR 73 2HG2 THR 73 -7.173 13.225 1.243 362 HG23 THR 73 3HG2 THR 73 -8.210 14.479 0.564 363 H ARG 74 H ARG 74 -11.776 13.519 1.116 364 HA ARG 74 HA ARG 74 -13.607 13.473 3.178 365 HB2 ARG 74 1HB ARG 74 -14.163 14.574 1.151 366 HB3 ARG 74 2HB ARG 74 -13.984 13.095 0.219 367 HG2 ARG 74 1HG ARG 74 -15.984 12.200 1.036 368 HG3 ARG 74 2HG ARG 74 -16.062 13.365 2.359 369 HD2 ARG 74 1HD ARG 74 -16.257 14.112 -0.558 370 HD3 ARG 74 2HD ARG 74 -17.654 13.826 0.481 371 HE ARG 74 HE ARG 74 -16.390 15.674 1.890 372 HH11 ARG 74 1HH1 ARG 74 -16.985 15.554 -1.561 373 HH12 ARG 74 2HH1 ARG 74 -17.059 17.278 -1.731 374 HH21 ARG 74 1HH2 ARG 74 -16.504 17.927 1.671 375 HH22 ARG 74 2HH2 ARG 74 -16.780 18.630 0.108 376 H TYR 75 H TYR 75 -12.821 10.742 0.979 377 HA TYR 75 HA TYR 75 -14.674 9.130 2.568 378 HB2 TYR 75 1HB TYR 75 -13.380 8.525 -0.094 379 HB3 TYR 75 2HB TYR 75 -14.542 7.492 0.739 380 HD1 TYR 75 HD1 TYR 75 -14.132 10.156 -1.580 381 HD2 TYR 75 HD2 TYR 75 -16.854 8.521 1.249 382 HE1 TYR 75 HE1 TYR 75 -15.977 11.366 -2.665 383 HE2 TYR 75 HE2 TYR 75 -18.708 9.721 0.170 384 HH TYR 75 HH TYR 75 -19.027 11.721 -1.244 385 H VAL 76 H VAL 76 -11.515 9.838 2.834 386 HA VAL 76 HA VAL 76 -10.596 7.117 3.308 387 HB VAL 76 HB VAL 76 -9.199 9.775 3.623 388 HG11 VAL 76 1HG1 VAL 76 -8.060 7.023 4.135 389 HG12 VAL 76 2HG1 VAL 76 -8.456 8.200 5.384 390 HG13 VAL 76 3HG1 VAL 76 -7.183 8.550 4.215 391 HG21 VAL 76 1HG2 VAL 76 -8.776 7.433 1.770 392 HG22 VAL 76 2HG2 VAL 76 -7.787 8.892 1.817 393 HG23 VAL 76 3HG2 VAL 76 -9.481 8.990 1.337 394 H SER 77 H SER 77 -10.550 6.125 5.198 395 HA SER 77 HA SER 77 -12.078 7.315 7.326 396 HB2 SER 77 1HB SER 77 -10.794 4.578 7.214 397 HB3 SER 77 2HB SER 77 -12.107 5.093 8.279 398 HG SER 77 HG SER 77 -13.412 5.375 6.426 399 H ALA 78 H ALA 78 -8.752 6.171 6.885 400 HA ALA 78 HA ALA 78 -7.693 7.899 8.856 401 HB1 ALA 78 1HB ALA 78 -6.962 6.195 10.487 402 HB2 ALA 78 2HB ALA 78 -7.944 4.997 9.643 403 HB3 ALA 78 3HB ALA 78 -8.717 6.369 10.435 404 H MET 79 H MET 79 -5.442 7.917 8.802 405 HA MET 79 HA MET 79 -3.890 5.916 7.550 406 HB2 MET 79 1HB MET 79 -3.253 7.076 5.501 407 HB3 MET 79 2HB MET 79 -4.977 6.734 5.513 408 HG2 MET 79 1HG MET 79 -5.476 9.024 6.059 409 HG3 MET 79 2HG MET 79 -3.759 9.398 6.208 410 HE1 MET 79 1HE MET 79 -2.069 9.393 4.170 411 HE2 MET 79 2HE MET 79 -2.527 9.041 2.505 412 HE3 MET 79 3HE MET 79 -2.544 7.759 3.714 413 H SER 80 H SER 80 -1.724 6.279 7.735 414 HA SER 80 HA SER 80 -0.845 8.908 8.695 415 HB2 SER 80 1HB SER 80 -1.131 7.371 10.652 416 HB3 SER 80 2HB SER 80 0.045 6.280 9.919 417 HG SER 80 HG SER 80 0.742 7.987 11.548 418 H VAL 81 H VAL 81 1.315 9.415 8.187 419 HA VAL 81 HA VAL 81 2.513 7.700 6.114 420 HB VAL 81 HB VAL 81 2.548 10.727 6.181 421 HG11 VAL 81 1HG1 VAL 81 3.498 8.771 4.089 422 HG12 VAL 81 2HG1 VAL 81 4.511 9.795 5.108 423 HG13 VAL 81 3HG1 VAL 81 3.453 10.524 3.900 424 HG21 VAL 81 1HG2 VAL 81 1.049 10.602 4.229 425 HG22 VAL 81 2HG2 VAL 81 0.310 9.972 5.703 426 HG23 VAL 81 3HG2 VAL 81 0.915 8.859 4.474 427 H ALA 82 H ALA 82 4.466 6.991 6.731 428 HA ALA 82 HA ALA 82 6.109 8.744 8.424 429 HB1 ALA 82 1HB ALA 82 5.799 5.773 8.827 430 HB2 ALA 82 2HB ALA 82 5.031 7.015 9.818 431 HB3 ALA 82 3HB ALA 82 6.788 6.872 9.788 432 H LYS 83 H LYS 83 7.745 9.249 7.248 433 HA LYS 83 HA LYS 83 9.446 9.226 5.693 434 HB2 LYS 83 1HB LYS 83 9.857 6.356 6.549 435 HB3 LYS 83 2HB LYS 83 11.068 7.482 5.959 436 HG2 LYS 83 1HG LYS 83 9.618 7.654 8.593 437 HG3 LYS 83 2HG LYS 83 11.286 7.132 8.353 438 HD2 LYS 83 1HD LYS 83 11.795 9.382 7.436 439 HD3 LYS 83 2HD LYS 83 10.151 9.877 7.831 440 HE2 LYS 83 1HE LYS 83 11.612 10.616 9.581 441 HE3 LYS 83 2HE LYS 83 10.615 9.302 10.205 442 HZ1 LYS 83 1HZ LYS 83 12.927 9.070 10.868 443 HZ2 LYS 83 2HZ LYS 83 13.413 9.037 9.247 444 HZ3 LYS 83 3HZ LYS 83 12.458 7.786 9.873 445 H GLY 84 H GLY 84 7.073 8.847 4.449 446 HA2 GLY 84 1HA GLY 84 6.376 8.314 2.301 447 HA3 GLY 84 2HA GLY 84 7.788 7.278 2.128 448 H VAL 85 H VAL 85 7.149 5.834 4.596 449 HA VAL 85 HA VAL 85 5.419 3.817 3.658 450 HB VAL 85 HB VAL 85 6.110 4.416 6.543 451 HG11 VAL 85 1HG1 VAL 85 5.627 2.040 6.923 452 HG12 VAL 85 2HG1 VAL 85 5.113 1.885 5.242 453 HG13 VAL 85 3HG1 VAL 85 4.207 2.916 6.351 454 HG21 VAL 85 1HG2 VAL 85 7.886 2.759 6.270 455 HG22 VAL 85 2HG2 VAL 85 8.109 4.118 5.168 456 HG23 VAL 85 3HG2 VAL 85 7.469 2.587 4.566 457 H VAL 86 H VAL 86 3.198 3.399 4.036 458 HA VAL 86 HA VAL 86 1.708 5.604 5.244 459 HB VAL 86 HB VAL 86 1.105 4.514 2.483 460 HG11 VAL 86 1HG1 VAL 86 -0.304 6.634 4.101 461 HG12 VAL 86 2HG1 VAL 86 -0.914 5.014 3.770 462 HG13 VAL 86 3HG1 VAL 86 -0.699 6.161 2.451 463 HG21 VAL 86 1HG2 VAL 86 2.002 7.269 3.327 464 HG22 VAL 86 2HG2 VAL 86 1.593 6.764 1.687 465 HG23 VAL 86 3HG2 VAL 86 3.001 6.077 2.497 466 H SER 87 H SER 87 0.685 4.620 6.791 467 HA SER 87 HA SER 87 -0.537 2.007 6.305 468 HB2 SER 87 1HB SER 87 0.841 2.296 8.342 469 HB3 SER 87 2HB SER 87 -0.278 3.534 8.908 470 HG SER 87 HG SER 87 -0.757 1.506 9.824 471 H LEU 88 H LEU 88 -2.553 1.801 5.798 472 HA LEU 88 HA LEU 88 -4.450 4.004 6.271 473 HB2 LEU 88 1HB LEU 88 -4.722 1.570 4.481 474 HB3 LEU 88 2HB LEU 88 -5.913 2.836 4.654 475 HG LEU 88 HG LEU 88 -4.822 3.136 2.561 476 HD11 LEU 88 1HD1 LEU 88 -3.681 5.159 4.466 477 HD12 LEU 88 2HD1 LEU 88 -5.315 5.179 3.800 478 HD13 LEU 88 3HD1 LEU 88 -3.923 5.362 2.732 479 HD21 LEU 88 1HD2 LEU 88 -2.796 1.875 2.907 480 HD22 LEU 88 2HD2 LEU 88 -2.200 3.086 4.043 481 HD23 LEU 88 3HD2 LEU 88 -2.402 3.498 2.340 482 H THR 89 H THR 89 -6.215 3.652 7.621 483 HA THR 89 HA THR 89 -6.301 0.976 8.847 484 HB THR 89 HB THR 89 -6.757 3.567 10.329 485 HG1 THR 89 HG1 THR 89 -4.460 2.323 9.576 486 HG21 THR 89 1HG2 THR 89 -7.873 1.581 11.277 487 HG22 THR 89 2HG2 THR 89 -6.575 2.167 12.318 488 HG23 THR 89 3HG2 THR 89 -6.322 0.743 11.311 489 H GLY 90 H GLY 90 -8.144 0.015 8.874 490 HA2 GLY 90 1HA GLY 90 -10.389 -0.443 8.520 491 HA3 GLY 90 2HA GLY 90 -10.598 0.913 9.612 492 H GLN 91 H GLN 91 -9.515 0.782 6.222 493 HA GLN 91 HA GLN 91 -11.065 3.103 5.606 494 HB2 GLN 91 1HB GLN 91 -8.946 2.665 4.490 495 HB3 GLN 91 2HB GLN 91 -9.572 1.161 3.830 496 HG2 GLN 91 1HG GLN 91 -9.517 2.844 2.122 497 HG3 GLN 91 2HG GLN 91 -11.189 2.441 2.502 498 HE21 GLN 91 1HE2 GLN 91 -12.491 3.973 3.461 499 HE22 GLN 91 2HE2 GLN 91 -12.059 5.641 3.555 500 H GLU 92 H GLU 92 -13.139 3.175 5.119 501 HA GLU 92 HA GLU 92 -15.283 2.524 4.735 502 HB2 GLU 92 1HB GLU 92 -13.872 1.096 2.482 503 HB3 GLU 92 2HB GLU 92 -15.619 1.232 2.602 504 HG2 GLU 92 1HG GLU 92 -15.405 3.679 2.537 505 HG3 GLU 92 2HG GLU 92 -13.667 3.497 2.333 506 H SER 93 H SER 93 -14.974 -0.402 3.200 507 HA SER 93 HA SER 93 -16.286 -1.812 5.301 508 HB2 SER 93 1HB SER 93 -15.125 -2.916 2.738 509 HB3 SER 93 2HB SER 93 -16.409 -3.625 3.719 510 HG SER 93 HG SER 93 -17.651 -1.712 3.241 511 H LEU 94 H LEU 94 -13.036 -1.242 4.644 512 HA LEU 94 HA LEU 94 -12.037 -3.843 5.416 513 HB2 LEU 94 1HB LEU 94 -10.517 -1.284 4.915 514 HB3 LEU 94 2HB LEU 94 -9.830 -2.894 5.054 515 HG LEU 94 HG LEU 94 -11.596 -1.865 2.831 516 HD11 LEU 94 1HD1 LEU 94 -9.292 -1.117 2.702 517 HD12 LEU 94 2HD1 LEU 94 -9.630 -2.301 1.440 518 HD13 LEU 94 3HD1 LEU 94 -8.726 -2.778 2.876 519 HD21 LEU 94 1HD2 LEU 94 -11.291 -4.064 1.785 520 HD22 LEU 94 2HD2 LEU 94 -12.186 -4.175 3.298 521 HD23 LEU 94 3HD2 LEU 94 -10.489 -4.642 3.245 522 H ASN 95 H ASN 95 -13.635 -2.638 7.329 523 HA ASN 95 HA ASN 95 -12.354 -1.286 9.395 524 HB2 ASN 95 1HB ASN 95 -14.791 -1.659 9.261 525 HB3 ASN 95 2HB ASN 95 -14.536 -3.370 9.585 526 HD21 ASN 95 1HD2 ASN 95 -14.370 -0.153 10.922 527 HD22 ASN 95 2HD2 ASN 95 -14.366 -0.638 12.583 528 H GLY 96 H GLY 96 -10.988 -1.864 10.988 529 HA2 GLY 96 1HA GLY 96 -9.710 -3.224 12.368 530 HA3 GLY 96 2HA GLY 96 -10.542 -4.624 11.702 531 H LEU 97 H LEU 97 -9.662 -3.158 9.018 532 HA LEU 97 HA LEU 97 -7.301 -4.840 8.756 533 HB2 LEU 97 1HB LEU 97 -9.200 -5.003 7.156 534 HB3 LEU 97 2HB LEU 97 -8.900 -3.347 6.675 535 HG LEU 97 HG LEU 97 -6.760 -5.433 6.341 536 HD11 LEU 97 1HD1 LEU 97 -8.834 -6.272 5.277 537 HD12 LEU 97 2HD1 LEU 97 -7.578 -5.872 4.107 538 HD13 LEU 97 3HD1 LEU 97 -8.931 -4.773 4.356 539 HD21 LEU 97 1HD2 LEU 97 -6.085 -3.958 4.511 540 HD22 LEU 97 2HD2 LEU 97 -6.131 -3.099 6.051 541 HD23 LEU 97 3HD2 LEU 97 -7.435 -2.883 4.883 542 H SER 98 H SER 98 -5.309 -4.075 8.548 543 HA SER 98 HA SER 98 -4.951 -1.174 8.167 544 HB2 SER 98 1HB SER 98 -3.086 -3.175 9.475 545 HB3 SER 98 2HB SER 98 -2.751 -1.457 9.261 546 HG SER 98 HG SER 98 -5.079 -2.294 10.607 547 H VAL 99 H VAL 99 -3.980 -0.536 6.340 548 HA VAL 99 HA VAL 99 -2.560 -2.567 4.737 549 HB VAL 99 HB VAL 99 -3.509 0.142 3.796 550 HG11 VAL 99 1HG1 VAL 99 -3.147 -0.768 1.562 551 HG12 VAL 99 2HG1 VAL 99 -2.559 -2.272 2.272 552 HG13 VAL 99 3HG1 VAL 99 -1.662 -0.772 2.515 553 HG21 VAL 99 1HG2 VAL 99 -5.447 -1.198 4.394 554 HG22 VAL 99 2HG2 VAL 99 -4.842 -2.529 3.407 555 HG23 VAL 99 3HG2 VAL 99 -5.326 -1.015 2.644 556 H VAL 100 H VAL 100 -0.362 -2.378 4.577 557 HA VAL 100 HA VAL 100 0.781 0.147 5.552 558 HB VAL 100 HB VAL 100 1.994 -2.612 5.822 559 HG11 VAL 100 1HG1 VAL 100 3.668 -0.856 5.594 560 HG12 VAL 100 2HG1 VAL 100 3.654 -1.494 7.239 561 HG13 VAL 100 3HG1 VAL 100 2.900 0.062 6.891 562 HG21 VAL 100 1HG2 VAL 100 0.079 -2.375 7.301 563 HG22 VAL 100 2HG2 VAL 100 0.713 -0.843 7.907 564 HG23 VAL 100 3HG2 VAL 100 1.576 -2.347 8.233 565 H MET 101 H MET 101 1.304 1.182 3.745 566 HA MET 101 HA MET 101 2.529 -0.268 1.527 567 HB2 MET 101 1HB MET 101 0.907 1.428 0.912 568 HB3 MET 101 2HB MET 101 1.787 2.650 1.820 569 HG2 MET 101 1HG MET 101 3.662 2.479 0.297 570 HG3 MET 101 2HG MET 101 2.849 1.192 -0.586 571 HE1 MET 101 1HE MET 101 -0.117 3.030 -2.289 572 HE2 MET 101 2HE MET 101 -0.147 2.156 -0.758 573 HE3 MET 101 3HE MET 101 0.769 1.514 -2.121 574 H THR 102 H THR 102 4.582 -0.735 1.715 575 HA THR 102 HA THR 102 6.402 1.205 2.960 576 HB THR 102 HB THR 102 6.984 -1.694 2.343 577 HG1 THR 102 HG1 THR 102 5.254 -1.600 3.819 578 HG21 THR 102 1HG2 THR 102 8.264 0.275 4.244 579 HG22 THR 102 2HG2 THR 102 8.942 -0.264 2.707 580 HG23 THR 102 3HG2 THR 102 8.735 -1.410 4.031 581 HA PRO 103 HA PRO 103 7.506 1.791 -1.452 582 HB2 PRO 103 1HB PRO 103 8.737 4.187 -0.973 583 HB3 PRO 103 2HB PRO 103 7.004 4.019 -1.292 584 HG2 PRO 103 1HG PRO 103 8.425 4.298 1.333 585 HG3 PRO 103 2HG PRO 103 6.920 5.066 0.782 586 HD2 PRO 103 1HD PRO 103 6.923 2.940 2.427 587 HD3 PRO 103 2HD PRO 103 5.659 3.171 1.195 588 H GLY 104 H GLY 104 9.357 1.216 -2.397 589 HA2 GLY 104 1HA GLY 104 11.865 1.462 -0.877 590 HA3 GLY 104 2HA GLY 104 11.442 -0.070 -1.633 591 H TRP 105 H TRP 105 13.450 2.337 -2.026 592 HA TRP 105 HA TRP 105 13.230 2.276 -4.959 593 HB2 TRP 105 1HB TRP 105 12.709 4.531 -3.969 594 HB3 TRP 105 2HB TRP 105 14.347 4.571 -3.328 595 HD1 TRP 105 HD1 TRP 105 12.895 3.862 -6.875 596 HE1 TRP 105 HE1 TRP 105 14.265 5.235 -8.570 597 HE3 TRP 105 HE3 TRP 105 16.110 6.169 -3.636 598 HZ2 TRP 105 HZ2 TRP 105 16.414 7.066 -8.532 599 HZ3 TRP 105 HZ3 TRP 105 17.790 7.721 -4.546 600 HH2 TRP 105 HH2 TRP 105 17.937 8.158 -6.944 601 H ASP 106 H ASP 106 14.462 0.273 -3.910 602 HA ASP 106 HA ASP 106 17.273 0.803 -3.431 603 HB2 ASP 106 1HB ASP 106 15.632 -1.730 -3.461 604 HB3 ASP 106 2HB ASP 106 17.378 -1.732 -3.255 605 H ASN 107 H ASN 107 17.849 1.660 -5.442 606 HA ASN 107 HA ASN 107 17.439 0.500 -7.944 607 HB2 ASN 107 1HB ASN 107 18.305 2.782 -7.622 608 HB3 ASN 107 2HB ASN 107 19.808 2.128 -6.984 609 HD21 ASN 107 1HD2 ASN 107 17.973 0.909 -9.748 610 HD22 ASN 107 2HD2 ASN 107 19.192 1.256 -10.922 611 H ALA 108 H ALA 108 19.884 -0.144 -5.496 612 HA ALA 108 HA ALA 108 21.609 -1.679 -7.142 613 HB1 ALA 108 1HB ALA 108 22.345 -0.590 -5.071 614 HB2 ALA 108 2HB ALA 108 22.709 -2.315 -5.074 615 HB3 ALA 108 3HB ALA 108 21.345 -1.704 -4.140 616 H ASN 109 H ASN 109 18.726 -2.438 -5.357 617 HA ASN 109 HA ASN 109 19.187 -5.312 -5.761 618 HB2 ASN 109 1HB ASN 109 17.246 -3.803 -4.008 619 HB3 ASN 109 2HB ASN 109 17.120 -5.539 -4.282 620 HD21 ASN 109 1HD2 ASN 109 17.603 -4.091 -1.817 621 HD22 ASN 109 2HD2 ASN 109 19.114 -4.673 -1.204 622 H GLY 110 H GLY 110 17.974 -2.857 -7.410 623 HA2 GLY 110 1HA GLY 110 16.449 -2.592 -9.115 624 HA3 GLY 110 2HA GLY 110 16.386 -4.347 -9.192 625 H VAL 111 H VAL 111 15.580 -2.807 -6.212 626 HA VAL 111 HA VAL 111 12.783 -3.607 -6.612 627 HB VAL 111 HB VAL 111 14.309 -3.130 -4.041 628 HG11 VAL 111 1HG1 VAL 111 12.299 -4.002 -2.912 629 HG12 VAL 111 2HG1 VAL 111 11.454 -4.008 -4.460 630 HG13 VAL 111 3HG1 VAL 111 11.988 -2.484 -3.755 631 HG21 VAL 111 1HG2 VAL 111 14.050 -5.535 -3.701 632 HG22 VAL 111 2HG2 VAL 111 14.930 -5.196 -5.192 633 HG23 VAL 111 3HG2 VAL 111 13.234 -5.672 -5.259 634 H THR 112 H THR 112 11.925 -1.852 -7.585 635 HA THR 112 HA THR 112 11.979 0.671 -6.078 636 HB THR 112 HB THR 112 11.800 1.823 -8.323 637 HG1 THR 112 HG1 THR 112 11.344 -0.392 -9.329 638 HG21 THR 112 1HG2 THR 112 14.210 1.693 -8.794 639 HG22 THR 112 2HG2 THR 112 14.328 0.258 -7.775 640 HG23 THR 112 3HG2 THR 112 13.897 1.812 -7.063 641 H GLY 113 H GLY 113 9.975 0.559 -5.161 642 HA2 GLY 113 1HA GLY 113 7.708 1.249 -6.584 643 HA3 GLY 113 2HA GLY 113 7.704 -0.505 -6.506 644 H TRP 114 H TRP 114 5.722 -0.274 -5.303 645 HA TRP 114 HA TRP 114 6.150 0.573 -2.511 646 HB2 TRP 114 1HB TRP 114 3.512 0.515 -3.995 647 HB3 TRP 114 2HB TRP 114 3.820 1.192 -2.398 648 HD1 TRP 114 HD1 TRP 114 5.392 3.464 -2.361 649 HE1 TRP 114 HE1 TRP 114 5.567 5.372 -4.093 650 HE3 TRP 114 HE3 TRP 114 3.339 1.077 -6.385 651 HZ2 TRP 114 HZ2 TRP 114 4.896 5.796 -6.799 652 HZ3 TRP 114 HZ3 TRP 114 3.134 2.305 -8.508 653 HH2 TRP 114 HH2 TRP 114 3.896 4.617 -8.708 654 H ALA 115 H ALA 115 6.100 -1.059 -1.073 655 HA ALA 115 HA ALA 115 4.790 -3.563 -1.801 656 HB1 ALA 115 1HB ALA 115 6.392 -2.870 0.662 657 HB2 ALA 115 2HB ALA 115 7.025 -3.656 -0.783 658 HB3 ALA 115 3HB ALA 115 5.819 -4.474 0.211 659 H ARG 116 H ARG 116 2.735 -3.755 -1.380 660 HA ARG 116 HA ARG 116 1.588 -2.207 0.858 661 HB2 ARG 116 1HB ARG 116 0.143 -3.313 -1.552 662 HB3 ARG 116 2HB ARG 116 -0.592 -2.392 -0.251 663 HG2 ARG 116 1HG ARG 116 -0.355 -0.803 -1.887 664 HG3 ARG 116 2HG ARG 116 1.114 -0.558 -0.941 665 HD2 ARG 116 1HD ARG 116 1.462 -0.569 -3.413 666 HD3 ARG 116 2HD ARG 116 2.427 -1.752 -2.538 667 HE ARG 116 HE ARG 116 0.765 -3.437 -3.265 668 HH11 ARG 116 1HH1 ARG 116 1.004 -0.430 -5.059 669 HH12 ARG 116 2HH1 ARG 116 0.430 -1.121 -6.540 670 HH21 ARG 116 1HH2 ARG 116 0.038 -4.349 -5.209 671 HH22 ARG 116 2HH2 ARG 116 -0.131 -3.351 -6.624 672 H ASN 117 H ASN 117 1.035 -3.289 2.590 673 HA ASN 117 HA ASN 117 0.367 -6.144 2.323 674 HB2 ASN 117 1HB ASN 117 1.579 -4.605 4.624 675 HB3 ASN 117 2HB ASN 117 0.935 -6.229 4.803 676 HD21 ASN 117 1HD2 ASN 117 1.993 -7.954 3.838 677 HD22 ASN 117 2HD2 ASN 117 3.628 -7.834 3.284 678 H CYS 118 H CYS 118 -1.695 -6.678 2.696 679 HA CYS 118 HA CYS 118 -3.370 -4.809 4.215 680 HB2 CYS 118 1HB CYS 118 -4.154 -7.150 2.458 681 HB3 CYS 118 2HB CYS 118 -5.280 -6.076 3.284 682 H ASN 119 H ASN 119 -3.615 -5.246 6.306 683 HA ASN 119 HA ASN 119 -3.428 -8.061 7.155 684 HB2 ASN 119 1HB ASN 119 -2.584 -5.526 8.557 685 HB3 ASN 119 2HB ASN 119 -2.743 -7.066 9.393 686 HD21 ASN 119 1HD2 ASN 119 -0.578 -7.140 9.918 687 HD22 ASN 119 2HD2 ASN 119 0.654 -7.458 8.745 688 H ILE 120 H ILE 120 -5.461 -8.732 7.346 689 HA ILE 120 HA ILE 120 -7.081 -7.415 9.390 690 HB ILE 120 HB ILE 120 -8.123 -6.741 7.351 691 HG12 ILE 120 1HG1 ILE 120 -10.337 -7.896 7.484 692 HG13 ILE 120 2HG1 ILE 120 -9.617 -9.039 8.608 693 HG21 ILE 120 1HG2 ILE 120 -8.060 -9.634 6.536 694 HG22 ILE 120 2HG2 ILE 120 -7.142 -8.306 5.824 695 HG23 ILE 120 3HG2 ILE 120 -8.897 -8.352 5.659 696 HD11 ILE 120 1HD1 ILE 120 -10.901 -7.305 9.742 697 HD12 ILE 120 2HD1 ILE 120 -9.855 -6.071 9.042 698 HD13 ILE 120 3HD1 ILE 120 -9.197 -7.241 10.184 699 H GLN 121 H GLN 121 -7.056 -8.865 11.022 700 HA GLN 121 HA GLN 121 -6.194 -11.539 10.486 701 HB2 GLN 121 1HB GLN 121 -5.419 -10.154 12.409 702 HB3 GLN 121 2HB GLN 121 -7.015 -10.325 13.124 703 HG2 GLN 121 1HG GLN 121 -6.726 -12.711 13.301 704 HG3 GLN 121 2HG GLN 121 -5.176 -12.614 12.467 705 HE21 GLN 121 1HE2 GLN 121 -4.022 -13.477 14.152 706 HE22 GLN 121 2HE2 GLN 121 -3.743 -12.626 15.629 707 H SER 122 H SER 122 -9.285 -10.104 11.543 708 HA SER 122 HA SER 122 -10.324 -12.792 12.032 709 HB2 SER 122 1HB SER 122 -12.242 -11.563 13.075 710 HB3 SER 122 2HB SER 122 -10.683 -11.208 13.821 711 HG SER 122 HG SER 122 -11.961 -9.603 11.836 712 H ASP 123 H ASP 123 -10.104 -10.972 9.376 713 HA ASP 123 HA ASP 123 -12.660 -11.901 8.317 714 HB2 ASP 123 1HB ASP 123 -11.758 -9.017 8.182 715 HB3 ASP 123 2HB ASP 123 -13.077 -9.686 7.233 716 H SER 124 H SER 124 -11.365 -13.383 7.173 717 HA SER 124 HA SER 124 -9.126 -12.722 5.617 718 HB2 SER 124 1HB SER 124 -9.784 -15.032 6.340 719 HB3 SER 124 2HB SER 124 -11.058 -15.002 5.121 720 HG SER 124 HG SER 124 -9.573 -15.693 3.814 721 H ALA 125 H ALA 125 -12.549 -12.519 4.917 722 HA ALA 125 HA ALA 125 -12.427 -12.448 2.113 723 HB1 ALA 125 1HB ALA 125 -14.508 -12.783 3.343 724 HB2 ALA 125 2HB ALA 125 -14.640 -11.434 2.215 725 HB3 ALA 125 3HB ALA 125 -14.425 -11.124 3.938 726 H LEU 126 H LEU 126 -12.161 -9.891 4.533 727 HA LEU 126 HA LEU 126 -12.134 -7.738 2.707 728 HB2 LEU 126 1HB LEU 126 -10.946 -7.934 5.472 729 HB3 LEU 126 2HB LEU 126 -11.142 -6.445 4.570 730 HG LEU 126 HG LEU 126 -13.367 -8.224 5.568 731 HD11 LEU 126 1HD1 LEU 126 -12.412 -5.506 6.441 732 HD12 LEU 126 2HD1 LEU 126 -12.320 -7.004 7.363 733 HD13 LEU 126 3HD1 LEU 126 -13.889 -6.285 7.002 734 HD21 LEU 126 1HD2 LEU 126 -14.862 -6.441 4.786 735 HD22 LEU 126 2HD2 LEU 126 -13.977 -7.186 3.457 736 HD23 LEU 126 3HD2 LEU 126 -13.483 -5.610 4.071 737 H GLN 127 H GLN 127 -9.670 -9.882 3.960 738 HA GLN 127 HA GLN 127 -7.446 -8.466 2.912 739 HB2 GLN 127 1HB GLN 127 -7.151 -10.200 4.623 740 HB3 GLN 127 2HB GLN 127 -7.727 -11.419 3.494 741 HG2 GLN 127 1HG GLN 127 -5.820 -10.963 2.030 742 HG3 GLN 127 2HG GLN 127 -5.234 -9.755 3.175 743 HE21 GLN 127 1HE2 GLN 127 -3.881 -12.116 2.244 744 HE22 GLN 127 2HE2 GLN 127 -3.577 -13.099 3.638 745 H GLN 128 H GLN 128 -9.493 -11.064 1.690 746 HA GLN 128 HA GLN 128 -8.108 -11.634 -0.659 747 HB2 GLN 128 1HB GLN 128 -11.078 -11.729 -0.102 748 HB3 GLN 128 2HB GLN 128 -10.311 -12.453 -1.511 749 HG2 GLN 128 1HG GLN 128 -9.072 -13.971 -0.119 750 HG3 GLN 128 2HG GLN 128 -9.668 -13.177 1.337 751 HE21 GLN 128 1HE2 GLN 128 -9.891 -15.953 0.517 752 HE22 GLN 128 2HE2 GLN 128 -11.583 -16.308 0.473 753 H ALA 129 H ALA 129 -10.547 -9.173 0.005 754 HA ALA 129 HA ALA 129 -10.636 -8.185 -2.669 755 HB1 ALA 129 1HB ALA 129 -11.520 -6.897 -0.092 756 HB2 ALA 129 2HB ALA 129 -12.516 -7.893 -1.155 757 HB3 ALA 129 3HB ALA 129 -11.917 -6.329 -1.714 758 H CYS 130 H CYS 130 -9.000 -7.143 0.301 759 HA CYS 130 HA CYS 130 -7.911 -4.770 -0.825 760 HB2 CYS 130 1HB CYS 130 -8.249 -5.126 1.610 761 HB3 CYS 130 2HB CYS 130 -6.955 -6.325 1.592 762 H GLU 131 H GLU 131 -6.532 -7.966 -0.152 763 HA GLU 131 HA GLU 131 -3.921 -7.404 -1.035 764 HB2 GLU 131 1HB GLU 131 -4.634 -9.343 0.395 765 HB3 GLU 131 2HB GLU 131 -5.325 -10.081 -1.042 766 HG2 GLU 131 1HG GLU 131 -3.046 -10.006 -2.072 767 HG3 GLU 131 2HG GLU 131 -2.428 -9.493 -0.500 768 H ASP 132 H ASP 132 -6.840 -8.206 -2.709 769 HA ASP 132 HA ASP 132 -5.768 -9.126 -5.135 770 HB2 ASP 132 1HB ASP 132 -8.175 -9.260 -4.503 771 HB3 ASP 132 2HB ASP 132 -8.301 -7.520 -4.727 772 H VAL 133 H VAL 133 -6.734 -5.851 -4.140 773 HA VAL 133 HA VAL 133 -5.636 -4.687 -6.551 774 HB VAL 133 HB VAL 133 -6.811 -3.358 -4.104 775 HG11 VAL 133 1HG1 VAL 133 -6.253 -2.206 -6.835 776 HG12 VAL 133 2HG1 VAL 133 -5.283 -1.908 -5.394 777 HG13 VAL 133 3HG1 VAL 133 -6.958 -1.361 -5.458 778 HG21 VAL 133 1HG2 VAL 133 -8.439 -4.752 -5.239 779 HG22 VAL 133 2HG2 VAL 133 -8.027 -4.012 -6.785 780 HG23 VAL 133 3HG2 VAL 133 -8.797 -3.049 -5.524 781 H PHE 134 H PHE 134 -4.944 -4.596 -3.093 782 HA PHE 134 HA PHE 134 -2.605 -2.932 -3.469 783 HB2 PHE 134 1HB PHE 134 -3.945 -4.022 -0.992 784 HB3 PHE 134 2HB PHE 134 -2.465 -3.078 -0.953 785 HD1 PHE 134 HD1 PHE 134 -6.059 -2.978 -1.761 786 HD2 PHE 134 HD2 PHE 134 -2.493 -0.713 -1.236 787 HE1 PHE 134 HE1 PHE 134 -7.377 -0.904 -1.753 788 HE2 PHE 134 HE2 PHE 134 -3.810 1.367 -1.225 789 HZ PHE 134 HZ PHE 134 -6.257 1.272 -1.486 790 H ARG 135 H ARG 135 -2.730 -5.706 -4.460 791 HA ARG 135 HA ARG 135 -1.524 -7.626 -2.925 792 HB2 ARG 135 1HB ARG 135 -0.727 -8.593 -5.106 793 HB3 ARG 135 2HB ARG 135 -2.436 -8.172 -5.071 794 HG2 ARG 135 1HG ARG 135 -1.965 -6.115 -6.285 795 HG3 ARG 135 2HG ARG 135 -0.246 -6.506 -6.297 796 HD2 ARG 135 1HD ARG 135 -2.375 -8.252 -7.520 797 HD3 ARG 135 2HD ARG 135 -1.475 -7.035 -8.418 798 HE ARG 135 HE ARG 135 0.523 -8.461 -7.435 799 HH11 ARG 135 1HH1 ARG 135 -2.487 -9.553 -8.861 800 HH12 ARG 135 2HH1 ARG 135 -1.800 -11.009 -9.510 801 HH21 ARG 135 1HH2 ARG 135 1.439 -10.365 -8.301 802 HH22 ARG 135 2HH2 ARG 135 0.428 -11.468 -9.199 803 H PHE 136 H PHE 136 0.524 -8.370 -2.610 804 HA PHE 136 HA PHE 136 2.684 -6.468 -3.172 805 HB2 PHE 136 1HB PHE 136 3.752 -7.248 -1.030 806 HB3 PHE 136 2HB PHE 136 2.292 -6.289 -0.829 807 HD1 PHE 136 HD1 PHE 136 3.958 -9.319 0.021 808 HD2 PHE 136 HD2 PHE 136 0.098 -7.565 -0.400 809 HE1 PHE 136 HE1 PHE 136 3.007 -11.061 1.470 810 HE2 PHE 136 HE2 PHE 136 -0.856 -9.309 1.051 811 HZ PHE 136 HZ PHE 136 0.599 -11.058 1.986 812 H ASP 137 H ASP 137 3.946 -7.282 -4.618 813 HA ASP 137 HA ASP 137 4.132 -10.166 -4.961 814 HB2 ASP 137 1HB ASP 137 5.184 -7.886 -6.661 815 HB3 ASP 137 2HB ASP 137 5.292 -9.589 -7.078 816 H ASP 138 H ASP 138 6.043 -11.292 -4.927 817 HA ASP 138 HA ASP 138 7.912 -10.574 -2.972 818 HB2 ASP 138 1HB ASP 138 7.932 -12.700 -5.106 819 HB3 ASP 138 2HB ASP 138 9.268 -12.505 -3.978 820 H ALA 139 H ALA 139 7.668 -9.611 -6.186 821 HA ALA 139 HA ALA 139 10.404 -9.219 -6.802 822 HB1 ALA 139 1HB ALA 139 8.666 -9.309 -8.523 823 HB2 ALA 139 2HB ALA 139 9.585 -7.807 -8.617 824 HB3 ALA 139 3HB ALA 139 7.975 -7.811 -7.901 825 H ASN 140 H ASN 140 8.166 -7.532 -4.813 826 HA ASN 140 HA ASN 140 9.902 -5.162 -4.765 827 HB2 ASN 140 1HB ASN 140 7.009 -5.505 -3.956 828 HB3 ASN 140 2HB ASN 140 7.941 -4.038 -3.666 829 HD21 ASN 140 1HD2 ASN 140 8.565 -2.765 -5.420 830 HD22 ASN 140 2HD2 ASN 140 7.804 -2.905 -6.968 831 H LEU 141 H LEU 141 9.927 -7.889 -3.227 832 HA LEU 141 HA LEU 141 10.805 -6.705 -0.757 833 HB2 LEU 141 1HB LEU 141 9.390 -8.187 0.665 834 HB3 LEU 141 2HB LEU 141 8.517 -6.917 -0.165 835 HG LEU 141 HG LEU 141 8.190 -8.949 -1.924 836 HD11 LEU 141 1HD1 LEU 141 9.334 -10.573 -0.510 837 HD12 LEU 141 2HD1 LEU 141 7.624 -10.972 -0.683 838 HD13 LEU 141 3HD1 LEU 141 8.209 -10.230 0.805 839 HD21 LEU 141 1HD2 LEU 141 6.478 -8.364 0.482 840 HD22 LEU 141 2HD2 LEU 141 5.955 -9.196 -0.983 841 HD23 LEU 141 3HD2 LEU 141 6.446 -7.504 -1.056 842 H VAL 142 H VAL 142 12.676 -7.604 -0.337 843 HA VAL 142 HA VAL 142 13.281 -10.264 -1.308 844 HB VAL 142 HB VAL 142 14.978 -8.539 -1.584 845 HG11 VAL 142 1HG1 VAL 142 14.976 -8.346 1.422 846 HG12 VAL 142 2HG1 VAL 142 14.472 -7.098 0.282 847 HG13 VAL 142 3HG1 VAL 142 16.161 -7.592 0.357 848 HG21 VAL 142 1HG2 VAL 142 16.901 -9.690 -0.555 849 HG22 VAL 142 2HG2 VAL 142 15.779 -10.799 -1.339 850 HG23 VAL 142 3HG2 VAL 142 15.779 -10.644 0.417 851 HA PRO 143 HA PRO 143 12.045 -12.152 2.498 852 HB2 PRO 143 1HB PRO 143 13.280 -14.562 2.141 853 HB3 PRO 143 2HB PRO 143 11.767 -14.113 1.351 854 HG2 PRO 143 1HG PRO 143 14.557 -14.063 0.276 855 HG3 PRO 143 2HG PRO 143 13.058 -14.586 -0.518 856 HD2 PRO 143 1HD PRO 143 14.174 -12.175 -0.991 857 HD3 PRO 143 2HD PRO 143 12.419 -12.424 -1.012 858 H ARG 144 H ARG 144 12.847 -12.102 4.487 859 HA ARG 144 HA ARG 144 15.775 -12.029 4.792 860 HB2 ARG 144 1HB ARG 144 14.625 -9.906 5.348 861 HB3 ARG 144 2HB ARG 144 13.670 -10.756 6.554 862 HG2 ARG 144 1HG ARG 144 15.384 -9.633 7.709 863 HG3 ARG 144 2HG ARG 144 15.816 -11.341 7.702 864 HD2 ARG 144 1HD ARG 144 16.890 -9.381 5.689 865 HD3 ARG 144 2HD ARG 144 17.684 -9.687 7.229 866 HE ARG 144 HE ARG 144 17.537 -11.481 4.937 867 HH11 ARG 144 1HH1 ARG 144 18.384 -11.052 8.310 868 HH12 ARG 144 2HH1 ARG 144 19.501 -12.382 8.330 869 HH21 ARG 144 1HH2 ARG 144 19.010 -13.233 4.959 870 HH22 ARG 144 2HH2 ARG 144 19.871 -13.613 6.420 871 H GLY 145 H GLY 145 16.662 -13.648 5.939 872 HA2 GLY 145 1HA GLY 145 15.007 -15.047 7.910 873 HA3 GLY 145 2HA GLY 145 15.724 -15.987 6.608 874 H SER 146 H SER 146 16.193 -14.620 9.671 875 HA SER 146 HA SER 146 19.090 -14.941 9.581 876 HB2 SER 146 1HB SER 146 17.298 -14.083 11.869 877 HB3 SER 146 2HB SER 146 19.062 -14.029 11.856 878 HG SER 146 HG SER 146 17.218 -12.466 10.403 879 H GLY 147 H GLY 147 20.006 -16.828 10.055 880 HA2 GLY 147 1HA GLY 147 20.265 -18.647 11.677 881 HA3 GLY 147 2HA GLY 147 18.510 -18.693 11.794 882 H LEU 148 H LEU 148 20.284 -18.358 8.798 883 HA LEU 148 HA LEU 148 18.898 -20.596 7.664 884 HB2 LEU 148 1HB LEU 148 21.095 -18.857 6.533 885 HB3 LEU 148 2HB LEU 148 20.185 -20.042 5.619 886 HG LEU 148 HG LEU 148 19.013 -17.574 6.911 887 HD11 LEU 148 1HD1 LEU 148 18.779 -16.732 4.638 888 HD12 LEU 148 2HD1 LEU 148 19.581 -18.171 4.011 889 HD13 LEU 148 3HD1 LEU 148 20.473 -17.037 5.023 890 HD21 LEU 148 1HD2 LEU 148 17.022 -18.135 5.558 891 HD22 LEU 148 2HD2 LEU 148 17.373 -19.334 6.799 892 HD23 LEU 148 3HD2 LEU 148 17.784 -19.662 5.116 893 H GLU 149 H GLU 149 19.577 -22.415 8.770 894 HA GLU 149 HA GLU 149 22.420 -23.039 8.863 895 HB2 GLU 149 1HB GLU 149 20.038 -24.588 9.904 896 HB3 GLU 149 2HB GLU 149 21.720 -25.026 10.158 897 HG2 GLU 149 1HG GLU 149 22.051 -22.904 11.373 898 HG3 GLU 149 2HG GLU 149 20.335 -22.555 11.182 899 H HIS 150 H HIS 150 19.820 -23.524 6.783 900 HA HIS 150 HA HIS 150 20.836 -26.007 5.676 901 HB2 HIS 150 1HB HIS 150 18.530 -24.209 4.946 902 HB3 HIS 150 2HB HIS 150 19.038 -25.533 3.903 903 HD1 HIS 150 HD1 HIS 150 18.712 -27.967 4.841 904 HD2 HIS 150 HD2 HIS 150 17.065 -24.953 7.184 905 HE1 HIS 150 HE1 HIS 150 17.138 -29.123 6.426 906 HE2 HIS 150 HE2 HIS 150 16.265 -27.294 7.925 907 H HIS 151 H HIS 151 21.703 -26.204 3.584 908 HA HIS 151 HA HIS 151 23.096 -23.760 2.720 909 HB2 HIS 151 1HB HIS 151 23.836 -26.656 2.238 910 HB3 HIS 151 2HB HIS 151 24.763 -25.260 1.704 911 HD1 HIS 151 HD1 HIS 151 24.473 -27.603 4.442 912 HD2 HIS 151 HD2 HIS 151 25.760 -23.676 3.997 913 HE1 HIS 151 HE1 HIS 151 25.854 -27.110 6.484 914 HE2 HIS 151 HE2 HIS 151 26.729 -24.775 6.133 915 H HIS 152 H HIS 152 23.507 -23.574 0.379 916 HA HIS 152 HA HIS 152 21.428 -24.861 -1.250 917 HB2 HIS 152 1HB HIS 152 22.127 -21.914 -1.253 918 HB3 HIS 152 2HB HIS 152 21.103 -22.696 -2.452 919 HD1 HIS 152 HD1 HIS 152 18.691 -23.166 -1.809 920 HD2 HIS 152 HD2 HIS 152 20.959 -21.646 1.318 921 HE1 HIS 152 HE1 HIS 152 17.047 -22.628 0.018 922 HE2 HIS 152 HE2 HIS 152 18.427 -21.559 1.834 923 H HIS 153 H HIS 153 23.791 -25.974 -1.314 924 HA HIS 153 HA HIS 153 25.549 -24.814 -3.271 925 HB2 HIS 153 1HB HIS 153 25.411 -27.553 -2.012 926 HB3 HIS 153 2HB HIS 153 26.570 -27.159 -3.274 927 HD1 HIS 153 HD1 HIS 153 28.396 -25.344 -2.656 928 HD2 HIS 153 HD2 HIS 153 26.090 -26.721 0.518 929 HE1 HIS 153 HE1 HIS 153 29.639 -24.676 -0.579 930 HE2 HIS 153 HE2 HIS 153 28.301 -25.645 1.323 931 H HIS 154 H HIS 154 22.968 -27.179 -3.232 932 HA HIS 154 HA HIS 154 23.000 -27.157 -6.174 933 HB2 HIS 154 1HB HIS 154 22.296 -29.430 -4.312 934 HB3 HIS 154 2HB HIS 154 21.893 -29.428 -6.022 935 HD1 HIS 154 HD1 HIS 154 23.584 -30.464 -7.506 936 HD2 HIS 154 HD2 HIS 154 25.233 -29.240 -3.893 937 HE1 HIS 154 HE1 HIS 154 25.961 -31.277 -7.539 938 HE2 HIS 154 HE2 HIS 154 26.877 -30.683 -5.271 939 H HIS 155 H HIS 155 20.985 -27.072 -7.201 940 HA HIS 155 HA HIS 155 18.592 -26.842 -5.564 941 HB2 HIS 155 1HB HIS 155 19.588 -24.527 -5.780 942 HB3 HIS 155 2HB HIS 155 19.343 -24.654 -7.517 943 HD1 HIS 155 HD1 HIS 155 17.742 -23.475 -4.527 944 HD2 HIS 155 HD2 HIS 155 16.449 -25.045 -8.150 945 HE1 HIS 155 HE1 HIS 155 15.328 -22.805 -4.731 946 HE2 HIS 155 HE2 HIS 155 14.632 -23.595 -7.016 Start of MODEL 14 1 H1 MET 24 1H MET 24 -21.155 -13.792 -1.539 2 H2 MET 24 2H MET 24 -22.440 -13.210 -2.465 3 H3 MET 24 3H MET 24 -22.587 -13.305 -0.786 4 HA MET 24 HA MET 24 -22.226 -11.039 -1.453 5 HB2 MET 24 1HB MET 24 -19.835 -12.308 -0.103 6 HB3 MET 24 2HB MET 24 -20.157 -10.582 -0.131 7 HG2 MET 24 1HG MET 24 -22.284 -11.005 1.059 8 HG3 MET 24 2HG MET 24 -21.846 -12.710 1.163 9 HE1 MET 24 1HE MET 24 -19.789 -13.632 2.522 10 HE2 MET 24 2HE MET 24 -18.675 -12.624 3.445 11 HE3 MET 24 3HE MET 24 -18.683 -12.544 1.683 12 H GLU 25 H GLU 25 -21.940 -10.385 -3.529 13 HA GLU 25 HA GLU 25 -19.538 -11.055 -4.986 14 HB2 GLU 25 1HB GLU 25 -21.699 -10.779 -6.147 15 HB3 GLU 25 2HB GLU 25 -21.744 -9.094 -5.652 16 HG2 GLU 25 1HG GLU 25 -19.697 -8.682 -6.942 17 HG3 GLU 25 2HG GLU 25 -19.708 -10.364 -7.468 18 H ASN 26 H ASN 26 -17.698 -9.935 -4.942 19 HA ASN 26 HA ASN 26 -17.727 -7.435 -3.395 20 HB2 ASN 26 1HB ASN 26 -15.524 -9.479 -3.729 21 HB3 ASN 26 2HB ASN 26 -15.369 -7.978 -2.823 22 HD21 ASN 26 1HD2 ASN 26 -18.079 -8.110 -1.760 23 HD22 ASN 26 2HD2 ASN 26 -18.052 -9.339 -0.545 24 H TYR 27 H TYR 27 -18.143 -7.710 -6.293 25 HA TYR 27 HA TYR 27 -15.757 -6.926 -7.635 26 HB2 TYR 27 1HB TYR 27 -17.636 -8.020 -8.810 27 HB3 TYR 27 2HB TYR 27 -18.638 -6.606 -8.512 28 HD1 TYR 27 HD1 TYR 27 -18.590 -4.765 -9.990 29 HD2 TYR 27 HD2 TYR 27 -15.563 -7.746 -10.259 30 HE1 TYR 27 HE1 TYR 27 -17.787 -3.752 -12.077 31 HE2 TYR 27 HE2 TYR 27 -14.754 -6.735 -12.348 32 HH TYR 27 HH TYR 27 -15.710 -3.660 -13.393 33 H LEU 28 H LEU 28 -18.470 -5.207 -6.195 34 HA LEU 28 HA LEU 28 -17.660 -2.625 -7.106 35 HB2 LEU 28 1HB LEU 28 -19.486 -3.476 -4.856 36 HB3 LEU 28 2HB LEU 28 -19.216 -1.804 -5.302 37 HG LEU 28 HG LEU 28 -20.395 -3.889 -7.139 38 HD11 LEU 28 1HD1 LEU 28 -22.519 -2.741 -6.758 39 HD12 LEU 28 2HD1 LEU 28 -21.741 -1.698 -5.567 40 HD13 LEU 28 3HD1 LEU 28 -21.882 -3.430 -5.265 41 HD21 LEU 28 1HD2 LEU 28 -19.261 -2.103 -8.335 42 HD22 LEU 28 2HD2 LEU 28 -20.137 -0.896 -7.394 43 HD23 LEU 28 3HD2 LEU 28 -21.009 -1.946 -8.509 44 H ARG 29 H ARG 29 -17.172 -4.509 -4.162 45 HA ARG 29 HA ARG 29 -15.717 -2.571 -2.747 46 HB2 ARG 29 1HB ARG 29 -16.554 -4.556 -1.626 47 HB3 ARG 29 2HB ARG 29 -15.551 -5.591 -2.633 48 HG2 ARG 29 1HG ARG 29 -13.600 -4.985 -1.545 49 HG3 ARG 29 2HG ARG 29 -14.296 -3.496 -0.907 50 HD2 ARG 29 1HD ARG 29 -14.140 -4.941 0.939 51 HD3 ARG 29 2HD ARG 29 -15.836 -4.978 0.464 52 HE ARG 29 HE ARG 29 -14.257 -7.088 -0.695 53 HH11 ARG 29 1HH1 ARG 29 -16.230 -6.107 2.036 54 HH12 ARG 29 2HH1 ARG 29 -16.485 -7.732 2.590 55 HH21 ARG 29 1HH2 ARG 29 -14.572 -9.235 0.076 56 HH22 ARG 29 2HH2 ARG 29 -15.552 -9.496 1.487 57 H LYS 30 H LYS 30 -14.720 -5.028 -5.074 58 HA LYS 30 HA LYS 30 -11.955 -4.621 -4.958 59 HB2 LYS 30 1HB LYS 30 -13.826 -5.965 -6.691 60 HB3 LYS 30 2HB LYS 30 -12.615 -5.133 -7.652 61 HG2 LYS 30 1HG LYS 30 -11.900 -7.379 -7.269 62 HG3 LYS 30 2HG LYS 30 -10.852 -6.290 -6.366 63 HD2 LYS 30 1HD LYS 30 -11.936 -6.834 -4.310 64 HD3 LYS 30 2HD LYS 30 -13.210 -7.720 -5.150 65 HE2 LYS 30 1HE LYS 30 -10.290 -8.477 -5.095 66 HE3 LYS 30 2HE LYS 30 -11.557 -9.224 -4.125 67 HZ1 LYS 30 1HZ LYS 30 -12.609 -10.021 -6.105 68 HZ2 LYS 30 2HZ LYS 30 -10.989 -10.491 -6.139 69 HZ3 LYS 30 3HZ LYS 30 -11.512 -9.197 -7.092 70 H ALA 31 H ALA 31 -14.364 -3.159 -7.184 71 HA ALA 31 HA ALA 31 -12.635 -1.424 -8.465 72 HB1 ALA 31 1HB ALA 31 -14.613 -0.216 -9.157 73 HB2 ALA 31 2HB ALA 31 -15.560 -1.000 -7.895 74 HB3 ALA 31 3HB ALA 31 -14.902 -1.952 -9.226 75 H ALA 32 H ALA 32 -14.488 -0.931 -5.486 76 HA ALA 32 HA ALA 32 -13.925 1.799 -5.151 77 HB1 ALA 32 1HB ALA 32 -15.632 0.634 -3.846 78 HB2 ALA 32 2HB ALA 32 -14.478 1.454 -2.794 79 HB3 ALA 32 3HB ALA 32 -14.377 -0.291 -3.024 80 H LEU 33 H LEU 33 -12.217 -1.094 -4.082 81 HA LEU 33 HA LEU 33 -10.104 0.274 -2.769 82 HB2 LEU 33 1HB LEU 33 -10.156 -2.496 -3.979 83 HB3 LEU 33 2HB LEU 33 -8.936 -1.892 -2.866 84 HG LEU 33 HG LEU 33 -11.866 -2.241 -2.219 85 HD11 LEU 33 1HD1 LEU 33 -10.728 -4.372 -2.529 86 HD12 LEU 33 2HD1 LEU 33 -11.145 -4.102 -0.837 87 HD13 LEU 33 3HD1 LEU 33 -9.483 -3.879 -1.381 88 HD21 LEU 33 1HD2 LEU 33 -10.831 -0.424 -0.959 89 HD22 LEU 33 2HD2 LEU 33 -9.541 -1.510 -0.444 90 HD23 LEU 33 3HD2 LEU 33 -11.198 -1.797 0.082 91 H THR 34 H THR 34 -10.611 -0.866 -6.054 92 HA THR 34 HA THR 34 -8.030 -0.322 -7.048 93 HB THR 34 HB THR 34 -10.658 -0.207 -8.549 94 HG1 THR 34 HG1 THR 34 -10.179 -2.236 -7.443 95 HG21 THR 34 1HG2 THR 34 -9.283 -0.707 -10.524 96 HG22 THR 34 2HG2 THR 34 -7.829 -0.620 -9.529 97 HG23 THR 34 3HG2 THR 34 -8.813 0.821 -9.781 98 H ASP 35 H ASP 35 -10.919 1.648 -6.653 99 HA ASP 35 HA ASP 35 -9.923 3.975 -7.945 100 HB2 ASP 35 1HB ASP 35 -12.294 3.790 -7.635 101 HB3 ASP 35 2HB ASP 35 -12.105 3.551 -5.899 102 H MET 36 H MET 36 -9.932 2.823 -4.620 103 HA MET 36 HA MET 36 -8.750 5.073 -3.416 104 HB2 MET 36 1HB MET 36 -9.800 3.174 -2.181 105 HB3 MET 36 2HB MET 36 -8.418 2.175 -2.603 106 HG2 MET 36 1HG MET 36 -8.196 2.992 -0.349 107 HG3 MET 36 2HG MET 36 -6.951 3.702 -1.381 108 HE1 MET 36 1HE MET 36 -10.747 4.772 -1.344 109 HE2 MET 36 2HE MET 36 -10.745 5.993 -0.073 110 HE3 MET 36 3HE MET 36 -10.444 4.302 0.328 111 H LEU 37 H LEU 37 -7.337 2.169 -4.863 112 HA LEU 37 HA LEU 37 -4.636 2.838 -4.429 113 HB2 LEU 37 1HB LEU 37 -5.409 0.589 -5.042 114 HB3 LEU 37 2HB LEU 37 -5.891 1.186 -6.626 115 HG LEU 37 HG LEU 37 -3.436 1.784 -6.988 116 HD11 LEU 37 1HD1 LEU 37 -1.811 0.530 -5.667 117 HD12 LEU 37 2HD1 LEU 37 -3.106 -0.055 -4.621 118 HD13 LEU 37 3HD1 LEU 37 -2.713 1.663 -4.660 119 HD21 LEU 37 1HD2 LEU 37 -2.874 -0.492 -7.652 120 HD22 LEU 37 2HD2 LEU 37 -4.545 -0.104 -8.064 121 HD23 LEU 37 3HD2 LEU 37 -4.195 -1.114 -6.662 122 H GLN 38 H GLN 38 -6.860 3.525 -7.097 123 HA GLN 38 HA GLN 38 -4.970 4.794 -8.769 124 HB2 GLN 38 1HB GLN 38 -7.972 4.995 -8.618 125 HB3 GLN 38 2HB GLN 38 -7.019 5.849 -9.823 126 HG2 GLN 38 1HG GLN 38 -7.111 2.864 -9.452 127 HG3 GLN 38 2HG GLN 38 -7.957 3.778 -10.699 128 HE21 GLN 38 1HE2 GLN 38 -4.886 2.590 -9.601 129 HE22 GLN 38 2HE2 GLN 38 -4.015 2.900 -11.064 130 H THR 39 H THR 39 -6.753 5.876 -6.001 131 HA THR 39 HA THR 39 -6.284 8.677 -6.418 132 HB THR 39 HB THR 39 -6.877 7.272 -3.801 133 HG1 THR 39 HG1 THR 39 -8.409 6.869 -5.599 134 HG21 THR 39 1HG2 THR 39 -7.854 9.430 -3.164 135 HG22 THR 39 2HG2 THR 39 -7.398 10.104 -4.727 136 HG23 THR 39 3HG2 THR 39 -6.150 9.610 -3.583 137 H PHE 40 H PHE 40 -4.576 6.024 -4.944 138 HA PHE 40 HA PHE 40 -2.613 7.559 -3.575 139 HB2 PHE 40 1HB PHE 40 -3.027 5.228 -2.974 140 HB3 PHE 40 2HB PHE 40 -2.536 4.703 -4.579 141 HD1 PHE 40 HD1 PHE 40 -1.015 6.994 -2.039 142 HD2 PHE 40 HD2 PHE 40 -0.577 3.551 -4.505 143 HE1 PHE 40 HE1 PHE 40 1.307 6.737 -1.263 144 HE2 PHE 40 HE2 PHE 40 1.743 3.288 -3.737 145 HZ PHE 40 HZ PHE 40 2.690 4.883 -2.114 146 H VAL 41 H VAL 41 -2.929 6.324 -6.831 147 HA VAL 41 HA VAL 41 -0.349 6.467 -7.752 148 HB VAL 41 HB VAL 41 -2.883 7.056 -9.269 149 HG11 VAL 41 1HG1 VAL 41 -0.112 6.528 -10.326 150 HG12 VAL 41 2HG1 VAL 41 -0.989 8.054 -10.429 151 HG13 VAL 41 3HG1 VAL 41 -1.578 6.635 -11.297 152 HG21 VAL 41 1HG2 VAL 41 -2.606 4.764 -10.076 153 HG22 VAL 41 2HG2 VAL 41 -2.753 4.816 -8.318 154 HG23 VAL 41 3HG2 VAL 41 -1.174 4.584 -9.065 155 HA PRO 42 HA PRO 42 -0.965 11.211 -8.934 156 HB2 PRO 42 1HB PRO 42 -2.808 11.899 -6.704 157 HB3 PRO 42 2HB PRO 42 -2.710 12.571 -8.337 158 HG2 PRO 42 1HG PRO 42 -4.658 10.881 -7.677 159 HG3 PRO 42 2HG PRO 42 -3.893 10.818 -9.276 160 HD2 PRO 42 1HD PRO 42 -3.519 9.025 -6.920 161 HD3 PRO 42 2HD PRO 42 -3.530 8.633 -8.649 162 H TYR 43 H TYR 43 -1.291 10.084 -5.539 163 HA TYR 43 HA TYR 43 0.436 12.124 -4.553 164 HB2 TYR 43 1HB TYR 43 -0.670 9.588 -3.343 165 HB3 TYR 43 2HB TYR 43 0.438 10.651 -2.467 166 HD1 TYR 43 HD1 TYR 43 -2.928 10.423 -3.986 167 HD2 TYR 43 HD2 TYR 43 -0.299 12.737 -1.564 168 HE1 TYR 43 HE1 TYR 43 -4.809 11.856 -3.319 169 HE2 TYR 43 HE2 TYR 43 -2.177 14.173 -0.890 170 HH TYR 43 HH TYR 43 -4.352 14.823 -1.621 171 H ARG 44 H ARG 44 0.914 8.967 -5.894 172 HA ARG 44 HA ARG 44 3.461 8.346 -4.969 173 HB2 ARG 44 1HB ARG 44 2.245 7.919 -7.695 174 HB3 ARG 44 2HB ARG 44 3.809 7.271 -7.232 175 HG2 ARG 44 1HG ARG 44 2.750 5.986 -5.447 176 HG3 ARG 44 2HG ARG 44 1.175 6.631 -5.925 177 HD2 ARG 44 1HD ARG 44 1.617 4.359 -6.846 178 HD3 ARG 44 2HD ARG 44 1.355 5.569 -8.099 179 HE ARG 44 HE ARG 44 3.963 4.429 -7.352 180 HH11 ARG 44 1HH1 ARG 44 1.885 6.039 -9.658 181 HH12 ARG 44 2HH1 ARG 44 3.053 6.008 -10.935 182 HH21 ARG 44 1HH2 ARG 44 5.514 4.381 -9.049 183 HH22 ARG 44 2HH2 ARG 44 5.123 5.075 -10.586 184 H THR 45 H THR 45 2.533 10.328 -7.758 185 HA THR 45 HA THR 45 4.964 11.205 -8.621 186 HB THR 45 HB THR 45 2.495 12.922 -8.341 187 HG1 THR 45 HG1 THR 45 2.789 11.879 -10.779 188 HG21 THR 45 1HG2 THR 45 3.349 14.088 -10.309 189 HG22 THR 45 2HG2 THR 45 4.775 13.049 -10.317 190 HG23 THR 45 3HG2 THR 45 4.507 14.172 -8.983 191 H ALA 46 H ALA 46 3.053 12.653 -5.983 192 HA ALA 46 HA ALA 46 4.917 14.658 -5.299 193 HB1 ALA 46 1HB ALA 46 2.590 14.706 -4.550 194 HB2 ALA 46 2HB ALA 46 3.699 14.809 -3.183 195 HB3 ALA 46 3HB ALA 46 2.880 13.288 -3.543 196 H VAL 47 H VAL 47 4.489 11.346 -4.299 197 HA VAL 47 HA VAL 47 6.445 11.226 -2.276 198 HB VAL 47 HB VAL 47 5.438 9.055 -4.124 199 HG11 VAL 47 1HG1 VAL 47 6.406 7.439 -2.589 200 HG12 VAL 47 2HG1 VAL 47 7.071 8.744 -1.608 201 HG13 VAL 47 3HG1 VAL 47 7.666 8.485 -3.248 202 HG21 VAL 47 1HG2 VAL 47 4.143 8.346 -2.159 203 HG22 VAL 47 2HG2 VAL 47 3.726 9.982 -2.668 204 HG23 VAL 47 3HG2 VAL 47 4.763 9.733 -1.262 205 H GLU 48 H GLU 48 6.662 10.523 -5.760 206 HA GLU 48 HA GLU 48 9.371 9.783 -5.802 207 HB2 GLU 48 1HB GLU 48 7.813 11.159 -8.008 208 HB3 GLU 48 2HB GLU 48 9.298 10.247 -8.208 209 HG2 GLU 48 1HG GLU 48 8.159 8.202 -7.563 210 HG3 GLU 48 2HG GLU 48 6.671 9.107 -7.275 211 H LEU 49 H LEU 49 7.807 12.918 -6.269 212 HA LEU 49 HA LEU 49 10.104 14.427 -6.817 213 HB2 LEU 49 1HB LEU 49 7.349 15.006 -5.893 214 HB3 LEU 49 2HB LEU 49 8.547 16.254 -5.610 215 HG LEU 49 HG LEU 49 7.277 16.613 -7.688 216 HD11 LEU 49 1HD1 LEU 49 10.190 15.992 -8.138 217 HD12 LEU 49 2HD1 LEU 49 9.537 17.493 -7.481 218 HD13 LEU 49 3HD1 LEU 49 9.183 17.029 -9.144 219 HD21 LEU 49 1HD2 LEU 49 7.654 15.165 -9.623 220 HD22 LEU 49 2HD2 LEU 49 6.858 14.296 -8.309 221 HD23 LEU 49 3HD2 LEU 49 8.580 14.056 -8.613 222 H CYS 50 H CYS 50 8.514 13.664 -3.750 223 HA CYS 50 HA CYS 50 10.309 15.230 -2.179 224 HB2 CYS 50 1HB CYS 50 8.026 14.629 -1.427 225 HB3 CYS 50 2HB CYS 50 8.516 12.943 -1.333 226 H ALA 51 H ALA 51 10.319 11.985 -3.421 227 HA ALA 51 HA ALA 51 12.173 10.900 -1.528 228 HB1 ALA 51 1HB ALA 51 10.582 9.488 -2.780 229 HB2 ALA 51 2HB ALA 51 12.255 8.969 -2.984 230 HB3 ALA 51 3HB ALA 51 11.447 9.867 -4.269 231 H LEU 52 H LEU 52 12.375 12.323 -4.746 232 HA LEU 52 HA LEU 52 15.123 11.577 -5.103 233 HB2 LEU 52 1HB LEU 52 13.469 11.841 -6.965 234 HB3 LEU 52 2HB LEU 52 13.482 13.572 -6.670 235 HG LEU 52 HG LEU 52 15.930 13.576 -7.199 236 HD11 LEU 52 1HD1 LEU 52 16.450 11.259 -6.761 237 HD12 LEU 52 2HD1 LEU 52 16.814 11.640 -8.443 238 HD13 LEU 52 3HD1 LEU 52 15.353 10.739 -8.039 239 HD21 LEU 52 1HD2 LEU 52 15.608 13.403 -9.618 240 HD22 LEU 52 2HD2 LEU 52 14.269 14.252 -8.845 241 HD23 LEU 52 3HD2 LEU 52 14.075 12.575 -9.354 242 H GLU 53 H GLU 53 13.524 14.188 -3.586 243 HA GLU 53 HA GLU 53 15.423 16.229 -4.089 244 HB2 GLU 53 1HB GLU 53 13.054 16.589 -3.351 245 HB3 GLU 53 2HB GLU 53 13.517 16.027 -1.754 246 HG2 GLU 53 1HG GLU 53 15.111 17.880 -1.574 247 HG3 GLU 53 2HG GLU 53 14.605 18.454 -3.164 248 H HIS 54 H HIS 54 14.959 13.999 -1.384 249 HA HIS 54 HA HIS 54 17.599 14.833 -0.350 250 HB2 HIS 54 1HB HIS 54 15.248 13.634 1.123 251 HB3 HIS 54 2HB HIS 54 16.847 13.827 1.833 252 HD1 HIS 54 HD1 HIS 54 13.738 15.447 1.861 253 HD2 HIS 54 HD2 HIS 54 17.655 16.774 1.433 254 HE1 HIS 54 HE1 HIS 54 13.687 17.896 2.410 255 HE2 HIS 54 HE2 HIS 54 16.023 18.710 1.950 256 H GLY 55 H GLY 55 15.944 12.403 -1.890 257 HA2 GLY 55 1HA GLY 55 16.724 10.425 -2.785 258 HA3 GLY 55 2HA GLY 55 18.172 10.570 -1.797 259 H GLY 56 H GLY 56 16.647 10.870 0.715 260 HA2 GLY 56 1HA GLY 56 15.165 8.344 0.760 261 HA3 GLY 56 2HA GLY 56 15.828 9.154 2.168 262 H LEU 57 H LEU 57 13.117 8.139 1.506 263 HA LEU 57 HA LEU 57 11.363 10.382 1.323 264 HB2 LEU 57 1HB LEU 57 10.960 7.504 2.097 265 HB3 LEU 57 2HB LEU 57 9.655 8.676 2.138 266 HG LEU 57 HG LEU 57 11.240 8.182 -0.370 267 HD11 LEU 57 1HD1 LEU 57 8.748 6.756 0.535 268 HD12 LEU 57 2HD1 LEU 57 10.341 6.031 0.334 269 HD13 LEU 57 3HD1 LEU 57 9.467 6.647 -1.070 270 HD21 LEU 57 1HD2 LEU 57 8.501 9.300 0.200 271 HD22 LEU 57 2HD2 LEU 57 9.164 9.019 -1.407 272 HD23 LEU 57 3HD2 LEU 57 9.918 10.201 -0.340 273 H ASP 58 H ASP 58 13.385 9.518 3.715 274 HA ASP 58 HA ASP 58 12.068 9.377 6.101 275 HB2 ASP 58 1HB ASP 58 14.498 9.203 5.896 276 HB3 ASP 58 2HB ASP 58 14.603 10.920 5.526 277 H THR 59 H THR 59 12.547 12.251 4.144 278 HA THR 59 HA THR 59 11.622 13.994 6.278 279 HB THR 59 HB THR 59 12.065 15.807 4.639 280 HG1 THR 59 HG1 THR 59 11.694 14.524 2.724 281 HG21 THR 59 1HG2 THR 59 14.527 15.490 4.569 282 HG22 THR 59 2HG2 THR 59 14.293 13.819 5.082 283 HG23 THR 59 3HG2 THR 59 13.831 15.143 6.150 284 H CYS 60 H CYS 60 10.097 12.047 4.160 285 HA CYS 60 HA CYS 60 8.145 13.981 3.192 286 HB2 CYS 60 1HB CYS 60 8.351 11.022 2.616 287 HB3 CYS 60 2HB CYS 60 7.390 12.204 1.733 288 H ASP 61 H ASP 61 7.392 14.299 5.463 289 HA ASP 61 HA ASP 61 5.537 12.164 6.303 290 HB2 ASP 61 1HB ASP 61 6.777 14.409 7.912 291 HB3 ASP 61 2HB ASP 61 5.515 13.346 8.520 292 H GLY 62 H GLY 62 3.407 12.707 6.812 293 HA2 GLY 62 1HA GLY 62 2.267 14.700 5.149 294 HA3 GLY 62 2HA GLY 62 1.411 13.745 6.353 295 H GLY 63 H GLY 63 2.374 16.810 5.503 296 HA2 GLY 63 1HA GLY 63 1.469 18.625 6.879 297 HA3 GLY 63 2HA GLY 63 2.079 17.758 8.285 298 H SER 64 H SER 64 4.406 17.323 6.044 299 HA SER 64 HA SER 64 5.787 19.821 6.734 300 HB2 SER 64 1HB SER 64 7.872 18.460 7.054 301 HB3 SER 64 2HB SER 64 6.624 18.157 8.262 302 HG SER 64 HG SER 64 6.120 16.450 6.373 303 H ASN 65 H ASN 65 7.647 20.292 5.347 304 HA ASN 65 HA ASN 65 8.564 20.706 3.325 305 HB2 ASN 65 1HB ASN 65 8.074 17.740 3.036 306 HB3 ASN 65 2HB ASN 65 8.997 18.690 1.876 307 HD21 ASN 65 1HD2 ASN 65 10.948 17.658 2.234 308 HD22 ASN 65 2HD2 ASN 65 11.829 17.806 3.723 309 H GLY 66 H GLY 66 5.660 21.066 3.538 310 HA2 GLY 66 1HA GLY 66 4.158 21.989 2.014 311 HA3 GLY 66 2HA GLY 66 5.150 21.369 0.701 312 H ILE 67 H ILE 67 4.845 18.786 2.588 313 HA ILE 67 HA ILE 67 2.860 17.584 0.912 314 HB ILE 67 HB ILE 67 4.327 16.502 3.327 315 HG12 ILE 67 1HG1 ILE 67 4.800 16.102 0.365 316 HG13 ILE 67 2HG1 ILE 67 5.794 17.086 1.434 317 HG21 ILE 67 1HG2 ILE 67 2.713 15.015 1.254 318 HG22 ILE 67 2HG2 ILE 67 2.224 15.305 2.924 319 HG23 ILE 67 3HG2 ILE 67 3.625 14.292 2.579 320 HD11 ILE 67 1HD1 ILE 67 5.400 14.113 1.637 321 HD12 ILE 67 2HD1 ILE 67 6.409 15.100 2.695 322 HD13 ILE 67 3HD1 ILE 67 6.820 14.932 0.987 323 HA PRO 68 HA PRO 68 -0.643 18.828 3.306 324 HB2 PRO 68 1HB PRO 68 -1.843 16.301 2.301 325 HB3 PRO 68 2HB PRO 68 -2.444 17.958 2.182 326 HG2 PRO 68 1HG PRO 68 -1.404 16.741 0.058 327 HG3 PRO 68 2HG PRO 68 -1.094 18.465 0.369 328 HD2 PRO 68 1HD PRO 68 0.685 16.095 0.822 329 HD3 PRO 68 2HD PRO 68 1.098 17.719 0.224 330 H SER 69 H SER 69 -1.929 18.168 5.088 331 HA SER 69 HA SER 69 -0.487 16.328 6.825 332 HB2 SER 69 1HB SER 69 -1.042 18.593 7.646 333 HB3 SER 69 2HB SER 69 -2.754 18.257 7.405 334 HG SER 69 HG SER 69 -1.048 17.460 9.423 335 HA PRO 70 HA PRO 70 -3.049 12.889 6.082 336 HB2 PRO 70 1HB PRO 70 -3.350 11.985 8.714 337 HB3 PRO 70 2HB PRO 70 -2.051 11.548 7.601 338 HG2 PRO 70 1HG PRO 70 -2.087 13.587 9.771 339 HG3 PRO 70 2HG PRO 70 -0.762 12.537 9.234 340 HD2 PRO 70 1HD PRO 70 -0.817 15.134 8.584 341 HD3 PRO 70 2HD PRO 70 -0.239 13.913 7.431 342 H THR 71 H THR 71 -5.083 12.875 5.621 343 HA THR 71 HA THR 71 -7.092 13.614 7.598 344 HB THR 71 HB THR 71 -6.624 15.688 6.322 345 HG1 THR 71 HG1 THR 71 -8.739 16.156 6.082 346 HG21 THR 71 1HG2 THR 71 -5.899 14.690 4.211 347 HG22 THR 71 2HG2 THR 71 -7.222 15.825 3.947 348 HG23 THR 71 3HG2 THR 71 -7.532 14.089 3.925 349 H THR 72 H THR 72 -9.343 13.286 6.318 350 HA THR 72 HA THR 72 -9.094 10.797 4.784 351 HB THR 72 HB THR 72 -11.079 9.895 5.978 352 HG1 THR 72 HG1 THR 72 -11.186 12.348 6.986 353 HG21 THR 72 1HG2 THR 72 -8.811 9.204 6.610 354 HG22 THR 72 2HG2 THR 72 -9.896 9.220 8.002 355 HG23 THR 72 3HG2 THR 72 -8.735 10.530 7.772 356 H THR 73 H THR 73 -10.163 10.906 2.932 357 HA THR 73 HA THR 73 -11.969 13.008 2.316 358 HB THR 73 HB THR 73 -12.270 11.897 0.175 359 HG1 THR 73 HG1 THR 73 -11.386 9.823 -0.175 360 HG21 THR 73 1HG2 THR 73 -10.167 13.133 0.517 361 HG22 THR 73 2HG2 THR 73 -9.961 11.781 -0.594 362 HG23 THR 73 3HG2 THR 73 -9.396 11.647 1.070 363 H ARG 74 H ARG 74 -14.158 12.122 1.172 364 HA ARG 74 HA ARG 74 -15.853 11.511 3.276 365 HB2 ARG 74 1HB ARG 74 -16.732 12.519 1.282 366 HB3 ARG 74 2HB ARG 74 -16.226 11.152 0.301 367 HG2 ARG 74 1HG ARG 74 -18.615 11.092 0.647 368 HG3 ARG 74 2HG ARG 74 -17.847 9.730 1.464 369 HD2 ARG 74 1HD ARG 74 -17.963 10.930 3.589 370 HD3 ARG 74 2HD ARG 74 -18.715 12.303 2.779 371 HE ARG 74 HE ARG 74 -20.157 9.863 2.384 372 HH11 ARG 74 1HH1 ARG 74 -19.627 12.505 4.621 373 HH12 ARG 74 2HH1 ARG 74 -21.185 12.345 5.369 374 HH21 ARG 74 1HH2 ARG 74 -22.203 9.653 3.370 375 HH22 ARG 74 2HH2 ARG 74 -22.650 10.735 4.654 376 H TYR 75 H TYR 75 -14.437 9.279 0.865 377 HA TYR 75 HA TYR 75 -15.740 7.057 2.164 378 HB2 TYR 75 1HB TYR 75 -13.866 7.126 -0.203 379 HB3 TYR 75 2HB TYR 75 -14.747 5.705 0.366 380 HD1 TYR 75 HD1 TYR 75 -17.396 6.535 0.874 381 HD2 TYR 75 HD2 TYR 75 -14.773 7.907 -2.180 382 HE1 TYR 75 HE1 TYR 75 -19.334 7.169 -0.493 383 HE2 TYR 75 HE2 TYR 75 -16.707 8.551 -3.554 384 HH TYR 75 HH TYR 75 -19.076 7.981 -3.779 385 H VAL 76 H VAL 76 -12.697 8.625 2.475 386 HA VAL 76 HA VAL 76 -11.273 6.217 3.208 387 HB VAL 76 HB VAL 76 -10.469 9.126 3.338 388 HG11 VAL 76 1HG1 VAL 76 -8.241 8.392 3.979 389 HG12 VAL 76 2HG1 VAL 76 -8.778 6.714 4.003 390 HG13 VAL 76 3HG1 VAL 76 -9.416 7.858 5.183 391 HG21 VAL 76 1HG2 VAL 76 -9.530 6.828 1.624 392 HG22 VAL 76 2HG2 VAL 76 -8.900 8.473 1.573 393 HG23 VAL 76 3HG2 VAL 76 -10.571 8.155 1.103 394 H SER 77 H SER 77 -11.012 5.392 5.150 395 HA SER 77 HA SER 77 -12.613 6.506 7.296 396 HB2 SER 77 1HB SER 77 -12.742 4.083 6.748 397 HB3 SER 77 2HB SER 77 -11.044 3.911 7.197 398 HG SER 77 HG SER 77 -12.826 5.052 9.042 399 H ALA 78 H ALA 78 -9.226 5.714 6.645 400 HA ALA 78 HA ALA 78 -8.247 7.694 8.418 401 HB1 ALA 78 1HB ALA 78 -7.187 6.236 10.071 402 HB2 ALA 78 2HB ALA 78 -7.975 4.836 9.347 403 HB3 ALA 78 3HB ALA 78 -8.942 6.088 10.125 404 H MET 79 H MET 79 -6.046 8.010 8.155 405 HA MET 79 HA MET 79 -4.326 6.075 6.999 406 HB2 MET 79 1HB MET 79 -3.775 7.304 4.918 407 HB3 MET 79 2HB MET 79 -5.407 6.650 4.916 408 HG2 MET 79 1HG MET 79 -6.377 8.763 5.190 409 HG3 MET 79 2HG MET 79 -4.851 9.496 5.680 410 HE1 MET 79 1HE MET 79 -6.794 7.839 2.646 411 HE2 MET 79 2HE MET 79 -5.269 6.958 2.712 412 HE3 MET 79 3HE MET 79 -5.606 8.038 1.357 413 H SER 80 H SER 80 -2.224 6.588 7.313 414 HA SER 80 HA SER 80 -1.603 9.299 8.285 415 HB2 SER 80 1HB SER 80 -0.551 6.699 9.443 416 HB3 SER 80 2HB SER 80 -0.164 8.323 10.012 417 HG SER 80 HG SER 80 -2.833 7.974 9.896 418 H VAL 81 H VAL 81 0.522 10.045 7.791 419 HA VAL 81 HA VAL 81 1.832 8.483 5.666 420 HB VAL 81 HB VAL 81 1.723 11.499 5.851 421 HG11 VAL 81 1HG1 VAL 81 2.636 9.671 3.636 422 HG12 VAL 81 2HG1 VAL 81 3.668 10.661 4.669 423 HG13 VAL 81 3HG1 VAL 81 2.549 11.430 3.544 424 HG21 VAL 81 1HG2 VAL 81 -0.512 10.670 5.437 425 HG22 VAL 81 2HG2 VAL 81 0.083 9.670 4.111 426 HG23 VAL 81 3HG2 VAL 81 0.139 11.429 3.983 427 H ALA 82 H ALA 82 3.772 7.804 6.358 428 HA ALA 82 HA ALA 82 5.334 9.598 8.081 429 HB1 ALA 82 1HB ALA 82 5.005 6.632 8.509 430 HB2 ALA 82 2HB ALA 82 4.273 7.898 9.497 431 HB3 ALA 82 3HB ALA 82 6.028 7.713 9.454 432 H LYS 83 H LYS 83 6.993 10.093 6.979 433 HA LYS 83 HA LYS 83 8.710 10.087 5.438 434 HB2 LYS 83 1HB LYS 83 9.104 7.326 6.609 435 HB3 LYS 83 2HB LYS 83 10.330 8.277 5.775 436 HG2 LYS 83 1HG LYS 83 10.255 9.964 7.506 437 HG3 LYS 83 2HG LYS 83 8.948 9.104 8.320 438 HD2 LYS 83 1HD LYS 83 10.474 7.181 8.625 439 HD3 LYS 83 2HD LYS 83 11.773 8.145 7.917 440 HE2 LYS 83 1HE LYS 83 10.211 8.838 10.403 441 HE3 LYS 83 2HE LYS 83 11.847 8.184 10.367 442 HZ1 LYS 83 1HZ LYS 83 11.855 10.578 10.671 443 HZ2 LYS 83 2HZ LYS 83 11.005 10.799 9.227 444 HZ3 LYS 83 3HZ LYS 83 12.579 10.166 9.194 445 H GLY 84 H GLY 84 6.384 9.583 4.193 446 HA2 GLY 84 1HA GLY 84 5.770 9.062 2.011 447 HA3 GLY 84 2HA GLY 84 7.217 8.071 1.869 448 H VAL 85 H VAL 85 6.556 6.601 4.324 449 HA VAL 85 HA VAL 85 4.907 4.544 3.308 450 HB VAL 85 HB VAL 85 5.584 5.070 6.207 451 HG11 VAL 85 1HG1 VAL 85 3.814 3.440 5.957 452 HG12 VAL 85 2HG1 VAL 85 5.301 2.643 6.464 453 HG13 VAL 85 3HG1 VAL 85 4.777 2.540 4.785 454 HG21 VAL 85 1HG2 VAL 85 7.470 3.528 5.850 455 HG22 VAL 85 2HG2 VAL 85 7.615 5.002 4.892 456 HG23 VAL 85 3HG2 VAL 85 7.099 3.499 4.127 457 H VAL 86 H VAL 86 2.710 3.993 3.776 458 HA VAL 86 HA VAL 86 1.195 6.018 5.210 459 HB VAL 86 HB VAL 86 -0.553 6.091 3.441 460 HG11 VAL 86 1HG1 VAL 86 0.640 7.655 1.968 461 HG12 VAL 86 2HG1 VAL 86 2.174 7.088 2.632 462 HG13 VAL 86 3HG1 VAL 86 1.017 7.919 3.671 463 HG21 VAL 86 1HG2 VAL 86 0.030 5.453 1.152 464 HG22 VAL 86 2HG2 VAL 86 0.006 4.060 2.233 465 HG23 VAL 86 3HG2 VAL 86 1.545 4.762 1.734 466 H SER 87 H SER 87 0.279 4.909 6.729 467 HA SER 87 HA SER 87 -0.875 2.282 6.134 468 HB2 SER 87 1HB SER 87 -0.451 3.617 8.816 469 HB3 SER 87 2HB SER 87 -0.954 1.947 8.550 470 HG SER 87 HG SER 87 1.413 2.848 7.354 471 H LEU 88 H LEU 88 -2.954 1.946 5.967 472 HA LEU 88 HA LEU 88 -4.832 3.901 7.107 473 HB2 LEU 88 1HB LEU 88 -6.303 3.591 5.145 474 HB3 LEU 88 2HB LEU 88 -4.777 4.367 4.753 475 HG LEU 88 HG LEU 88 -5.046 1.414 4.337 476 HD11 LEU 88 1HD1 LEU 88 -7.048 2.340 3.305 477 HD12 LEU 88 2HD1 LEU 88 -5.895 1.829 2.074 478 HD13 LEU 88 3HD1 LEU 88 -6.071 3.541 2.457 479 HD21 LEU 88 1HD2 LEU 88 -3.482 1.876 2.515 480 HD22 LEU 88 2HD2 LEU 88 -2.861 2.508 4.040 481 HD23 LEU 88 3HD2 LEU 88 -3.577 3.602 2.859 482 H THR 89 H THR 89 -6.753 3.031 7.939 483 HA THR 89 HA THR 89 -6.823 0.098 8.079 484 HB THR 89 HB THR 89 -7.084 1.949 10.460 485 HG1 THR 89 HG1 THR 89 -4.964 0.272 9.544 486 HG21 THR 89 1HG2 THR 89 -7.037 -0.119 11.791 487 HG22 THR 89 2HG2 THR 89 -7.041 -1.073 10.308 488 HG23 THR 89 3HG2 THR 89 -8.434 -0.071 10.718 489 H GLY 90 H GLY 90 -8.809 -0.816 8.601 490 HA2 GLY 90 1HA GLY 90 -11.071 -1.097 8.261 491 HA3 GLY 90 2HA GLY 90 -11.204 0.368 9.217 492 H GLN 91 H GLN 91 -9.926 -0.112 5.954 493 HA GLN 91 HA GLN 91 -11.387 2.235 5.108 494 HB2 GLN 91 1HB GLN 91 -9.019 1.817 4.480 495 HB3 GLN 91 2HB GLN 91 -9.539 0.427 3.537 496 HG2 GLN 91 1HG GLN 91 -9.072 2.472 2.214 497 HG3 GLN 91 2HG GLN 91 -10.694 1.814 1.993 498 HE21 GLN 91 1HE2 GLN 91 -12.434 3.003 2.591 499 HE22 GLN 91 2HE2 GLN 91 -12.348 4.636 3.144 500 H GLU 92 H GLU 92 -13.290 2.212 4.115 501 HA GLU 92 HA GLU 92 -15.216 1.495 3.177 502 HB2 GLU 92 1HB GLU 92 -13.343 -0.388 1.739 503 HB3 GLU 92 2HB GLU 92 -15.021 -0.119 1.296 504 HG2 GLU 92 1HG GLU 92 -12.808 1.908 1.246 505 HG3 GLU 92 2HG GLU 92 -13.596 1.164 -0.138 506 H SER 93 H SER 93 -15.426 -1.446 2.284 507 HA SER 93 HA SER 93 -16.739 -2.442 4.562 508 HB2 SER 93 1HB SER 93 -17.217 -3.104 2.209 509 HB3 SER 93 2HB SER 93 -15.692 -3.987 2.182 510 HG SER 93 HG SER 93 -17.960 -4.490 3.816 511 H LEU 94 H LEU 94 -13.442 -2.238 3.930 512 HA LEU 94 HA LEU 94 -12.658 -4.778 5.058 513 HB2 LEU 94 1HB LEU 94 -10.923 -2.422 4.338 514 HB3 LEU 94 2HB LEU 94 -10.392 -4.069 4.643 515 HG LEU 94 HG LEU 94 -12.061 -3.142 2.299 516 HD11 LEU 94 1HD1 LEU 94 -10.058 -3.818 1.008 517 HD12 LEU 94 2HD1 LEU 94 -9.199 -4.043 2.533 518 HD13 LEU 94 3HD1 LEU 94 -9.783 -2.442 2.077 519 HD21 LEU 94 1HD2 LEU 94 -11.010 -5.889 2.975 520 HD22 LEU 94 2HD2 LEU 94 -11.775 -5.428 1.455 521 HD23 LEU 94 3HD2 LEU 94 -12.701 -5.391 2.955 522 H ASN 95 H ASN 95 -14.192 -3.154 6.778 523 HA ASN 95 HA ASN 95 -12.795 -1.773 8.730 524 HB2 ASN 95 1HB ASN 95 -15.231 -1.876 8.674 525 HB3 ASN 95 2HB ASN 95 -15.185 -3.595 9.046 526 HD21 ASN 95 1HD2 ASN 95 -14.646 -0.380 10.303 527 HD22 ASN 95 2HD2 ASN 95 -14.699 -0.820 11.974 528 H GLY 96 H GLY 96 -11.588 -2.322 10.476 529 HA2 GLY 96 1HA GLY 96 -10.420 -3.695 11.949 530 HA3 GLY 96 2HA GLY 96 -11.144 -5.097 11.171 531 H LEU 97 H LEU 97 -10.234 -3.917 8.509 532 HA LEU 97 HA LEU 97 -7.709 -5.334 8.522 533 HB2 LEU 97 1HB LEU 97 -9.387 -5.793 6.800 534 HB3 LEU 97 2HB LEU 97 -9.337 -4.118 6.291 535 HG LEU 97 HG LEU 97 -6.833 -5.756 6.137 536 HD11 LEU 97 1HD1 LEU 97 -8.570 -7.139 5.108 537 HD12 LEU 97 2HD1 LEU 97 -7.472 -6.483 3.895 538 HD13 LEU 97 3HD1 LEU 97 -9.072 -5.772 4.114 539 HD21 LEU 97 1HD2 LEU 97 -7.984 -3.563 4.415 540 HD22 LEU 97 2HD2 LEU 97 -6.392 -4.301 4.243 541 HD23 LEU 97 3HD2 LEU 97 -6.771 -3.341 5.672 542 H SER 98 H SER 98 -5.731 -4.446 8.209 543 HA SER 98 HA SER 98 -5.630 -1.528 7.829 544 HB2 SER 98 1HB SER 98 -4.909 -2.399 10.105 545 HB3 SER 98 2HB SER 98 -3.564 -3.187 9.283 546 HG SER 98 HG SER 98 -2.603 -1.344 9.548 547 H VAL 99 H VAL 99 -4.363 -0.755 6.245 548 HA VAL 99 HA VAL 99 -2.822 -2.710 4.657 549 HB VAL 99 HB VAL 99 -3.888 -0.056 3.680 550 HG11 VAL 99 1HG1 VAL 99 -2.809 -2.446 2.197 551 HG12 VAL 99 2HG1 VAL 99 -1.984 -0.906 2.440 552 HG13 VAL 99 3HG1 VAL 99 -3.449 -0.975 1.461 553 HG21 VAL 99 1HG2 VAL 99 -5.784 -1.467 4.259 554 HG22 VAL 99 2HG2 VAL 99 -5.112 -2.783 3.297 555 HG23 VAL 99 3HG2 VAL 99 -5.640 -1.296 2.509 556 H VAL 100 H VAL 100 -0.655 -2.382 4.539 557 HA VAL 100 HA VAL 100 0.330 0.247 5.416 558 HB VAL 100 HB VAL 100 1.725 -2.409 5.808 559 HG11 VAL 100 1HG1 VAL 100 3.287 -1.112 7.188 560 HG12 VAL 100 2HG1 VAL 100 2.428 0.367 6.760 561 HG13 VAL 100 3HG1 VAL 100 3.271 -0.552 5.516 562 HG21 VAL 100 1HG2 VAL 100 -0.209 -2.252 7.266 563 HG22 VAL 100 2HG2 VAL 100 0.299 -0.651 7.803 564 HG23 VAL 100 3HG2 VAL 100 1.273 -2.064 8.203 565 H MET 101 H MET 101 0.927 1.270 3.662 566 HA MET 101 HA MET 101 2.289 -0.187 1.497 567 HB2 MET 101 1HB MET 101 0.457 1.284 0.800 568 HB3 MET 101 2HB MET 101 1.223 2.645 1.602 569 HG2 MET 101 1HG MET 101 1.664 2.883 -0.697 570 HG3 MET 101 2HG MET 101 3.166 2.351 0.049 571 HE1 MET 101 1HE MET 101 0.413 -0.229 -2.595 572 HE2 MET 101 2HE MET 101 0.205 1.495 -2.289 573 HE3 MET 101 3HE MET 101 -0.088 0.329 -0.999 574 H THR 102 H THR 102 4.416 -0.365 1.794 575 HA THR 102 HA THR 102 5.873 1.949 2.899 576 HB THR 102 HB THR 102 6.968 -0.849 2.708 577 HG1 THR 102 HG1 THR 102 5.747 0.243 5.033 578 HG21 THR 102 1HG2 THR 102 7.630 1.473 4.518 579 HG22 THR 102 2HG2 THR 102 8.562 0.975 3.105 580 HG23 THR 102 3HG2 THR 102 8.438 -0.094 4.502 581 HA PRO 103 HA PRO 103 7.119 1.907 -1.507 582 HB2 PRO 103 1HB PRO 103 7.507 4.583 -1.693 583 HB3 PRO 103 2HB PRO 103 5.913 3.830 -1.854 584 HG2 PRO 103 1HG PRO 103 7.126 5.199 0.515 585 HG3 PRO 103 2HG PRO 103 5.469 5.298 -0.107 586 HD2 PRO 103 1HD PRO 103 6.193 3.753 2.018 587 HD3 PRO 103 2HD PRO 103 4.835 3.354 0.939 588 H GLY 104 H GLY 104 9.127 1.501 -2.114 589 HA2 GLY 104 1HA GLY 104 11.301 3.182 -1.091 590 HA3 GLY 104 2HA GLY 104 11.475 1.427 -1.039 591 H TRP 105 H TRP 105 9.972 3.505 -3.450 592 HA TRP 105 HA TRP 105 11.269 1.977 -5.537 593 HB2 TRP 105 1HB TRP 105 8.778 2.672 -5.450 594 HB3 TRP 105 2HB TRP 105 9.352 4.250 -5.979 595 HD1 TRP 105 HD1 TRP 105 9.740 0.571 -7.175 596 HE1 TRP 105 HE1 TRP 105 9.633 0.554 -9.743 597 HE3 TRP 105 HE3 TRP 105 9.266 5.593 -7.996 598 HZ2 TRP 105 HZ2 TRP 105 9.375 2.419 -11.835 599 HZ3 TRP 105 HZ3 TRP 105 9.090 6.390 -10.315 600 HH2 TRP 105 HH2 TRP 105 9.145 4.836 -12.193 601 H ASP 106 H ASP 106 13.153 3.319 -4.243 602 HA ASP 106 HA ASP 106 13.717 5.824 -5.602 603 HB2 ASP 106 1HB ASP 106 15.360 4.246 -3.607 604 HB3 ASP 106 2HB ASP 106 15.744 5.855 -4.203 605 H ASN 107 H ASN 107 13.545 4.387 -7.620 606 HA ASN 107 HA ASN 107 15.327 2.325 -8.179 607 HB2 ASN 107 1HB ASN 107 13.189 3.108 -9.434 608 HB3 ASN 107 2HB ASN 107 14.287 4.151 -10.330 609 HD21 ASN 107 1HD2 ASN 107 12.681 1.983 -11.329 610 HD22 ASN 107 2HD2 ASN 107 13.771 0.821 -12.008 611 H ALA 108 H ALA 108 15.710 5.789 -8.528 612 HA ALA 108 HA ALA 108 18.115 5.533 -10.112 613 HB1 ALA 108 1HB ALA 108 16.494 7.373 -10.464 614 HB2 ALA 108 2HB ALA 108 18.137 7.935 -10.156 615 HB3 ALA 108 3HB ALA 108 16.926 8.008 -8.877 616 H ASN 109 H ASN 109 17.337 5.518 -6.813 617 HA ASN 109 HA ASN 109 19.967 6.555 -6.028 618 HB2 ASN 109 1HB ASN 109 17.586 5.846 -4.297 619 HB3 ASN 109 2HB ASN 109 19.074 6.594 -3.734 620 HD21 ASN 109 1HD2 ASN 109 16.312 7.545 -3.598 621 HD22 ASN 109 2HD2 ASN 109 16.292 9.075 -4.399 622 H GLY 110 H GLY 110 18.065 3.628 -6.129 623 HA2 GLY 110 1HA GLY 110 20.120 1.849 -6.188 624 HA3 GLY 110 2HA GLY 110 19.902 2.137 -4.471 625 H VAL 111 H VAL 111 17.706 1.770 -3.607 626 HA VAL 111 HA VAL 111 16.851 -0.847 -4.352 627 HB VAL 111 HB VAL 111 15.159 -0.588 -2.566 628 HG11 VAL 111 1HG1 VAL 111 16.728 -0.323 -0.697 629 HG12 VAL 111 2HG1 VAL 111 17.924 0.350 -1.805 630 HG13 VAL 111 3HG1 VAL 111 17.403 -1.325 -1.982 631 HG21 VAL 111 1HG2 VAL 111 15.140 1.464 -1.210 632 HG22 VAL 111 2HG2 VAL 111 14.616 1.758 -2.869 633 HG23 VAL 111 3HG2 VAL 111 16.243 2.221 -2.363 634 H THR 112 H THR 112 14.279 -1.191 -4.419 635 HA THR 112 HA THR 112 12.765 0.837 -5.679 636 HB THR 112 HB THR 112 14.205 0.360 -7.587 637 HG1 THR 112 HG1 THR 112 12.362 -0.524 -8.991 638 HG21 THR 112 1HG2 THR 112 14.812 -1.947 -7.043 639 HG22 THR 112 2HG2 THR 112 14.189 -1.820 -8.687 640 HG23 THR 112 3HG2 THR 112 13.166 -2.467 -7.406 641 H GLY 113 H GLY 113 10.615 0.362 -5.655 642 HA2 GLY 113 1HA GLY 113 8.959 -1.462 -6.102 643 HA3 GLY 113 2HA GLY 113 9.872 -2.395 -4.928 644 H TRP 114 H TRP 114 7.219 -2.104 -4.584 645 HA TRP 114 HA TRP 114 7.042 -0.308 -2.251 646 HB2 TRP 114 1HB TRP 114 4.851 -1.249 -4.119 647 HB3 TRP 114 2HB TRP 114 4.550 -0.423 -2.595 648 HD1 TRP 114 HD1 TRP 114 4.846 2.191 -2.546 649 HE1 TRP 114 HE1 TRP 114 5.168 3.958 -4.394 650 HE3 TRP 114 HE3 TRP 114 5.982 -0.915 -6.445 651 HZ2 TRP 114 HZ2 TRP 114 5.807 4.018 -7.143 652 HZ3 TRP 114 HZ3 TRP 114 6.423 0.077 -8.653 653 HH2 TRP 114 HH2 TRP 114 6.336 2.491 -8.994 654 H ALA 115 H ALA 115 6.737 -1.349 -0.320 655 HA ALA 115 HA ALA 115 6.049 -4.188 -0.412 656 HB1 ALA 115 1HB ALA 115 6.671 -4.307 1.878 657 HB2 ALA 115 2HB ALA 115 6.645 -2.557 2.043 658 HB3 ALA 115 3HB ALA 115 7.899 -3.328 1.072 659 H ARG 116 H ARG 116 3.988 -4.691 -0.460 660 HA ARG 116 HA ARG 116 2.057 -2.887 0.828 661 HB2 ARG 116 1HB ARG 116 1.633 -4.867 -1.419 662 HB3 ARG 116 2HB ARG 116 0.355 -3.930 -0.661 663 HG2 ARG 116 1HG ARG 116 0.759 -2.662 -2.507 664 HG3 ARG 116 2HG ARG 116 1.866 -1.902 -1.365 665 HD2 ARG 116 1HD ARG 116 3.088 -2.191 -3.367 666 HD3 ARG 116 2HD ARG 116 3.654 -3.448 -2.272 667 HE ARG 116 HE ARG 116 1.531 -4.395 -3.911 668 HH11 ARG 116 1HH1 ARG 116 4.977 -3.733 -3.920 669 HH12 ARG 116 2HH1 ARG 116 5.287 -4.744 -5.296 670 HH21 ARG 116 1HH2 ARG 116 1.953 -5.744 -5.685 671 HH22 ARG 116 2HH2 ARG 116 3.582 -5.919 -6.290 672 H ASN 117 H ASN 117 0.757 -3.630 2.404 673 HA ASN 117 HA ASN 117 0.709 -6.504 2.956 674 HB2 ASN 117 1HB ASN 117 1.535 -4.375 4.934 675 HB3 ASN 117 2HB ASN 117 1.082 -6.005 5.396 676 HD21 ASN 117 1HD2 ASN 117 3.506 -4.012 3.933 677 HD22 ASN 117 2HD2 ASN 117 4.750 -5.214 3.877 678 H CYS 118 H CYS 118 -1.370 -7.042 3.063 679 HA CYS 118 HA CYS 118 -3.255 -5.155 4.303 680 HB2 CYS 118 1HB CYS 118 -3.803 -7.653 2.671 681 HB3 CYS 118 2HB CYS 118 -5.023 -6.549 3.305 682 H ASN 119 H ASN 119 -3.638 -5.500 6.416 683 HA ASN 119 HA ASN 119 -3.248 -8.248 7.418 684 HB2 ASN 119 1HB ASN 119 -2.793 -5.615 8.830 685 HB3 ASN 119 2HB ASN 119 -2.691 -7.190 9.608 686 HD21 ASN 119 1HD2 ASN 119 -1.460 -8.419 7.215 687 HD22 ASN 119 2HD2 ASN 119 0.179 -7.867 7.211 688 H ILE 120 H ILE 120 -5.213 -9.080 7.513 689 HA ILE 120 HA ILE 120 -6.981 -7.897 9.513 690 HB ILE 120 HB ILE 120 -8.033 -7.336 7.427 691 HG12 ILE 120 1HG1 ILE 120 -10.151 -8.691 7.554 692 HG13 ILE 120 2HG1 ILE 120 -9.359 -9.679 8.770 693 HG21 ILE 120 1HG2 ILE 120 -8.684 -9.063 5.782 694 HG22 ILE 120 2HG2 ILE 120 -7.722 -10.231 6.688 695 HG23 ILE 120 3HG2 ILE 120 -6.942 -8.840 5.933 696 HD11 ILE 120 1HD1 ILE 120 -9.124 -7.718 10.203 697 HD12 ILE 120 2HD1 ILE 120 -10.807 -8.016 9.778 698 HD13 ILE 120 3HD1 ILE 120 -9.909 -6.730 8.973 699 H GLN 121 H GLN 121 -6.799 -9.344 11.160 700 HA GLN 121 HA GLN 121 -5.794 -11.977 10.627 701 HB2 GLN 121 1HB GLN 121 -5.034 -10.680 12.569 702 HB3 GLN 121 2HB GLN 121 -6.659 -10.708 13.235 703 HG2 GLN 121 1HG GLN 121 -5.272 -12.333 14.349 704 HG3 GLN 121 2HG GLN 121 -6.534 -13.145 13.429 705 HE21 GLN 121 1HE2 GLN 121 -3.667 -11.759 11.975 706 HE22 GLN 121 2HE2 GLN 121 -2.950 -13.263 11.518 707 H SER 122 H SER 122 -8.922 -10.653 11.591 708 HA SER 122 HA SER 122 -9.939 -13.283 12.260 709 HB2 SER 122 1HB SER 122 -12.035 -11.913 12.783 710 HB3 SER 122 2HB SER 122 -10.601 -11.557 13.748 711 HG SER 122 HG SER 122 -11.775 -10.058 11.661 712 H ASP 123 H ASP 123 -9.868 -11.310 9.484 713 HA ASP 123 HA ASP 123 -12.143 -12.755 8.326 714 HB2 ASP 123 1HB ASP 123 -11.749 -9.759 8.227 715 HB3 ASP 123 2HB ASP 123 -12.927 -10.643 7.265 716 H SER 124 H SER 124 -10.474 -13.959 7.229 717 HA SER 124 HA SER 124 -8.583 -12.839 5.495 718 HB2 SER 124 1HB SER 124 -10.002 -15.500 5.201 719 HB3 SER 124 2HB SER 124 -8.456 -15.052 4.482 720 HG SER 124 HG SER 124 -8.098 -16.231 6.364 721 H ALA 125 H ALA 125 -12.009 -13.219 5.155 722 HA ALA 125 HA ALA 125 -12.271 -13.120 2.367 723 HB1 ALA 125 1HB ALA 125 -14.120 -13.650 3.881 724 HB2 ALA 125 2HB ALA 125 -14.538 -12.341 2.774 725 HB3 ALA 125 3HB ALA 125 -14.126 -11.981 4.452 726 H LEU 126 H LEU 126 -11.972 -10.551 4.773 727 HA LEU 126 HA LEU 126 -12.288 -8.405 2.950 728 HB2 LEU 126 1HB LEU 126 -10.874 -8.493 5.616 729 HB3 LEU 126 2HB LEU 126 -11.279 -7.029 4.741 730 HG LEU 126 HG LEU 126 -13.241 -9.002 5.919 731 HD11 LEU 126 1HD1 LEU 126 -12.137 -7.644 7.600 732 HD12 LEU 126 2HD1 LEU 126 -13.821 -7.156 7.413 733 HD13 LEU 126 3HD1 LEU 126 -12.534 -6.180 6.702 734 HD21 LEU 126 1HD2 LEU 126 -13.733 -6.418 4.447 735 HD22 LEU 126 2HD2 LEU 126 -14.957 -7.387 5.262 736 HD23 LEU 126 3HD2 LEU 126 -14.110 -8.038 3.860 737 H GLN 127 H GLN 127 -9.585 -10.332 4.059 738 HA GLN 127 HA GLN 127 -7.522 -8.767 2.959 739 HB2 GLN 127 1HB GLN 127 -7.059 -10.582 4.547 740 HB3 GLN 127 2HB GLN 127 -7.604 -11.762 3.362 741 HG2 GLN 127 1HG GLN 127 -5.789 -11.103 1.867 742 HG3 GLN 127 2HG GLN 127 -5.235 -9.923 3.054 743 HE21 GLN 127 1HE2 GLN 127 -6.448 -13.119 3.827 744 HE22 GLN 127 2HE2 GLN 127 -4.948 -13.758 4.397 745 H GLN 128 H GLN 128 -9.564 -11.308 1.626 746 HA GLN 128 HA GLN 128 -8.222 -11.827 -0.743 747 HB2 GLN 128 1HB GLN 128 -11.187 -11.819 -0.170 748 HB3 GLN 128 2HB GLN 128 -10.491 -12.432 -1.665 749 HG2 GLN 128 1HG GLN 128 -9.201 -14.071 -0.355 750 HG3 GLN 128 2HG GLN 128 -9.983 -13.478 1.109 751 HE21 GLN 128 1HE2 GLN 128 -11.623 -13.765 -1.959 752 HE22 GLN 128 2HE2 GLN 128 -12.656 -15.072 -1.508 753 H ALA 129 H ALA 129 -10.468 -9.222 0.005 754 HA ALA 129 HA ALA 129 -10.543 -8.197 -2.654 755 HB1 ALA 129 1HB ALA 129 -11.628 -6.242 -1.636 756 HB2 ALA 129 2HB ALA 129 -11.274 -6.894 -0.037 757 HB3 ALA 129 3HB ALA 129 -12.365 -7.757 -1.120 758 H CYS 130 H CYS 130 -8.776 -7.345 0.289 759 HA CYS 130 HA CYS 130 -7.515 -5.059 -0.830 760 HB2 CYS 130 1HB CYS 130 -7.832 -5.425 1.608 761 HB3 CYS 130 2HB CYS 130 -6.629 -6.712 1.544 762 H GLU 131 H GLU 131 -6.384 -8.372 -0.216 763 HA GLU 131 HA GLU 131 -3.766 -8.005 -1.172 764 HB2 GLU 131 1HB GLU 131 -3.562 -10.392 -1.167 765 HB3 GLU 131 2HB GLU 131 -4.538 -9.937 0.226 766 HG2 GLU 131 1HG GLU 131 -6.558 -10.571 -0.940 767 HG3 GLU 131 2HG GLU 131 -5.633 -10.944 -2.393 768 H ASP 132 H ASP 132 -6.774 -8.494 -2.796 769 HA ASP 132 HA ASP 132 -5.690 -9.377 -5.274 770 HB2 ASP 132 1HB ASP 132 -8.067 -9.707 -4.576 771 HB3 ASP 132 2HB ASP 132 -8.325 -7.979 -4.794 772 H VAL 133 H VAL 133 -6.847 -6.184 -4.160 773 HA VAL 133 HA VAL 133 -5.977 -4.939 -6.627 774 HB VAL 133 HB VAL 133 -7.119 -3.708 -4.113 775 HG11 VAL 133 1HG1 VAL 133 -7.460 -1.700 -5.444 776 HG12 VAL 133 2HG1 VAL 133 -6.688 -2.471 -6.831 777 HG13 VAL 133 3HG1 VAL 133 -5.748 -2.116 -5.381 778 HG21 VAL 133 1HG2 VAL 133 -8.710 -5.159 -5.212 779 HG22 VAL 133 2HG2 VAL 133 -8.388 -4.384 -6.761 780 HG23 VAL 133 3HG2 VAL 133 -9.166 -3.475 -5.468 781 H PHE 134 H PHE 134 -5.098 -4.756 -3.216 782 HA PHE 134 HA PHE 134 -2.779 -3.111 -3.751 783 HB2 PHE 134 1HB PHE 134 -3.978 -4.192 -1.201 784 HB3 PHE 134 2HB PHE 134 -2.439 -3.340 -1.237 785 HD1 PHE 134 HD1 PHE 134 -6.061 -3.014 -1.537 786 HD2 PHE 134 HD2 PHE 134 -2.336 -0.965 -1.768 787 HE1 PHE 134 HE1 PHE 134 -7.242 -0.859 -1.445 788 HE2 PHE 134 HE2 PHE 134 -3.511 1.193 -1.673 789 HZ PHE 134 HZ PHE 134 -5.968 1.248 -1.514 790 H ARG 135 H ARG 135 -2.949 -5.747 -4.875 791 HA ARG 135 HA ARG 135 -1.892 -7.849 -3.475 792 HB2 ARG 135 1HB ARG 135 -1.201 -8.768 -5.671 793 HB3 ARG 135 2HB ARG 135 -2.832 -8.107 -5.704 794 HG2 ARG 135 1HG ARG 135 -2.180 -6.246 -6.953 795 HG3 ARG 135 2HG ARG 135 -0.472 -6.478 -6.576 796 HD2 ARG 135 1HD ARG 135 -2.166 -8.283 -8.304 797 HD3 ARG 135 2HD ARG 135 -0.978 -7.116 -8.884 798 HE ARG 135 HE ARG 135 -0.459 -9.707 -7.701 799 HH11 ARG 135 1HH1 ARG 135 0.881 -6.588 -8.593 800 HH12 ARG 135 2HH1 ARG 135 2.516 -7.165 -8.622 801 HH21 ARG 135 1HH2 ARG 135 1.700 -10.455 -7.740 802 HH22 ARG 135 2HH2 ARG 135 2.989 -9.354 -8.142 803 H PHE 136 H PHE 136 0.106 -8.691 -3.139 804 HA PHE 136 HA PHE 136 2.288 -6.738 -3.347 805 HB2 PHE 136 1HB PHE 136 3.108 -7.910 -1.187 806 HB3 PHE 136 2HB PHE 136 1.820 -6.720 -1.077 807 HD1 PHE 136 HD1 PHE 136 -0.477 -7.405 -0.611 808 HD2 PHE 136 HD2 PHE 136 2.698 -10.241 -0.729 809 HE1 PHE 136 HE1 PHE 136 -1.900 -9.043 0.550 810 HE2 PHE 136 HE2 PHE 136 1.280 -11.880 0.431 811 HZ PHE 136 HZ PHE 136 -1.022 -11.281 1.070 812 H ASP 137 H ASP 137 3.944 -7.387 -4.484 813 HA ASP 137 HA ASP 137 4.381 -10.119 -5.181 814 HB2 ASP 137 1HB ASP 137 6.235 -7.733 -5.450 815 HB3 ASP 137 2HB ASP 137 6.485 -9.310 -6.188 816 H ASP 138 H ASP 138 5.336 -11.592 -3.989 817 HA ASP 138 HA ASP 138 6.236 -11.097 -1.375 818 HB2 ASP 138 1HB ASP 138 5.306 -13.261 -2.231 819 HB3 ASP 138 2HB ASP 138 6.821 -13.524 -3.087 820 H ALA 139 H ALA 139 7.780 -10.663 -4.336 821 HA ALA 139 HA ALA 139 10.478 -11.130 -3.598 822 HB1 ALA 139 1HB ALA 139 9.349 -9.308 -5.723 823 HB2 ALA 139 2HB ALA 139 9.777 -11.007 -5.933 824 HB3 ALA 139 3HB ALA 139 11.033 -9.817 -5.588 825 H ASN 140 H ASN 140 8.238 -8.625 -2.889 826 HA ASN 140 HA ASN 140 10.399 -6.845 -2.002 827 HB2 ASN 140 1HB ASN 140 7.449 -6.330 -2.450 828 HB3 ASN 140 2HB ASN 140 8.555 -5.148 -1.757 829 HD21 ASN 140 1HD2 ASN 140 10.143 -4.217 -3.073 830 HD22 ASN 140 2HD2 ASN 140 10.045 -4.285 -4.800 831 H LEU 141 H LEU 141 9.007 -9.349 -0.769 832 HA LEU 141 HA LEU 141 8.763 -8.195 1.917 833 HB2 LEU 141 1HB LEU 141 6.967 -10.319 0.743 834 HB3 LEU 141 2HB LEU 141 6.943 -9.785 2.411 835 HG LEU 141 HG LEU 141 6.251 -8.069 0.023 836 HD11 LEU 141 1HD1 LEU 141 4.516 -9.397 2.098 837 HD12 LEU 141 2HD1 LEU 141 4.583 -9.779 0.377 838 HD13 LEU 141 3HD1 LEU 141 3.957 -8.218 0.913 839 HD21 LEU 141 1HD2 LEU 141 5.428 -6.484 1.718 840 HD22 LEU 141 2HD2 LEU 141 7.166 -6.742 1.839 841 HD23 LEU 141 3HD2 LEU 141 6.078 -7.521 2.988 842 H VAL 142 H VAL 142 10.726 -8.936 2.641 843 HA VAL 142 HA VAL 142 11.786 -11.501 2.239 844 HB VAL 142 HB VAL 142 12.175 -9.693 4.633 845 HG11 VAL 142 1HG1 VAL 142 12.966 -11.979 5.010 846 HG12 VAL 142 2HG1 VAL 142 14.299 -10.831 4.928 847 HG13 VAL 142 3HG1 VAL 142 13.951 -11.873 3.550 848 HG21 VAL 142 1HG2 VAL 142 14.192 -8.911 3.430 849 HG22 VAL 142 2HG2 VAL 142 12.687 -8.479 2.623 850 HG23 VAL 142 3HG2 VAL 142 13.658 -9.818 2.016 851 HA PRO 143 HA PRO 143 9.052 -13.940 4.808 852 HB2 PRO 143 1HB PRO 143 10.615 -16.165 4.988 853 HB3 PRO 143 2HB PRO 143 9.651 -15.776 3.561 854 HG2 PRO 143 1HG PRO 143 12.569 -15.357 4.053 855 HG3 PRO 143 2HG PRO 143 11.748 -15.917 2.584 856 HD2 PRO 143 1HD PRO 143 12.625 -13.370 2.896 857 HD3 PRO 143 2HD PRO 143 11.197 -13.776 1.933 858 H ARG 144 H ARG 144 8.908 -14.499 6.992 859 HA ARG 144 HA ARG 144 11.097 -13.331 8.556 860 HB2 ARG 144 1HB ARG 144 8.152 -13.491 9.172 861 HB3 ARG 144 2HB ARG 144 9.364 -12.911 10.299 862 HG2 ARG 144 1HG ARG 144 9.999 -11.203 8.556 863 HG3 ARG 144 2HG ARG 144 8.542 -11.687 7.688 864 HD2 ARG 144 1HD ARG 144 8.094 -9.737 9.056 865 HD3 ARG 144 2HD ARG 144 7.196 -11.129 9.660 866 HE ARG 144 HE ARG 144 9.346 -11.244 11.207 867 HH11 ARG 144 1HH1 ARG 144 7.399 -8.498 10.287 868 HH12 ARG 144 2HH1 ARG 144 7.721 -7.606 11.743 869 HH21 ARG 144 1HH2 ARG 144 9.774 -10.096 13.143 870 HH22 ARG 144 2HH2 ARG 144 9.095 -8.511 13.359 871 H GLY 145 H GLY 145 12.369 -14.862 9.340 872 HA2 GLY 145 1HA GLY 145 11.389 -17.346 10.398 873 HA3 GLY 145 2HA GLY 145 13.024 -16.715 10.562 874 H SER 146 H SER 146 13.292 -17.065 12.767 875 HA SER 146 HA SER 146 11.323 -16.654 14.710 876 HB2 SER 146 1HB SER 146 14.328 -16.498 15.059 877 HB3 SER 146 2HB SER 146 13.138 -16.846 16.317 878 HG SER 146 HG SER 146 12.555 -18.641 14.686 879 H GLY 147 H GLY 147 10.846 -14.945 16.067 880 HA2 GLY 147 1HA GLY 147 11.339 -12.714 16.902 881 HA3 GLY 147 2HA GLY 147 12.085 -12.361 15.350 882 H LEU 148 H LEU 148 9.032 -14.052 15.739 883 HA LEU 148 HA LEU 148 7.732 -12.314 13.903 884 HB2 LEU 148 1HB LEU 148 6.677 -14.461 15.743 885 HB3 LEU 148 2HB LEU 148 5.635 -13.539 14.682 886 HG LEU 148 HG LEU 148 6.029 -15.603 13.608 887 HD11 LEU 148 1HD1 LEU 148 7.169 -14.990 11.555 888 HD12 LEU 148 2HD1 LEU 148 7.889 -13.594 12.355 889 HD13 LEU 148 3HD1 LEU 148 6.143 -13.675 12.125 890 HD21 LEU 148 1HD2 LEU 148 7.939 -16.353 14.895 891 HD22 LEU 148 2HD2 LEU 148 8.973 -15.180 14.077 892 HD23 LEU 148 3HD2 LEU 148 8.257 -16.510 13.166 893 H GLU 149 H GLU 149 7.039 -10.326 14.340 894 HA GLU 149 HA GLU 149 6.668 -9.428 17.045 895 HB2 GLU 149 1HB GLU 149 6.118 -7.258 16.049 896 HB3 GLU 149 2HB GLU 149 7.591 -7.910 15.345 897 HG2 GLU 149 1HG GLU 149 6.362 -8.609 13.372 898 HG3 GLU 149 2HG GLU 149 4.862 -8.012 14.080 899 H HIS 150 H HIS 150 4.728 -10.798 14.594 900 HA HIS 150 HA HIS 150 2.228 -10.005 15.874 901 HB2 HIS 150 1HB HIS 150 2.779 -11.783 13.485 902 HB3 HIS 150 2HB HIS 150 1.172 -11.422 14.099 903 HD1 HIS 150 HD1 HIS 150 2.107 -10.729 11.206 904 HD2 HIS 150 HD2 HIS 150 2.082 -8.084 14.415 905 HE1 HIS 150 HE1 HIS 150 1.993 -8.435 10.189 906 HE2 HIS 150 HE2 HIS 150 2.140 -6.849 12.142 907 H HIS 151 H HIS 151 0.663 -11.777 16.401 908 HA HIS 151 HA HIS 151 2.072 -14.112 17.507 909 HB2 HIS 151 1HB HIS 151 -0.538 -12.839 18.364 910 HB3 HIS 151 2HB HIS 151 0.076 -14.360 19.004 911 HD1 HIS 151 HD1 HIS 151 -0.167 -11.053 20.025 912 HD2 HIS 151 HD2 HIS 151 3.004 -13.735 19.930 913 HE1 HIS 151 HE1 HIS 151 1.506 -10.179 21.681 914 HE2 HIS 151 HE2 HIS 151 3.335 -11.910 21.731 915 H HIS 152 H HIS 152 1.341 -16.157 16.988 916 HA HIS 152 HA HIS 152 -0.749 -16.281 14.928 917 HB2 HIS 152 1HB HIS 152 1.503 -16.130 13.865 918 HB3 HIS 152 2HB HIS 152 1.969 -17.599 14.709 919 HD1 HIS 152 HD1 HIS 152 1.758 -19.639 13.345 920 HD2 HIS 152 HD2 HIS 152 -0.885 -16.684 12.096 921 HE1 HIS 152 HE1 HIS 152 0.622 -20.568 11.303 922 HE2 HIS 152 HE2 HIS 152 -0.899 -18.727 10.507 923 H HIS 153 H HIS 153 -1.899 -17.089 16.892 924 HA HIS 153 HA HIS 153 -1.472 -19.992 17.054 925 HB2 HIS 153 1HB HIS 153 -2.330 -19.983 19.371 926 HB3 HIS 153 2HB HIS 153 -0.827 -19.095 19.198 927 HD1 HIS 153 HD1 HIS 153 -0.793 -16.756 20.067 928 HD2 HIS 153 HD2 HIS 153 -4.657 -18.253 19.709 929 HE1 HIS 153 HE1 HIS 153 -2.282 -15.074 21.197 930 HE2 HIS 153 HE2 HIS 153 -4.625 -15.946 20.883 931 H HIS 154 H HIS 154 -3.102 -18.554 15.214 932 HA HIS 154 HA HIS 154 -5.814 -19.334 16.030 933 HB2 HIS 154 1HB HIS 154 -4.810 -17.729 13.672 934 HB3 HIS 154 2HB HIS 154 -6.475 -18.272 13.819 935 HD1 HIS 154 HD1 HIS 154 -8.011 -16.927 15.317 936 HD2 HIS 154 HD2 HIS 154 -4.042 -15.725 15.533 937 HE1 HIS 154 HE1 HIS 154 -8.025 -14.787 16.635 938 HE2 HIS 154 HE2 HIS 154 -5.635 -13.989 16.593 939 H HIS 155 H HIS 155 -4.130 -19.447 12.917 940 HA HIS 155 HA HIS 155 -4.201 -22.335 12.867 941 HB2 HIS 155 1HB HIS 155 -6.428 -21.693 11.975 942 HB3 HIS 155 2HB HIS 155 -5.636 -20.716 10.744 943 HD1 HIS 155 HD1 HIS 155 -6.098 -24.320 11.775 944 HD2 HIS 155 HD2 HIS 155 -4.810 -22.097 8.509 945 HE1 HIS 155 HE1 HIS 155 -5.835 -25.969 9.896 946 HE2 HIS 155 HE2 HIS 155 -5.242 -24.570 7.890 Start of MODEL 15 1 H1 MET 24 1H MET 24 -17.473 -11.894 -6.781 2 H2 MET 24 2H MET 24 -16.770 -10.585 -7.584 3 H3 MET 24 3H MET 24 -16.938 -12.067 -8.372 4 HA MET 24 HA MET 24 -18.580 -10.497 -9.139 5 HB2 MET 24 1HB MET 24 -19.724 -12.748 -7.474 6 HB3 MET 24 2HB MET 24 -20.595 -11.880 -8.727 7 HG2 MET 24 1HG MET 24 -18.162 -13.605 -9.107 8 HG3 MET 24 2HG MET 24 -19.817 -14.007 -9.551 9 HE1 MET 24 1HE MET 24 -20.834 -11.165 -10.730 10 HE2 MET 24 2HE MET 24 -21.188 -12.741 -11.437 11 HE3 MET 24 3HE MET 24 -20.525 -11.452 -12.442 12 H GLU 25 H GLU 25 -19.399 -11.443 -5.797 13 HA GLU 25 HA GLU 25 -21.413 -9.624 -5.355 14 HB2 GLU 25 1HB GLU 25 -20.970 -11.453 -3.838 15 HB3 GLU 25 2HB GLU 25 -19.421 -10.757 -3.394 16 HG2 GLU 25 1HG GLU 25 -20.554 -8.865 -2.361 17 HG3 GLU 25 2HG GLU 25 -22.115 -9.539 -2.826 18 H ASN 26 H ASN 26 -18.029 -9.206 -4.288 19 HA ASN 26 HA ASN 26 -18.630 -6.437 -3.638 20 HB2 ASN 26 1HB ASN 26 -16.276 -8.233 -3.106 21 HB3 ASN 26 2HB ASN 26 -16.195 -6.502 -2.805 22 HD21 ASN 26 1HD2 ASN 26 -16.005 -8.721 -0.955 23 HD22 ASN 26 2HD2 ASN 26 -17.256 -8.477 0.215 24 H TYR 27 H TYR 27 -18.570 -7.095 -6.465 25 HA TYR 27 HA TYR 27 -16.054 -6.461 -7.594 26 HB2 TYR 27 1HB TYR 27 -17.788 -7.649 -8.856 27 HB3 TYR 27 2HB TYR 27 -18.799 -6.210 -8.830 28 HD1 TYR 27 HD1 TYR 27 -15.169 -6.719 -9.584 29 HD2 TYR 27 HD2 TYR 27 -18.954 -5.362 -10.980 30 HE1 TYR 27 HE1 TYR 27 -14.121 -5.952 -11.672 31 HE2 TYR 27 HE2 TYR 27 -17.913 -4.592 -13.068 32 HH TYR 27 HH TYR 27 -15.687 -3.903 -13.866 33 H LEU 28 H LEU 28 -18.916 -4.460 -6.927 34 HA LEU 28 HA LEU 28 -17.730 -2.084 -7.992 35 HB2 LEU 28 1HB LEU 28 -20.076 -2.443 -6.122 36 HB3 LEU 28 2HB LEU 28 -19.607 -0.916 -6.840 37 HG LEU 28 HG LEU 28 -20.548 -3.351 -8.364 38 HD11 LEU 28 1HD1 LEU 28 -22.335 -2.278 -7.097 39 HD12 LEU 28 2HD1 LEU 28 -22.534 -2.016 -8.831 40 HD13 LEU 28 3HD1 LEU 28 -21.911 -0.721 -7.807 41 HD21 LEU 28 1HD2 LEU 28 -18.968 -2.082 -9.677 42 HD22 LEU 28 2HD2 LEU 28 -19.806 -0.579 -9.291 43 HD23 LEU 28 3HD2 LEU 28 -20.598 -1.800 -10.286 44 H ARG 29 H ARG 29 -17.909 -3.622 -4.873 45 HA ARG 29 HA ARG 29 -16.800 -1.527 -3.334 46 HB2 ARG 29 1HB ARG 29 -17.969 -3.528 -2.410 47 HB3 ARG 29 2HB ARG 29 -16.587 -4.509 -2.872 48 HG2 ARG 29 1HG ARG 29 -16.366 -4.063 -0.568 49 HG3 ARG 29 2HG ARG 29 -15.186 -3.039 -1.390 50 HD2 ARG 29 1HD ARG 29 -16.285 -1.751 0.313 51 HD3 ARG 29 2HD ARG 29 -16.795 -1.162 -1.265 52 HE ARG 29 HE ARG 29 -18.584 -3.121 -0.229 53 HH11 ARG 29 1HH1 ARG 29 -17.684 0.258 -0.017 54 HH12 ARG 29 2HH1 ARG 29 -19.241 0.757 0.580 55 HH21 ARG 29 1HH2 ARG 29 -20.619 -2.472 0.562 56 HH22 ARG 29 2HH2 ARG 29 -20.914 -0.797 0.902 57 H LYS 30 H LYS 30 -15.418 -4.138 -5.242 58 HA LYS 30 HA LYS 30 -12.720 -3.721 -4.530 59 HB2 LYS 30 1HB LYS 30 -13.984 -4.910 -6.998 60 HB3 LYS 30 2HB LYS 30 -12.243 -4.831 -6.767 61 HG2 LYS 30 1HG LYS 30 -14.181 -6.268 -4.965 62 HG3 LYS 30 2HG LYS 30 -13.158 -7.020 -6.186 63 HD2 LYS 30 1HD LYS 30 -11.169 -6.206 -4.991 64 HD3 LYS 30 2HD LYS 30 -12.213 -5.507 -3.752 65 HE2 LYS 30 1HE LYS 30 -11.310 -7.678 -3.058 66 HE3 LYS 30 2HE LYS 30 -13.067 -7.714 -3.197 67 HZ1 LYS 30 1HZ LYS 30 -12.888 -8.828 -5.288 68 HZ2 LYS 30 2HZ LYS 30 -11.953 -9.675 -4.164 69 HZ3 LYS 30 3HZ LYS 30 -11.202 -8.670 -5.303 70 H ALA 31 H ALA 31 -14.655 -2.492 -7.289 71 HA ALA 31 HA ALA 31 -12.745 -0.887 -8.435 72 HB1 ALA 31 1HB ALA 31 -14.959 -1.337 -9.386 73 HB2 ALA 31 2HB ALA 31 -14.570 0.383 -9.381 74 HB3 ALA 31 3HB ALA 31 -15.679 -0.272 -8.177 75 H ALA 32 H ALA 32 -14.643 -0.278 -5.541 76 HA ALA 32 HA ALA 32 -14.010 2.472 -5.285 77 HB1 ALA 32 1HB ALA 32 -14.672 0.480 -3.115 78 HB2 ALA 32 2HB ALA 32 -15.845 1.415 -4.044 79 HB3 ALA 32 3HB ALA 32 -14.717 2.236 -2.964 80 H LEU 33 H LEU 33 -12.562 -0.462 -3.960 81 HA LEU 33 HA LEU 33 -10.391 0.784 -2.648 82 HB2 LEU 33 1HB LEU 33 -10.723 -1.999 -3.771 83 HB3 LEU 33 2HB LEU 33 -9.351 -1.502 -2.794 84 HG LEU 33 HG LEU 33 -12.219 -1.464 -1.845 85 HD11 LEU 33 1HD1 LEU 33 -11.505 -3.746 -2.287 86 HD12 LEU 33 2HD1 LEU 33 -11.620 -3.457 -0.553 87 HD13 LEU 33 3HD1 LEU 33 -10.041 -3.491 -1.338 88 HD21 LEU 33 1HD2 LEU 33 -11.174 -1.251 0.378 89 HD22 LEU 33 2HD2 LEU 33 -10.823 0.123 -0.670 90 HD23 LEU 33 3HD2 LEU 33 -9.596 -1.113 -0.398 91 H THR 34 H THR 34 -10.852 -0.481 -5.894 92 HA THR 34 HA THR 34 -8.201 -0.211 -6.798 93 HB THR 34 HB THR 34 -10.752 -0.039 -8.417 94 HG1 THR 34 HG1 THR 34 -10.537 -1.991 -7.180 95 HG21 THR 34 1HG2 THR 34 -9.345 -0.805 -10.282 96 HG22 THR 34 2HG2 THR 34 -7.926 -0.724 -9.239 97 HG23 THR 34 3HG2 THR 34 -8.798 0.750 -9.656 98 H ASP 35 H ASP 35 -10.969 1.991 -6.850 99 HA ASP 35 HA ASP 35 -9.727 4.125 -8.177 100 HB2 ASP 35 1HB ASP 35 -12.137 4.087 -7.810 101 HB3 ASP 35 2HB ASP 35 -11.897 4.174 -6.069 102 H MET 36 H MET 36 -9.823 3.231 -4.764 103 HA MET 36 HA MET 36 -8.419 5.460 -3.770 104 HB2 MET 36 1HB MET 36 -9.548 3.970 -2.237 105 HB3 MET 36 2HB MET 36 -8.536 2.621 -2.733 106 HG2 MET 36 1HG MET 36 -7.860 3.536 -0.571 107 HG3 MET 36 2HG MET 36 -6.589 3.686 -1.786 108 HE1 MET 36 1HE MET 36 -6.395 5.308 0.882 109 HE2 MET 36 2HE MET 36 -5.943 6.901 0.277 110 HE3 MET 36 3HE MET 36 -5.242 5.454 -0.444 111 H LEU 37 H LEU 37 -7.267 2.287 -4.873 112 HA LEU 37 HA LEU 37 -4.522 2.721 -4.544 113 HB2 LEU 37 1HB LEU 37 -5.451 0.529 -5.028 114 HB3 LEU 37 2HB LEU 37 -6.011 1.084 -6.602 115 HG LEU 37 HG LEU 37 -3.524 1.497 -7.131 116 HD11 LEU 37 1HD1 LEU 37 -2.687 1.308 -4.846 117 HD12 LEU 37 2HD1 LEU 37 -1.949 0.103 -5.901 118 HD13 LEU 37 3HD1 LEU 37 -3.229 -0.369 -4.783 119 HD21 LEU 37 1HD2 LEU 37 -3.226 -0.818 -7.821 120 HD22 LEU 37 2HD2 LEU 37 -4.874 -0.270 -8.134 121 HD23 LEU 37 3HD2 LEU 37 -4.539 -1.315 -6.754 122 H GLN 38 H GLN 38 -6.650 3.395 -7.292 123 HA GLN 38 HA GLN 38 -4.622 4.425 -8.965 124 HB2 GLN 38 1HB GLN 38 -7.616 4.636 -8.987 125 HB3 GLN 38 2HB GLN 38 -6.630 5.500 -10.162 126 HG2 GLN 38 1HG GLN 38 -6.588 2.522 -9.719 127 HG3 GLN 38 2HG GLN 38 -7.452 3.351 -11.015 128 HE21 GLN 38 1HE2 GLN 38 -5.238 1.382 -11.088 129 HE22 GLN 38 2HE2 GLN 38 -3.989 2.136 -12.018 130 H THR 39 H THR 39 -6.479 5.837 -6.392 131 HA THR 39 HA THR 39 -5.760 8.548 -7.017 132 HB THR 39 HB THR 39 -6.668 7.381 -4.375 133 HG1 THR 39 HG1 THR 39 -8.137 7.113 -6.207 134 HG21 THR 39 1HG2 THR 39 -6.700 10.228 -5.396 135 HG22 THR 39 2HG2 THR 39 -5.625 9.592 -4.151 136 HG23 THR 39 3HG2 THR 39 -7.362 9.675 -3.855 137 H PHE 40 H PHE 40 -4.311 5.901 -5.293 138 HA PHE 40 HA PHE 40 -2.356 7.356 -3.858 139 HB2 PHE 40 1HB PHE 40 -2.839 5.072 -3.245 140 HB3 PHE 40 2HB PHE 40 -2.392 4.499 -4.847 141 HD1 PHE 40 HD1 PHE 40 -0.471 3.279 -4.835 142 HD2 PHE 40 HD2 PHE 40 -0.750 6.665 -2.270 143 HE1 PHE 40 HE1 PHE 40 1.829 2.882 -4.072 144 HE2 PHE 40 HE2 PHE 40 1.553 6.276 -1.501 145 HZ PHE 40 HZ PHE 40 2.850 4.383 -2.400 146 H VAL 41 H VAL 41 -2.504 6.134 -7.144 147 HA VAL 41 HA VAL 41 0.183 6.344 -7.836 148 HB VAL 41 HB VAL 41 -2.196 6.742 -9.650 149 HG11 VAL 41 1HG1 VAL 41 0.666 6.083 -10.314 150 HG12 VAL 41 2HG1 VAL 41 -0.138 7.621 -10.628 151 HG13 VAL 41 3HG1 VAL 41 -0.674 6.160 -11.461 152 HG21 VAL 41 1HG2 VAL 41 -0.576 4.288 -8.993 153 HG22 VAL 41 2HG2 VAL 41 -1.841 4.378 -10.220 154 HG23 VAL 41 3HG2 VAL 41 -2.245 4.595 -8.516 155 HA PRO 42 HA PRO 42 -0.561 10.981 -9.188 156 HB2 PRO 42 1HB PRO 42 -2.827 11.690 -7.422 157 HB3 PRO 42 2HB PRO 42 -2.489 12.195 -9.081 158 HG2 PRO 42 1HG PRO 42 -4.415 10.429 -8.541 159 HG3 PRO 42 2HG PRO 42 -3.410 10.287 -9.995 160 HD2 PRO 42 1HD PRO 42 -3.262 8.760 -7.430 161 HD3 PRO 42 2HD PRO 42 -3.037 8.198 -9.095 162 H TYR 43 H TYR 43 -1.236 9.741 -5.924 163 HA TYR 43 HA TYR 43 -0.005 11.955 -4.590 164 HB2 TYR 43 1HB TYR 43 -0.893 9.204 -3.751 165 HB3 TYR 43 2HB TYR 43 0.121 10.170 -2.678 166 HD1 TYR 43 HD1 TYR 43 -1.126 11.050 -0.958 167 HD2 TYR 43 HD2 TYR 43 -2.823 10.982 -4.859 168 HE1 TYR 43 HE1 TYR 43 -3.115 12.217 -0.108 169 HE2 TYR 43 HE2 TYR 43 -4.816 12.150 -4.019 170 HH TYR 43 HH TYR 43 -5.989 12.559 -1.980 171 H ARG 44 H ARG 44 1.056 9.030 -6.080 172 HA ARG 44 HA ARG 44 3.566 8.677 -4.958 173 HB2 ARG 44 1HB ARG 44 2.550 8.203 -7.745 174 HB3 ARG 44 2HB ARG 44 4.215 7.854 -7.304 175 HG2 ARG 44 1HG ARG 44 1.854 6.706 -5.841 176 HG3 ARG 44 2HG ARG 44 2.627 5.915 -7.221 177 HD2 ARG 44 1HD ARG 44 3.968 6.669 -4.623 178 HD3 ARG 44 2HD ARG 44 3.521 5.037 -5.125 179 HE ARG 44 HE ARG 44 5.128 5.889 -7.138 180 HH11 ARG 44 1HH1 ARG 44 5.511 5.759 -3.660 181 HH12 ARG 44 2HH1 ARG 44 7.232 5.588 -3.725 182 HH21 ARG 44 1HH2 ARG 44 7.403 5.685 -7.237 183 HH22 ARG 44 2HH2 ARG 44 8.313 5.540 -5.767 184 H THR 45 H THR 45 2.634 10.783 -7.673 185 HA THR 45 HA THR 45 5.011 11.928 -8.284 186 HB THR 45 HB THR 45 2.469 13.522 -7.933 187 HG1 THR 45 HG1 THR 45 3.294 11.726 -9.986 188 HG21 THR 45 1HG2 THR 45 4.459 14.847 -8.485 189 HG22 THR 45 2HG2 THR 45 3.318 14.815 -9.829 190 HG23 THR 45 3HG2 THR 45 4.766 13.809 -9.877 191 H ALA 46 H ALA 46 2.903 12.957 -5.595 192 HA ALA 46 HA ALA 46 4.587 15.023 -4.664 193 HB1 ALA 46 1HB ALA 46 2.233 14.837 -4.017 194 HB2 ALA 46 2HB ALA 46 3.281 14.900 -2.600 195 HB3 ALA 46 3HB ALA 46 2.594 13.361 -3.121 196 H VAL 47 H VAL 47 4.350 11.620 -3.942 197 HA VAL 47 HA VAL 47 6.180 11.598 -1.759 198 HB VAL 47 HB VAL 47 5.236 9.339 -3.530 199 HG11 VAL 47 1HG1 VAL 47 6.736 9.219 -0.916 200 HG12 VAL 47 2HG1 VAL 47 7.358 8.749 -2.497 201 HG13 VAL 47 3HG1 VAL 47 6.038 7.837 -1.761 202 HG21 VAL 47 1HG2 VAL 47 3.439 10.381 -2.274 203 HG22 VAL 47 2HG2 VAL 47 4.364 10.224 -0.780 204 HG23 VAL 47 3HG2 VAL 47 3.792 8.782 -1.620 205 H GLU 48 H GLU 48 6.530 10.847 -5.209 206 HA GLU 48 HA GLU 48 9.238 10.005 -4.979 207 HB2 GLU 48 1HB GLU 48 7.791 10.960 -7.460 208 HB3 GLU 48 2HB GLU 48 9.270 10.011 -7.415 209 HG2 GLU 48 1HG GLU 48 8.012 8.187 -6.308 210 HG3 GLU 48 2HG GLU 48 6.539 9.138 -6.499 211 H LEU 49 H LEU 49 7.676 13.080 -5.629 212 HA LEU 49 HA LEU 49 9.956 14.468 -6.521 213 HB2 LEU 49 1HB LEU 49 7.259 15.169 -5.598 214 HB3 LEU 49 2HB LEU 49 8.468 16.405 -5.300 215 HG LEU 49 HG LEU 49 7.268 16.754 -7.424 216 HD11 LEU 49 1HD1 LEU 49 9.212 17.150 -8.806 217 HD12 LEU 49 2HD1 LEU 49 10.174 16.059 -7.814 218 HD13 LEU 49 3HD1 LEU 49 9.565 17.566 -7.129 219 HD21 LEU 49 1HD2 LEU 49 8.566 14.168 -8.275 220 HD22 LEU 49 2HD2 LEU 49 7.668 15.270 -9.319 221 HD23 LEU 49 3HD2 LEU 49 6.840 14.422 -8.011 222 H CYS 50 H CYS 50 8.586 14.083 -3.251 223 HA CYS 50 HA CYS 50 10.701 15.616 -2.067 224 HB2 CYS 50 1HB CYS 50 9.834 14.682 0.094 225 HB3 CYS 50 2HB CYS 50 8.636 15.532 -0.872 226 H ALA 51 H ALA 51 10.038 12.175 -2.504 227 HA ALA 51 HA ALA 51 12.238 11.048 -1.296 228 HB1 ALA 51 1HB ALA 51 11.162 10.185 -3.975 229 HB2 ALA 51 2HB ALA 51 10.418 9.794 -2.426 230 HB3 ALA 51 3HB ALA 51 12.032 9.193 -2.805 231 H LEU 52 H LEU 52 12.123 12.702 -4.407 232 HA LEU 52 HA LEU 52 14.831 12.003 -5.083 233 HB2 LEU 52 1HB LEU 52 12.898 13.997 -6.269 234 HB3 LEU 52 2HB LEU 52 14.499 13.700 -6.916 235 HG LEU 52 HG LEU 52 12.375 11.567 -6.676 236 HD11 LEU 52 1HD1 LEU 52 13.158 13.226 -9.067 237 HD12 LEU 52 2HD1 LEU 52 11.621 13.295 -8.205 238 HD13 LEU 52 3HD1 LEU 52 12.072 11.837 -9.087 239 HD21 LEU 52 1HD2 LEU 52 13.818 10.360 -8.256 240 HD22 LEU 52 2HD2 LEU 52 14.642 10.694 -6.734 241 HD23 LEU 52 3HD2 LEU 52 14.998 11.666 -8.162 242 H GLU 53 H GLU 53 13.303 14.493 -3.288 243 HA GLU 53 HA GLU 53 15.317 16.487 -3.542 244 HB2 GLU 53 1HB GLU 53 12.995 16.988 -2.882 245 HB3 GLU 53 2HB GLU 53 13.232 16.102 -1.384 246 HG2 GLU 53 1HG GLU 53 13.377 18.494 -1.024 247 HG3 GLU 53 2HG GLU 53 14.916 17.710 -0.683 248 H HIS 54 H HIS 54 14.698 13.895 -1.222 249 HA HIS 54 HA HIS 54 17.184 14.639 0.186 250 HB2 HIS 54 1HB HIS 54 15.089 14.584 1.549 251 HB3 HIS 54 2HB HIS 54 14.936 12.869 1.185 252 HD1 HIS 54 HD1 HIS 54 15.842 11.396 2.973 253 HD2 HIS 54 HD2 HIS 54 17.747 15.094 2.876 254 HE1 HIS 54 HE1 HIS 54 17.472 11.372 4.882 255 HE2 HIS 54 HE2 HIS 54 18.500 13.669 4.896 256 H GLY 55 H GLY 55 15.824 12.380 -1.925 257 HA2 GLY 55 1HA GLY 55 16.844 10.654 -3.040 258 HA3 GLY 55 2HA GLY 55 18.201 10.749 -1.923 259 H GLY 56 H GLY 56 16.527 10.541 0.470 260 HA2 GLY 56 1HA GLY 56 15.134 7.995 0.024 261 HA3 GLY 56 2HA GLY 56 15.737 8.556 1.576 262 H LEU 57 H LEU 57 13.226 7.583 1.353 263 HA LEU 57 HA LEU 57 11.235 9.580 0.907 264 HB2 LEU 57 1HB LEU 57 11.122 6.897 2.281 265 HB3 LEU 57 2HB LEU 57 9.722 7.902 1.961 266 HG LEU 57 HG LEU 57 11.522 6.923 -0.243 267 HD11 LEU 57 1HD1 LEU 57 9.870 5.152 -0.629 268 HD12 LEU 57 2HD1 LEU 57 9.043 5.614 0.860 269 HD13 LEU 57 3HD1 LEU 57 10.683 4.972 0.924 270 HD21 LEU 57 1HD2 LEU 57 8.669 7.892 -0.217 271 HD22 LEU 57 2HD2 LEU 57 9.578 7.371 -1.634 272 HD23 LEU 57 3HD2 LEU 57 10.066 8.820 -0.756 273 H ASP 58 H ASP 58 13.449 9.403 3.251 274 HA ASP 58 HA ASP 58 12.300 9.376 5.728 275 HB2 ASP 58 1HB ASP 58 14.425 11.387 5.035 276 HB3 ASP 58 2HB ASP 58 14.217 10.483 6.531 277 H THR 59 H THR 59 12.471 12.086 3.507 278 HA THR 59 HA THR 59 11.282 13.892 5.419 279 HB THR 59 HB THR 59 11.398 15.492 3.415 280 HG1 THR 59 HG1 THR 59 11.805 14.435 1.611 281 HG21 THR 59 1HG2 THR 59 13.017 15.538 5.229 282 HG22 THR 59 2HG2 THR 59 13.843 15.760 3.687 283 HG23 THR 59 3HG2 THR 59 13.902 14.198 4.502 284 H CYS 60 H CYS 60 9.961 11.598 3.427 285 HA CYS 60 HA CYS 60 7.803 13.256 2.391 286 HB2 CYS 60 1HB CYS 60 8.463 10.338 1.979 287 HB3 CYS 60 2HB CYS 60 7.135 11.185 1.191 288 H ASP 61 H ASP 61 7.158 13.602 4.738 289 HA ASP 61 HA ASP 61 5.404 11.429 5.658 290 HB2 ASP 61 1HB ASP 61 6.408 13.893 7.103 291 HB3 ASP 61 2HB ASP 61 5.267 12.737 7.786 292 H GLY 62 H GLY 62 3.239 11.933 6.321 293 HA2 GLY 62 1HA GLY 62 1.913 13.628 4.439 294 HA3 GLY 62 2HA GLY 62 1.152 12.732 5.749 295 H GLY 63 H GLY 63 2.310 15.761 4.677 296 HA2 GLY 63 1HA GLY 63 1.211 17.660 5.893 297 HA3 GLY 63 2HA GLY 63 1.853 16.917 7.354 298 H SER 64 H SER 64 4.076 16.463 4.922 299 HA SER 64 HA SER 64 5.330 19.071 5.168 300 HB2 SER 64 1HB SER 64 6.690 16.526 6.090 301 HB3 SER 64 2HB SER 64 7.465 18.105 5.957 302 HG SER 64 HG SER 64 5.183 18.288 7.390 303 H ASN 65 H ASN 65 7.192 19.316 3.735 304 HA ASN 65 HA ASN 65 8.281 19.135 1.756 305 HB2 ASN 65 1HB ASN 65 8.013 16.291 2.610 306 HB3 ASN 65 2HB ASN 65 8.602 16.627 0.984 307 HD21 ASN 65 1HD2 ASN 65 10.613 17.572 0.708 308 HD22 ASN 65 2HD2 ASN 65 11.747 17.750 2.009 309 H GLY 66 H GLY 66 5.673 19.812 1.393 310 HA2 GLY 66 1HA GLY 66 4.384 20.174 -0.499 311 HA3 GLY 66 2HA GLY 66 5.344 18.968 -1.345 312 H ILE 67 H ILE 67 4.559 17.318 1.267 313 HA ILE 67 HA ILE 67 2.201 16.158 0.015 314 HB ILE 67 HB ILE 67 3.799 15.153 2.378 315 HG12 ILE 67 1HG1 ILE 67 3.895 14.373 -0.544 316 HG13 ILE 67 2HG1 ILE 67 5.171 15.184 0.361 317 HG21 ILE 67 1HG2 ILE 67 2.635 13.042 2.001 318 HG22 ILE 67 2HG2 ILE 67 1.734 13.766 0.670 319 HG23 ILE 67 3HG2 ILE 67 1.484 14.342 2.318 320 HD11 ILE 67 1HD1 ILE 67 4.155 12.400 0.864 321 HD12 ILE 67 2HD1 ILE 67 5.441 13.211 1.758 322 HD13 ILE 67 3HD1 ILE 67 5.659 12.827 0.049 323 HA PRO 68 HA PRO 68 -0.205 18.464 2.970 324 HB2 PRO 68 1HB PRO 68 -2.640 17.574 2.184 325 HB3 PRO 68 2HB PRO 68 -1.723 18.779 1.272 326 HG2 PRO 68 1HG PRO 68 -2.024 15.847 0.771 327 HG3 PRO 68 2HG PRO 68 -2.013 17.193 -0.391 328 HD2 PRO 68 1HD PRO 68 0.150 15.582 0.089 329 HD3 PRO 68 2HD PRO 68 0.287 17.269 -0.458 330 H SER 69 H SER 69 -1.211 18.050 4.910 331 HA SER 69 HA SER 69 -0.892 15.739 6.330 332 HB2 SER 69 1HB SER 69 -3.187 17.703 6.575 333 HB3 SER 69 2HB SER 69 -2.638 16.594 7.834 334 HG SER 69 HG SER 69 -1.503 18.966 6.917 335 HA PRO 70 HA PRO 70 -3.119 12.573 4.390 336 HB2 PRO 70 1HB PRO 70 -4.224 11.402 6.722 337 HB3 PRO 70 2HB PRO 70 -2.731 10.943 5.903 338 HG2 PRO 70 1HG PRO 70 -3.131 12.641 8.295 339 HG3 PRO 70 2HG PRO 70 -1.756 11.615 7.857 340 HD2 PRO 70 1HD PRO 70 -1.628 14.298 7.693 341 HD3 PRO 70 2HD PRO 70 -0.799 13.251 6.520 342 H THR 71 H THR 71 -4.971 12.621 3.375 343 HA THR 71 HA THR 71 -7.145 14.211 4.565 344 HB THR 71 HB THR 71 -6.514 13.918 1.620 345 HG1 THR 71 HG1 THR 71 -5.093 15.234 3.387 346 HG21 THR 71 1HG2 THR 71 -7.947 15.866 1.353 347 HG22 THR 71 2HG2 THR 71 -8.212 15.933 3.093 348 HG23 THR 71 3HG2 THR 71 -8.826 14.568 2.161 349 H THR 72 H THR 72 -9.128 13.249 4.688 350 HA THR 72 HA THR 72 -9.356 10.613 3.446 351 HB THR 72 HB THR 72 -11.334 10.384 5.046 352 HG1 THR 72 HG1 THR 72 -11.777 12.062 6.252 353 HG21 THR 72 1HG2 THR 72 -9.173 9.284 5.422 354 HG22 THR 72 2HG2 THR 72 -9.903 9.804 6.940 355 HG23 THR 72 3HG2 THR 72 -8.578 10.733 6.234 356 H THR 73 H THR 73 -10.612 10.366 1.790 357 HA THR 73 HA THR 73 -12.320 12.455 0.814 358 HB THR 73 HB THR 73 -12.714 11.011 -1.088 359 HG1 THR 73 HG1 THR 73 -11.723 8.852 -1.021 360 HG21 THR 73 1HG2 THR 73 -10.551 12.165 -1.044 361 HG22 THR 73 2HG2 THR 73 -10.423 10.604 -1.855 362 HG23 THR 73 3HG2 THR 73 -9.833 10.790 -0.203 363 H ARG 74 H ARG 74 -14.573 11.527 -0.076 364 HA ARG 74 HA ARG 74 -16.246 11.100 2.085 365 HB2 ARG 74 1HB ARG 74 -17.131 11.846 -0.030 366 HB3 ARG 74 2HB ARG 74 -16.615 10.364 -0.822 367 HG2 ARG 74 1HG ARG 74 -18.204 9.106 0.600 368 HG3 ARG 74 2HG ARG 74 -18.776 10.638 1.255 369 HD2 ARG 74 1HD ARG 74 -19.380 11.337 -1.054 370 HD3 ARG 74 2HD ARG 74 -18.920 9.733 -1.620 371 HE ARG 74 HE ARG 74 -21.029 10.094 0.401 372 HH11 ARG 74 1HH1 ARG 74 -19.967 8.835 -2.709 373 HH12 ARG 74 2HH1 ARG 74 -21.421 7.920 -2.959 374 HH21 ARG 74 1HH2 ARG 74 -22.934 8.892 0.034 375 HH22 ARG 74 2HH2 ARG 74 -23.094 7.952 -1.414 376 H TYR 75 H TYR 75 -14.578 8.713 0.062 377 HA TYR 75 HA TYR 75 -15.952 6.547 1.423 378 HB2 TYR 75 1HB TYR 75 -13.887 6.356 -0.774 379 HB3 TYR 75 2HB TYR 75 -15.040 5.118 -0.269 380 HD1 TYR 75 HD1 TYR 75 -17.433 5.358 -0.814 381 HD2 TYR 75 HD2 TYR 75 -14.547 8.133 -2.234 382 HE1 TYR 75 HE1 TYR 75 -19.064 6.213 -2.440 383 HE2 TYR 75 HE2 TYR 75 -16.165 8.999 -3.863 384 HH TYR 75 HH TYR 75 -18.200 8.245 -5.013 385 H VAL 76 H VAL 76 -12.868 8.160 1.518 386 HA VAL 76 HA VAL 76 -11.485 5.858 2.581 387 HB VAL 76 HB VAL 76 -10.600 8.729 2.295 388 HG11 VAL 76 1HG1 VAL 76 -9.516 7.644 4.239 389 HG12 VAL 76 2HG1 VAL 76 -8.378 8.017 2.946 390 HG13 VAL 76 3HG1 VAL 76 -8.944 6.361 3.171 391 HG21 VAL 76 1HG2 VAL 76 -9.817 6.213 0.831 392 HG22 VAL 76 2HG2 VAL 76 -9.126 7.813 0.561 393 HG23 VAL 76 3HG2 VAL 76 -10.826 7.513 0.195 394 H SER 77 H SER 77 -11.336 5.274 4.579 395 HA SER 77 HA SER 77 -12.874 6.718 6.551 396 HB2 SER 77 1HB SER 77 -13.095 4.258 6.296 397 HB3 SER 77 2HB SER 77 -11.407 4.070 6.780 398 HG SER 77 HG SER 77 -12.493 3.805 8.632 399 H ALA 78 H ALA 78 -9.506 5.682 6.117 400 HA ALA 78 HA ALA 78 -8.523 7.766 7.805 401 HB1 ALA 78 1HB ALA 78 -8.336 4.924 8.797 402 HB2 ALA 78 2HB ALA 78 -9.266 6.226 9.539 403 HB3 ALA 78 3HB ALA 78 -7.505 6.310 9.499 404 H MET 79 H MET 79 -6.305 8.032 7.608 405 HA MET 79 HA MET 79 -4.699 6.056 6.271 406 HB2 MET 79 1HB MET 79 -4.019 7.524 4.405 407 HB3 MET 79 2HB MET 79 -5.717 7.075 4.319 408 HG2 MET 79 1HG MET 79 -6.449 9.201 4.809 409 HG3 MET 79 2HG MET 79 -4.943 9.649 5.609 410 HE1 MET 79 1HE MET 79 -5.393 9.263 1.029 411 HE2 MET 79 2HE MET 79 -6.736 9.058 2.153 412 HE3 MET 79 3HE MET 79 -5.420 7.884 2.130 413 H SER 80 H SER 80 -2.512 6.419 6.476 414 HA SER 80 HA SER 80 -1.629 8.893 7.764 415 HB2 SER 80 1HB SER 80 -2.019 7.299 9.605 416 HB3 SER 80 2HB SER 80 -0.995 6.112 8.803 417 HG SER 80 HG SER 80 0.719 7.108 9.511 418 H VAL 81 H VAL 81 0.311 9.572 7.041 419 HA VAL 81 HA VAL 81 1.734 7.800 5.161 420 HB VAL 81 HB VAL 81 1.755 10.820 5.136 421 HG11 VAL 81 1HG1 VAL 81 2.733 8.781 3.142 422 HG12 VAL 81 2HG1 VAL 81 3.720 9.868 4.121 423 HG13 VAL 81 3HG1 VAL 81 2.674 10.520 2.861 424 HG21 VAL 81 1HG2 VAL 81 -0.488 10.123 4.641 425 HG22 VAL 81 2HG2 VAL 81 0.097 8.927 3.487 426 HG23 VAL 81 3HG2 VAL 81 0.290 10.646 3.146 427 H ALA 82 H ALA 82 3.744 7.226 5.775 428 HA ALA 82 HA ALA 82 5.227 8.985 7.571 429 HB1 ALA 82 1HB ALA 82 4.061 7.386 9.020 430 HB2 ALA 82 2HB ALA 82 5.808 7.134 9.046 431 HB3 ALA 82 3HB ALA 82 4.774 6.052 8.112 432 H LYS 83 H LYS 83 6.899 9.391 6.448 433 HA LYS 83 HA LYS 83 8.785 9.217 5.110 434 HB2 LYS 83 1HB LYS 83 8.941 6.357 6.093 435 HB3 LYS 83 2HB LYS 83 10.268 7.383 5.565 436 HG2 LYS 83 1HG LYS 83 8.622 7.722 8.064 437 HG3 LYS 83 2HG LYS 83 10.298 7.177 7.965 438 HD2 LYS 83 1HD LYS 83 10.993 9.318 7.126 439 HD3 LYS 83 2HD LYS 83 9.323 9.871 7.032 440 HE2 LYS 83 1HE LYS 83 9.175 9.554 9.512 441 HE3 LYS 83 2HE LYS 83 10.913 9.246 9.509 442 HZ1 LYS 83 1HZ LYS 83 9.576 11.736 8.586 443 HZ2 LYS 83 2HZ LYS 83 11.245 11.442 8.526 444 HZ3 LYS 83 3HZ LYS 83 10.460 11.545 10.019 445 H GLY 84 H GLY 84 6.515 8.948 3.695 446 HA2 GLY 84 1HA GLY 84 5.963 8.426 1.507 447 HA3 GLY 84 2HA GLY 84 7.320 7.309 1.456 448 H VAL 85 H VAL 85 6.309 6.029 3.957 449 HA VAL 85 HA VAL 85 4.676 4.024 2.769 450 HB VAL 85 HB VAL 85 5.217 4.487 5.705 451 HG11 VAL 85 1HG1 VAL 85 4.773 2.078 5.924 452 HG12 VAL 85 2HG1 VAL 85 4.327 2.023 4.219 453 HG13 VAL 85 3HG1 VAL 85 3.366 2.973 5.354 454 HG21 VAL 85 1HG2 VAL 85 6.751 2.915 3.646 455 HG22 VAL 85 2HG2 VAL 85 7.000 2.774 5.387 456 HG23 VAL 85 3HG2 VAL 85 7.315 4.306 4.572 457 H VAL 86 H VAL 86 2.438 3.624 3.000 458 HA VAL 86 HA VAL 86 0.957 5.732 4.376 459 HB VAL 86 HB VAL 86 -0.712 5.810 2.568 460 HG11 VAL 86 1HG1 VAL 86 2.076 6.449 1.619 461 HG12 VAL 86 2HG1 VAL 86 1.087 7.468 2.661 462 HG13 VAL 86 3HG1 VAL 86 0.579 7.148 1.004 463 HG21 VAL 86 1HG2 VAL 86 -0.334 3.620 1.573 464 HG22 VAL 86 2HG2 VAL 86 1.250 4.144 1.002 465 HG23 VAL 86 3HG2 VAL 86 -0.210 4.896 0.361 466 H SER 87 H SER 87 -0.163 4.831 5.876 467 HA SER 87 HA SER 87 -1.124 2.090 5.548 468 HB2 SER 87 1HB SER 87 -1.095 3.780 8.056 469 HB3 SER 87 2HB SER 87 -1.336 2.036 7.950 470 HG SER 87 HG SER 87 0.745 1.756 7.795 471 H LEU 88 H LEU 88 -3.154 1.604 5.257 472 HA LEU 88 HA LEU 88 -5.219 3.671 5.661 473 HB2 LEU 88 1HB LEU 88 -5.341 1.187 3.926 474 HB3 LEU 88 2HB LEU 88 -6.601 2.392 4.082 475 HG LEU 88 HG LEU 88 -5.611 2.812 2.005 476 HD11 LEU 88 1HD1 LEU 88 -4.270 4.718 3.905 477 HD12 LEU 88 2HD1 LEU 88 -5.933 4.834 3.331 478 HD13 LEU 88 3HD1 LEU 88 -4.594 4.993 2.195 479 HD21 LEU 88 1HD2 LEU 88 -3.621 1.426 2.261 480 HD22 LEU 88 2HD2 LEU 88 -2.893 2.651 3.301 481 HD23 LEU 88 3HD2 LEU 88 -3.217 3.012 1.605 482 H THR 89 H THR 89 -7.080 3.078 6.874 483 HA THR 89 HA THR 89 -6.953 0.424 8.119 484 HB THR 89 HB THR 89 -7.414 2.948 9.718 485 HG1 THR 89 HG1 THR 89 -5.077 1.511 9.073 486 HG21 THR 89 1HG2 THR 89 -8.414 0.903 10.652 487 HG22 THR 89 2HG2 THR 89 -7.069 1.473 11.640 488 HG23 THR 89 3HG2 THR 89 -6.847 0.098 10.559 489 H GLY 90 H GLY 90 -8.857 -0.506 8.561 490 HA2 GLY 90 1HA GLY 90 -11.099 -0.979 8.235 491 HA3 GLY 90 2HA GLY 90 -11.320 0.567 9.035 492 H GLN 91 H GLN 91 -10.101 -0.276 5.805 493 HA GLN 91 HA GLN 91 -11.763 1.875 4.746 494 HB2 GLN 91 1HB GLN 91 -9.328 1.737 4.240 495 HB3 GLN 91 2HB GLN 91 -9.623 0.231 3.380 496 HG2 GLN 91 1HG GLN 91 -9.382 2.166 1.894 497 HG3 GLN 91 2HG GLN 91 -10.953 1.375 1.742 498 HE21 GLN 91 1HE2 GLN 91 -12.777 2.475 2.277 499 HE22 GLN 91 2HE2 GLN 91 -12.803 4.149 2.705 500 H GLU 92 H GLU 92 -13.626 1.479 3.735 501 HA GLU 92 HA GLU 92 -15.344 0.417 2.715 502 HB2 GLU 92 1HB GLU 92 -13.003 -0.960 1.418 503 HB3 GLU 92 2HB GLU 92 -14.660 -1.253 0.924 504 HG2 GLU 92 1HG GLU 92 -13.192 1.360 0.824 505 HG3 GLU 92 2HG GLU 92 -13.674 0.357 -0.538 506 H SER 93 H SER 93 -14.739 -2.563 1.864 507 HA SER 93 HA SER 93 -16.155 -3.780 3.987 508 HB2 SER 93 1HB SER 93 -16.213 -4.558 1.623 509 HB3 SER 93 2HB SER 93 -14.542 -5.092 1.781 510 HG SER 93 HG SER 93 -16.132 -6.074 3.766 511 H LEU 94 H LEU 94 -12.927 -2.930 3.681 512 HA LEU 94 HA LEU 94 -11.779 -5.197 5.060 513 HB2 LEU 94 1HB LEU 94 -10.448 -2.585 4.353 514 HB3 LEU 94 2HB LEU 94 -9.668 -4.114 4.722 515 HG LEU 94 HG LEU 94 -11.323 -3.533 2.258 516 HD11 LEU 94 1HD1 LEU 94 -8.352 -3.845 2.641 517 HD12 LEU 94 2HD1 LEU 94 -9.212 -2.374 2.185 518 HD13 LEU 94 3HD1 LEU 94 -9.172 -3.749 1.081 519 HD21 LEU 94 1HD2 LEU 94 -11.502 -5.868 2.958 520 HD22 LEU 94 2HD2 LEU 94 -9.745 -5.992 3.003 521 HD23 LEU 94 3HD2 LEU 94 -10.568 -5.711 1.472 522 H ASN 95 H ASN 95 -13.760 -3.954 6.527 523 HA ASN 95 HA ASN 95 -12.884 -1.970 8.328 524 HB2 ASN 95 1HB ASN 95 -15.268 -2.596 7.952 525 HB3 ASN 95 2HB ASN 95 -14.969 -4.107 8.805 526 HD21 ASN 95 1HD2 ASN 95 -15.333 -0.671 9.115 527 HD22 ASN 95 2HD2 ASN 95 -15.494 -0.641 10.837 528 H GLY 96 H GLY 96 -11.618 -2.065 10.071 529 HA2 GLY 96 1HA GLY 96 -10.510 -3.002 11.904 530 HA3 GLY 96 2HA GLY 96 -11.131 -4.581 11.434 531 H LEU 97 H LEU 97 -10.059 -3.692 8.622 532 HA LEU 97 HA LEU 97 -7.513 -5.042 9.005 533 HB2 LEU 97 1HB LEU 97 -9.182 -5.734 7.270 534 HB3 LEU 97 2HB LEU 97 -8.913 -4.201 6.468 535 HG LEU 97 HG LEU 97 -6.665 -6.162 6.896 536 HD11 LEU 97 1HD1 LEU 97 -8.534 -5.988 4.536 537 HD12 LEU 97 2HD1 LEU 97 -8.469 -7.310 5.700 538 HD13 LEU 97 3HD1 LEU 97 -7.093 -6.995 4.646 539 HD21 LEU 97 1HD2 LEU 97 -7.127 -3.967 4.882 540 HD22 LEU 97 2HD2 LEU 97 -5.709 -5.012 4.969 541 HD23 LEU 97 3HD2 LEU 97 -6.054 -3.881 6.277 542 H SER 98 H SER 98 -5.617 -4.023 8.975 543 HA SER 98 HA SER 98 -5.528 -1.256 7.981 544 HB2 SER 98 1HB SER 98 -3.618 -2.669 9.865 545 HB3 SER 98 2HB SER 98 -3.511 -0.983 9.360 546 HG SER 98 HG SER 98 -5.305 -2.215 11.114 547 H VAL 99 H VAL 99 -4.544 -0.900 6.123 548 HA VAL 99 HA VAL 99 -2.799 -2.984 4.992 549 HB VAL 99 HB VAL 99 -3.945 -0.570 3.571 550 HG11 VAL 99 1HG1 VAL 99 -1.956 -1.507 2.532 551 HG12 VAL 99 2HG1 VAL 99 -3.382 -1.785 1.534 552 HG13 VAL 99 3HG1 VAL 99 -2.711 -3.100 2.499 553 HG21 VAL 99 1HG2 VAL 99 -5.006 -3.390 3.594 554 HG22 VAL 99 2HG2 VAL 99 -5.586 -2.079 2.566 555 HG23 VAL 99 3HG2 VAL 99 -5.782 -1.979 4.317 556 H VAL 100 H VAL 100 -0.626 -2.614 4.903 557 HA VAL 100 HA VAL 100 0.247 0.170 5.285 558 HB VAL 100 HB VAL 100 1.809 -2.331 5.950 559 HG11 VAL 100 1HG1 VAL 100 3.204 -0.414 5.371 560 HG12 VAL 100 2HG1 VAL 100 3.336 -0.805 7.088 561 HG13 VAL 100 3HG1 VAL 100 2.358 0.568 6.567 562 HG21 VAL 100 1HG2 VAL 100 -0.068 -2.147 7.462 563 HG22 VAL 100 2HG2 VAL 100 0.302 -0.448 7.761 564 HG23 VAL 100 3HG2 VAL 100 1.414 -1.704 8.310 565 H MET 101 H MET 101 0.553 0.900 3.277 566 HA MET 101 HA MET 101 1.927 -0.769 1.309 567 HB2 MET 101 1HB MET 101 0.048 0.529 0.482 568 HB3 MET 101 2HB MET 101 0.747 2.013 1.114 569 HG2 MET 101 1HG MET 101 1.075 1.918 -1.258 570 HG3 MET 101 2HG MET 101 2.629 1.769 -0.444 571 HE1 MET 101 1HE MET 101 0.374 -1.659 -2.546 572 HE2 MET 101 2HE MET 101 -0.125 0.033 -2.560 573 HE3 MET 101 3HE MET 101 -0.234 -0.908 -1.071 574 H THR 102 H THR 102 4.056 -0.858 1.456 575 HA THR 102 HA THR 102 5.493 1.542 2.374 576 HB THR 102 HB THR 102 6.427 -1.326 2.503 577 HG1 THR 102 HG1 THR 102 4.799 -1.065 4.001 578 HG21 THR 102 1HG2 THR 102 7.586 1.151 3.776 579 HG22 THR 102 2HG2 THR 102 8.237 0.355 2.347 580 HG23 THR 102 3HG2 THR 102 8.224 -0.489 3.894 581 HA PRO 103 HA PRO 103 6.995 1.283 -1.941 582 HB2 PRO 103 1HB PRO 103 7.651 3.939 -2.030 583 HB3 PRO 103 2HB PRO 103 6.049 3.314 -2.451 584 HG2 PRO 103 1HG PRO 103 6.978 4.588 0.091 585 HG3 PRO 103 2HG PRO 103 5.439 4.787 -0.768 586 HD2 PRO 103 1HD PRO 103 5.725 3.218 1.425 587 HD3 PRO 103 2HD PRO 103 4.546 2.866 0.140 588 H GLY 104 H GLY 104 9.108 1.085 -2.534 589 HA2 GLY 104 1HA GLY 104 11.447 1.668 -2.249 590 HA3 GLY 104 2HA GLY 104 11.128 1.885 -0.534 591 H TRP 105 H TRP 105 9.656 -0.771 -2.127 592 HA TRP 105 HA TRP 105 11.730 -2.587 -1.112 593 HB2 TRP 105 1HB TRP 105 9.821 -2.717 0.391 594 HB3 TRP 105 2HB TRP 105 8.729 -2.957 -0.968 595 HD1 TRP 105 HD1 TRP 105 11.681 -4.785 0.751 596 HE1 TRP 105 HE1 TRP 105 11.322 -7.317 0.473 597 HE3 TRP 105 HE3 TRP 105 7.487 -4.687 -2.165 598 HZ2 TRP 105 HZ2 TRP 105 9.485 -9.045 -0.810 599 HZ3 TRP 105 HZ3 TRP 105 6.491 -6.821 -2.875 600 HH2 TRP 105 HH2 TRP 105 7.472 -8.954 -2.211 601 H ASP 106 H ASP 106 12.701 -3.205 -2.940 602 HA ASP 106 HA ASP 106 11.152 -4.768 -4.821 603 HB2 ASP 106 1HB ASP 106 11.026 -2.504 -5.783 604 HB3 ASP 106 2HB ASP 106 12.783 -2.398 -5.756 605 H ASN 107 H ASN 107 12.286 -6.407 -5.633 606 HA ASN 107 HA ASN 107 14.771 -7.034 -4.419 607 HB2 ASN 107 1HB ASN 107 14.656 -9.103 -5.752 608 HB3 ASN 107 2HB ASN 107 13.135 -8.768 -4.935 609 HD21 ASN 107 1HD2 ASN 107 14.736 -9.138 -7.952 610 HD22 ASN 107 2HD2 ASN 107 13.337 -8.990 -8.957 611 H ALA 108 H ALA 108 13.910 -5.700 -7.539 612 HA ALA 108 HA ALA 108 16.499 -6.343 -8.678 613 HB1 ALA 108 1HB ALA 108 14.476 -6.539 -10.039 614 HB2 ALA 108 2HB ALA 108 15.625 -5.392 -10.730 615 HB3 ALA 108 3HB ALA 108 14.203 -4.805 -9.870 616 H ASN 109 H ASN 109 14.645 -3.357 -8.076 617 HA ASN 109 HA ASN 109 17.109 -1.816 -8.505 618 HB2 ASN 109 1HB ASN 109 14.194 -1.060 -8.509 619 HB3 ASN 109 2HB ASN 109 15.460 0.161 -8.430 620 HD21 ASN 109 1HD2 ASN 109 13.465 -0.392 -10.504 621 HD22 ASN 109 2HD2 ASN 109 14.364 -0.641 -11.959 622 H GLY 110 H GLY 110 14.894 -2.727 -6.014 623 HA2 GLY 110 1HA GLY 110 15.564 -2.603 -3.728 624 HA3 GLY 110 2HA GLY 110 16.524 -1.186 -4.121 625 H VAL 111 H VAL 111 15.089 0.686 -5.041 626 HA VAL 111 HA VAL 111 13.102 1.109 -2.946 627 HB VAL 111 HB VAL 111 14.934 2.753 -3.208 628 HG11 VAL 111 1HG1 VAL 111 14.909 4.322 -5.081 629 HG12 VAL 111 2HG1 VAL 111 13.603 3.408 -5.832 630 HG13 VAL 111 3HG1 VAL 111 15.190 2.669 -5.626 631 HG21 VAL 111 1HG2 VAL 111 13.519 4.773 -3.121 632 HG22 VAL 111 2HG2 VAL 111 12.885 3.453 -2.140 633 HG23 VAL 111 3HG2 VAL 111 12.157 3.816 -3.704 634 H THR 112 H THR 112 13.254 0.576 -6.335 635 HA THR 112 HA THR 112 10.851 2.029 -6.969 636 HB THR 112 HB THR 112 12.060 0.057 -8.857 637 HG1 THR 112 HG1 THR 112 13.303 2.470 -8.991 638 HG21 THR 112 1HG2 THR 112 11.560 1.827 -10.476 639 HG22 THR 112 2HG2 THR 112 11.039 2.886 -9.166 640 HG23 THR 112 3HG2 THR 112 10.127 1.422 -9.533 641 H GLY 113 H GLY 113 9.905 0.517 -5.122 642 HA2 GLY 113 1HA GLY 113 8.086 -1.258 -6.476 643 HA3 GLY 113 2HA GLY 113 9.199 -2.096 -5.403 644 H TRP 114 H TRP 114 6.734 -2.466 -4.703 645 HA TRP 114 HA TRP 114 6.246 -0.639 -2.457 646 HB2 TRP 114 1HB TRP 114 4.155 -1.638 -4.407 647 HB3 TRP 114 2HB TRP 114 3.801 -0.787 -2.909 648 HD1 TRP 114 HD1 TRP 114 4.177 1.841 -2.873 649 HE1 TRP 114 HE1 TRP 114 4.497 3.569 -4.756 650 HE3 TRP 114 HE3 TRP 114 5.225 -1.339 -6.740 651 HZ2 TRP 114 HZ2 TRP 114 5.110 3.584 -7.506 652 HZ3 TRP 114 HZ3 TRP 114 5.664 -0.385 -8.966 653 HH2 TRP 114 HH2 TRP 114 5.607 2.026 -9.339 654 H ALA 115 H ALA 115 6.150 -1.786 -0.614 655 HA ALA 115 HA ALA 115 5.592 -4.638 -0.753 656 HB1 ALA 115 1HB ALA 115 6.234 -3.010 1.694 657 HB2 ALA 115 2HB ALA 115 7.454 -3.735 0.651 658 HB3 ALA 115 3HB ALA 115 6.312 -4.761 1.518 659 H ARG 116 H ARG 116 3.734 -5.540 -0.202 660 HA ARG 116 HA ARG 116 1.615 -3.770 0.810 661 HB2 ARG 116 1HB ARG 116 1.445 -6.289 -0.846 662 HB3 ARG 116 2HB ARG 116 0.047 -5.527 -0.101 663 HG2 ARG 116 1HG ARG 116 -0.063 -4.682 -2.218 664 HG3 ARG 116 2HG ARG 116 0.856 -3.421 -1.403 665 HD2 ARG 116 1HD ARG 116 2.775 -3.895 -2.541 666 HD3 ARG 116 2HD ARG 116 2.401 -5.616 -2.665 667 HE ARG 116 HE ARG 116 0.543 -4.559 -4.266 668 HH11 ARG 116 1HH1 ARG 116 4.021 -4.019 -4.122 669 HH12 ARG 116 2HH1 ARG 116 4.131 -3.607 -5.808 670 HH21 ARG 116 1HH2 ARG 116 0.724 -4.031 -6.472 671 HH22 ARG 116 2HH2 ARG 116 2.279 -3.591 -7.132 672 H ASN 117 H ASN 117 0.611 -4.210 2.658 673 HA ASN 117 HA ASN 117 0.897 -6.831 3.904 674 HB2 ASN 117 1HB ASN 117 2.802 -5.566 4.756 675 HB3 ASN 117 2HB ASN 117 1.749 -4.233 5.199 676 HD21 ASN 117 1HD2 ASN 117 2.764 -7.464 5.988 677 HD22 ASN 117 2HD2 ASN 117 2.101 -7.490 7.585 678 H CYS 118 H CYS 118 -0.963 -7.434 4.826 679 HA CYS 118 HA CYS 118 -2.954 -5.353 5.463 680 HB2 CYS 118 1HB CYS 118 -3.353 -8.036 4.134 681 HB3 CYS 118 2HB CYS 118 -4.678 -7.133 4.864 682 H ASN 119 H ASN 119 -3.565 -5.381 7.559 683 HA ASN 119 HA ASN 119 -3.174 -7.913 9.026 684 HB2 ASN 119 1HB ASN 119 -3.282 -5.085 10.099 685 HB3 ASN 119 2HB ASN 119 -3.085 -6.535 11.078 686 HD21 ASN 119 1HD2 ASN 119 -1.583 -4.329 8.891 687 HD22 ASN 119 2HD2 ASN 119 0.033 -4.915 9.065 688 H ILE 120 H ILE 120 -5.083 -8.907 8.805 689 HA ILE 120 HA ILE 120 -7.269 -7.697 10.309 690 HB ILE 120 HB ILE 120 -7.929 -7.372 8.021 691 HG12 ILE 120 1HG1 ILE 120 -9.986 -8.834 7.919 692 HG13 ILE 120 2HG1 ILE 120 -9.377 -9.654 9.350 693 HG21 ILE 120 1HG2 ILE 120 -7.390 -10.303 7.615 694 HG22 ILE 120 2HG2 ILE 120 -6.516 -8.948 6.902 695 HG23 ILE 120 3HG2 ILE 120 -8.193 -9.254 6.447 696 HD11 ILE 120 1HD1 ILE 120 -9.488 -7.582 10.605 697 HD12 ILE 120 2HD1 ILE 120 -11.052 -7.962 9.888 698 HD13 ILE 120 3HD1 ILE 120 -10.030 -6.723 9.164 699 H GLN 121 H GLN 121 -7.083 -8.982 12.099 700 HA GLN 121 HA GLN 121 -5.911 -11.581 11.855 701 HB2 GLN 121 1HB GLN 121 -7.021 -10.154 14.272 702 HB3 GLN 121 2HB GLN 121 -6.086 -11.644 14.317 703 HG2 GLN 121 1HG GLN 121 -5.135 -8.952 13.355 704 HG3 GLN 121 2HG GLN 121 -4.670 -9.766 14.845 705 HE21 GLN 121 1HE2 GLN 121 -3.014 -8.830 12.633 706 HE22 GLN 121 2HE2 GLN 121 -2.164 -10.218 12.052 707 H SER 122 H SER 122 -9.137 -10.524 11.756 708 HA SER 122 HA SER 122 -10.120 -13.065 12.828 709 HB2 SER 122 1HB SER 122 -12.349 -11.913 12.814 710 HB3 SER 122 2HB SER 122 -11.137 -11.138 13.838 711 HG SER 122 HG SER 122 -12.178 -10.316 11.345 712 H ASP 123 H ASP 123 -9.708 -11.482 9.796 713 HA ASP 123 HA ASP 123 -11.537 -13.382 8.523 714 HB2 ASP 123 1HB ASP 123 -11.626 -10.384 8.152 715 HB3 ASP 123 2HB ASP 123 -12.422 -11.526 7.076 716 H SER 124 H SER 124 -9.856 -14.486 7.564 717 HA SER 124 HA SER 124 -7.709 -13.348 6.164 718 HB2 SER 124 1HB SER 124 -9.044 -15.997 5.569 719 HB3 SER 124 2HB SER 124 -7.377 -15.545 5.220 720 HG SER 124 HG SER 124 -8.239 -16.727 7.365 721 H ALA 125 H ALA 125 -11.034 -13.774 5.292 722 HA ALA 125 HA ALA 125 -10.820 -13.736 2.493 723 HB1 ALA 125 1HB ALA 125 -13.084 -12.725 4.207 724 HB2 ALA 125 2HB ALA 125 -12.861 -14.391 3.672 725 HB3 ALA 125 3HB ALA 125 -13.172 -13.120 2.491 726 H LEU 126 H LEU 126 -11.048 -11.125 4.866 727 HA LEU 126 HA LEU 126 -11.289 -9.048 2.948 728 HB2 LEU 126 1HB LEU 126 -10.254 -8.937 5.783 729 HB3 LEU 126 2HB LEU 126 -10.666 -7.543 4.805 730 HG LEU 126 HG LEU 126 -12.572 -9.654 5.818 731 HD11 LEU 126 1HD1 LEU 126 -12.260 -6.730 6.477 732 HD12 LEU 126 2HD1 LEU 126 -11.884 -8.092 7.534 733 HD13 LEU 126 3HD1 LEU 126 -13.552 -7.777 7.061 734 HD21 LEU 126 1HD2 LEU 126 -14.332 -8.244 4.820 735 HD22 LEU 126 2HD2 LEU 126 -13.265 -8.957 3.612 736 HD23 LEU 126 3HD2 LEU 126 -13.083 -7.261 4.057 737 H GLN 127 H GLN 127 -8.624 -10.732 4.431 738 HA GLN 127 HA GLN 127 -6.530 -9.093 3.486 739 HB2 GLN 127 1HB GLN 127 -6.096 -10.718 5.209 740 HB3 GLN 127 2HB GLN 127 -6.635 -12.033 4.172 741 HG2 GLN 127 1HG GLN 127 -4.742 -11.671 2.702 742 HG3 GLN 127 2HG GLN 127 -4.208 -10.320 3.704 743 HE21 GLN 127 1HE2 GLN 127 -3.311 -10.735 5.721 744 HE22 GLN 127 2HE2 GLN 127 -2.731 -12.302 6.161 745 H GLN 128 H GLN 128 -8.291 -11.793 2.088 746 HA GLN 128 HA GLN 128 -6.795 -11.977 -0.308 747 HB2 GLN 128 1HB GLN 128 -9.669 -12.705 0.290 748 HB3 GLN 128 2HB GLN 128 -8.822 -13.144 -1.188 749 HG2 GLN 128 1HG GLN 128 -8.017 -13.978 1.586 750 HG3 GLN 128 2HG GLN 128 -8.909 -14.974 0.440 751 HE21 GLN 128 1HE2 GLN 128 -7.425 -14.068 -1.865 752 HE22 GLN 128 2HE2 GLN 128 -5.866 -14.810 -1.768 753 H ALA 129 H ALA 129 -9.484 -10.003 0.733 754 HA ALA 129 HA ALA 129 -10.206 -9.004 -1.813 755 HB1 ALA 129 1HB ALA 129 -11.741 -8.986 0.087 756 HB2 ALA 129 2HB ALA 129 -11.534 -7.371 -0.594 757 HB3 ALA 129 3HB ALA 129 -10.713 -7.810 0.906 758 H CYS 130 H CYS 130 -8.167 -7.680 0.798 759 HA CYS 130 HA CYS 130 -7.565 -5.285 -0.616 760 HB2 CYS 130 1HB CYS 130 -5.831 -4.923 1.061 761 HB3 CYS 130 2HB CYS 130 -7.304 -5.489 1.845 762 H GLU 131 H GLU 131 -6.005 -8.429 -0.336 763 HA GLU 131 HA GLU 131 -3.670 -7.881 -1.789 764 HB2 GLU 131 1HB GLU 131 -4.109 -9.923 -0.416 765 HB3 GLU 131 2HB GLU 131 -5.189 -10.492 -1.678 766 HG2 GLU 131 1HG GLU 131 -3.170 -10.266 -3.238 767 HG3 GLU 131 2HG GLU 131 -2.213 -10.167 -1.758 768 H ASP 132 H ASP 132 -6.934 -8.420 -2.810 769 HA ASP 132 HA ASP 132 -6.369 -9.222 -5.474 770 HB2 ASP 132 1HB ASP 132 -8.535 -9.673 -4.409 771 HB3 ASP 132 2HB ASP 132 -8.859 -7.947 -4.323 772 H VAL 133 H VAL 133 -7.158 -6.085 -4.009 773 HA VAL 133 HA VAL 133 -6.855 -4.722 -6.541 774 HB VAL 133 HB VAL 133 -7.271 -3.637 -3.751 775 HG11 VAL 133 1HG1 VAL 133 -6.139 -1.993 -5.143 776 HG12 VAL 133 2HG1 VAL 133 -7.812 -1.515 -4.859 777 HG13 VAL 133 3HG1 VAL 133 -7.344 -2.215 -6.410 778 HG21 VAL 133 1HG2 VAL 133 -9.553 -3.223 -4.526 779 HG22 VAL 133 2HG2 VAL 133 -9.152 -4.936 -4.588 780 HG23 VAL 133 3HG2 VAL 133 -9.169 -3.978 -6.068 781 H PHE 134 H PHE 134 -5.096 -4.921 -3.482 782 HA PHE 134 HA PHE 134 -2.949 -3.248 -4.460 783 HB2 PHE 134 1HB PHE 134 -3.342 -4.674 -1.820 784 HB3 PHE 134 2HB PHE 134 -1.954 -3.661 -2.198 785 HD1 PHE 134 HD1 PHE 134 -2.227 -1.239 -2.519 786 HD2 PHE 134 HD2 PHE 134 -5.480 -3.708 -1.307 787 HE1 PHE 134 HE1 PHE 134 -3.482 0.762 -1.832 788 HE2 PHE 134 HE2 PHE 134 -6.740 -1.710 -0.618 789 HZ PHE 134 HZ PHE 134 -5.745 0.530 -0.885 790 H ARG 135 H ARG 135 -3.649 -5.870 -5.571 791 HA ARG 135 HA ARG 135 -1.939 -7.944 -5.025 792 HB2 ARG 135 1HB ARG 135 -2.216 -8.628 -7.403 793 HB3 ARG 135 2HB ARG 135 -3.729 -8.195 -6.621 794 HG2 ARG 135 1HG ARG 135 -3.754 -6.063 -7.735 795 HG3 ARG 135 2HG ARG 135 -2.159 -6.368 -8.426 796 HD2 ARG 135 1HD ARG 135 -3.969 -6.768 -10.044 797 HD3 ARG 135 2HD ARG 135 -3.038 -8.226 -9.708 798 HE ARG 135 HE ARG 135 -5.531 -7.794 -8.230 799 HH11 ARG 135 1HH1 ARG 135 -3.743 -9.541 -10.685 800 HH12 ARG 135 2HH1 ARG 135 -4.905 -10.823 -10.804 801 HH21 ARG 135 1HH2 ARG 135 -7.073 -9.486 -8.380 802 HH22 ARG 135 2HH2 ARG 135 -6.794 -10.794 -9.494 803 H PHE 136 H PHE 136 -0.024 -8.708 -6.084 804 HA PHE 136 HA PHE 136 1.928 -6.575 -5.836 805 HB2 PHE 136 1HB PHE 136 2.281 -9.571 -5.973 806 HB3 PHE 136 2HB PHE 136 3.569 -8.411 -5.675 807 HD1 PHE 136 HD1 PHE 136 3.856 -7.400 -3.520 808 HD2 PHE 136 HD2 PHE 136 0.565 -10.004 -4.267 809 HE1 PHE 136 HE1 PHE 136 3.434 -7.561 -1.103 810 HE2 PHE 136 HE2 PHE 136 0.140 -10.160 -1.849 811 HZ PHE 136 HZ PHE 136 1.575 -8.939 -0.265 812 H ASP 137 H ASP 137 2.953 -5.696 -7.481 813 HA ASP 137 HA ASP 137 2.822 -6.390 -10.157 814 HB2 ASP 137 1HB ASP 137 5.149 -5.094 -8.709 815 HB3 ASP 137 2HB ASP 137 4.905 -5.091 -10.449 816 H ASP 138 H ASP 138 3.633 -7.980 -11.313 817 HA ASP 138 HA ASP 138 4.860 -10.215 -10.158 818 HB2 ASP 138 1HB ASP 138 3.514 -10.427 -12.151 819 HB3 ASP 138 2HB ASP 138 4.588 -9.358 -13.046 820 H ALA 139 H ALA 139 6.181 -7.386 -11.680 821 HA ALA 139 HA ALA 139 8.821 -8.479 -12.026 822 HB1 ALA 139 1HB ALA 139 7.877 -5.618 -12.169 823 HB2 ALA 139 2HB ALA 139 7.954 -6.743 -13.526 824 HB3 ALA 139 3HB ALA 139 9.436 -6.227 -12.722 825 H ASN 140 H ASN 140 7.048 -7.119 -9.495 826 HA ASN 140 HA ASN 140 9.350 -6.116 -8.016 827 HB2 ASN 140 1HB ASN 140 7.169 -4.888 -8.057 828 HB3 ASN 140 2HB ASN 140 6.418 -6.251 -7.241 829 HD21 ASN 140 1HD2 ASN 140 9.614 -4.911 -6.571 830 HD22 ASN 140 2HD2 ASN 140 9.226 -4.369 -4.968 831 H LEU 141 H LEU 141 8.096 -9.038 -8.635 832 HA LEU 141 HA LEU 141 8.697 -10.118 -5.962 833 HB2 LEU 141 1HB LEU 141 6.897 -11.328 -8.058 834 HB3 LEU 141 2HB LEU 141 7.189 -11.958 -6.450 835 HG LEU 141 HG LEU 141 5.737 -9.398 -7.114 836 HD11 LEU 141 1HD1 LEU 141 4.806 -12.107 -6.185 837 HD12 LEU 141 2HD1 LEU 141 4.398 -11.283 -7.691 838 HD13 LEU 141 3HD1 LEU 141 3.805 -10.659 -6.154 839 HD21 LEU 141 1HD2 LEU 141 6.296 -10.717 -4.456 840 HD22 LEU 141 2HD2 LEU 141 5.197 -9.362 -4.706 841 HD23 LEU 141 3HD2 LEU 141 6.920 -9.165 -5.015 842 H VAL 142 H VAL 142 10.761 -10.936 -6.109 843 HA VAL 142 HA VAL 142 11.555 -12.401 -8.452 844 HB VAL 142 HB VAL 142 13.273 -11.203 -7.258 845 HG11 VAL 142 1HG1 VAL 142 14.015 -11.897 -5.008 846 HG12 VAL 142 2HG1 VAL 142 12.613 -12.962 -4.900 847 HG13 VAL 142 3HG1 VAL 142 12.391 -11.217 -5.013 848 HG21 VAL 142 1HG2 VAL 142 13.916 -13.246 -8.423 849 HG22 VAL 142 2HG2 VAL 142 13.644 -14.178 -6.950 850 HG23 VAL 142 3HG2 VAL 142 14.930 -12.973 -7.006 851 HA PRO 143 HA PRO 143 9.577 -16.175 -6.995 852 HB2 PRO 143 1HB PRO 143 10.796 -17.315 -9.416 853 HB3 PRO 143 2HB PRO 143 9.095 -17.216 -8.961 854 HG2 PRO 143 1HG PRO 143 10.120 -15.711 -10.939 855 HG3 PRO 143 2HG PRO 143 8.829 -15.119 -9.878 856 HD2 PRO 143 1HD PRO 143 11.768 -14.522 -9.798 857 HD3 PRO 143 2HD PRO 143 10.384 -13.435 -9.556 858 H ARG 144 H ARG 144 10.407 -17.697 -5.697 859 HA ARG 144 HA ARG 144 13.296 -18.232 -5.879 860 HB2 ARG 144 1HB ARG 144 11.474 -18.423 -3.472 861 HB3 ARG 144 2HB ARG 144 13.170 -18.876 -3.487 862 HG2 ARG 144 1HG ARG 144 12.098 -16.107 -3.999 863 HG3 ARG 144 2HG ARG 144 12.820 -16.676 -2.492 864 HD2 ARG 144 1HD ARG 144 14.908 -17.168 -3.737 865 HD3 ARG 144 2HD ARG 144 14.177 -16.463 -5.176 866 HE ARG 144 HE ARG 144 14.112 -14.656 -2.981 867 HH11 ARG 144 1HH1 ARG 144 16.194 -15.991 -5.458 868 HH12 ARG 144 2HH1 ARG 144 17.263 -14.623 -5.481 869 HH21 ARG 144 1HH2 ARG 144 15.511 -12.842 -3.020 870 HH22 ARG 144 2HH2 ARG 144 16.882 -12.837 -4.086 871 H GLY 145 H GLY 145 13.771 -20.148 -6.713 872 HA2 GLY 145 1HA GLY 145 13.686 -22.514 -6.785 873 HA3 GLY 145 2HA GLY 145 12.087 -22.447 -6.049 874 H SER 146 H SER 146 11.573 -23.994 -7.826 875 HA SER 146 HA SER 146 11.107 -22.556 -10.355 876 HB2 SER 146 1HB SER 146 11.014 -24.834 -11.419 877 HB3 SER 146 2HB SER 146 12.598 -24.396 -10.781 878 HG SER 146 HG SER 146 10.666 -26.094 -9.568 879 H GLY 147 H GLY 147 9.052 -22.011 -10.636 880 HA2 GLY 147 1HA GLY 147 6.782 -22.636 -11.031 881 HA3 GLY 147 2HA GLY 147 6.974 -23.947 -9.876 882 H LEU 148 H LEU 148 8.427 -21.729 -8.201 883 HA LEU 148 HA LEU 148 6.002 -20.943 -6.796 884 HB2 LEU 148 1HB LEU 148 8.916 -20.606 -6.065 885 HB3 LEU 148 2HB LEU 148 7.583 -20.065 -5.068 886 HG LEU 148 HG LEU 148 6.852 -22.552 -5.068 887 HD11 LEU 148 1HD1 LEU 148 8.347 -23.321 -6.824 888 HD12 LEU 148 2HD1 LEU 148 8.695 -24.139 -5.301 889 HD13 LEU 148 3HD1 LEU 148 9.745 -22.838 -5.863 890 HD21 LEU 148 1HD2 LEU 148 8.308 -23.000 -3.158 891 HD22 LEU 148 2HD2 LEU 148 7.672 -21.356 -3.117 892 HD23 LEU 148 3HD2 LEU 148 9.337 -21.645 -3.624 893 H GLU 149 H GLU 149 5.146 -19.388 -8.127 894 HA GLU 149 HA GLU 149 6.772 -17.019 -8.677 895 HB2 GLU 149 1HB GLU 149 5.522 -18.000 -10.559 896 HB3 GLU 149 2HB GLU 149 4.018 -17.791 -9.676 897 HG2 GLU 149 1HG GLU 149 4.319 -15.372 -9.726 898 HG3 GLU 149 2HG GLU 149 5.828 -15.578 -10.613 899 H HIS 150 H HIS 150 3.973 -18.124 -6.906 900 HA HIS 150 HA HIS 150 3.021 -15.557 -6.148 901 HB2 HIS 150 1HB HIS 150 2.541 -18.311 -5.012 902 HB3 HIS 150 2HB HIS 150 1.788 -16.865 -4.351 903 HD1 HIS 150 HD1 HIS 150 1.056 -19.518 -6.569 904 HD2 HIS 150 HD2 HIS 150 0.367 -15.420 -6.632 905 HE1 HIS 150 HE1 HIS 150 -0.840 -19.174 -8.180 906 HE2 HIS 150 HE2 HIS 150 -1.348 -16.708 -8.069 907 H HIS 151 H HIS 151 3.822 -14.208 -4.729 908 HA HIS 151 HA HIS 151 6.049 -15.064 -3.054 909 HB2 HIS 151 1HB HIS 151 5.964 -12.903 -4.470 910 HB3 HIS 151 2HB HIS 151 4.911 -12.276 -3.210 911 HD1 HIS 151 HD1 HIS 151 5.994 -11.776 -0.903 912 HD2 HIS 151 HD2 HIS 151 8.664 -13.089 -3.805 913 HE1 HIS 151 HE1 HIS 151 8.282 -11.254 -0.001 914 HE2 HIS 151 HE2 HIS 151 9.879 -11.961 -1.819 915 H HIS 152 H HIS 152 5.483 -15.976 -1.187 916 HA HIS 152 HA HIS 152 2.916 -15.476 0.005 917 HB2 HIS 152 1HB HIS 152 5.235 -17.246 0.746 918 HB3 HIS 152 2HB HIS 152 3.829 -17.075 1.788 919 HD1 HIS 152 HD1 HIS 152 2.279 -18.968 1.475 920 HD2 HIS 152 HD2 HIS 152 4.159 -17.923 -2.081 921 HE1 HIS 152 HE1 HIS 152 1.369 -20.544 -0.257 922 HE2 HIS 152 HE2 HIS 152 2.362 -19.749 -2.430 923 H HIS 153 H HIS 153 2.867 -15.240 2.482 924 HA HIS 153 HA HIS 153 4.043 -12.660 2.996 925 HB2 HIS 153 1HB HIS 153 2.025 -14.352 4.445 926 HB3 HIS 153 2HB HIS 153 2.712 -12.915 5.193 927 HD1 HIS 153 HD1 HIS 153 1.788 -10.680 4.480 928 HD2 HIS 153 HD2 HIS 153 0.437 -13.823 2.126 929 HE1 HIS 153 HE1 HIS 153 -0.016 -9.705 3.026 930 HE2 HIS 153 HE2 HIS 153 -0.912 -11.659 1.711 931 H HIS 154 H HIS 154 6.213 -13.121 3.207 932 HA HIS 154 HA HIS 154 6.881 -13.972 5.916 933 HB2 HIS 154 1HB HIS 154 8.969 -15.088 5.061 934 HB3 HIS 154 2HB HIS 154 7.476 -15.931 4.678 935 HD1 HIS 154 HD1 HIS 154 10.295 -14.040 3.084 936 HD2 HIS 154 HD2 HIS 154 6.891 -16.146 1.962 937 HE1 HIS 154 HE1 HIS 154 10.501 -14.387 0.603 938 HE2 HIS 154 HE2 HIS 154 8.512 -15.799 -0.024 939 H HIS 155 H HIS 155 6.465 -11.429 4.939 940 HA HIS 155 HA HIS 155 9.148 -10.297 5.299 941 HB2 HIS 155 1HB HIS 155 8.492 -10.059 2.914 942 HB3 HIS 155 2HB HIS 155 7.041 -9.198 3.416 943 HD1 HIS 155 HD1 HIS 155 7.249 -6.721 3.507 944 HD2 HIS 155 HD2 HIS 155 10.945 -8.608 3.757 945 HE1 HIS 155 HE1 HIS 155 8.957 -4.877 3.477 946 HE2 HIS 155 HE2 HIS 155 11.164 -6.035 3.819 Start of MODEL 16 1 H1 MET 24 1H MET 24 -14.407 -15.668 -6.794 2 H2 MET 24 2H MET 24 -15.647 -16.308 -5.841 3 H3 MET 24 3H MET 24 -14.035 -16.652 -5.473 4 HA MET 24 HA MET 24 -14.975 -15.014 -3.970 5 HB2 MET 24 1HB MET 24 -12.546 -15.022 -4.530 6 HB3 MET 24 2HB MET 24 -12.868 -13.859 -5.810 7 HG2 MET 24 1HG MET 24 -13.710 -12.278 -4.121 8 HG3 MET 24 2HG MET 24 -13.290 -13.435 -2.862 9 HE1 MET 24 1HE MET 24 -12.269 -10.461 -2.779 10 HE2 MET 24 2HE MET 24 -10.577 -10.698 -2.339 11 HE3 MET 24 3HE MET 24 -11.832 -11.680 -1.582 12 H GLU 25 H GLU 25 -17.066 -14.312 -4.412 13 HA GLU 25 HA GLU 25 -17.550 -12.449 -6.559 14 HB2 GLU 25 1HB GLU 25 -19.314 -13.536 -4.370 15 HB3 GLU 25 2HB GLU 25 -19.863 -12.352 -5.547 16 HG2 GLU 25 1HG GLU 25 -19.196 -13.992 -7.336 17 HG3 GLU 25 2HG GLU 25 -18.978 -15.176 -6.045 18 H ASN 26 H ASN 26 -15.897 -10.976 -5.722 19 HA ASN 26 HA ASN 26 -17.208 -8.939 -4.064 20 HB2 ASN 26 1HB ASN 26 -14.477 -10.117 -3.685 21 HB3 ASN 26 2HB ASN 26 -14.715 -8.407 -3.336 22 HD21 ASN 26 1HD2 ASN 26 -15.521 -11.665 -2.405 23 HD22 ASN 26 2HD2 ASN 26 -16.176 -11.266 -0.858 24 H TYR 27 H TYR 27 -17.175 -9.119 -6.856 25 HA TYR 27 HA TYR 27 -14.890 -7.892 -8.016 26 HB2 TYR 27 1HB TYR 27 -17.664 -8.291 -9.155 27 HB3 TYR 27 2HB TYR 27 -16.246 -7.813 -10.079 28 HD1 TYR 27 HD1 TYR 27 -14.412 -9.416 -10.462 29 HD2 TYR 27 HD2 TYR 27 -17.992 -10.576 -8.475 30 HE1 TYR 27 HE1 TYR 27 -13.838 -11.779 -10.817 31 HE2 TYR 27 HE2 TYR 27 -17.424 -12.944 -8.824 32 HH TYR 27 HH TYR 27 -16.052 -14.300 -10.373 33 H LEU 28 H LEU 28 -18.078 -6.694 -7.065 34 HA LEU 28 HA LEU 28 -17.712 -4.116 -8.218 35 HB2 LEU 28 1HB LEU 28 -19.589 -5.032 -6.036 36 HB3 LEU 28 2HB LEU 28 -19.660 -3.463 -6.812 37 HG LEU 28 HG LEU 28 -20.120 -6.133 -8.155 38 HD11 LEU 28 1HD1 LEU 28 -21.956 -5.481 -6.713 39 HD12 LEU 28 2HD1 LEU 28 -22.419 -5.319 -8.408 40 HD13 LEU 28 3HD1 LEU 28 -22.008 -3.887 -7.465 41 HD21 LEU 28 1HD2 LEU 28 -20.192 -3.329 -9.265 42 HD22 LEU 28 2HD2 LEU 28 -20.795 -4.759 -10.102 43 HD23 LEU 28 3HD2 LEU 28 -19.080 -4.620 -9.718 44 H ARG 29 H ARG 29 -17.365 -5.387 -4.927 45 HA ARG 29 HA ARG 29 -16.465 -2.967 -3.786 46 HB2 ARG 29 1HB ARG 29 -17.248 -4.606 -2.280 47 HB3 ARG 29 2HB ARG 29 -16.231 -5.857 -2.976 48 HG2 ARG 29 1HG ARG 29 -14.358 -5.154 -1.856 49 HG3 ARG 29 2HG ARG 29 -14.950 -3.501 -1.678 50 HD2 ARG 29 1HD ARG 29 -14.907 -4.821 0.443 51 HD3 ARG 29 2HD ARG 29 -16.482 -4.153 0.028 52 HE ARG 29 HE ARG 29 -15.928 -6.924 -0.734 53 HH11 ARG 29 1HH1 ARG 29 -17.555 -4.673 1.403 54 HH12 ARG 29 2HH1 ARG 29 -18.687 -5.852 1.984 55 HH21 ARG 29 1HH2 ARG 29 -17.400 -8.478 0.046 56 HH22 ARG 29 2HH2 ARG 29 -18.590 -8.023 1.229 57 H LYS 30 H LYS 30 -14.859 -5.558 -5.502 58 HA LYS 30 HA LYS 30 -12.213 -4.820 -4.876 59 HB2 LYS 30 1HB LYS 30 -12.950 -7.017 -5.869 60 HB3 LYS 30 2HB LYS 30 -13.127 -6.186 -7.409 61 HG2 LYS 30 1HG LYS 30 -10.783 -5.684 -7.472 62 HG3 LYS 30 2HG LYS 30 -10.563 -6.324 -5.843 63 HD2 LYS 30 1HD LYS 30 -11.265 -8.545 -6.657 64 HD3 LYS 30 2HD LYS 30 -11.372 -7.885 -8.292 65 HE2 LYS 30 1HE LYS 30 -8.991 -7.304 -8.196 66 HE3 LYS 30 2HE LYS 30 -8.895 -7.987 -6.574 67 HZ1 LYS 30 1HZ LYS 30 -9.470 -9.442 -9.092 68 HZ2 LYS 30 2HZ LYS 30 -9.592 -10.136 -7.559 69 HZ3 LYS 30 3HZ LYS 30 -8.090 -9.585 -8.119 70 H ALA 31 H ALA 31 -14.343 -3.922 -7.646 71 HA ALA 31 HA ALA 31 -12.455 -2.246 -8.865 72 HB1 ALA 31 1HB ALA 31 -14.342 -1.338 -10.090 73 HB2 ALA 31 2HB ALA 31 -15.463 -2.086 -8.953 74 HB3 ALA 31 3HB ALA 31 -14.459 -3.094 -9.996 75 H ALA 32 H ALA 32 -14.765 -1.735 -6.272 76 HA ALA 32 HA ALA 32 -14.565 1.067 -6.104 77 HB1 ALA 32 1HB ALA 32 -15.345 0.812 -3.801 78 HB2 ALA 32 2HB ALA 32 -15.022 -0.919 -3.878 79 HB3 ALA 32 3HB ALA 32 -16.272 -0.209 -4.899 80 H LEU 33 H LEU 33 -12.718 -1.540 -4.602 81 HA LEU 33 HA LEU 33 -10.869 0.068 -3.206 82 HB2 LEU 33 1HB LEU 33 -10.449 -2.679 -4.407 83 HB3 LEU 33 2HB LEU 33 -9.444 -1.934 -3.175 84 HG LEU 33 HG LEU 33 -12.333 -2.756 -2.839 85 HD11 LEU 33 1HD1 LEU 33 -10.830 -4.663 -2.973 86 HD12 LEU 33 2HD1 LEU 33 -11.443 -4.458 -1.333 87 HD13 LEU 33 3HD1 LEU 33 -9.800 -3.955 -1.729 88 HD21 LEU 33 1HD2 LEU 33 -11.976 -2.234 -0.468 89 HD22 LEU 33 2HD2 LEU 33 -11.831 -0.807 -1.492 90 HD23 LEU 33 3HD2 LEU 33 -10.383 -1.589 -0.859 91 H THR 34 H THR 34 -11.067 -1.040 -6.509 92 HA THR 34 HA THR 34 -8.442 -0.322 -7.295 93 HB THR 34 HB THR 34 -10.924 -0.575 -9.006 94 HG1 THR 34 HG1 THR 34 -10.401 -2.504 -7.853 95 HG21 THR 34 1HG2 THR 34 -9.379 -0.934 -10.856 96 HG22 THR 34 2HG2 THR 34 -8.004 -0.730 -9.771 97 HG23 THR 34 3HG2 THR 34 -9.070 0.634 -10.107 98 H ASP 35 H ASP 35 -11.528 1.384 -7.230 99 HA ASP 35 HA ASP 35 -10.601 3.701 -8.618 100 HB2 ASP 35 1HB ASP 35 -12.990 3.230 -8.490 101 HB3 ASP 35 2HB ASP 35 -12.943 3.350 -6.731 102 H MET 36 H MET 36 -10.924 2.786 -5.231 103 HA MET 36 HA MET 36 -9.967 5.165 -4.082 104 HB2 MET 36 1HB MET 36 -11.020 3.421 -2.731 105 HB3 MET 36 2HB MET 36 -9.705 2.314 -3.091 106 HG2 MET 36 1HG MET 36 -9.492 3.249 -0.861 107 HG3 MET 36 2HG MET 36 -8.148 3.737 -1.896 108 HE1 MET 36 1HE MET 36 -11.668 6.504 -0.773 109 HE2 MET 36 2HE MET 36 -11.524 4.828 -0.245 110 HE3 MET 36 3HE MET 36 -11.820 5.197 -1.945 111 H LEU 37 H LEU 37 -8.307 2.267 -5.232 112 HA LEU 37 HA LEU 37 -5.683 3.020 -4.659 113 HB2 LEU 37 1HB LEU 37 -6.283 0.779 -5.378 114 HB3 LEU 37 2HB LEU 37 -6.785 1.394 -6.949 115 HG LEU 37 HG LEU 37 -4.389 2.107 -7.321 116 HD11 LEU 37 1HD1 LEU 37 -2.694 0.913 -5.961 117 HD12 LEU 37 2HD1 LEU 37 -3.978 0.436 -4.850 118 HD13 LEU 37 3HD1 LEU 37 -3.585 2.138 -5.062 119 HD21 LEU 37 1HD2 LEU 37 -3.661 -0.133 -7.938 120 HD22 LEU 37 2HD2 LEU 37 -5.362 0.111 -8.342 121 HD23 LEU 37 3HD2 LEU 37 -4.917 -0.834 -6.920 122 H GLN 38 H GLN 38 -7.738 3.755 -7.451 123 HA GLN 38 HA GLN 38 -5.757 5.057 -8.980 124 HB2 GLN 38 1HB GLN 38 -8.762 5.357 -8.987 125 HB3 GLN 38 2HB GLN 38 -7.703 6.113 -10.167 126 HG2 GLN 38 1HG GLN 38 -8.073 3.162 -9.712 127 HG3 GLN 38 2HG GLN 38 -8.665 4.102 -11.079 128 HE21 GLN 38 1HE2 GLN 38 -5.900 2.630 -9.594 129 HE22 GLN 38 2HE2 GLN 38 -4.830 2.794 -10.945 130 H THR 39 H THR 39 -7.950 6.200 -6.479 131 HA THR 39 HA THR 39 -7.191 8.954 -6.731 132 HB THR 39 HB THR 39 -8.443 7.521 -4.371 133 HG1 THR 39 HG1 THR 39 -9.699 8.977 -6.483 134 HG21 THR 39 1HG2 THR 39 -8.447 10.453 -5.117 135 HG22 THR 39 2HG2 THR 39 -7.510 9.733 -3.809 136 HG23 THR 39 3HG2 THR 39 -9.272 9.731 -3.736 137 H PHE 40 H PHE 40 -6.037 6.178 -4.988 138 HA PHE 40 HA PHE 40 -4.342 7.545 -3.165 139 HB2 PHE 40 1HB PHE 40 -5.184 5.271 -2.767 140 HB3 PHE 40 2HB PHE 40 -4.251 4.687 -4.138 141 HD1 PHE 40 HD1 PHE 40 -3.767 6.484 -0.897 142 HD2 PHE 40 HD2 PHE 40 -2.202 3.760 -3.771 143 HE1 PHE 40 HE1 PHE 40 -1.856 6.027 0.581 144 HE2 PHE 40 HE2 PHE 40 -0.294 3.298 -2.302 145 HZ PHE 40 HZ PHE 40 -0.114 4.430 -0.124 146 H VAL 41 H VAL 41 -3.896 6.272 -6.411 147 HA VAL 41 HA VAL 41 -1.172 6.150 -6.638 148 HB VAL 41 HB VAL 41 -3.194 6.999 -8.700 149 HG11 VAL 41 1HG1 VAL 41 -0.281 6.365 -9.129 150 HG12 VAL 41 2HG1 VAL 41 -1.034 7.947 -9.323 151 HG13 VAL 41 3HG1 VAL 41 -1.478 6.620 -10.397 152 HG21 VAL 41 1HG2 VAL 41 -1.689 4.432 -8.238 153 HG22 VAL 41 2HG2 VAL 41 -2.808 4.740 -9.568 154 HG23 VAL 41 3HG2 VAL 41 -3.397 4.717 -7.906 155 HA PRO 42 HA PRO 42 -0.994 10.967 -7.774 156 HB2 PRO 42 1HB PRO 42 -3.260 11.791 -6.032 157 HB3 PRO 42 2HB PRO 42 -2.701 12.485 -7.558 158 HG2 PRO 42 1HG PRO 42 -4.893 10.983 -7.474 159 HG3 PRO 42 2HG PRO 42 -3.763 10.873 -8.835 160 HD2 PRO 42 1HD PRO 42 -4.162 9.007 -6.542 161 HD3 PRO 42 2HD PRO 42 -3.765 8.652 -8.233 162 H TYR 43 H TYR 43 -1.764 9.406 -4.724 163 HA TYR 43 HA TYR 43 -0.573 11.509 -3.114 164 HB2 TYR 43 1HB TYR 43 -1.652 8.758 -2.474 165 HB3 TYR 43 2HB TYR 43 -0.762 9.709 -1.285 166 HD1 TYR 43 HD1 TYR 43 -3.862 9.547 -3.286 167 HD2 TYR 43 HD2 TYR 43 -1.766 11.582 -0.192 168 HE1 TYR 43 HE1 TYR 43 -5.932 10.706 -2.652 169 HE2 TYR 43 HE2 TYR 43 -3.834 12.746 0.449 170 HH TYR 43 HH TYR 43 -6.895 11.812 -0.705 171 H ARG 44 H ARG 44 0.203 8.394 -4.474 172 HA ARG 44 HA ARG 44 2.619 7.853 -3.196 173 HB2 ARG 44 1HB ARG 44 1.737 7.185 -6.007 174 HB3 ARG 44 2HB ARG 44 3.186 6.538 -5.253 175 HG2 ARG 44 1HG ARG 44 1.809 5.497 -3.516 176 HG3 ARG 44 2HG ARG 44 0.359 6.117 -4.315 177 HD2 ARG 44 1HD ARG 44 0.837 4.810 -6.291 178 HD3 ARG 44 2HD ARG 44 2.383 4.297 -5.623 179 HE ARG 44 HE ARG 44 0.620 3.397 -3.796 180 HH11 ARG 44 1HH1 ARG 44 0.797 3.101 -7.277 181 HH12 ARG 44 2HH1 ARG 44 0.030 1.545 -7.318 182 HH21 ARG 44 1HH2 ARG 44 -0.397 1.337 -3.840 183 HH22 ARG 44 2HH2 ARG 44 -0.650 0.539 -5.359 184 H THR 45 H THR 45 1.964 9.675 -6.153 185 HA THR 45 HA THR 45 4.481 10.297 -6.973 186 HB THR 45 HB THR 45 2.158 12.222 -6.941 187 HG1 THR 45 HG1 THR 45 2.842 10.072 -8.686 188 HG21 THR 45 1HG2 THR 45 3.165 13.075 -9.021 189 HG22 THR 45 2HG2 THR 45 4.526 11.974 -8.800 190 HG23 THR 45 3HG2 THR 45 4.243 13.272 -7.639 191 H ALA 46 H ALA 46 2.701 11.879 -4.344 192 HA ALA 46 HA ALA 46 4.562 13.943 -3.847 193 HB1 ALA 46 1HB ALA 46 3.490 14.116 -1.643 194 HB2 ALA 46 2HB ALA 46 2.658 12.588 -1.936 195 HB3 ALA 46 3HB ALA 46 2.301 13.994 -2.939 196 H VAL 47 H VAL 47 4.265 10.674 -2.739 197 HA VAL 47 HA VAL 47 6.449 10.743 -0.873 198 HB VAL 47 HB VAL 47 5.027 8.398 -2.149 199 HG11 VAL 47 1HG1 VAL 47 7.054 8.415 0.083 200 HG12 VAL 47 2HG1 VAL 47 7.279 7.730 -1.526 201 HG13 VAL 47 3HG1 VAL 47 6.102 7.019 -0.421 202 HG21 VAL 47 1HG2 VAL 47 3.981 8.156 0.053 203 HG22 VAL 47 2HG2 VAL 47 3.624 9.728 -0.664 204 HG23 VAL 47 3HG2 VAL 47 4.834 9.594 0.614 205 H GLU 48 H GLU 48 6.020 9.681 -4.203 206 HA GLU 48 HA GLU 48 8.558 8.532 -4.576 207 HB2 GLU 48 1HB GLU 48 6.780 9.814 -6.665 208 HB3 GLU 48 2HB GLU 48 8.087 8.683 -6.969 209 HG2 GLU 48 1HG GLU 48 5.533 8.083 -5.489 210 HG3 GLU 48 2HG GLU 48 5.925 7.600 -7.137 211 H LEU 49 H LEU 49 7.342 11.813 -5.121 212 HA LEU 49 HA LEU 49 9.655 12.847 -6.339 213 HB2 LEU 49 1HB LEU 49 7.244 13.961 -5.061 214 HB3 LEU 49 2HB LEU 49 8.642 15.023 -5.064 215 HG LEU 49 HG LEU 49 7.129 15.407 -6.986 216 HD11 LEU 49 1HD1 LEU 49 9.838 14.342 -7.765 217 HD12 LEU 49 2HD1 LEU 49 9.510 15.955 -7.137 218 HD13 LEU 49 3HD1 LEU 49 8.848 15.466 -8.696 219 HD21 LEU 49 1HD2 LEU 49 7.971 12.641 -7.840 220 HD22 LEU 49 2HD2 LEU 49 7.023 13.779 -8.796 221 HD23 LEU 49 3HD2 LEU 49 6.356 13.109 -7.306 222 H CYS 50 H CYS 50 8.697 12.668 -2.937 223 HA CYS 50 HA CYS 50 10.964 13.997 -1.905 224 HB2 CYS 50 1HB CYS 50 9.067 13.683 -0.479 225 HB3 CYS 50 2HB CYS 50 9.103 11.941 -0.710 226 H ALA 51 H ALA 51 10.268 10.558 -2.441 227 HA ALA 51 HA ALA 51 12.729 9.501 -1.675 228 HB1 ALA 51 1HB ALA 51 10.727 8.153 -2.155 229 HB2 ALA 51 2HB ALA 51 12.161 7.555 -2.989 230 HB3 ALA 51 3HB ALA 51 10.946 8.474 -3.877 231 H LEU 52 H LEU 52 11.872 11.212 -4.582 232 HA LEU 52 HA LEU 52 14.279 10.434 -5.981 233 HB2 LEU 52 1HB LEU 52 12.159 12.491 -6.601 234 HB3 LEU 52 2HB LEU 52 13.545 12.192 -7.629 235 HG LEU 52 HG LEU 52 11.419 10.151 -6.955 236 HD11 LEU 52 1HD1 LEU 52 11.887 11.728 -9.480 237 HD12 LEU 52 2HD1 LEU 52 10.540 11.930 -8.360 238 HD13 LEU 52 3HD1 LEU 52 10.709 10.432 -9.276 239 HD21 LEU 52 1HD2 LEU 52 13.770 10.046 -8.840 240 HD22 LEU 52 2HD2 LEU 52 12.477 8.851 -8.774 241 HD23 LEU 52 3HD2 LEU 52 13.537 9.078 -7.384 242 H GLU 53 H GLU 53 13.208 13.075 -3.984 243 HA GLU 53 HA GLU 53 15.298 14.882 -4.702 244 HB2 GLU 53 1HB GLU 53 13.130 15.652 -3.846 245 HB3 GLU 53 2HB GLU 53 13.459 14.874 -2.305 246 HG2 GLU 53 1HG GLU 53 13.878 17.197 -2.060 247 HG3 GLU 53 2HG GLU 53 15.432 16.367 -2.046 248 H HIS 54 H HIS 54 14.778 12.634 -2.037 249 HA HIS 54 HA HIS 54 17.439 13.375 -0.981 250 HB2 HIS 54 1HB HIS 54 15.079 12.157 0.463 251 HB3 HIS 54 2HB HIS 54 16.664 12.406 1.186 252 HD1 HIS 54 HD1 HIS 54 17.225 14.735 2.006 253 HD2 HIS 54 HD2 HIS 54 13.624 14.554 -0.059 254 HE1 HIS 54 HE1 HIS 54 16.109 16.955 2.395 255 HE2 HIS 54 HE2 HIS 54 13.858 16.748 1.283 256 H GLY 55 H GLY 55 15.738 11.003 -2.560 257 HA2 GLY 55 1HA GLY 55 16.261 8.925 -3.322 258 HA3 GLY 55 2HA GLY 55 17.878 9.158 -2.682 259 H GLY 56 H GLY 56 16.955 9.449 0.153 260 HA2 GLY 56 1HA GLY 56 15.593 6.887 0.512 261 HA3 GLY 56 2HA GLY 56 16.493 7.756 1.743 262 H LEU 57 H LEU 57 13.827 6.616 1.847 263 HA LEU 57 HA LEU 57 11.887 8.713 1.755 264 HB2 LEU 57 1HB LEU 57 11.807 6.004 3.077 265 HB3 LEU 57 2HB LEU 57 10.435 7.080 2.906 266 HG LEU 57 HG LEU 57 11.952 5.942 0.564 267 HD11 LEU 57 1HD1 LEU 57 10.916 4.170 1.932 268 HD12 LEU 57 2HD1 LEU 57 10.179 4.327 0.340 269 HD13 LEU 57 3HD1 LEU 57 9.359 4.979 1.757 270 HD21 LEU 57 1HD2 LEU 57 10.736 7.974 0.046 271 HD22 LEU 57 2HD2 LEU 57 9.279 7.319 0.788 272 HD23 LEU 57 3HD2 LEU 57 9.926 6.585 -0.679 273 H ASP 58 H ASP 58 14.372 8.244 3.843 274 HA ASP 58 HA ASP 58 13.332 8.301 6.403 275 HB2 ASP 58 1HB ASP 58 15.833 9.704 5.451 276 HB3 ASP 58 2HB ASP 58 15.462 9.269 7.115 277 H THR 59 H THR 59 13.729 10.948 4.144 278 HA THR 59 HA THR 59 12.879 12.899 6.115 279 HB THR 59 HB THR 59 13.135 14.508 4.215 280 HG1 THR 59 HG1 THR 59 12.717 12.979 2.527 281 HG21 THR 59 1HG2 THR 59 15.486 12.682 4.736 282 HG22 THR 59 2HG2 THR 59 15.004 14.056 5.731 283 HG23 THR 59 3HG2 THR 59 15.582 14.319 4.086 284 H CYS 60 H CYS 60 11.203 10.720 4.312 285 HA CYS 60 HA CYS 60 9.278 12.578 3.177 286 HB2 CYS 60 1HB CYS 60 9.398 9.566 3.004 287 HB3 CYS 60 2HB CYS 60 8.361 10.619 2.048 288 H ASP 61 H ASP 61 8.690 13.205 5.461 289 HA ASP 61 HA ASP 61 6.651 11.358 6.518 290 HB2 ASP 61 1HB ASP 61 8.248 13.539 7.865 291 HB3 ASP 61 2HB ASP 61 6.797 12.852 8.592 292 H GLY 62 H GLY 62 4.587 12.134 6.994 293 HA2 GLY 62 1HA GLY 62 3.609 13.979 5.073 294 HA3 GLY 62 2HA GLY 62 2.675 13.235 6.360 295 H GLY 63 H GLY 63 3.792 16.104 5.161 296 HA2 GLY 63 1HA GLY 63 2.968 18.123 6.240 297 HA3 GLY 63 2HA GLY 63 3.428 17.410 7.780 298 H SER 64 H SER 64 5.783 16.646 5.570 299 HA SER 64 HA SER 64 7.286 19.111 5.874 300 HB2 SER 64 1HB SER 64 7.722 17.875 7.956 301 HB3 SER 64 2HB SER 64 8.241 16.476 7.021 302 HG SER 64 HG SER 64 9.702 18.517 7.826 303 H ASN 65 H ASN 65 9.455 18.913 4.770 304 HA ASN 65 HA ASN 65 10.621 18.644 2.849 305 HB2 ASN 65 1HB ASN 65 9.856 15.819 3.534 306 HB3 ASN 65 2HB ASN 65 10.872 16.184 2.142 307 HD21 ASN 65 1HD2 ASN 65 10.646 16.352 5.641 308 HD22 ASN 65 2HD2 ASN 65 12.344 16.533 5.931 309 H GLY 66 H GLY 66 8.064 19.558 2.320 310 HA2 GLY 66 1HA GLY 66 7.057 20.099 0.292 311 HA3 GLY 66 2HA GLY 66 7.938 18.782 -0.467 312 H ILE 67 H ILE 67 6.725 17.252 2.057 313 HA ILE 67 HA ILE 67 4.458 16.289 0.518 314 HB ILE 67 HB ILE 67 5.664 15.183 3.058 315 HG12 ILE 67 1HG1 ILE 67 5.988 14.368 0.162 316 HG13 ILE 67 2HG1 ILE 67 7.236 15.047 1.204 317 HG21 ILE 67 1HG2 ILE 67 4.358 13.171 2.552 318 HG22 ILE 67 2HG2 ILE 67 3.646 13.985 1.158 319 HG23 ILE 67 3HG2 ILE 67 3.314 14.573 2.787 320 HD11 ILE 67 1HD1 ILE 67 7.149 13.062 2.608 321 HD12 ILE 67 2HD1 ILE 67 7.509 12.652 0.929 322 HD13 ILE 67 3HD1 ILE 67 5.890 12.384 1.577 323 HA PRO 68 HA PRO 68 1.828 18.842 3.083 324 HB2 PRO 68 1HB PRO 68 -0.389 17.482 1.746 325 HB3 PRO 68 2HB PRO 68 0.068 19.186 1.695 326 HG2 PRO 68 1HG PRO 68 0.358 17.537 -0.429 327 HG3 PRO 68 2HG PRO 68 1.442 18.908 -0.114 328 HD2 PRO 68 1HD PRO 68 1.869 15.985 0.392 329 HD3 PRO 68 2HD PRO 68 3.017 17.213 -0.201 330 H SER 69 H SER 69 0.723 18.500 4.960 331 HA SER 69 HA SER 69 0.742 16.108 6.311 332 HB2 SER 69 1HB SER 69 -1.054 17.159 7.748 333 HB3 SER 69 2HB SER 69 0.380 18.155 7.505 334 HG SER 69 HG SER 69 -1.087 19.585 6.957 335 HA PRO 70 HA PRO 70 -2.046 13.609 4.002 336 HB2 PRO 70 1HB PRO 70 -2.611 11.784 6.001 337 HB3 PRO 70 2HB PRO 70 -1.189 11.729 4.952 338 HG2 PRO 70 1HG PRO 70 -1.462 12.805 7.727 339 HG3 PRO 70 2HG PRO 70 -0.141 11.862 7.013 340 HD2 PRO 70 1HD PRO 70 0.084 14.507 7.348 341 HD3 PRO 70 2HD PRO 70 0.749 13.708 5.908 342 H THR 71 H THR 71 -4.113 13.799 3.574 343 HA THR 71 HA THR 71 -5.932 14.651 5.722 344 HB THR 71 HB THR 71 -5.396 16.488 4.114 345 HG1 THR 71 HG1 THR 71 -7.342 16.975 4.790 346 HG21 THR 71 1HG2 THR 71 -6.309 16.374 1.833 347 HG22 THR 71 2HG2 THR 71 -6.749 14.687 2.103 348 HG23 THR 71 3HG2 THR 71 -5.052 15.166 2.099 349 H THR 72 H THR 72 -8.314 14.346 4.752 350 HA THR 72 HA THR 72 -8.400 11.677 3.532 351 HB THR 72 HB THR 72 -10.443 11.228 4.952 352 HG1 THR 72 HG1 THR 72 -9.397 13.455 6.411 353 HG21 THR 72 1HG2 THR 72 -7.812 11.570 6.395 354 HG22 THR 72 2HG2 THR 72 -8.286 10.178 5.421 355 HG23 THR 72 3HG2 THR 72 -9.147 10.542 6.914 356 H THR 73 H THR 73 -9.544 11.640 1.754 357 HA THR 73 HA THR 73 -11.290 13.756 0.967 358 HB THR 73 HB THR 73 -11.757 12.415 -1.005 359 HG1 THR 73 HG1 THR 73 -10.997 10.269 -1.143 360 HG21 THR 73 1HG2 THR 73 -9.492 12.067 -1.873 361 HG22 THR 73 2HG2 THR 73 -8.847 12.160 -0.234 362 HG23 THR 73 3HG2 THR 73 -9.598 13.578 -0.967 363 H ARG 74 H ARG 74 -13.579 12.887 0.104 364 HA ARG 74 HA ARG 74 -15.150 12.404 2.322 365 HB2 ARG 74 1HB ARG 74 -16.180 13.278 0.370 366 HB3 ARG 74 2HB ARG 74 -15.651 11.918 -0.609 367 HG2 ARG 74 1HG ARG 74 -18.031 11.790 -0.152 368 HG3 ARG 74 2HG ARG 74 -17.171 10.446 0.596 369 HD2 ARG 74 1HD ARG 74 -17.187 11.684 2.742 370 HD3 ARG 74 2HD ARG 74 -18.153 12.945 1.975 371 HE ARG 74 HE ARG 74 -19.721 10.920 1.504 372 HH11 ARG 74 1HH1 ARG 74 -17.854 11.498 4.417 373 HH12 ARG 74 2HH1 ARG 74 -18.992 10.696 5.450 374 HH21 ARG 74 1HH2 ARG 74 -21.205 9.850 2.868 375 HH22 ARG 74 2HH2 ARG 74 -20.896 9.758 4.572 376 H TYR 75 H TYR 75 -13.841 10.021 -0.009 377 HA TYR 75 HA TYR 75 -15.174 7.904 1.447 378 HB2 TYR 75 1HB TYR 75 -13.444 7.697 -1.018 379 HB3 TYR 75 2HB TYR 75 -14.564 6.483 -0.392 380 HD1 TYR 75 HD1 TYR 75 -17.057 7.238 -0.198 381 HD2 TYR 75 HD2 TYR 75 -14.174 9.157 -2.666 382 HE1 TYR 75 HE1 TYR 75 -18.867 8.203 -1.556 383 HE2 TYR 75 HE2 TYR 75 -15.973 10.125 -4.028 384 HH TYR 75 HH TYR 75 -18.303 9.695 -4.569 385 H VAL 76 H VAL 76 -12.072 9.364 1.468 386 HA VAL 76 HA VAL 76 -10.670 6.954 2.249 387 HB VAL 76 HB VAL 76 -9.800 9.845 2.183 388 HG11 VAL 76 1HG1 VAL 76 -7.566 9.118 2.800 389 HG12 VAL 76 2HG1 VAL 76 -8.122 7.451 2.936 390 HG13 VAL 76 3HG1 VAL 76 -8.706 8.667 4.070 391 HG21 VAL 76 1HG2 VAL 76 -8.320 9.072 0.401 392 HG22 VAL 76 2HG2 VAL 76 -10.007 8.716 0.021 393 HG23 VAL 76 3HG2 VAL 76 -8.942 7.433 0.591 394 H SER 77 H SER 77 -10.260 6.257 4.238 395 HA SER 77 HA SER 77 -11.909 7.424 6.321 396 HB2 SER 77 1HB SER 77 -11.901 4.952 5.795 397 HB3 SER 77 2HB SER 77 -10.266 4.884 6.458 398 HG SER 77 HG SER 77 -12.197 4.415 7.873 399 H ALA 78 H ALA 78 -8.497 6.558 5.833 400 HA ALA 78 HA ALA 78 -7.511 8.662 7.424 401 HB1 ALA 78 1HB ALA 78 -6.620 7.389 9.316 402 HB2 ALA 78 2HB ALA 78 -7.447 5.944 8.735 403 HB3 ALA 78 3HB ALA 78 -8.383 7.334 9.284 404 H MET 79 H MET 79 -5.282 8.809 7.315 405 HA MET 79 HA MET 79 -3.634 6.673 6.403 406 HB2 MET 79 1HB MET 79 -2.860 7.821 4.317 407 HB3 MET 79 2HB MET 79 -4.498 7.190 4.227 408 HG2 MET 79 1HG MET 79 -5.448 9.340 4.380 409 HG3 MET 79 2HG MET 79 -3.925 10.063 4.888 410 HE1 MET 79 1HE MET 79 -5.844 8.343 1.901 411 HE2 MET 79 2HE MET 79 -4.360 7.399 2.018 412 HE3 MET 79 3HE MET 79 -4.637 8.437 0.619 413 H SER 80 H SER 80 -1.535 7.049 6.898 414 HA SER 80 HA SER 80 -0.729 9.788 7.579 415 HB2 SER 80 1HB SER 80 -0.220 7.351 9.311 416 HB3 SER 80 2HB SER 80 0.357 8.985 9.634 417 HG SER 80 HG SER 80 -1.912 9.605 9.661 418 H VAL 81 H VAL 81 1.407 10.269 7.142 419 HA VAL 81 HA VAL 81 2.815 8.244 5.542 420 HB VAL 81 HB VAL 81 3.250 11.236 5.516 421 HG11 VAL 81 1HG1 VAL 81 4.160 9.072 3.623 422 HG12 VAL 81 2HG1 VAL 81 5.174 9.968 4.758 423 HG13 VAL 81 3HG1 VAL 81 4.417 10.804 3.403 424 HG21 VAL 81 1HG2 VAL 81 2.002 11.280 3.420 425 HG22 VAL 81 2HG2 VAL 81 0.991 10.736 4.760 426 HG23 VAL 81 3HG2 VAL 81 1.628 9.567 3.603 427 H ALA 82 H ALA 82 4.485 7.315 6.524 428 HA ALA 82 HA ALA 82 6.057 8.912 8.424 429 HB1 ALA 82 1HB ALA 82 6.193 7.037 9.946 430 HB2 ALA 82 2HB ALA 82 5.216 6.050 8.862 431 HB3 ALA 82 3HB ALA 82 4.502 7.450 9.664 432 H LYS 83 H LYS 83 7.937 9.078 7.600 433 HA LYS 83 HA LYS 83 9.798 8.747 6.244 434 HB2 LYS 83 1HB LYS 83 9.627 5.962 7.430 435 HB3 LYS 83 2HB LYS 83 11.062 6.711 6.742 436 HG2 LYS 83 1HG LYS 83 9.609 7.557 9.238 437 HG3 LYS 83 2HG LYS 83 11.191 6.783 9.145 438 HD2 LYS 83 1HD LYS 83 12.049 8.736 7.928 439 HD3 LYS 83 2HD LYS 83 10.471 9.504 8.064 440 HE2 LYS 83 1HE LYS 83 10.728 9.289 10.572 441 HE3 LYS 83 2HE LYS 83 12.405 8.840 10.271 442 HZ1 LYS 83 1HZ LYS 83 12.238 11.195 10.707 443 HZ2 LYS 83 2HZ LYS 83 11.095 11.383 9.468 444 HZ3 LYS 83 3HZ LYS 83 12.690 10.954 9.091 445 H GLY 84 H GLY 84 7.526 8.581 4.791 446 HA2 GLY 84 1HA GLY 84 7.020 8.145 2.590 447 HA3 GLY 84 2HA GLY 84 8.369 7.022 2.527 448 H VAL 85 H VAL 85 7.367 5.487 4.804 449 HA VAL 85 HA VAL 85 5.462 3.848 3.438 450 HB VAL 85 HB VAL 85 5.599 2.291 5.136 451 HG11 VAL 85 1HG1 VAL 85 8.153 3.850 5.447 452 HG12 VAL 85 2HG1 VAL 85 7.791 2.708 4.155 453 HG13 VAL 85 3HG1 VAL 85 7.915 2.143 5.821 454 HG21 VAL 85 1HG2 VAL 85 6.289 4.472 7.092 455 HG22 VAL 85 2HG2 VAL 85 6.184 2.753 7.468 456 HG23 VAL 85 3HG2 VAL 85 4.743 3.635 6.961 457 H VAL 86 H VAL 86 3.208 3.560 3.874 458 HA VAL 86 HA VAL 86 2.074 5.773 5.415 459 HB VAL 86 HB VAL 86 0.294 6.013 3.676 460 HG11 VAL 86 1HG1 VAL 86 2.096 7.623 3.809 461 HG12 VAL 86 2HG1 VAL 86 1.670 7.334 2.123 462 HG13 VAL 86 3HG1 VAL 86 3.122 6.599 2.805 463 HG21 VAL 86 1HG2 VAL 86 0.727 5.200 1.426 464 HG22 VAL 86 2HG2 VAL 86 0.590 3.859 2.564 465 HG23 VAL 86 3HG2 VAL 86 2.177 4.376 1.991 466 H SER 87 H SER 87 0.809 5.057 6.891 467 HA SER 87 HA SER 87 -0.485 2.464 6.592 468 HB2 SER 87 1HB SER 87 -0.965 2.913 9.111 469 HB3 SER 87 2HB SER 87 0.683 2.531 8.613 470 HG SER 87 HG SER 87 -0.316 4.807 9.731 471 H LEU 88 H LEU 88 -2.511 2.261 6.112 472 HA LEU 88 HA LEU 88 -4.387 4.468 6.687 473 HB2 LEU 88 1HB LEU 88 -4.582 2.341 4.542 474 HB3 LEU 88 2HB LEU 88 -5.790 3.570 4.869 475 HG LEU 88 HG LEU 88 -3.856 5.243 4.348 476 HD11 LEU 88 1HD1 LEU 88 -2.871 2.762 2.944 477 HD12 LEU 88 2HD1 LEU 88 -2.045 3.639 4.233 478 HD13 LEU 88 3HD1 LEU 88 -2.283 4.401 2.662 479 HD21 LEU 88 1HD2 LEU 88 -4.462 5.173 1.958 480 HD22 LEU 88 2HD2 LEU 88 -5.862 5.060 3.023 481 HD23 LEU 88 3HD2 LEU 88 -5.244 3.614 2.225 482 H THR 89 H THR 89 -6.409 3.865 7.622 483 HA THR 89 HA THR 89 -6.540 1.076 8.539 484 HB THR 89 HB THR 89 -7.112 3.459 10.312 485 HG1 THR 89 HG1 THR 89 -4.882 3.328 9.943 486 HG21 THR 89 1HG2 THR 89 -7.123 1.786 12.111 487 HG22 THR 89 2HG2 THR 89 -6.865 0.507 10.924 488 HG23 THR 89 3HG2 THR 89 -8.363 1.440 10.906 489 H GLY 90 H GLY 90 -8.485 0.173 8.584 490 HA2 GLY 90 1HA GLY 90 -10.711 -0.174 8.052 491 HA3 GLY 90 2HA GLY 90 -10.952 1.261 9.031 492 H GLN 91 H GLN 91 -9.543 0.795 5.798 493 HA GLN 91 HA GLN 91 -10.836 3.187 4.881 494 HB2 GLN 91 1HB GLN 91 -8.575 2.500 4.166 495 HB3 GLN 91 2HB GLN 91 -9.256 1.089 3.371 496 HG2 GLN 91 1HG GLN 91 -8.640 2.981 1.872 497 HG3 GLN 91 2HG GLN 91 -10.305 2.419 1.724 498 HE21 GLN 91 1HE2 GLN 91 -11.945 3.758 2.224 499 HE22 GLN 91 2HE2 GLN 91 -11.751 5.430 2.610 500 H GLU 92 H GLU 92 -12.805 3.333 4.027 501 HA GLU 92 HA GLU 92 -14.923 2.738 3.460 502 HB2 GLU 92 1HB GLU 92 -13.268 1.183 1.487 503 HB3 GLU 92 2HB GLU 92 -15.023 1.176 1.432 504 HG2 GLU 92 1HG GLU 92 -14.923 3.680 1.280 505 HG3 GLU 92 2HG GLU 92 -13.187 3.508 1.038 506 H SER 93 H SER 93 -14.736 -0.263 2.157 507 HA SER 93 HA SER 93 -16.264 -1.433 4.261 508 HB2 SER 93 1HB SER 93 -16.662 -1.863 1.837 509 HB3 SER 93 2HB SER 93 -15.126 -2.727 1.773 510 HG SER 93 HG SER 93 -16.433 -3.778 3.774 511 H LEU 94 H LEU 94 -12.968 -1.143 3.724 512 HA LEU 94 HA LEU 94 -12.180 -3.728 4.740 513 HB2 LEU 94 1HB LEU 94 -10.482 -1.295 4.198 514 HB3 LEU 94 2HB LEU 94 -9.909 -2.934 4.456 515 HG LEU 94 HG LEU 94 -11.528 -1.975 2.093 516 HD11 LEU 94 1HD1 LEU 94 -9.475 -2.472 0.830 517 HD12 LEU 94 2HD1 LEU 94 -8.641 -2.800 2.349 518 HD13 LEU 94 3HD1 LEU 94 -9.252 -1.181 2.010 519 HD21 LEU 94 1HD2 LEU 94 -11.148 -4.207 1.168 520 HD22 LEU 94 2HD2 LEU 94 -12.089 -4.277 2.657 521 HD23 LEU 94 3HD2 LEU 94 -10.379 -4.704 2.675 522 H ASN 95 H ASN 95 -13.838 -2.229 6.450 523 HA ASN 95 HA ASN 95 -12.588 -0.911 8.546 524 HB2 ASN 95 1HB ASN 95 -15.057 -1.177 8.259 525 HB3 ASN 95 2HB ASN 95 -14.897 -2.850 8.783 526 HD21 ASN 95 1HD2 ASN 95 -14.788 0.476 9.752 527 HD22 ASN 95 2HD2 ASN 95 -14.834 0.191 11.461 528 H GLY 96 H GLY 96 -11.322 -1.512 10.200 529 HA2 GLY 96 1HA GLY 96 -10.267 -2.938 11.720 530 HA3 GLY 96 2HA GLY 96 -11.026 -4.311 10.922 531 H LEU 97 H LEU 97 -9.965 -2.891 8.350 532 HA LEU 97 HA LEU 97 -7.511 -4.454 8.323 533 HB2 LEU 97 1HB LEU 97 -9.287 -4.725 6.586 534 HB3 LEU 97 2HB LEU 97 -8.970 -3.082 6.073 535 HG LEU 97 HG LEU 97 -6.763 -5.115 6.024 536 HD11 LEU 97 1HD1 LEU 97 -7.382 -5.699 3.754 537 HD12 LEU 97 2HD1 LEU 97 -8.795 -4.652 3.844 538 HD13 LEU 97 3HD1 LEU 97 -8.702 -6.095 4.852 539 HD21 LEU 97 1HD2 LEU 97 -7.394 -2.669 4.374 540 HD22 LEU 97 2HD2 LEU 97 -5.984 -3.707 4.174 541 HD23 LEU 97 3HD2 LEU 97 -6.189 -2.774 5.656 542 H SER 98 H SER 98 -5.567 -3.580 8.337 543 HA SER 98 HA SER 98 -5.316 -0.685 7.875 544 HB2 SER 98 1HB SER 98 -4.699 -1.476 10.162 545 HB3 SER 98 2HB SER 98 -3.463 -2.504 9.440 546 HG SER 98 HG SER 98 -3.527 0.272 8.936 547 H VAL 99 H VAL 99 -4.163 -0.042 6.176 548 HA VAL 99 HA VAL 99 -2.691 -2.071 4.636 549 HB VAL 99 HB VAL 99 -3.492 0.699 3.722 550 HG11 VAL 99 1HG1 VAL 99 -1.634 -0.276 2.490 551 HG12 VAL 99 2HG1 VAL 99 -3.077 -0.172 1.480 552 HG13 VAL 99 3HG1 VAL 99 -2.594 -1.722 2.169 553 HG21 VAL 99 1HG2 VAL 99 -5.316 -0.362 2.479 554 HG22 VAL 99 2HG2 VAL 99 -5.506 -0.571 4.220 555 HG23 VAL 99 3HG2 VAL 99 -4.921 -1.907 3.231 556 H VAL 100 H VAL 100 -0.494 -1.959 4.517 557 HA VAL 100 HA VAL 100 0.762 0.553 5.389 558 HB VAL 100 HB VAL 100 1.844 -2.219 5.919 559 HG11 VAL 100 1HG1 VAL 100 3.460 -1.048 7.349 560 HG12 VAL 100 2HG1 VAL 100 2.770 0.497 6.851 561 HG13 VAL 100 3HG1 VAL 100 3.577 -0.532 5.667 562 HG21 VAL 100 1HG2 VAL 100 0.539 -0.293 7.840 563 HG22 VAL 100 2HG2 VAL 100 1.308 -1.820 8.272 564 HG23 VAL 100 3HG2 VAL 100 -0.146 -1.816 7.272 565 H MET 101 H MET 101 1.476 1.393 3.552 566 HA MET 101 HA MET 101 2.720 -0.392 1.567 567 HB2 MET 101 1HB MET 101 0.932 1.205 0.799 568 HB3 MET 101 2HB MET 101 2.027 2.526 1.193 569 HG2 MET 101 1HG MET 101 3.675 1.544 -0.386 570 HG3 MET 101 2HG MET 101 2.454 0.370 -0.857 571 HE1 MET 101 1HE MET 101 2.274 4.242 -0.058 572 HE2 MET 101 2HE MET 101 2.308 4.897 -1.693 573 HE3 MET 101 3HE MET 101 3.708 4.031 -1.062 574 H THR 102 H THR 102 4.803 -0.656 1.758 575 HA THR 102 HA THR 102 6.480 1.566 2.712 576 HB THR 102 HB THR 102 7.170 -1.377 2.546 577 HG1 THR 102 HG1 THR 102 6.849 -0.118 5.014 578 HG21 THR 102 1HG2 THR 102 9.070 -0.806 3.958 579 HG22 THR 102 2HG2 THR 102 8.577 0.886 3.963 580 HG23 THR 102 3HG2 THR 102 9.117 0.131 2.464 581 HA PRO 103 HA PRO 103 7.588 1.603 -1.723 582 HB2 PRO 103 1HB PRO 103 8.761 4.200 -1.022 583 HB3 PRO 103 2HB PRO 103 7.508 3.822 -2.210 584 HG2 PRO 103 1HG PRO 103 6.958 5.139 0.082 585 HG3 PRO 103 2HG PRO 103 5.802 4.027 -0.674 586 HD2 PRO 103 1HD PRO 103 7.630 3.569 1.657 587 HD3 PRO 103 2HD PRO 103 5.933 3.074 1.445 588 H GLY 104 H GLY 104 9.597 1.618 -2.815 589 HA2 GLY 104 1HA GLY 104 12.036 1.927 -2.704 590 HA3 GLY 104 2HA GLY 104 11.950 1.333 -1.050 591 H TRP 105 H TRP 105 13.173 0.412 -3.772 592 HA TRP 105 HA TRP 105 11.928 -2.011 -4.469 593 HB2 TRP 105 1HB TRP 105 13.587 -0.819 -5.897 594 HB3 TRP 105 2HB TRP 105 14.855 -1.299 -4.773 595 HD1 TRP 105 HD1 TRP 105 12.258 -2.954 -7.121 596 HE1 TRP 105 HE1 TRP 105 13.247 -5.176 -7.970 597 HE3 TRP 105 HE3 TRP 105 16.613 -2.986 -4.443 598 HZ2 TRP 105 HZ2 TRP 105 15.565 -6.725 -7.565 599 HZ3 TRP 105 HZ3 TRP 105 18.163 -4.875 -4.735 600 HH2 TRP 105 HH2 TRP 105 17.646 -6.705 -6.263 601 H ASP 106 H ASP 106 11.643 -3.677 -3.191 602 HA ASP 106 HA ASP 106 13.687 -4.279 -1.168 603 HB2 ASP 106 1HB ASP 106 11.538 -3.680 -0.187 604 HB3 ASP 106 2HB ASP 106 10.730 -4.895 -1.165 605 H ASN 107 H ASN 107 14.962 -5.801 -1.904 606 HA ASN 107 HA ASN 107 14.260 -7.663 -3.922 607 HB2 ASN 107 1HB ASN 107 16.562 -6.844 -3.537 608 HB3 ASN 107 2HB ASN 107 16.597 -7.695 -1.996 609 HD21 ASN 107 1HD2 ASN 107 18.322 -8.959 -2.563 610 HD22 ASN 107 2HD2 ASN 107 18.208 -10.241 -3.719 611 H ALA 108 H ALA 108 14.061 -7.712 -0.462 612 HA ALA 108 HA ALA 108 14.201 -10.481 -0.018 613 HB1 ALA 108 1HB ALA 108 13.204 -10.016 2.145 614 HB2 ALA 108 2HB ALA 108 12.711 -8.414 1.593 615 HB3 ALA 108 3HB ALA 108 14.423 -8.802 1.758 616 H ASN 109 H ASN 109 11.327 -8.373 -0.214 617 HA ASN 109 HA ASN 109 9.605 -10.691 -0.470 618 HB2 ASN 109 1HB ASN 109 9.101 -7.724 -0.396 619 HB3 ASN 109 2HB ASN 109 7.820 -8.853 -0.820 620 HD21 ASN 109 1HD2 ASN 109 6.965 -10.182 0.748 621 HD22 ASN 109 2HD2 ASN 109 7.290 -9.966 2.432 622 H GLY 110 H GLY 110 11.187 -8.436 -2.540 623 HA2 GLY 110 1HA GLY 110 11.583 -8.809 -4.822 624 HA3 GLY 110 2HA GLY 110 10.256 -9.960 -4.845 625 H VAL 111 H VAL 111 9.826 -6.818 -3.431 626 HA VAL 111 HA VAL 111 7.829 -6.227 -5.460 627 HB VAL 111 HB VAL 111 7.282 -4.254 -3.989 628 HG11 VAL 111 1HG1 VAL 111 6.203 -5.625 -2.252 629 HG12 VAL 111 2HG1 VAL 111 7.190 -7.001 -2.740 630 HG13 VAL 111 3HG1 VAL 111 6.011 -6.318 -3.861 631 HG21 VAL 111 1HG2 VAL 111 9.480 -4.058 -2.902 632 HG22 VAL 111 2HG2 VAL 111 9.197 -5.598 -2.087 633 HG23 VAL 111 3HG2 VAL 111 8.170 -4.211 -1.732 634 H THR 112 H THR 112 7.961 -4.705 -6.953 635 HA THR 112 HA THR 112 10.563 -3.888 -7.742 636 HB THR 112 HB THR 112 7.977 -2.918 -8.953 637 HG1 THR 112 HG1 THR 112 8.499 -4.936 -10.333 638 HG21 THR 112 1HG2 THR 112 10.702 -3.496 -10.123 639 HG22 THR 112 2HG2 THR 112 10.023 -1.896 -9.818 640 HG23 THR 112 3HG2 THR 112 9.290 -2.951 -11.028 641 H GLY 113 H GLY 113 7.869 -2.199 -6.214 642 HA2 GLY 113 1HA GLY 113 9.599 0.140 -5.905 643 HA3 GLY 113 2HA GLY 113 8.083 0.375 -6.758 644 H TRP 114 H TRP 114 6.404 -1.258 -5.200 645 HA TRP 114 HA TRP 114 6.555 0.084 -2.584 646 HB2 TRP 114 1HB TRP 114 4.054 -0.349 -4.233 647 HB3 TRP 114 2HB TRP 114 4.104 0.338 -2.612 648 HD1 TRP 114 HD1 TRP 114 5.492 2.768 -2.441 649 HE1 TRP 114 HE1 TRP 114 5.536 4.716 -4.137 650 HE3 TRP 114 HE3 TRP 114 3.851 0.261 -6.581 651 HZ2 TRP 114 HZ2 TRP 114 4.919 5.121 -6.856 652 HZ3 TRP 114 HZ3 TRP 114 3.591 1.506 -8.687 653 HH2 TRP 114 HH2 TRP 114 4.114 3.887 -8.818 654 H ALA 115 H ALA 115 6.482 -1.287 -0.909 655 HA ALA 115 HA ALA 115 5.463 -3.986 -1.297 656 HB1 ALA 115 1HB ALA 115 6.254 -4.426 0.947 657 HB2 ALA 115 2HB ALA 115 6.570 -2.713 1.203 658 HB3 ALA 115 3HB ALA 115 7.524 -3.616 0.030 659 H ARG 116 H ARG 116 3.376 -4.379 -1.038 660 HA ARG 116 HA ARG 116 1.808 -2.483 0.578 661 HB2 ARG 116 1HB ARG 116 0.893 -4.252 -1.696 662 HB3 ARG 116 2HB ARG 116 -0.160 -3.229 -0.733 663 HG2 ARG 116 1HG ARG 116 0.145 -1.913 -2.572 664 HG3 ARG 116 2HG ARG 116 1.455 -1.330 -1.547 665 HD2 ARG 116 1HD ARG 116 3.048 -2.107 -2.940 666 HD3 ARG 116 2HD ARG 116 2.174 -3.606 -3.255 667 HE ARG 116 HE ARG 116 0.748 -1.684 -4.579 668 HH11 ARG 116 1HH1 ARG 116 4.083 -2.774 -4.675 669 HH12 ARG 116 2HH1 ARG 116 4.280 -2.396 -6.360 670 HH21 ARG 116 1HH2 ARG 116 1.030 -1.189 -6.798 671 HH22 ARG 116 2HH2 ARG 116 2.560 -1.500 -7.559 672 H ASN 117 H ASN 117 0.951 -3.196 2.385 673 HA ASN 117 HA ASN 117 0.519 -6.089 2.720 674 HB2 ASN 117 1HB ASN 117 1.575 -4.162 4.808 675 HB3 ASN 117 2HB ASN 117 1.197 -5.853 5.086 676 HD21 ASN 117 1HD2 ASN 117 3.448 -3.608 3.750 677 HD22 ASN 117 2HD2 ASN 117 4.709 -4.749 3.418 678 H CYS 118 H CYS 118 -1.499 -6.593 3.347 679 HA CYS 118 HA CYS 118 -3.147 -4.441 4.504 680 HB2 CYS 118 1HB CYS 118 -4.027 -6.774 2.785 681 HB3 CYS 118 2HB CYS 118 -5.098 -5.567 3.496 682 H ASN 119 H ASN 119 -3.579 -4.754 6.580 683 HA ASN 119 HA ASN 119 -3.522 -7.513 7.617 684 HB2 ASN 119 1HB ASN 119 -2.954 -4.893 9.016 685 HB3 ASN 119 2HB ASN 119 -2.998 -6.459 9.817 686 HD21 ASN 119 1HD2 ASN 119 -1.374 -7.973 9.370 687 HD22 ASN 119 2HD2 ASN 119 0.134 -7.501 8.667 688 H ILE 120 H ILE 120 -5.531 -8.249 7.757 689 HA ILE 120 HA ILE 120 -7.462 -6.681 9.301 690 HB ILE 120 HB ILE 120 -8.210 -6.329 7.091 691 HG12 ILE 120 1HG1 ILE 120 -10.344 -7.575 6.940 692 HG13 ILE 120 2HG1 ILE 120 -9.782 -8.649 8.210 693 HG21 ILE 120 1HG2 ILE 120 -8.557 -8.152 5.469 694 HG22 ILE 120 2HG2 ILE 120 -7.808 -9.268 6.610 695 HG23 ILE 120 3HG2 ILE 120 -6.869 -7.937 5.933 696 HD11 ILE 120 1HD1 ILE 120 -10.218 -5.689 8.508 697 HD12 ILE 120 2HD1 ILE 120 -9.760 -6.815 9.785 698 HD13 ILE 120 3HD1 ILE 120 -11.341 -6.948 9.018 699 H GLN 121 H GLN 121 -7.743 -7.852 11.118 700 HA GLN 121 HA GLN 121 -7.012 -10.616 11.203 701 HB2 GLN 121 1HB GLN 121 -8.279 -8.888 13.333 702 HB3 GLN 121 2HB GLN 121 -7.578 -10.479 13.591 703 HG2 GLN 121 1HG GLN 121 -5.394 -9.611 12.893 704 HG3 GLN 121 2HG GLN 121 -6.111 -8.013 12.691 705 HE21 GLN 121 1HE2 GLN 121 -5.103 -10.436 14.963 706 HE22 GLN 121 2HE2 GLN 121 -5.175 -9.433 16.369 707 H SER 122 H SER 122 -10.119 -8.897 11.242 708 HA SER 122 HA SER 122 -11.505 -11.291 12.088 709 HB2 SER 122 1HB SER 122 -12.664 -8.609 11.315 710 HB3 SER 122 2HB SER 122 -13.459 -9.880 12.245 711 HG SER 122 HG SER 122 -12.157 -9.467 13.955 712 H ASP 123 H ASP 123 -10.667 -9.905 9.098 713 HA ASP 123 HA ASP 123 -12.606 -11.599 7.718 714 HB2 ASP 123 1HB ASP 123 -12.285 -8.632 7.257 715 HB3 ASP 123 2HB ASP 123 -13.023 -9.705 6.077 716 H SER 124 H SER 124 -10.762 -12.896 7.267 717 HA SER 124 HA SER 124 -8.395 -11.997 6.092 718 HB2 SER 124 1HB SER 124 -9.661 -14.703 5.636 719 HB3 SER 124 2HB SER 124 -7.942 -14.300 5.631 720 HG SER 124 HG SER 124 -8.117 -14.955 7.643 721 H ALA 125 H ALA 125 -11.511 -12.665 4.660 722 HA ALA 125 HA ALA 125 -10.724 -12.910 1.971 723 HB1 ALA 125 1HB ALA 125 -13.047 -12.395 1.429 724 HB2 ALA 125 2HB ALA 125 -13.319 -11.860 3.087 725 HB3 ALA 125 3HB ALA 125 -12.940 -13.550 2.757 726 H LEU 126 H LEU 126 -11.289 -10.103 4.003 727 HA LEU 126 HA LEU 126 -11.332 -8.219 1.875 728 HB2 LEU 126 1HB LEU 126 -10.736 -7.869 4.808 729 HB3 LEU 126 2HB LEU 126 -10.883 -6.542 3.674 730 HG LEU 126 HG LEU 126 -13.068 -8.476 4.444 731 HD11 LEU 126 1HD1 LEU 126 -12.739 -5.537 5.002 732 HD12 LEU 126 2HD1 LEU 126 -12.541 -6.836 6.174 733 HD13 LEU 126 3HD1 LEU 126 -14.121 -6.529 5.455 734 HD21 LEU 126 1HD2 LEU 126 -13.104 -6.154 2.522 735 HD22 LEU 126 2HD2 LEU 126 -14.531 -7.014 3.098 736 HD23 LEU 126 3HD2 LEU 126 -13.328 -7.857 2.125 737 H GLN 127 H GLN 127 -8.829 -9.706 3.802 738 HA GLN 127 HA GLN 127 -6.671 -8.085 2.992 739 HB2 GLN 127 1HB GLN 127 -6.372 -9.652 4.809 740 HB3 GLN 127 2HB GLN 127 -6.764 -11.008 3.759 741 HG2 GLN 127 1HG GLN 127 -4.743 -10.574 2.450 742 HG3 GLN 127 2HG GLN 127 -4.344 -9.231 3.522 743 HE21 GLN 127 1HE2 GLN 127 -4.544 -12.679 3.200 744 HE22 GLN 127 2HE2 GLN 127 -3.639 -13.068 4.621 745 H GLN 128 H GLN 128 -8.152 -10.958 1.623 746 HA GLN 128 HA GLN 128 -6.403 -11.422 -0.494 747 HB2 GLN 128 1HB GLN 128 -9.395 -11.858 -0.402 748 HB3 GLN 128 2HB GLN 128 -8.294 -12.595 -1.559 749 HG2 GLN 128 1HG GLN 128 -7.197 -13.816 0.211 750 HG3 GLN 128 2HG GLN 128 -8.198 -13.011 1.419 751 HE21 GLN 128 1HE2 GLN 128 -7.903 -15.844 0.831 752 HE22 GLN 128 2HE2 GLN 128 -9.488 -16.424 0.458 753 H ALA 129 H ALA 129 -9.331 -9.437 -0.347 754 HA ALA 129 HA ALA 129 -9.202 -8.565 -3.038 755 HB1 ALA 129 1HB ALA 129 -10.909 -6.943 -2.390 756 HB2 ALA 129 2HB ALA 129 -10.625 -7.322 -0.691 757 HB3 ALA 129 3HB ALA 129 -11.285 -8.551 -1.771 758 H CYS 130 H CYS 130 -8.226 -7.091 0.034 759 HA CYS 130 HA CYS 130 -7.437 -4.605 -1.000 760 HB2 CYS 130 1HB CYS 130 -7.805 -4.969 1.382 761 HB3 CYS 130 2HB CYS 130 -6.443 -6.087 1.445 762 H GLU 131 H GLU 131 -5.485 -7.495 -0.261 763 HA GLU 131 HA GLU 131 -3.042 -6.358 -1.104 764 HB2 GLU 131 1HB GLU 131 -3.297 -8.344 0.406 765 HB3 GLU 131 2HB GLU 131 -3.778 -9.288 -0.995 766 HG2 GLU 131 1HG GLU 131 -1.582 -8.782 -2.030 767 HG3 GLU 131 2HG GLU 131 -1.106 -7.982 -0.530 768 H ASP 132 H ASP 132 -5.613 -8.032 -2.764 769 HA ASP 132 HA ASP 132 -4.148 -8.657 -5.120 770 HB2 ASP 132 1HB ASP 132 -6.520 -9.494 -4.208 771 HB3 ASP 132 2HB ASP 132 -7.090 -8.217 -5.278 772 H VAL 133 H VAL 133 -6.195 -5.950 -4.140 773 HA VAL 133 HA VAL 133 -5.985 -4.697 -6.731 774 HB VAL 133 HB VAL 133 -7.193 -3.698 -4.149 775 HG11 VAL 133 1HG1 VAL 133 -7.333 -2.500 -6.915 776 HG12 VAL 133 2HG1 VAL 133 -6.442 -1.835 -5.546 777 HG13 VAL 133 3HG1 VAL 133 -8.201 -1.929 -5.490 778 HG21 VAL 133 1HG2 VAL 133 -8.446 -4.780 -6.669 779 HG22 VAL 133 2HG2 VAL 133 -9.322 -4.110 -5.295 780 HG23 VAL 133 3HG2 VAL 133 -8.381 -5.587 -5.102 781 H PHE 134 H PHE 134 -4.706 -4.041 -3.455 782 HA PHE 134 HA PHE 134 -3.521 -1.593 -4.370 783 HB2 PHE 134 1HB PHE 134 -3.519 -3.041 -1.743 784 HB3 PHE 134 2HB PHE 134 -2.419 -1.697 -2.021 785 HD1 PHE 134 HD1 PHE 134 -5.987 -2.655 -1.908 786 HD2 PHE 134 HD2 PHE 134 -3.170 0.538 -1.954 787 HE1 PHE 134 HE1 PHE 134 -7.783 -1.065 -1.368 788 HE2 PHE 134 HE2 PHE 134 -4.962 2.128 -1.410 789 HZ PHE 134 HZ PHE 134 -7.275 1.329 -1.124 790 H ARG 135 H ARG 135 -2.468 -4.870 -4.254 791 HA ARG 135 HA ARG 135 0.294 -3.947 -4.652 792 HB2 ARG 135 1HB ARG 135 0.039 -5.515 -2.789 793 HB3 ARG 135 2HB ARG 135 -0.718 -6.681 -3.859 794 HG2 ARG 135 1HG ARG 135 1.360 -6.861 -5.135 795 HG3 ARG 135 2HG ARG 135 2.126 -5.699 -4.054 796 HD2 ARG 135 1HD ARG 135 1.738 -7.233 -2.168 797 HD3 ARG 135 2HD ARG 135 1.029 -8.402 -3.282 798 HE ARG 135 HE ARG 135 3.535 -7.830 -4.287 799 HH11 ARG 135 1HH1 ARG 135 2.217 -9.161 -1.325 800 HH12 ARG 135 2HH1 ARG 135 3.605 -10.142 -0.994 801 HH21 ARG 135 1HH2 ARG 135 5.375 -9.131 -3.842 802 HH22 ARG 135 2HH2 ARG 135 5.395 -10.123 -2.420 803 H PHE 136 H PHE 136 0.605 -3.657 -6.774 804 HA PHE 136 HA PHE 136 0.391 -6.103 -8.377 805 HB2 PHE 136 1HB PHE 136 -0.223 -3.287 -9.279 806 HB3 PHE 136 2HB PHE 136 0.149 -4.585 -10.401 807 HD1 PHE 136 HD1 PHE 136 -1.343 -6.714 -10.212 808 HD2 PHE 136 HD2 PHE 136 -2.421 -2.881 -8.697 809 HE1 PHE 136 HE1 PHE 136 -3.716 -7.351 -10.291 810 HE2 PHE 136 HE2 PHE 136 -4.793 -3.522 -8.772 811 HZ PHE 136 HZ PHE 136 -5.443 -5.756 -9.571 812 H ASP 137 H ASP 137 2.493 -6.715 -8.346 813 HA ASP 137 HA ASP 137 4.571 -4.824 -8.990 814 HB2 ASP 137 1HB ASP 137 4.597 -7.841 -8.707 815 HB3 ASP 137 2HB ASP 137 6.025 -6.872 -9.045 816 H ASP 138 H ASP 138 5.952 -5.112 -10.862 817 HA ASP 138 HA ASP 138 4.394 -4.796 -13.160 818 HB2 ASP 138 1HB ASP 138 6.450 -4.420 -14.343 819 HB3 ASP 138 2HB ASP 138 6.609 -3.712 -12.740 820 H ALA 139 H ALA 139 5.785 -7.634 -11.815 821 HA ALA 139 HA ALA 139 5.858 -9.153 -14.241 822 HB1 ALA 139 1HB ALA 139 6.210 -11.084 -12.785 823 HB2 ALA 139 2HB ALA 139 5.824 -10.096 -11.375 824 HB3 ALA 139 3HB ALA 139 7.265 -9.747 -12.333 825 H ASN 140 H ASN 140 3.435 -8.266 -11.978 826 HA ASN 140 HA ASN 140 1.614 -10.382 -12.842 827 HB2 ASN 140 1HB ASN 140 1.248 -8.184 -10.785 828 HB3 ASN 140 2HB ASN 140 0.093 -9.471 -11.117 829 HD21 ASN 140 1HD2 ASN 140 0.543 -11.565 -10.428 830 HD22 ASN 140 2HD2 ASN 140 1.777 -11.899 -9.263 831 H LEU 141 H LEU 141 2.603 -7.545 -14.009 832 HA LEU 141 HA LEU 141 -0.037 -6.819 -15.083 833 HB2 LEU 141 1HB LEU 141 2.398 -5.066 -14.734 834 HB3 LEU 141 2HB LEU 141 0.876 -4.560 -15.440 835 HG LEU 141 HG LEU 141 1.262 -5.431 -12.573 836 HD11 LEU 141 1HD1 LEU 141 2.347 -3.308 -13.000 837 HD12 LEU 141 2HD1 LEU 141 0.881 -3.057 -12.054 838 HD13 LEU 141 3HD1 LEU 141 0.891 -2.691 -13.779 839 HD21 LEU 141 1HD2 LEU 141 -1.136 -4.307 -14.017 840 HD22 LEU 141 2HD2 LEU 141 -1.018 -4.532 -12.274 841 HD23 LEU 141 3HD2 LEU 141 -0.974 -5.930 -13.348 842 H VAL 142 H VAL 142 -0.087 -7.959 -16.965 843 HA VAL 142 HA VAL 142 2.172 -8.344 -18.630 844 HB VAL 142 HB VAL 142 0.255 -9.875 -18.681 845 HG11 VAL 142 1HG1 VAL 142 -1.252 -7.591 -19.948 846 HG12 VAL 142 2HG1 VAL 142 -1.560 -8.295 -18.362 847 HG13 VAL 142 3HG1 VAL 142 -1.827 -9.252 -19.817 848 HG21 VAL 142 1HG2 VAL 142 0.765 -8.498 -21.314 849 HG22 VAL 142 2HG2 VAL 142 0.054 -10.099 -21.123 850 HG23 VAL 142 3HG2 VAL 142 1.715 -9.808 -20.612 851 HA PRO 143 HA PRO 143 2.372 -4.332 -20.582 852 HB2 PRO 143 1HB PRO 143 3.583 -5.916 -22.782 853 HB3 PRO 143 2HB PRO 143 4.209 -4.494 -21.947 854 HG2 PRO 143 1HG PRO 143 5.212 -6.927 -21.482 855 HG3 PRO 143 2HG PRO 143 5.050 -5.728 -20.185 856 HD2 PRO 143 1HD PRO 143 3.383 -8.139 -20.758 857 HD3 PRO 143 2HD PRO 143 3.836 -7.416 -19.201 858 H ARG 144 H ARG 144 0.934 -3.329 -21.834 859 HA ARG 144 HA ARG 144 -1.173 -4.829 -23.034 860 HB2 ARG 144 1HB ARG 144 -0.621 -1.861 -23.230 861 HB3 ARG 144 2HB ARG 144 -2.136 -2.669 -23.609 862 HG2 ARG 144 1HG ARG 144 -2.349 -3.363 -21.271 863 HG3 ARG 144 2HG ARG 144 -0.847 -2.517 -20.893 864 HD2 ARG 144 1HD ARG 144 -1.859 -0.412 -21.632 865 HD3 ARG 144 2HD ARG 144 -3.360 -1.266 -21.985 866 HE ARG 144 HE ARG 144 -2.808 -1.802 -19.342 867 HH11 ARG 144 1HH1 ARG 144 -3.336 1.050 -21.288 868 HH12 ARG 144 2HH1 ARG 144 -4.035 1.966 -19.990 869 HH21 ARG 144 1HH2 ARG 144 -3.741 -0.605 -17.624 870 HH22 ARG 144 2HH2 ARG 144 -4.255 1.027 -17.901 871 H GLY 145 H GLY 145 -1.202 -5.670 -25.008 872 HA2 GLY 145 1HA GLY 145 0.932 -5.336 -26.831 873 HA3 GLY 145 2HA GLY 145 -0.579 -6.168 -27.162 874 H SER 146 H SER 146 0.973 -4.443 -28.906 875 HA SER 146 HA SER 146 -0.245 -1.877 -29.093 876 HB2 SER 146 1HB SER 146 1.995 -2.507 -30.058 877 HB3 SER 146 2HB SER 146 1.142 -3.435 -31.292 878 HG SER 146 HG SER 146 1.426 -0.690 -30.993 879 H GLY 147 H GLY 147 -2.232 -1.407 -29.796 880 HA2 GLY 147 1HA GLY 147 -3.870 -1.604 -31.611 881 HA3 GLY 147 2HA GLY 147 -3.546 -3.333 -31.613 882 H LEU 148 H LEU 148 -3.425 -3.149 -28.575 883 HA LEU 148 HA LEU 148 -6.269 -3.496 -28.104 884 HB2 LEU 148 1HB LEU 148 -3.950 -3.694 -26.169 885 HB3 LEU 148 2HB LEU 148 -5.594 -4.215 -25.863 886 HG LEU 148 HG LEU 148 -3.697 -5.442 -27.871 887 HD11 LEU 148 1HD1 LEU 148 -3.740 -7.373 -26.365 888 HD12 LEU 148 2HD1 LEU 148 -4.728 -6.458 -25.225 889 HD13 LEU 148 3HD1 LEU 148 -3.079 -5.942 -25.576 890 HD21 LEU 148 1HD2 LEU 148 -6.519 -6.179 -27.103 891 HD22 LEU 148 2HD2 LEU 148 -5.439 -7.194 -28.056 892 HD23 LEU 148 3HD2 LEU 148 -5.956 -5.627 -28.680 893 H GLU 149 H GLU 149 -7.132 -1.451 -28.275 894 HA GLU 149 HA GLU 149 -5.984 0.639 -26.552 895 HB2 GLU 149 1HB GLU 149 -7.844 0.979 -28.916 896 HB3 GLU 149 2HB GLU 149 -7.042 2.263 -28.025 897 HG2 GLU 149 1HG GLU 149 -4.868 1.415 -28.790 898 HG3 GLU 149 2HG GLU 149 -5.695 0.166 -29.715 899 H HIS 150 H HIS 150 -8.982 -0.971 -27.464 900 HA HIS 150 HA HIS 150 -10.560 0.699 -25.693 901 HB2 HIS 150 1HB HIS 150 -11.338 -1.684 -27.384 902 HB3 HIS 150 2HB HIS 150 -12.463 -0.725 -26.432 903 HD1 HIS 150 HD1 HIS 150 -12.957 1.707 -27.291 904 HD2 HIS 150 HD2 HIS 150 -10.615 -0.609 -29.821 905 HE1 HIS 150 HE1 HIS 150 -12.993 2.885 -29.508 906 HE2 HIS 150 HE2 HIS 150 -11.482 1.523 -30.993 907 H HIS 151 H HIS 151 -9.979 0.258 -23.595 908 HA HIS 151 HA HIS 151 -9.753 -2.333 -22.521 909 HB2 HIS 151 1HB HIS 151 -10.161 -1.181 -20.295 910 HB3 HIS 151 2HB HIS 151 -8.802 -0.591 -21.236 911 HD1 HIS 151 HD1 HIS 151 -8.707 1.870 -21.597 912 HD2 HIS 151 HD2 HIS 151 -12.502 0.612 -20.473 913 HE1 HIS 151 HE1 HIS 151 -10.035 3.970 -21.233 914 HE2 HIS 151 HE2 HIS 151 -12.369 3.179 -20.731 915 H HIS 152 H HIS 152 -11.302 -3.780 -22.704 916 HA HIS 152 HA HIS 152 -13.899 -3.176 -21.515 917 HB2 HIS 152 1HB HIS 152 -14.168 -2.831 -23.954 918 HB3 HIS 152 2HB HIS 152 -13.606 -4.475 -24.235 919 HD1 HIS 152 HD1 HIS 152 -16.573 -2.542 -22.988 920 HD2 HIS 152 HD2 HIS 152 -15.491 -6.479 -23.775 921 HE1 HIS 152 HE1 HIS 152 -18.708 -3.864 -22.897 922 HE2 HIS 152 HE2 HIS 152 -18.005 -6.260 -23.211 923 H HIS 153 H HIS 153 -11.398 -5.388 -22.390 924 HA HIS 153 HA HIS 153 -12.650 -7.405 -20.650 925 HB2 HIS 153 1HB HIS 153 -10.806 -7.847 -23.010 926 HB3 HIS 153 2HB HIS 153 -11.285 -9.109 -21.881 927 HD1 HIS 153 HD1 HIS 153 -13.855 -9.788 -21.915 928 HD2 HIS 153 HD2 HIS 153 -12.611 -7.297 -25.001 929 HE1 HIS 153 HE1 HIS 153 -15.668 -9.906 -23.649 930 HE2 HIS 153 HE2 HIS 153 -14.989 -8.233 -25.408 931 H HIS 154 H HIS 154 -11.319 -5.400 -19.496 932 HA HIS 154 HA HIS 154 -9.161 -6.684 -18.161 933 HB2 HIS 154 1HB HIS 154 -8.131 -5.808 -20.358 934 HB3 HIS 154 2HB HIS 154 -8.355 -4.203 -19.674 935 HD1 HIS 154 HD1 HIS 154 -6.075 -7.048 -19.694 936 HD2 HIS 154 HD2 HIS 154 -6.834 -3.802 -17.209 937 HE1 HIS 154 HE1 HIS 154 -4.054 -6.842 -18.214 938 HE2 HIS 154 HE2 HIS 154 -4.590 -4.955 -16.635 939 H HIS 155 H HIS 155 -10.416 -3.473 -19.011 940 HA HIS 155 HA HIS 155 -11.166 -3.041 -16.238 941 HB2 HIS 155 1HB HIS 155 -8.859 -2.084 -16.501 942 HB3 HIS 155 2HB HIS 155 -9.490 -1.016 -17.746 943 HD1 HIS 155 HD1 HIS 155 -11.221 0.832 -16.928 944 HD2 HIS 155 HD2 HIS 155 -9.237 -1.230 -13.909 945 HE1 HIS 155 HE1 HIS 155 -11.535 2.211 -14.843 946 HE2 HIS 155 HE2 HIS 155 -10.286 0.972 -13.041 Start of MODEL 17 1 H1 MET 24 1H MET 24 -17.079 -14.329 0.774 2 H2 MET 24 2H MET 24 -18.386 -13.890 -0.200 3 H3 MET 24 3H MET 24 -17.285 -12.718 0.305 4 HA MET 24 HA MET 24 -15.533 -13.761 -0.951 5 HB2 MET 24 1HB MET 24 -16.397 -16.052 -0.855 6 HB3 MET 24 2HB MET 24 -17.742 -15.601 -1.891 7 HG2 MET 24 1HG MET 24 -16.005 -16.791 -3.118 8 HG3 MET 24 2HG MET 24 -16.221 -15.149 -3.720 9 HE1 MET 24 1HE MET 24 -12.393 -15.789 -4.243 10 HE2 MET 24 2HE MET 24 -13.928 -15.387 -5.014 11 HE3 MET 24 3HE MET 24 -13.665 -17.004 -4.364 12 H GLU 25 H GLU 25 -18.881 -12.982 -1.740 13 HA GLU 25 HA GLU 25 -18.233 -11.943 -4.336 14 HB2 GLU 25 1HB GLU 25 -20.684 -11.538 -2.614 15 HB3 GLU 25 2HB GLU 25 -20.524 -10.993 -4.276 16 HG2 GLU 25 1HG GLU 25 -20.146 -13.382 -4.922 17 HG3 GLU 25 2HG GLU 25 -20.577 -13.822 -3.270 18 H ASN 26 H ASN 26 -16.430 -10.666 -3.669 19 HA ASN 26 HA ASN 26 -17.202 -8.078 -2.497 20 HB2 ASN 26 1HB ASN 26 -14.845 -7.934 -1.680 21 HB3 ASN 26 2HB ASN 26 -15.762 -9.247 -0.953 22 HD21 ASN 26 1HD2 ASN 26 -14.020 -10.513 -0.433 23 HD22 ASN 26 2HD2 ASN 26 -13.016 -11.278 -1.618 24 H TYR 27 H TYR 27 -17.209 -8.944 -5.294 25 HA TYR 27 HA TYR 27 -14.829 -8.081 -6.589 26 HB2 TYR 27 1HB TYR 27 -17.582 -8.534 -7.762 27 HB3 TYR 27 2HB TYR 27 -16.073 -8.434 -8.664 28 HD1 TYR 27 HD1 TYR 27 -14.482 -10.277 -8.645 29 HD2 TYR 27 HD2 TYR 27 -18.113 -10.512 -6.433 30 HE1 TYR 27 HE1 TYR 27 -14.140 -12.692 -8.344 31 HE2 TYR 27 HE2 TYR 27 -17.776 -12.928 -6.132 32 HH TYR 27 HH TYR 27 -16.589 -14.764 -7.165 33 H LEU 28 H LEU 28 -17.950 -6.568 -5.937 34 HA LEU 28 HA LEU 28 -17.383 -4.168 -7.354 35 HB2 LEU 28 1HB LEU 28 -19.277 -4.708 -5.063 36 HB3 LEU 28 2HB LEU 28 -19.212 -3.196 -5.946 37 HG LEU 28 HG LEU 28 -19.893 -5.867 -7.185 38 HD11 LEU 28 1HD1 LEU 28 -21.612 -5.187 -5.604 39 HD12 LEU 28 2HD1 LEU 28 -22.189 -5.011 -7.261 40 HD13 LEU 28 3HD1 LEU 28 -21.683 -3.590 -6.345 41 HD21 LEU 28 1HD2 LEU 28 -20.038 -3.046 -8.248 42 HD22 LEU 28 2HD2 LEU 28 -20.646 -4.480 -9.072 43 HD23 LEU 28 3HD2 LEU 28 -18.918 -4.304 -8.771 44 H ARG 29 H ARG 29 -16.802 -5.288 -4.083 45 HA ARG 29 HA ARG 29 -15.811 -2.841 -3.067 46 HB2 ARG 29 1HB ARG 29 -16.490 -4.567 -1.531 47 HB3 ARG 29 2HB ARG 29 -15.331 -5.698 -2.211 48 HG2 ARG 29 1HG ARG 29 -13.511 -4.586 -1.262 49 HG3 ARG 29 2HG ARG 29 -14.459 -3.136 -0.932 50 HD2 ARG 29 1HD ARG 29 -14.081 -4.314 1.129 51 HD3 ARG 29 2HD ARG 29 -15.788 -4.425 0.705 52 HE ARG 29 HE ARG 29 -14.043 -6.646 -0.035 53 HH11 ARG 29 1HH1 ARG 29 -16.589 -5.373 2.017 54 HH12 ARG 29 2HH1 ARG 29 -17.012 -6.929 2.661 55 HH21 ARG 29 1HH2 ARG 29 -14.599 -8.696 0.854 56 HH22 ARG 29 2HH2 ARG 29 -15.894 -8.804 2.001 57 H LYS 30 H LYS 30 -14.328 -5.546 -4.757 58 HA LYS 30 HA LYS 30 -11.659 -4.761 -4.571 59 HB2 LYS 30 1HB LYS 30 -13.133 -6.214 -6.765 60 HB3 LYS 30 2HB LYS 30 -11.401 -5.929 -6.820 61 HG2 LYS 30 1HG LYS 30 -11.215 -7.144 -4.642 62 HG3 LYS 30 2HG LYS 30 -12.920 -7.568 -4.806 63 HD2 LYS 30 1HD LYS 30 -12.430 -8.681 -6.934 64 HD3 LYS 30 2HD LYS 30 -10.726 -8.257 -6.762 65 HE2 LYS 30 1HE LYS 30 -10.721 -9.542 -4.608 66 HE3 LYS 30 2HE LYS 30 -12.348 -10.095 -5.008 67 HZ1 LYS 30 1HZ LYS 30 -11.448 -11.076 -7.044 68 HZ2 LYS 30 2HZ LYS 30 -10.712 -11.722 -5.668 69 HZ3 LYS 30 3HZ LYS 30 -9.887 -10.581 -6.610 70 H ALA 31 H ALA 31 -14.091 -3.892 -7.068 71 HA ALA 31 HA ALA 31 -12.576 -2.098 -8.497 72 HB1 ALA 31 1HB ALA 31 -14.802 -2.840 -9.163 73 HB2 ALA 31 2HB ALA 31 -14.688 -1.079 -9.165 74 HB3 ALA 31 3HB ALA 31 -15.511 -1.908 -7.844 75 H ALA 32 H ALA 32 -14.386 -1.541 -5.502 76 HA ALA 32 HA ALA 32 -14.035 1.252 -5.394 77 HB1 ALA 32 1HB ALA 32 -14.565 1.055 -3.019 78 HB2 ALA 32 2HB ALA 32 -14.320 -0.689 -3.100 79 HB3 ALA 32 3HB ALA 32 -15.648 0.056 -3.987 80 H LEU 33 H LEU 33 -12.121 -1.428 -4.168 81 HA LEU 33 HA LEU 33 -10.103 0.154 -2.941 82 HB2 LEU 33 1HB LEU 33 -10.260 -2.705 -3.857 83 HB3 LEU 33 2HB LEU 33 -8.747 -2.035 -3.280 84 HG LEU 33 HG LEU 33 -9.356 -2.218 -1.124 85 HD11 LEU 33 1HD1 LEU 33 -11.587 -1.680 -0.229 86 HD12 LEU 33 2HD1 LEU 33 -12.151 -1.372 -1.870 87 HD13 LEU 33 3HD1 LEU 33 -10.896 -0.357 -1.163 88 HD21 LEU 33 1HD2 LEU 33 -11.613 -3.837 -2.281 89 HD22 LEU 33 2HD2 LEU 33 -10.933 -3.993 -0.662 90 HD23 LEU 33 3HD2 LEU 33 -9.955 -4.397 -2.074 91 H THR 34 H THR 34 -10.631 -1.085 -6.159 92 HA THR 34 HA THR 34 -8.109 -0.503 -7.262 93 HB THR 34 HB THR 34 -10.806 -0.441 -8.637 94 HG1 THR 34 HG1 THR 34 -10.103 -2.462 -7.526 95 HG21 THR 34 1HG2 THR 34 -8.017 -0.755 -9.754 96 HG22 THR 34 2HG2 THR 34 -9.070 0.646 -9.958 97 HG23 THR 34 3HG2 THR 34 -9.512 -0.902 -10.680 98 H ASP 35 H ASP 35 -11.027 1.431 -6.790 99 HA ASP 35 HA ASP 35 -10.098 3.726 -8.176 100 HB2 ASP 35 1HB ASP 35 -12.214 3.385 -6.044 101 HB3 ASP 35 2HB ASP 35 -11.869 4.930 -6.817 102 H MET 36 H MET 36 -9.988 2.677 -4.813 103 HA MET 36 HA MET 36 -8.860 5.016 -3.731 104 HB2 MET 36 1HB MET 36 -9.845 3.123 -2.407 105 HB3 MET 36 2HB MET 36 -8.412 2.178 -2.770 106 HG2 MET 36 1HG MET 36 -8.289 4.822 -1.356 107 HG3 MET 36 2HG MET 36 -8.516 3.296 -0.506 108 HE1 MET 36 1HE MET 36 -6.362 3.913 0.971 109 HE2 MET 36 2HE MET 36 -6.160 5.406 0.057 110 HE3 MET 36 3HE MET 36 -4.792 4.315 0.275 111 H LEU 37 H LEU 37 -7.351 2.057 -4.990 112 HA LEU 37 HA LEU 37 -4.685 2.820 -4.572 113 HB2 LEU 37 1HB LEU 37 -5.324 0.529 -5.077 114 HB3 LEU 37 2HB LEU 37 -5.885 1.014 -6.674 115 HG LEU 37 HG LEU 37 -3.481 1.700 -7.166 116 HD11 LEU 37 1HD1 LEU 37 -2.656 1.801 -4.881 117 HD12 LEU 37 2HD1 LEU 37 -1.748 0.613 -5.814 118 HD13 LEU 37 3HD1 LEU 37 -2.980 0.081 -4.671 119 HD21 LEU 37 1HD2 LEU 37 -3.990 -1.212 -6.588 120 HD22 LEU 37 2HD2 LEU 37 -2.826 -0.551 -7.737 121 HD23 LEU 37 3HD2 LEU 37 -4.555 -0.348 -8.017 122 H GLN 38 H GLN 38 -6.854 3.316 -7.321 123 HA GLN 38 HA GLN 38 -4.920 4.460 -9.032 124 HB2 GLN 38 1HB GLN 38 -7.929 4.658 -9.006 125 HB3 GLN 38 2HB GLN 38 -6.924 5.352 -10.271 126 HG2 GLN 38 1HG GLN 38 -7.070 2.437 -9.538 127 HG3 GLN 38 2HG GLN 38 -7.849 3.197 -10.925 128 HE21 GLN 38 1HE2 GLN 38 -4.837 2.136 -9.554 129 HE22 GLN 38 2HE2 GLN 38 -3.901 2.255 -11.007 130 H THR 39 H THR 39 -6.960 5.818 -6.526 131 HA THR 39 HA THR 39 -6.272 8.541 -7.132 132 HB THR 39 HB THR 39 -7.336 7.367 -4.549 133 HG1 THR 39 HG1 THR 39 -8.881 8.755 -6.472 134 HG21 THR 39 1HG2 THR 39 -7.361 10.208 -5.582 135 HG22 THR 39 2HG2 THR 39 -6.358 9.600 -4.267 136 HG23 THR 39 3HG2 THR 39 -8.112 9.645 -4.090 137 H PHE 40 H PHE 40 -4.935 5.971 -5.181 138 HA PHE 40 HA PHE 40 -3.282 7.597 -3.535 139 HB2 PHE 40 1HB PHE 40 -4.048 5.272 -2.992 140 HB3 PHE 40 2HB PHE 40 -2.927 4.678 -4.211 141 HD1 PHE 40 HD1 PHE 40 -1.056 3.728 -3.343 142 HD2 PHE 40 HD2 PHE 40 -2.734 7.113 -1.382 143 HE1 PHE 40 HE1 PHE 40 0.741 3.646 -1.675 144 HE2 PHE 40 HE2 PHE 40 -0.938 7.038 0.291 145 HZ PHE 40 HZ PHE 40 0.807 5.302 0.151 146 H VAL 41 H VAL 41 -2.781 5.947 -6.604 147 HA VAL 41 HA VAL 41 -0.006 6.076 -6.748 148 HB VAL 41 HB VAL 41 -1.990 6.181 -9.018 149 HG11 VAL 41 1HG1 VAL 41 -0.147 5.446 -10.443 150 HG12 VAL 41 2HG1 VAL 41 0.964 5.594 -9.083 151 HG13 VAL 41 3HG1 VAL 41 0.178 7.029 -9.739 152 HG21 VAL 41 1HG2 VAL 41 -1.442 3.781 -9.224 153 HG22 VAL 41 2HG2 VAL 41 -2.217 4.181 -7.690 154 HG23 VAL 41 3HG2 VAL 41 -0.475 3.905 -7.755 155 HA PRO 42 HA PRO 42 -0.564 10.471 -9.013 156 HB2 PRO 42 1HB PRO 42 -2.896 11.290 -7.346 157 HB3 PRO 42 2HB PRO 42 -2.471 11.754 -8.998 158 HG2 PRO 42 1HG PRO 42 -4.398 9.978 -8.536 159 HG3 PRO 42 2HG PRO 42 -3.287 9.794 -9.906 160 HD2 PRO 42 1HD PRO 42 -3.370 8.323 -7.318 161 HD3 PRO 42 2HD PRO 42 -2.893 7.755 -8.927 162 H TYR 43 H TYR 43 -1.393 9.803 -5.559 163 HA TYR 43 HA TYR 43 -0.111 12.198 -4.654 164 HB2 TYR 43 1HB TYR 43 -1.084 9.691 -3.269 165 HB3 TYR 43 2HB TYR 43 -0.214 10.960 -2.406 166 HD1 TYR 43 HD1 TYR 43 -1.307 12.936 -1.715 167 HD2 TYR 43 HD2 TYR 43 -3.306 10.237 -4.326 168 HE1 TYR 43 HE1 TYR 43 -3.410 14.155 -1.357 169 HE2 TYR 43 HE2 TYR 43 -5.413 11.452 -3.976 170 HH TYR 43 HH TYR 43 -5.552 14.505 -2.513 171 H ARG 44 H ARG 44 0.749 8.866 -5.194 172 HA ARG 44 HA ARG 44 3.226 8.816 -3.877 173 HB2 ARG 44 1HB ARG 44 2.319 7.301 -6.324 174 HB3 ARG 44 2HB ARG 44 3.782 6.949 -5.417 175 HG2 ARG 44 1HG ARG 44 0.996 6.839 -4.285 176 HG3 ARG 44 2HG ARG 44 1.903 5.447 -4.883 177 HD2 ARG 44 1HD ARG 44 2.312 5.357 -2.598 178 HD3 ARG 44 2HD ARG 44 3.721 6.222 -3.201 179 HE ARG 44 HE ARG 44 1.830 8.139 -2.520 180 HH11 ARG 44 1HH1 ARG 44 3.746 5.681 -0.933 181 HH12 ARG 44 2HH1 ARG 44 3.731 6.467 0.612 182 HH21 ARG 44 1HH2 ARG 44 1.790 9.194 -0.471 183 HH22 ARG 44 2HH2 ARG 44 2.614 8.470 0.872 184 H THR 45 H THR 45 2.367 9.666 -7.220 185 HA THR 45 HA THR 45 4.798 10.349 -8.233 186 HB THR 45 HB THR 45 2.262 11.939 -8.617 187 HG1 THR 45 HG1 THR 45 2.948 9.352 -9.268 188 HG21 THR 45 1HG2 THR 45 4.244 12.965 -9.624 189 HG22 THR 45 2HG2 THR 45 3.152 12.347 -10.864 190 HG23 THR 45 3HG2 THR 45 4.611 11.450 -10.449 191 H ALA 46 H ALA 46 2.768 12.379 -6.129 192 HA ALA 46 HA ALA 46 4.541 14.607 -6.130 193 HB1 ALA 46 1HB ALA 46 2.200 14.848 -5.502 194 HB2 ALA 46 2HB ALA 46 3.249 15.367 -4.181 195 HB3 ALA 46 3HB ALA 46 2.451 13.795 -4.109 196 H VAL 47 H VAL 47 4.217 11.729 -4.252 197 HA VAL 47 HA VAL 47 6.060 12.424 -2.188 198 HB VAL 47 HB VAL 47 5.095 9.691 -3.042 199 HG11 VAL 47 1HG1 VAL 47 6.486 10.516 -0.494 200 HG12 VAL 47 2HG1 VAL 47 7.221 9.589 -1.803 201 HG13 VAL 47 3HG1 VAL 47 5.881 8.905 -0.882 202 HG21 VAL 47 1HG2 VAL 47 3.290 11.132 -2.299 203 HG22 VAL 47 2HG2 VAL 47 4.191 11.544 -0.839 204 HG23 VAL 47 3HG2 VAL 47 3.613 9.895 -1.085 205 H GLU 48 H GLU 48 6.402 10.665 -5.257 206 HA GLU 48 HA GLU 48 9.073 9.851 -4.767 207 HB2 GLU 48 1HB GLU 48 9.221 9.300 -7.116 208 HB3 GLU 48 2HB GLU 48 7.666 8.777 -6.493 209 HG2 GLU 48 1HG GLU 48 6.586 10.680 -7.516 210 HG3 GLU 48 2HG GLU 48 8.144 11.286 -8.075 211 H LEU 49 H LEU 49 7.653 12.743 -6.161 212 HA LEU 49 HA LEU 49 10.010 14.013 -7.005 213 HB2 LEU 49 1HB LEU 49 7.457 15.148 -5.862 214 HB3 LEU 49 2HB LEU 49 8.726 16.134 -6.562 215 HG LEU 49 HG LEU 49 7.172 14.017 -8.054 216 HD11 LEU 49 1HD1 LEU 49 5.742 15.885 -7.430 217 HD12 LEU 49 2HD1 LEU 49 6.069 15.898 -9.163 218 HD13 LEU 49 3HD1 LEU 49 6.915 17.019 -8.097 219 HD21 LEU 49 1HD2 LEU 49 9.375 14.327 -8.990 220 HD22 LEU 49 2HD2 LEU 49 9.172 16.079 -8.971 221 HD23 LEU 49 3HD2 LEU 49 8.182 15.089 -10.043 222 H CYS 50 H CYS 50 8.352 13.986 -3.883 223 HA CYS 50 HA CYS 50 10.229 15.519 -2.440 224 HB2 CYS 50 1HB CYS 50 8.073 15.130 -1.472 225 HB3 CYS 50 2HB CYS 50 8.258 13.386 -1.600 226 H ALA 51 H ALA 51 10.172 12.211 -3.461 227 HA ALA 51 HA ALA 51 12.062 11.209 -1.558 228 HB1 ALA 51 1HB ALA 51 11.242 10.013 -4.204 229 HB2 ALA 51 2HB ALA 51 10.420 9.746 -2.668 230 HB3 ALA 51 3HB ALA 51 12.078 9.189 -2.888 231 H LEU 52 H LEU 52 12.181 12.439 -4.844 232 HA LEU 52 HA LEU 52 14.950 11.752 -5.211 233 HB2 LEU 52 1HB LEU 52 13.052 13.448 -6.834 234 HB3 LEU 52 2HB LEU 52 14.704 13.125 -7.308 235 HG LEU 52 HG LEU 52 12.559 11.025 -6.962 236 HD11 LEU 52 1HD1 LEU 52 13.771 12.190 -9.462 237 HD12 LEU 52 2HD1 LEU 52 12.127 12.456 -8.884 238 HD13 LEU 52 3HD1 LEU 52 12.633 10.844 -9.394 239 HD21 LEU 52 1HD2 LEU 52 14.741 10.107 -6.493 240 HD22 LEU 52 2HD2 LEU 52 15.400 10.843 -7.952 241 HD23 LEU 52 3HD2 LEU 52 14.206 9.552 -8.079 242 H GLU 53 H GLU 53 13.185 14.449 -4.003 243 HA GLU 53 HA GLU 53 15.039 16.503 -4.457 244 HB2 GLU 53 1HB GLU 53 12.752 16.982 -3.830 245 HB3 GLU 53 2HB GLU 53 12.967 16.170 -2.286 246 HG2 GLU 53 1HG GLU 53 14.540 17.872 -1.582 247 HG3 GLU 53 2HG GLU 53 14.398 18.674 -3.145 248 H HIS 54 H HIS 54 14.672 14.270 -1.730 249 HA HIS 54 HA HIS 54 17.239 15.280 -0.677 250 HB2 HIS 54 1HB HIS 54 15.277 15.427 0.854 251 HB3 HIS 54 2HB HIS 54 15.130 13.676 0.792 252 HD1 HIS 54 HD1 HIS 54 17.360 16.404 2.120 253 HD2 HIS 54 HD2 HIS 54 16.853 12.291 2.459 254 HE1 HIS 54 HE1 HIS 54 18.841 15.696 4.024 255 HE2 HIS 54 HE2 HIS 54 18.622 13.189 4.122 256 H GLY 55 H GLY 55 15.768 12.689 -2.252 257 HA2 GLY 55 1HA GLY 55 16.717 10.819 -3.190 258 HA3 GLY 55 2HA GLY 55 18.195 11.135 -2.290 259 H GLY 56 H GLY 56 16.804 11.247 0.307 260 HA2 GLY 56 1HA GLY 56 15.624 8.567 0.442 261 HA3 GLY 56 2HA GLY 56 16.267 9.463 1.809 262 H LEU 57 H LEU 57 13.637 8.155 1.316 263 HA LEU 57 HA LEU 57 11.653 10.197 1.151 264 HB2 LEU 57 1HB LEU 57 11.590 7.324 2.057 265 HB3 LEU 57 2HB LEU 57 10.173 8.354 2.116 266 HG LEU 57 HG LEU 57 11.663 7.992 -0.461 267 HD11 LEU 57 1HD1 LEU 57 9.519 6.175 0.630 268 HD12 LEU 57 2HD1 LEU 57 11.204 5.739 0.347 269 HD13 LEU 57 3HD1 LEU 57 10.158 6.144 -1.013 270 HD21 LEU 57 1HD2 LEU 57 9.996 9.746 -0.367 271 HD22 LEU 57 2HD2 LEU 57 8.800 8.608 0.253 272 HD23 LEU 57 3HD2 LEU 57 9.423 8.427 -1.385 273 H ASP 58 H ASP 58 13.859 9.578 3.482 274 HA ASP 58 HA ASP 58 12.598 9.559 5.918 275 HB2 ASP 58 1HB ASP 58 15.127 11.016 5.144 276 HB3 ASP 58 2HB ASP 58 14.614 10.720 6.802 277 H THR 59 H THR 59 13.008 12.255 3.725 278 HA THR 59 HA THR 59 11.943 14.120 5.683 279 HB THR 59 HB THR 59 12.328 15.772 3.774 280 HG1 THR 59 HG1 THR 59 12.647 14.728 1.938 281 HG21 THR 59 1HG2 THR 59 13.884 15.521 5.653 282 HG22 THR 59 2HG2 THR 59 14.752 15.818 4.148 283 HG23 THR 59 3HG2 THR 59 14.681 14.188 4.817 284 H CYS 60 H CYS 60 10.510 11.916 3.844 285 HA CYS 60 HA CYS 60 8.435 13.686 2.770 286 HB2 CYS 60 1HB CYS 60 9.024 10.774 2.216 287 HB3 CYS 60 2HB CYS 60 7.728 11.697 1.470 288 H ASP 61 H ASP 61 7.705 14.022 4.992 289 HA ASP 61 HA ASP 61 6.114 11.775 6.039 290 HB2 ASP 61 1HB ASP 61 7.161 14.245 7.445 291 HB3 ASP 61 2HB ASP 61 6.077 13.071 8.181 292 H GLY 62 H GLY 62 4.002 12.324 6.924 293 HA2 GLY 62 1HA GLY 62 2.501 13.980 5.175 294 HA3 GLY 62 2HA GLY 62 1.901 13.210 6.637 295 H GLY 63 H GLY 63 2.737 16.114 5.175 296 HA2 GLY 63 1HA GLY 63 1.843 18.092 6.339 297 HA3 GLY 63 2HA GLY 63 2.623 17.478 7.788 298 H SER 64 H SER 64 4.634 16.909 5.167 299 HA SER 64 HA SER 64 5.828 19.560 5.175 300 HB2 SER 64 1HB SER 64 7.360 17.103 6.052 301 HB3 SER 64 2HB SER 64 8.054 18.702 5.791 302 HG SER 64 HG SER 64 5.991 18.995 7.419 303 H ASN 65 H ASN 65 7.492 19.829 3.571 304 HA ASN 65 HA ASN 65 8.371 19.664 1.499 305 HB2 ASN 65 1HB ASN 65 8.484 16.763 2.325 306 HB3 ASN 65 2HB ASN 65 9.283 17.404 0.893 307 HD21 ASN 65 1HD2 ASN 65 9.318 17.262 4.371 308 HD22 ASN 65 2HD2 ASN 65 10.869 18.006 4.583 309 H GLY 66 H GLY 66 5.658 19.906 1.315 310 HA2 GLY 66 1HA GLY 66 4.318 19.989 -0.594 311 HA3 GLY 66 2HA GLY 66 5.294 18.715 -1.310 312 H ILE 67 H ILE 67 4.792 17.355 1.481 313 HA ILE 67 HA ILE 67 2.386 15.987 0.567 314 HB ILE 67 HB ILE 67 4.294 15.213 2.784 315 HG12 ILE 67 1HG1 ILE 67 4.093 14.229 -0.070 316 HG13 ILE 67 2HG1 ILE 67 5.395 15.214 0.590 317 HG21 ILE 67 1HG2 ILE 67 2.026 14.285 3.016 318 HG22 ILE 67 2HG2 ILE 67 3.218 13.032 2.669 319 HG23 ILE 67 3HG2 ILE 67 2.146 13.609 1.392 320 HD11 ILE 67 1HD1 ILE 67 6.050 12.887 0.396 321 HD12 ILE 67 2HD1 ILE 67 4.707 12.412 1.439 322 HD13 ILE 67 3HD1 ILE 67 6.020 13.400 2.083 323 HA PRO 68 HA PRO 68 0.144 18.393 3.551 324 HB2 PRO 68 1HB PRO 68 -2.259 17.149 3.259 325 HB3 PRO 68 2HB PRO 68 -1.637 18.341 2.112 326 HG2 PRO 68 1HG PRO 68 -1.637 15.357 1.938 327 HG3 PRO 68 2HG PRO 68 -1.944 16.561 0.666 328 HD2 PRO 68 1HD PRO 68 0.434 15.255 0.947 329 HD3 PRO 68 2HD PRO 68 0.306 16.895 0.274 330 H SER 69 H SER 69 -0.565 18.193 5.635 331 HA SER 69 HA SER 69 0.214 16.180 7.309 332 HB2 SER 69 1HB SER 69 -2.204 17.970 7.641 333 HB3 SER 69 2HB SER 69 -1.338 17.146 8.938 334 HG SER 69 HG SER 69 -0.624 19.396 7.450 335 HA PRO 70 HA PRO 70 -2.291 12.708 6.436 336 HB2 PRO 70 1HB PRO 70 -2.395 11.561 8.933 337 HB3 PRO 70 2HB PRO 70 -1.026 11.423 7.829 338 HG2 PRO 70 1HG PRO 70 -1.403 13.241 10.166 339 HG3 PRO 70 2HG PRO 70 0.053 12.377 9.638 340 HD2 PRO 70 1HD PRO 70 -0.302 15.010 9.156 341 HD3 PRO 70 2HD PRO 70 0.550 13.949 8.015 342 H THR 71 H THR 71 -4.370 12.661 6.115 343 HA THR 71 HA THR 71 -6.198 13.473 8.258 344 HB THR 71 HB THR 71 -5.821 15.385 6.681 345 HG1 THR 71 HG1 THR 71 -7.756 15.343 7.800 346 HG21 THR 71 1HG2 THR 71 -5.552 14.124 4.607 347 HG22 THR 71 2HG2 THR 71 -6.872 15.285 4.460 348 HG23 THR 71 3HG2 THR 71 -7.225 13.576 4.712 349 H THR 72 H THR 72 -8.491 12.927 7.662 350 HA THR 72 HA THR 72 -8.549 10.316 6.310 351 HB THR 72 HB THR 72 -10.505 9.811 7.861 352 HG1 THR 72 HG1 THR 72 -10.897 11.136 9.508 353 HG21 THR 72 1HG2 THR 72 -9.064 9.088 9.692 354 HG22 THR 72 2HG2 THR 72 -7.787 10.168 9.127 355 HG23 THR 72 3HG2 THR 72 -8.287 8.797 8.136 356 H THR 73 H THR 73 -9.843 10.182 4.641 357 HA THR 73 HA THR 73 -11.657 12.321 3.985 358 HB THR 73 HB THR 73 -12.096 11.046 1.923 359 HG1 THR 73 HG1 THR 73 -10.893 9.080 1.613 360 HG21 THR 73 1HG2 THR 73 -9.818 11.087 0.989 361 HG22 THR 73 2HG2 THR 73 -9.162 11.223 2.619 362 HG23 THR 73 3HG2 THR 73 -10.155 12.521 1.956 363 H ARG 74 H ARG 74 -13.910 11.339 3.038 364 HA ARG 74 HA ARG 74 -15.423 10.896 5.310 365 HB2 ARG 74 1HB ARG 74 -16.426 11.760 3.306 366 HB3 ARG 74 2HB ARG 74 -16.045 10.290 2.424 367 HG2 ARG 74 1HG ARG 74 -17.605 9.040 3.823 368 HG3 ARG 74 2HG ARG 74 -17.996 10.518 4.707 369 HD2 ARG 74 1HD ARG 74 -18.800 11.536 2.615 370 HD3 ARG 74 2HD ARG 74 -18.433 10.042 1.757 371 HE ARG 74 HE ARG 74 -20.234 9.737 3.993 372 HH11 ARG 74 1HH1 ARG 74 -19.930 10.324 0.559 373 HH12 ARG 74 2HH1 ARG 74 -21.559 9.858 0.205 374 HH21 ARG 74 1HH2 ARG 74 -22.389 9.122 3.525 375 HH22 ARG 74 2HH2 ARG 74 -22.963 9.186 1.889 376 H TYR 75 H TYR 75 -14.107 8.478 3.047 377 HA TYR 75 HA TYR 75 -15.365 6.383 4.647 378 HB2 TYR 75 1HB TYR 75 -13.886 6.160 2.023 379 HB3 TYR 75 2HB TYR 75 -14.802 4.881 2.820 380 HD1 TYR 75 HD1 TYR 75 -14.936 7.035 0.181 381 HD2 TYR 75 HD2 TYR 75 -17.323 5.830 3.490 382 HE1 TYR 75 HE1 TYR 75 -16.956 7.740 -1.028 383 HE2 TYR 75 HE2 TYR 75 -19.351 6.530 2.287 384 HH TYR 75 HH TYR 75 -19.352 7.276 -1.034 385 H VAL 76 H VAL 76 -12.667 7.987 5.151 386 HA VAL 76 HA VAL 76 -11.099 5.558 5.756 387 HB VAL 76 HB VAL 76 -10.095 8.396 5.461 388 HG11 VAL 76 1HG1 VAL 76 -8.881 7.103 7.185 389 HG12 VAL 76 2HG1 VAL 76 -7.872 7.486 5.791 390 HG13 VAL 76 3HG1 VAL 76 -8.536 5.864 5.979 391 HG21 VAL 76 1HG2 VAL 76 -10.650 7.345 3.326 392 HG22 VAL 76 2HG2 VAL 76 -9.642 5.959 3.746 393 HG23 VAL 76 3HG2 VAL 76 -8.905 7.543 3.505 394 H SER 77 H SER 77 -10.712 5.067 7.823 395 HA SER 77 HA SER 77 -11.832 6.858 9.844 396 HB2 SER 77 1HB SER 77 -10.959 3.977 10.132 397 HB3 SER 77 2HB SER 77 -11.909 4.913 11.289 398 HG SER 77 HG SER 77 -12.797 4.543 8.633 399 H ALA 78 H ALA 78 -8.800 5.222 8.998 400 HA ALA 78 HA ALA 78 -7.395 6.908 10.914 401 HB1 ALA 78 1HB ALA 78 -6.195 4.958 11.862 402 HB2 ALA 78 2HB ALA 78 -7.299 3.901 10.985 403 HB3 ALA 78 3HB ALA 78 -7.916 4.970 12.240 404 H MET 79 H MET 79 -5.108 6.966 10.585 405 HA MET 79 HA MET 79 -3.915 5.702 8.327 406 HB2 MET 79 1HB MET 79 -3.455 7.984 7.187 407 HB3 MET 79 2HB MET 79 -4.998 7.190 6.910 408 HG2 MET 79 1HG MET 79 -5.330 9.548 7.257 409 HG3 MET 79 2HG MET 79 -6.041 8.641 8.588 410 HE1 MET 79 1HE MET 79 -5.007 11.636 10.709 411 HE2 MET 79 2HE MET 79 -6.181 10.340 10.477 412 HE3 MET 79 3HE MET 79 -5.915 11.528 9.202 413 H SER 80 H SER 80 -1.719 6.315 8.011 414 HA SER 80 HA SER 80 -0.455 8.140 9.882 415 HB2 SER 80 1HB SER 80 0.235 5.186 9.890 416 HB3 SER 80 2HB SER 80 1.103 6.437 10.772 417 HG SER 80 HG SER 80 -1.519 6.588 11.345 418 H VAL 81 H VAL 81 1.363 9.024 9.028 419 HA VAL 81 HA VAL 81 2.542 7.736 6.653 420 HB VAL 81 HB VAL 81 2.141 10.722 6.958 421 HG11 VAL 81 1HG1 VAL 81 4.109 10.188 5.658 422 HG12 VAL 81 2HG1 VAL 81 2.841 10.785 4.588 423 HG13 VAL 81 3HG1 VAL 81 3.185 9.057 4.667 424 HG21 VAL 81 1HG2 VAL 81 0.006 9.600 6.598 425 HG22 VAL 81 2HG2 VAL 81 0.667 8.785 5.182 426 HG23 VAL 81 3HG2 VAL 81 0.482 10.539 5.182 427 H ALA 82 H ALA 82 4.656 7.360 6.922 428 HA ALA 82 HA ALA 82 6.251 9.214 8.516 429 HB1 ALA 82 1HB ALA 82 7.233 7.417 9.841 430 HB2 ALA 82 2HB ALA 82 6.163 6.250 9.066 431 HB3 ALA 82 3HB ALA 82 5.492 7.509 10.102 432 H LYS 83 H LYS 83 7.694 9.787 7.143 433 HA LYS 83 HA LYS 83 9.322 9.789 5.485 434 HB2 LYS 83 1HB LYS 83 9.942 7.146 6.816 435 HB3 LYS 83 2HB LYS 83 11.007 7.955 5.677 436 HG2 LYS 83 1HG LYS 83 11.108 9.890 7.230 437 HG3 LYS 83 2HG LYS 83 10.164 8.949 8.387 438 HD2 LYS 83 1HD LYS 83 11.879 7.305 8.562 439 HD3 LYS 83 2HD LYS 83 12.772 8.010 7.214 440 HE2 LYS 83 1HE LYS 83 13.031 10.088 8.584 441 HE3 LYS 83 2HE LYS 83 12.334 9.206 9.944 442 HZ1 LYS 83 1HZ LYS 83 14.776 8.378 8.466 443 HZ2 LYS 83 2HZ LYS 83 14.140 7.644 9.853 444 HZ3 LYS 83 3HZ LYS 83 14.779 9.205 9.945 445 H GLY 84 H GLY 84 6.961 9.102 4.383 446 HA2 GLY 84 1HA GLY 84 6.346 8.374 2.247 447 HA3 GLY 84 2HA GLY 84 7.767 7.337 2.216 448 H VAL 85 H VAL 85 7.034 6.236 4.882 449 HA VAL 85 HA VAL 85 5.401 4.054 4.113 450 HB VAL 85 HB VAL 85 5.966 5.020 6.927 451 HG11 VAL 85 1HG1 VAL 85 4.067 3.496 6.835 452 HG12 VAL 85 2HG1 VAL 85 5.455 2.730 7.608 453 HG13 VAL 85 3HG1 VAL 85 5.042 2.327 5.942 454 HG21 VAL 85 1HG2 VAL 85 8.004 4.528 5.624 455 HG22 VAL 85 2HG2 VAL 85 7.392 2.899 5.340 456 HG23 VAL 85 3HG2 VAL 85 7.767 3.425 6.978 457 H VAL 86 H VAL 86 3.202 3.729 4.233 458 HA VAL 86 HA VAL 86 1.601 5.830 5.490 459 HB VAL 86 HB VAL 86 1.073 4.866 2.668 460 HG11 VAL 86 1HG1 VAL 86 -0.961 5.344 3.920 461 HG12 VAL 86 2HG1 VAL 86 -0.695 6.565 2.675 462 HG13 VAL 86 3HG1 VAL 86 -0.331 6.932 4.360 463 HG21 VAL 86 1HG2 VAL 86 1.592 7.154 1.972 464 HG22 VAL 86 2HG2 VAL 86 2.986 6.391 2.738 465 HG23 VAL 86 3HG2 VAL 86 2.020 7.565 3.631 466 H SER 87 H SER 87 0.565 4.722 6.951 467 HA SER 87 HA SER 87 -0.555 2.100 6.257 468 HB2 SER 87 1HB SER 87 0.888 2.199 8.257 469 HB3 SER 87 2HB SER 87 -0.203 3.380 8.978 470 HG SER 87 HG SER 87 -1.757 1.850 9.166 471 H LEU 88 H LEU 88 -2.622 1.857 5.911 472 HA LEU 88 HA LEU 88 -4.488 3.983 6.761 473 HB2 LEU 88 1HB LEU 88 -4.802 2.023 4.472 474 HB3 LEU 88 2HB LEU 88 -5.955 3.260 4.925 475 HG LEU 88 HG LEU 88 -4.895 4.078 3.007 476 HD11 LEU 88 1HD1 LEU 88 -3.433 5.355 5.305 477 HD12 LEU 88 2HD1 LEU 88 -5.068 5.750 4.774 478 HD13 LEU 88 3HD1 LEU 88 -3.696 6.054 3.710 479 HD21 LEU 88 1HD2 LEU 88 -2.222 3.386 4.213 480 HD22 LEU 88 2HD2 LEU 88 -2.497 4.144 2.644 481 HD23 LEU 88 3HD2 LEU 88 -3.041 2.491 2.933 482 H THR 89 H THR 89 -6.426 3.340 7.756 483 HA THR 89 HA THR 89 -7.016 0.497 7.971 484 HB THR 89 HB THR 89 -6.692 2.204 10.455 485 HG1 THR 89 HG1 THR 89 -4.880 0.792 9.012 486 HG21 THR 89 1HG2 THR 89 -7.236 -0.751 10.134 487 HG22 THR 89 2HG2 THR 89 -8.397 0.460 10.676 488 HG23 THR 89 3HG2 THR 89 -6.985 0.090 11.663 489 H GLY 90 H GLY 90 -9.280 0.123 8.414 490 HA2 GLY 90 1HA GLY 90 -11.485 0.684 8.500 491 HA3 GLY 90 2HA GLY 90 -10.996 2.233 9.167 492 H GLN 91 H GLN 91 -10.364 0.727 6.013 493 HA GLN 91 HA GLN 91 -11.246 3.211 4.747 494 HB2 GLN 91 1HB GLN 91 -9.066 2.332 4.090 495 HB3 GLN 91 2HB GLN 91 -9.790 0.790 3.663 496 HG2 GLN 91 1HG GLN 91 -9.378 1.920 1.645 497 HG3 GLN 91 2HG GLN 91 -11.119 2.012 1.919 498 HE21 GLN 91 1HE2 GLN 91 -12.045 4.002 2.431 499 HE22 GLN 91 2HE2 GLN 91 -11.208 5.491 2.200 500 H GLU 92 H GLU 92 -13.242 3.338 3.982 501 HA GLU 92 HA GLU 92 -15.349 2.771 3.350 502 HB2 GLU 92 1HB GLU 92 -13.668 1.078 1.508 503 HB3 GLU 92 2HB GLU 92 -15.402 1.288 1.310 504 HG2 GLU 92 1HG GLU 92 -15.078 3.704 1.098 505 HG3 GLU 92 2HG GLU 92 -13.341 3.472 1.249 506 H SER 93 H SER 93 -15.174 -0.303 2.152 507 HA SER 93 HA SER 93 -16.789 -1.376 4.258 508 HB2 SER 93 1HB SER 93 -17.135 -1.898 1.854 509 HB3 SER 93 2HB SER 93 -15.595 -2.755 1.844 510 HG SER 93 HG SER 93 -17.745 -3.418 3.576 511 H LEU 94 H LEU 94 -13.476 -1.149 3.833 512 HA LEU 94 HA LEU 94 -12.760 -3.759 4.877 513 HB2 LEU 94 1HB LEU 94 -11.009 -1.404 4.171 514 HB3 LEU 94 2HB LEU 94 -10.456 -3.028 4.547 515 HG LEU 94 HG LEU 94 -12.091 -2.229 2.139 516 HD11 LEU 94 1HD1 LEU 94 -9.796 -1.478 1.986 517 HD12 LEU 94 2HD1 LEU 94 -10.063 -2.839 0.894 518 HD13 LEU 94 3HD1 LEU 94 -9.216 -3.087 2.421 519 HD21 LEU 94 1HD2 LEU 94 -12.683 -4.467 2.874 520 HD22 LEU 94 2HD2 LEU 94 -10.981 -4.915 2.943 521 HD23 LEU 94 3HD2 LEU 94 -11.730 -4.539 1.393 522 H ASN 95 H ASN 95 -14.295 -2.270 6.623 523 HA ASN 95 HA ASN 95 -12.987 -0.769 8.560 524 HB2 ASN 95 1HB ASN 95 -15.447 -1.119 8.449 525 HB3 ASN 95 2HB ASN 95 -15.213 -2.774 9.007 526 HD21 ASN 95 1HD2 ASN 95 -16.372 -2.530 10.879 527 HD22 ASN 95 2HD2 ASN 95 -15.839 -1.549 12.203 528 H GLY 96 H GLY 96 -11.783 -1.245 10.347 529 HA2 GLY 96 1HA GLY 96 -10.487 -2.488 11.802 530 HA3 GLY 96 2HA GLY 96 -11.273 -3.935 11.194 531 H LEU 97 H LEU 97 -10.383 -3.010 8.386 532 HA LEU 97 HA LEU 97 -8.001 -4.627 8.447 533 HB2 LEU 97 1HB LEU 97 -9.667 -4.934 6.697 534 HB3 LEU 97 2HB LEU 97 -9.462 -3.271 6.182 535 HG LEU 97 HG LEU 97 -7.092 -5.092 6.082 536 HD11 LEU 97 1HD1 LEU 97 -7.742 -5.841 3.854 537 HD12 LEU 97 2HD1 LEU 97 -9.294 -5.023 4.023 538 HD13 LEU 97 3HD1 LEU 97 -8.901 -6.391 5.063 539 HD21 LEU 97 1HD2 LEU 97 -6.854 -2.710 5.564 540 HD22 LEU 97 2HD2 LEU 97 -8.083 -2.861 4.309 541 HD23 LEU 97 3HD2 LEU 97 -6.547 -3.716 4.148 542 H SER 98 H SER 98 -5.939 -4.012 8.100 543 HA SER 98 HA SER 98 -5.430 -1.121 7.867 544 HB2 SER 98 1HB SER 98 -4.900 -2.269 10.098 545 HB3 SER 98 2HB SER 98 -3.618 -3.114 9.234 546 HG SER 98 HG SER 98 -3.842 -0.416 9.926 547 H VAL 99 H VAL 99 -4.240 -0.506 6.181 548 HA VAL 99 HA VAL 99 -2.723 -2.544 4.676 549 HB VAL 99 HB VAL 99 -3.685 0.162 3.711 550 HG11 VAL 99 1HG1 VAL 99 -1.660 -0.561 2.585 551 HG12 VAL 99 2HG1 VAL 99 -3.039 -0.633 1.489 552 HG13 VAL 99 3HG1 VAL 99 -2.407 -2.114 2.205 553 HG21 VAL 99 1HG2 VAL 99 -5.575 -1.323 4.053 554 HG22 VAL 99 2HG2 VAL 99 -4.778 -2.579 3.104 555 HG23 VAL 99 3HG2 VAL 99 -5.285 -1.077 2.329 556 H VAL 100 H VAL 100 -0.482 -2.262 4.539 557 HA VAL 100 HA VAL 100 0.510 0.204 5.795 558 HB VAL 100 HB VAL 100 1.732 -2.553 6.044 559 HG11 VAL 100 1HG1 VAL 100 3.263 -1.482 7.639 560 HG12 VAL 100 2HG1 VAL 100 2.530 0.083 7.283 561 HG13 VAL 100 3HG1 VAL 100 3.409 -0.786 6.024 562 HG21 VAL 100 1HG2 VAL 100 -0.284 -2.405 7.373 563 HG22 VAL 100 2HG2 VAL 100 0.247 -0.868 8.057 564 HG23 VAL 100 3HG2 VAL 100 1.126 -2.350 8.433 565 H MET 101 H MET 101 1.204 1.349 4.118 566 HA MET 101 HA MET 101 2.491 0.091 1.843 567 HB2 MET 101 1HB MET 101 0.941 2.175 1.832 568 HB3 MET 101 2HB MET 101 2.361 3.055 2.379 569 HG2 MET 101 1HG MET 101 2.164 3.286 0.015 570 HG3 MET 101 2HG MET 101 3.564 2.283 0.376 571 HE1 MET 101 1HE MET 101 -0.234 2.212 -0.565 572 HE2 MET 101 2HE MET 101 -0.149 0.934 0.647 573 HE3 MET 101 3HE MET 101 -0.466 0.530 -1.039 574 H THR 102 H THR 102 4.529 -0.536 2.035 575 HA THR 102 HA THR 102 6.331 1.008 3.788 576 HB THR 102 HB THR 102 6.665 -1.897 3.050 577 HG1 THR 102 HG1 THR 102 4.694 -0.944 4.461 578 HG21 THR 102 1HG2 THR 102 8.643 -0.738 3.933 579 HG22 THR 102 2HG2 THR 102 8.052 -1.953 5.066 580 HG23 THR 102 3HG2 THR 102 7.720 -0.244 5.350 581 HA PRO 103 HA PRO 103 8.439 1.788 -0.128 582 HB2 PRO 103 1HB PRO 103 10.457 3.009 1.655 583 HB3 PRO 103 2HB PRO 103 9.572 3.723 0.297 584 HG2 PRO 103 1HG PRO 103 8.999 4.398 2.829 585 HG3 PRO 103 2HG PRO 103 7.725 4.245 1.597 586 HD2 PRO 103 1HD PRO 103 8.524 2.316 3.750 587 HD3 PRO 103 2HD PRO 103 6.895 2.783 3.201 588 H GLY 104 H GLY 104 9.608 0.295 -1.072 589 HA2 GLY 104 1HA GLY 104 12.189 -0.322 -0.870 590 HA3 GLY 104 2HA GLY 104 11.510 -1.326 0.406 591 H TRP 105 H TRP 105 10.004 -0.463 -2.633 592 HA TRP 105 HA TRP 105 10.106 -3.284 -3.456 593 HB2 TRP 105 1HB TRP 105 7.848 -2.519 -2.679 594 HB3 TRP 105 2HB TRP 105 7.857 -1.324 -3.969 595 HD1 TRP 105 HD1 TRP 105 8.493 -5.167 -3.913 596 HE1 TRP 105 HE1 TRP 105 7.103 -6.212 -5.810 597 HE3 TRP 105 HE3 TRP 105 6.289 -0.929 -5.722 598 HZ2 TRP 105 HZ2 TRP 105 5.301 -5.346 -7.806 599 HZ3 TRP 105 HZ3 TRP 105 4.743 -1.122 -7.625 600 HH2 TRP 105 HH2 TRP 105 4.259 -3.286 -8.644 601 H ASP 106 H ASP 106 11.815 -3.087 -4.801 602 HA ASP 106 HA ASP 106 12.558 -0.791 -6.192 603 HB2 ASP 106 1HB ASP 106 13.336 -3.667 -6.668 604 HB3 ASP 106 2HB ASP 106 14.145 -2.285 -7.394 605 H ASN 107 H ASN 107 10.182 -3.087 -7.079 606 HA ASN 107 HA ASN 107 10.446 -3.007 -9.879 607 HB2 ASN 107 1HB ASN 107 9.084 -4.682 -8.672 608 HB3 ASN 107 2HB ASN 107 7.927 -3.421 -8.260 609 HD21 ASN 107 1HD2 ASN 107 6.525 -2.660 -9.828 610 HD22 ASN 107 2HD2 ASN 107 6.332 -3.433 -11.360 611 H ALA 108 H ALA 108 9.151 -0.677 -7.652 612 HA ALA 108 HA ALA 108 7.394 0.519 -9.611 613 HB1 ALA 108 1HB ALA 108 8.098 1.469 -6.845 614 HB2 ALA 108 2HB ALA 108 6.746 0.416 -7.257 615 HB3 ALA 108 3HB ALA 108 6.786 2.075 -7.854 616 H ASN 109 H ASN 109 10.274 1.671 -7.809 617 HA ASN 109 HA ASN 109 10.509 3.807 -9.832 618 HB2 ASN 109 1HB ASN 109 11.366 3.721 -6.945 619 HB3 ASN 109 2HB ASN 109 11.984 4.928 -8.064 620 HD21 ASN 109 1HD2 ASN 109 10.444 5.313 -5.674 621 HD22 ASN 109 2HD2 ASN 109 8.992 6.131 -6.145 622 H GLY 110 H GLY 110 11.644 0.947 -9.734 623 HA2 GLY 110 1HA GLY 110 13.565 -0.020 -10.576 624 HA3 GLY 110 2HA GLY 110 14.221 1.593 -10.807 625 H VAL 111 H VAL 111 14.551 2.690 -8.497 626 HA VAL 111 HA VAL 111 16.336 0.882 -7.042 627 HB VAL 111 HB VAL 111 17.220 2.976 -5.989 628 HG11 VAL 111 1HG1 VAL 111 18.340 1.985 -7.902 629 HG12 VAL 111 2HG1 VAL 111 18.414 3.743 -7.999 630 HG13 VAL 111 3HG1 VAL 111 17.270 2.852 -9.002 631 HG21 VAL 111 1HG2 VAL 111 16.648 5.128 -7.008 632 HG22 VAL 111 2HG2 VAL 111 15.239 4.381 -6.255 633 HG23 VAL 111 3HG2 VAL 111 15.432 4.334 -8.008 634 H THR 112 H THR 112 13.463 2.829 -6.620 635 HA THR 112 HA THR 112 13.187 1.716 -3.915 636 HB THR 112 HB THR 112 11.981 3.774 -3.237 637 HG1 THR 112 HG1 THR 112 13.009 5.362 -5.218 638 HG21 THR 112 1HG2 THR 112 14.793 4.257 -4.220 639 HG22 THR 112 2HG2 THR 112 14.338 3.559 -2.666 640 HG23 THR 112 3HG2 THR 112 13.942 5.240 -3.028 641 H GLY 113 H GLY 113 10.646 2.504 -3.346 642 HA2 GLY 113 1HA GLY 113 8.619 2.531 -5.100 643 HA3 GLY 113 2HA GLY 113 9.100 0.838 -5.134 644 H TRP 114 H TRP 114 6.617 1.158 -4.325 645 HA TRP 114 HA TRP 114 6.742 1.165 -1.388 646 HB2 TRP 114 1HB TRP 114 4.490 2.030 -3.205 647 HB3 TRP 114 2HB TRP 114 4.337 1.852 -1.458 648 HD1 TRP 114 HD1 TRP 114 5.683 3.633 0.073 649 HE1 TRP 114 HE1 TRP 114 6.507 6.016 -0.441 650 HE3 TRP 114 HE3 TRP 114 5.407 3.505 -5.030 651 HZ2 TRP 114 HZ2 TRP 114 6.983 7.627 -2.710 652 HZ3 TRP 114 HZ3 TRP 114 6.067 5.509 -6.296 653 HH2 TRP 114 HH2 TRP 114 6.837 7.526 -5.159 654 H ALA 115 H ALA 115 6.326 -0.696 -0.445 655 HA ALA 115 HA ALA 115 5.091 -2.852 -1.962 656 HB1 ALA 115 1HB ALA 115 7.133 -3.322 -0.677 657 HB2 ALA 115 2HB ALA 115 5.767 -4.276 -0.102 658 HB3 ALA 115 3HB ALA 115 6.297 -2.861 0.807 659 H ARG 116 H ARG 116 3.186 -3.803 -1.400 660 HA ARG 116 HA ARG 116 1.509 -2.212 0.419 661 HB2 ARG 116 1HB ARG 116 0.694 -3.929 -1.933 662 HB3 ARG 116 2HB ARG 116 -0.425 -3.111 -0.854 663 HG2 ARG 116 1HG ARG 116 -0.354 -1.689 -2.659 664 HG3 ARG 116 2HG ARG 116 0.832 -0.965 -1.575 665 HD2 ARG 116 1HD ARG 116 1.673 -1.010 -3.852 666 HD3 ARG 116 2HD ARG 116 2.633 -2.067 -2.823 667 HE ARG 116 HE ARG 116 1.108 -3.894 -3.802 668 HH11 ARG 116 1HH1 ARG 116 2.091 -1.020 -5.551 669 HH12 ARG 116 2HH1 ARG 116 2.085 -1.803 -7.097 670 HH21 ARG 116 1HH2 ARG 116 1.099 -4.929 -5.844 671 HH22 ARG 116 2HH2 ARG 116 1.519 -4.020 -7.266 672 H ASN 117 H ASN 117 0.363 -3.201 2.013 673 HA ASN 117 HA ASN 117 0.288 -6.116 2.121 674 HB2 ASN 117 1HB ASN 117 1.388 -4.362 4.328 675 HB3 ASN 117 2HB ASN 117 0.902 -6.030 4.569 676 HD21 ASN 117 1HD2 ASN 117 2.086 -7.687 3.511 677 HD22 ASN 117 2HD2 ASN 117 3.722 -7.419 3.019 678 H CYS 118 H CYS 118 -1.746 -6.709 2.532 679 HA CYS 118 HA CYS 118 -3.499 -4.806 3.926 680 HB2 CYS 118 1HB CYS 118 -4.215 -7.249 2.284 681 HB3 CYS 118 2HB CYS 118 -5.363 -6.127 3.015 682 H ASN 119 H ASN 119 -3.764 -5.150 6.033 683 HA ASN 119 HA ASN 119 -3.511 -7.918 7.017 684 HB2 ASN 119 1HB ASN 119 -1.647 -6.521 7.757 685 HB3 ASN 119 2HB ASN 119 -2.772 -5.332 8.407 686 HD21 ASN 119 1HD2 ASN 119 -3.718 -5.687 10.379 687 HD22 ASN 119 2HD2 ASN 119 -3.291 -7.007 11.411 688 H ILE 120 H ILE 120 -5.514 -8.600 7.275 689 HA ILE 120 HA ILE 120 -7.102 -7.213 9.296 690 HB ILE 120 HB ILE 120 -8.245 -6.718 7.249 691 HG12 ILE 120 1HG1 ILE 120 -10.407 -7.985 7.551 692 HG13 ILE 120 2HG1 ILE 120 -9.587 -8.942 8.774 693 HG21 ILE 120 1HG2 ILE 120 -9.037 -8.478 5.717 694 HG22 ILE 120 2HG2 ILE 120 -8.094 -9.655 6.632 695 HG23 ILE 120 3HG2 ILE 120 -7.281 -8.339 5.784 696 HD11 ILE 120 1HD1 ILE 120 -9.229 -6.953 10.117 697 HD12 ILE 120 2HD1 ILE 120 -10.937 -7.147 9.738 698 HD13 ILE 120 3HD1 ILE 120 -9.972 -5.958 8.867 699 H GLN 121 H GLN 121 -7.153 -8.544 11.025 700 HA GLN 121 HA GLN 121 -5.954 -11.122 10.716 701 HB2 GLN 121 1HB GLN 121 -5.363 -9.744 12.605 702 HB3 GLN 121 2HB GLN 121 -7.033 -9.682 13.143 703 HG2 GLN 121 1HG GLN 121 -6.965 -12.113 13.541 704 HG3 GLN 121 2HG GLN 121 -5.265 -12.114 13.077 705 HE21 GLN 121 1HE2 GLN 121 -3.741 -11.240 14.462 706 HE22 GLN 121 2HE2 GLN 121 -4.100 -10.863 16.114 707 H SER 122 H SER 122 -9.250 -10.027 11.438 708 HA SER 122 HA SER 122 -9.995 -12.757 12.129 709 HB2 SER 122 1HB SER 122 -12.148 -11.645 12.843 710 HB3 SER 122 2HB SER 122 -10.705 -11.094 13.696 711 HG SER 122 HG SER 122 -12.228 -9.778 11.712 712 H ASP 123 H ASP 123 -10.189 -10.722 9.396 713 HA ASP 123 HA ASP 123 -12.425 -12.296 8.340 714 HB2 ASP 123 1HB ASP 123 -12.220 -9.283 8.330 715 HB3 ASP 123 2HB ASP 123 -13.344 -10.182 7.314 716 H SER 124 H SER 124 -11.023 -13.448 7.031 717 HA SER 124 HA SER 124 -9.099 -12.337 5.318 718 HB2 SER 124 1HB SER 124 -10.667 -14.900 4.961 719 HB3 SER 124 2HB SER 124 -9.151 -14.492 4.159 720 HG SER 124 HG SER 124 -8.888 -14.166 6.809 721 H ALA 125 H ALA 125 -12.561 -12.550 5.008 722 HA ALA 125 HA ALA 125 -12.839 -12.387 2.230 723 HB1 ALA 125 1HB ALA 125 -14.622 -11.199 4.349 724 HB2 ALA 125 2HB ALA 125 -14.706 -12.847 3.729 725 HB3 ALA 125 3HB ALA 125 -15.065 -11.488 2.667 726 H LEU 126 H LEU 126 -12.146 -9.914 4.611 727 HA LEU 126 HA LEU 126 -12.468 -7.723 2.802 728 HB2 LEU 126 1HB LEU 126 -10.999 -7.894 5.433 729 HB3 LEU 126 2HB LEU 126 -11.336 -6.408 4.563 730 HG LEU 126 HG LEU 126 -13.388 -8.262 5.781 731 HD11 LEU 126 1HD1 LEU 126 -12.184 -7.001 7.454 732 HD12 LEU 126 2HD1 LEU 126 -13.821 -6.370 7.282 733 HD13 LEU 126 3HD1 LEU 126 -12.462 -5.505 6.564 734 HD21 LEU 126 1HD2 LEU 126 -15.007 -6.514 5.180 735 HD22 LEU 126 2HD2 LEU 126 -14.260 -7.242 3.759 736 HD23 LEU 126 3HD2 LEU 126 -13.738 -5.651 4.313 737 H GLN 127 H GLN 127 -9.810 -9.740 3.902 738 HA GLN 127 HA GLN 127 -7.735 -8.260 2.684 739 HB2 GLN 127 1HB GLN 127 -7.126 -9.839 4.372 740 HB3 GLN 127 2HB GLN 127 -7.913 -11.154 3.509 741 HG2 GLN 127 1HG GLN 127 -6.263 -11.072 1.768 742 HG3 GLN 127 2HG GLN 127 -5.513 -9.645 2.483 743 HE21 GLN 127 1HE2 GLN 127 -4.206 -9.879 4.287 744 HE22 GLN 127 2HE2 GLN 127 -3.647 -11.424 4.832 745 H GLN 128 H GLN 128 -9.702 -10.984 1.599 746 HA GLN 128 HA GLN 128 -8.381 -11.636 -0.739 747 HB2 GLN 128 1HB GLN 128 -11.340 -11.670 -0.131 748 HB3 GLN 128 2HB GLN 128 -10.628 -12.418 -1.555 749 HG2 GLN 128 1HG GLN 128 -9.342 -13.918 -0.165 750 HG3 GLN 128 2HG GLN 128 -9.947 -13.125 1.288 751 HE21 GLN 128 1HE2 GLN 128 -10.141 -15.904 0.440 752 HE22 GLN 128 2HE2 GLN 128 -11.827 -16.277 0.404 753 H ALA 129 H ALA 129 -10.704 -9.062 -0.174 754 HA ALA 129 HA ALA 129 -10.780 -8.199 -2.894 755 HB1 ALA 129 1HB ALA 129 -11.575 -6.707 -0.400 756 HB2 ALA 129 2HB ALA 129 -12.624 -7.774 -1.334 757 HB3 ALA 129 3HB ALA 129 -12.012 -6.286 -2.056 758 H CYS 130 H CYS 130 -9.127 -7.095 0.032 759 HA CYS 130 HA CYS 130 -7.954 -4.803 -1.142 760 HB2 CYS 130 1HB CYS 130 -8.289 -5.094 1.293 761 HB3 CYS 130 2HB CYS 130 -7.057 -6.356 1.298 762 H GLU 131 H GLU 131 -6.675 -8.046 -0.457 763 HA GLU 131 HA GLU 131 -4.058 -7.481 -1.356 764 HB2 GLU 131 1HB GLU 131 -3.595 -9.801 -1.139 765 HB3 GLU 131 2HB GLU 131 -4.685 -9.372 0.175 766 HG2 GLU 131 1HG GLU 131 -6.461 -10.517 -0.746 767 HG3 GLU 131 2HG GLU 131 -5.777 -10.479 -2.373 768 H ASP 132 H ASP 132 -6.970 -8.344 -3.016 769 HA ASP 132 HA ASP 132 -5.788 -9.299 -5.407 770 HB2 ASP 132 1HB ASP 132 -8.218 -9.526 -4.845 771 HB3 ASP 132 2HB ASP 132 -8.405 -7.799 -5.127 772 H VAL 133 H VAL 133 -6.845 -6.065 -4.395 773 HA VAL 133 HA VAL 133 -5.959 -4.873 -6.872 774 HB VAL 133 HB VAL 133 -6.987 -3.594 -4.336 775 HG11 VAL 133 1HG1 VAL 133 -5.603 -2.064 -5.663 776 HG12 VAL 133 2HG1 VAL 133 -7.299 -1.589 -5.663 777 HG13 VAL 133 3HG1 VAL 133 -6.608 -2.391 -7.075 778 HG21 VAL 133 1HG2 VAL 133 -8.358 -4.254 -6.937 779 HG22 VAL 133 2HG2 VAL 133 -9.065 -3.307 -5.630 780 HG23 VAL 133 3HG2 VAL 133 -8.656 -5.003 -5.369 781 H PHE 134 H PHE 134 -5.003 -4.703 -3.477 782 HA PHE 134 HA PHE 134 -2.649 -3.131 -4.061 783 HB2 PHE 134 1HB PHE 134 -3.724 -4.293 -1.483 784 HB3 PHE 134 2HB PHE 134 -2.256 -3.333 -1.587 785 HD1 PHE 134 HD1 PHE 134 -5.907 -3.268 -1.737 786 HD2 PHE 134 HD2 PHE 134 -2.348 -0.949 -2.031 787 HE1 PHE 134 HE1 PHE 134 -7.236 -1.208 -1.535 788 HE2 PHE 134 HE2 PHE 134 -3.671 1.113 -1.826 789 HZ PHE 134 HZ PHE 134 -6.118 0.985 -1.582 790 H ARG 135 H ARG 135 -2.969 -5.818 -5.148 791 HA ARG 135 HA ARG 135 -1.939 -7.900 -3.745 792 HB2 ARG 135 1HB ARG 135 -1.545 -8.986 -5.886 793 HB3 ARG 135 2HB ARG 135 -3.056 -8.088 -5.909 794 HG2 ARG 135 1HG ARG 135 -1.762 -6.218 -7.033 795 HG3 ARG 135 2HG ARG 135 -0.459 -7.390 -7.240 796 HD2 ARG 135 1HD ARG 135 -3.237 -7.456 -8.385 797 HD3 ARG 135 2HD ARG 135 -1.698 -7.460 -9.245 798 HE ARG 135 HE ARG 135 -1.372 -9.732 -8.222 799 HH11 ARG 135 1HH1 ARG 135 -4.562 -8.415 -8.777 800 HH12 ARG 135 2HH1 ARG 135 -5.320 -9.966 -8.944 801 HH21 ARG 135 1HH2 ARG 135 -2.370 -11.786 -8.410 802 HH22 ARG 135 2HH2 ARG 135 -4.069 -11.887 -8.738 803 H PHE 136 H PHE 136 -0.076 -8.857 -3.410 804 HA PHE 136 HA PHE 136 2.405 -7.489 -4.120 805 HB2 PHE 136 1HB PHE 136 3.091 -8.056 -1.666 806 HB3 PHE 136 2HB PHE 136 2.119 -6.618 -1.976 807 HD1 PHE 136 HD1 PHE 136 2.145 -9.974 -0.525 808 HD2 PHE 136 HD2 PHE 136 -0.229 -6.528 -1.312 809 HE1 PHE 136 HE1 PHE 136 0.446 -10.782 1.055 810 HE2 PHE 136 HE2 PHE 136 -1.934 -7.338 0.268 811 HZ PHE 136 HZ PHE 136 -1.595 -9.469 1.453 812 H ASP 137 H ASP 137 3.766 -8.908 -4.987 813 HA ASP 137 HA ASP 137 3.248 -11.727 -4.828 814 HB2 ASP 137 1HB ASP 137 4.104 -10.602 -6.898 815 HB3 ASP 137 2HB ASP 137 5.634 -10.329 -6.065 816 H ASP 138 H ASP 138 4.645 -13.314 -3.977 817 HA ASP 138 HA ASP 138 5.724 -12.490 -1.449 818 HB2 ASP 138 1HB ASP 138 5.659 -15.243 -2.702 819 HB3 ASP 138 2HB ASP 138 6.050 -14.886 -1.023 820 H ALA 139 H ALA 139 7.094 -11.956 -4.178 821 HA ALA 139 HA ALA 139 9.704 -13.127 -3.741 822 HB1 ALA 139 1HB ALA 139 8.963 -12.725 -6.026 823 HB2 ALA 139 2HB ALA 139 10.398 -11.766 -5.667 824 HB3 ALA 139 3HB ALA 139 8.811 -11.000 -5.687 825 H ASN 140 H ASN 140 8.057 -10.082 -3.218 826 HA ASN 140 HA ASN 140 10.402 -8.765 -2.166 827 HB2 ASN 140 1HB ASN 140 8.684 -7.435 -3.300 828 HB3 ASN 140 2HB ASN 140 7.473 -7.968 -2.141 829 HD21 ASN 140 1HD2 ASN 140 10.188 -5.882 -2.708 830 HD22 ASN 140 2HD2 ASN 140 10.007 -4.930 -1.276 831 H LEU 141 H LEU 141 7.926 -10.804 -1.037 832 HA LEU 141 HA LEU 141 8.260 -10.013 1.751 833 HB2 LEU 141 1HB LEU 141 6.410 -12.084 0.573 834 HB3 LEU 141 2HB LEU 141 6.378 -11.468 2.212 835 HG LEU 141 HG LEU 141 5.702 -9.919 -0.289 836 HD11 LEU 141 1HD1 LEU 141 4.044 -11.030 1.962 837 HD12 LEU 141 2HD1 LEU 141 3.950 -11.433 0.245 838 HD13 LEU 141 3HD1 LEU 141 3.458 -9.835 0.808 839 HD21 LEU 141 1HD2 LEU 141 5.023 -8.128 1.260 840 HD22 LEU 141 2HD2 LEU 141 6.757 -8.446 1.323 841 HD23 LEU 141 3HD2 LEU 141 5.703 -9.048 2.602 842 H VAL 142 H VAL 142 9.864 -10.964 2.828 843 HA VAL 142 HA VAL 142 11.240 -13.238 2.224 844 HB VAL 142 HB VAL 142 12.032 -11.764 3.939 845 HG11 VAL 142 1HG1 VAL 142 10.981 -11.668 6.168 846 HG12 VAL 142 2HG1 VAL 142 9.638 -12.630 5.554 847 HG13 VAL 142 3HG1 VAL 142 9.945 -11.022 4.898 848 HG21 VAL 142 1HG2 VAL 142 11.416 -14.492 5.055 849 HG22 VAL 142 2HG2 VAL 142 12.612 -13.376 5.712 850 HG23 VAL 142 3HG2 VAL 142 12.820 -14.038 4.091 851 HA PRO 143 HA PRO 143 8.179 -16.438 2.889 852 HB2 PRO 143 1HB PRO 143 10.263 -18.350 2.278 853 HB3 PRO 143 2HB PRO 143 8.863 -17.900 1.309 854 HG2 PRO 143 1HG PRO 143 11.441 -17.301 0.630 855 HG3 PRO 143 2HG PRO 143 10.035 -16.363 0.103 856 HD2 PRO 143 1HD PRO 143 11.997 -15.776 2.279 857 HD3 PRO 143 2HD PRO 143 11.198 -14.676 1.139 858 H ARG 144 H ARG 144 7.894 -18.277 4.257 859 HA ARG 144 HA ARG 144 9.273 -18.030 6.771 860 HB2 ARG 144 1HB ARG 144 7.230 -20.104 5.960 861 HB3 ARG 144 2HB ARG 144 7.720 -19.686 7.595 862 HG2 ARG 144 1HG ARG 144 6.772 -17.451 7.313 863 HG3 ARG 144 2HG ARG 144 6.262 -17.880 5.678 864 HD2 ARG 144 1HD ARG 144 4.881 -19.684 6.595 865 HD3 ARG 144 2HD ARG 144 5.377 -19.228 8.221 866 HE ARG 144 HE ARG 144 4.300 -16.954 7.092 867 HH11 ARG 144 1HH1 ARG 144 3.226 -20.201 7.789 868 HH12 ARG 144 2HH1 ARG 144 1.580 -19.739 8.086 869 HH21 ARG 144 1HH2 ARG 144 2.132 -16.325 7.462 870 HH22 ARG 144 2HH2 ARG 144 0.957 -17.524 7.900 871 H GLY 145 H GLY 145 11.165 -19.011 7.176 872 HA2 GLY 145 1HA GLY 145 12.537 -20.945 7.375 873 HA3 GLY 145 2HA GLY 145 11.624 -21.688 6.065 874 H SER 146 H SER 146 14.416 -19.952 6.894 875 HA SER 146 HA SER 146 14.838 -18.581 4.434 876 HB2 SER 146 1HB SER 146 16.853 -19.356 6.554 877 HB3 SER 146 2HB SER 146 17.056 -18.118 5.312 878 HG SER 146 HG SER 146 14.802 -17.584 6.586 879 H GLY 147 H GLY 147 15.417 -19.425 2.571 880 HA2 GLY 147 1HA GLY 147 16.656 -20.704 1.076 881 HA3 GLY 147 2HA GLY 147 17.347 -21.575 2.437 882 H LEU 148 H LEU 148 14.156 -21.647 3.038 883 HA LEU 148 HA LEU 148 13.925 -24.291 1.793 884 HB2 LEU 148 1HB LEU 148 12.349 -23.063 4.060 885 HB3 LEU 148 2HB LEU 148 12.129 -24.687 3.441 886 HG LEU 148 HG LEU 148 14.615 -23.654 4.814 887 HD11 LEU 148 1HD1 LEU 148 12.736 -23.910 6.341 888 HD12 LEU 148 2HD1 LEU 148 13.952 -25.156 6.626 889 HD13 LEU 148 3HD1 LEU 148 12.471 -25.553 5.755 890 HD21 LEU 148 1HD2 LEU 148 13.910 -26.389 3.754 891 HD22 LEU 148 2HD2 LEU 148 15.273 -26.050 4.818 892 HD23 LEU 148 3HD2 LEU 148 15.219 -25.342 3.206 893 H GLU 149 H GLU 149 13.307 -23.595 -0.260 894 HA GLU 149 HA GLU 149 10.870 -22.064 -0.577 895 HB2 GLU 149 1HB GLU 149 12.725 -21.883 -2.217 896 HB3 GLU 149 2HB GLU 149 12.519 -23.584 -2.618 897 HG2 GLU 149 1HG GLU 149 10.166 -23.014 -3.307 898 HG3 GLU 149 2HG GLU 149 10.624 -21.317 -3.150 899 H HIS 150 H HIS 150 12.001 -25.365 -0.993 900 HA HIS 150 HA HIS 150 9.249 -26.316 -1.317 901 HB2 HIS 150 1HB HIS 150 11.902 -27.736 -1.658 902 HB3 HIS 150 2HB HIS 150 10.334 -28.502 -1.855 903 HD1 HIS 150 HD1 HIS 150 8.913 -27.751 -3.935 904 HD2 HIS 150 HD2 HIS 150 12.805 -26.303 -3.833 905 HE1 HIS 150 HE1 HIS 150 9.385 -26.922 -6.263 906 HE2 HIS 150 HE2 HIS 150 11.792 -26.185 -6.211 907 H HIS 151 H HIS 151 8.437 -26.236 0.742 908 HA HIS 151 HA HIS 151 9.924 -27.103 3.020 909 HB2 HIS 151 1HB HIS 151 6.943 -26.663 2.709 910 HB3 HIS 151 2HB HIS 151 7.791 -26.863 4.236 911 HD1 HIS 151 HD1 HIS 151 6.809 -24.344 1.762 912 HD2 HIS 151 HD2 HIS 151 9.558 -24.652 4.869 913 HE1 HIS 151 HE1 HIS 151 7.506 -21.988 2.290 914 HE2 HIS 151 HE2 HIS 151 9.091 -22.184 4.236 915 H HIS 152 H HIS 152 10.511 -29.172 3.171 916 HA HIS 152 HA HIS 152 9.120 -31.274 1.863 917 HB2 HIS 152 1HB HIS 152 11.600 -31.207 2.348 918 HB3 HIS 152 2HB HIS 152 11.213 -31.562 4.026 919 HD1 HIS 152 HD1 HIS 152 11.178 -33.972 4.606 920 HD2 HIS 152 HD2 HIS 152 10.591 -33.343 0.542 921 HE1 HIS 152 HE1 HIS 152 11.086 -36.260 3.577 922 HE2 HIS 152 HE2 HIS 152 10.901 -35.848 1.100 923 H HIS 153 H HIS 153 7.532 -32.549 2.558 924 HA HIS 153 HA HIS 153 7.173 -33.248 5.290 925 HB2 HIS 153 1HB HIS 153 5.013 -32.210 5.695 926 HB3 HIS 153 2HB HIS 153 6.208 -30.970 5.353 927 HD1 HIS 153 HD1 HIS 153 6.052 -29.895 2.866 928 HD2 HIS 153 HD2 HIS 153 2.786 -32.132 4.139 929 HE1 HIS 153 HE1 HIS 153 4.154 -29.238 1.363 930 HE2 HIS 153 HE2 HIS 153 2.146 -30.421 2.312 931 H HIS 154 H HIS 154 6.135 -35.145 5.424 932 HA HIS 154 HA HIS 154 4.365 -35.936 3.223 933 HB2 HIS 154 1HB HIS 154 5.306 -38.202 3.202 934 HB3 HIS 154 2HB HIS 154 6.514 -37.006 2.767 935 HD1 HIS 154 HD1 HIS 154 8.702 -37.467 3.785 936 HD2 HIS 154 HD2 HIS 154 5.602 -38.843 6.182 937 HE1 HIS 154 HE1 HIS 154 9.809 -38.564 5.757 938 HE2 HIS 154 HE2 HIS 154 7.915 -39.206 7.284 939 H HIS 155 H HIS 155 3.996 -34.960 5.980 940 HA HIS 155 HA HIS 155 2.775 -35.351 7.845 941 HB2 HIS 155 1HB HIS 155 1.603 -37.493 6.067 942 HB3 HIS 155 2HB HIS 155 1.000 -37.162 7.685 943 HD1 HIS 155 HD1 HIS 155 1.016 -35.828 4.209 944 HD2 HIS 155 HD2 HIS 155 -0.400 -34.730 7.958 945 HE1 HIS 155 HE1 HIS 155 -0.612 -33.959 3.796 946 HE2 HIS 155 HE2 HIS 155 -1.277 -33.173 6.093 Start of MODEL 18 1 H1 MET 24 1H MET 24 -13.733 -14.084 -8.481 2 H2 MET 24 2H MET 24 -13.787 -12.930 -9.707 3 H3 MET 24 3H MET 24 -13.558 -14.557 -10.093 4 HA MET 24 HA MET 24 -15.799 -13.893 -10.587 5 HB2 MET 24 1HB MET 24 -15.545 -15.720 -8.189 6 HB3 MET 24 2HB MET 24 -17.005 -15.556 -9.153 7 HG2 MET 24 1HG MET 24 -15.811 -16.380 -11.112 8 HG3 MET 24 2HG MET 24 -14.340 -16.533 -10.153 9 HE1 MET 24 1HE MET 24 -15.451 -20.251 -10.788 10 HE2 MET 24 2HE MET 24 -14.150 -19.075 -10.971 11 HE3 MET 24 3HE MET 24 -15.643 -18.891 -11.892 12 H GLU 25 H GLU 25 -15.604 -14.039 -7.031 13 HA GLU 25 HA GLU 25 -17.686 -12.020 -6.884 14 HB2 GLU 25 1HB GLU 25 -17.682 -12.516 -4.465 15 HB3 GLU 25 2HB GLU 25 -17.914 -13.958 -5.442 16 HG2 GLU 25 1HG GLU 25 -15.501 -14.466 -5.152 17 HG3 GLU 25 2HG GLU 25 -15.396 -13.100 -4.045 18 H ASN 26 H ASN 26 -17.240 -10.556 -4.761 19 HA ASN 26 HA ASN 26 -16.176 -8.752 -3.908 20 HB2 ASN 26 1HB ASN 26 -13.713 -10.165 -4.934 21 HB3 ASN 26 2HB ASN 26 -13.645 -8.622 -4.094 22 HD21 ASN 26 1HD2 ASN 26 -14.061 -12.016 -3.802 23 HD22 ASN 26 2HD2 ASN 26 -14.110 -12.079 -2.074 24 H TYR 27 H TYR 27 -16.999 -8.995 -6.873 25 HA TYR 27 HA TYR 27 -15.056 -7.487 -8.310 26 HB2 TYR 27 1HB TYR 27 -16.724 -9.111 -9.326 27 HB3 TYR 27 2HB TYR 27 -17.933 -7.843 -9.139 28 HD1 TYR 27 HD1 TYR 27 -14.691 -8.643 -10.753 29 HD2 TYR 27 HD2 TYR 27 -18.090 -6.080 -10.718 30 HE1 TYR 27 HE1 TYR 27 -13.960 -7.648 -12.877 31 HE2 TYR 27 HE2 TYR 27 -17.366 -5.085 -12.845 32 HH TYR 27 HH TYR 27 -14.866 -6.446 -14.756 33 H LEU 28 H LEU 28 -18.164 -6.686 -6.824 34 HA LEU 28 HA LEU 28 -18.210 -3.970 -7.570 35 HB2 LEU 28 1HB LEU 28 -19.382 -5.355 -5.153 36 HB3 LEU 28 2HB LEU 28 -19.734 -3.698 -5.595 37 HG LEU 28 HG LEU 28 -20.363 -6.095 -7.325 38 HD11 LEU 28 1HD1 LEU 28 -21.692 -6.131 -5.289 39 HD12 LEU 28 2HD1 LEU 28 -22.690 -5.698 -6.678 40 HD13 LEU 28 3HD1 LEU 28 -22.162 -4.452 -5.547 41 HD21 LEU 28 1HD2 LEU 28 -21.150 -3.191 -7.541 42 HD22 LEU 28 2HD2 LEU 28 -21.739 -4.494 -8.573 43 HD23 LEU 28 3HD2 LEU 28 -20.033 -4.051 -8.601 44 H ARG 29 H ARG 29 -16.888 -5.628 -4.757 45 HA ARG 29 HA ARG 29 -15.939 -3.304 -3.456 46 HB2 ARG 29 1HB ARG 29 -16.299 -5.351 -2.221 47 HB3 ARG 29 2HB ARG 29 -15.132 -6.206 -3.215 48 HG2 ARG 29 1HG ARG 29 -13.337 -5.285 -2.151 49 HG3 ARG 29 2HG ARG 29 -14.215 -3.825 -1.694 50 HD2 ARG 29 1HD ARG 29 -13.690 -5.300 0.232 51 HD3 ARG 29 2HD ARG 29 -15.416 -5.012 0.016 52 HE ARG 29 HE ARG 29 -14.233 -7.463 -1.082 53 HH11 ARG 29 1HH1 ARG 29 -16.340 -5.918 1.271 54 HH12 ARG 29 2HH1 ARG 29 -17.129 -7.403 1.703 55 HH21 ARG 29 1HH2 ARG 29 -15.261 -9.404 -0.487 56 HH22 ARG 29 2HH2 ARG 29 -16.517 -9.377 0.720 57 H LYS 30 H LYS 30 -14.566 -5.451 -5.872 58 HA LYS 30 HA LYS 30 -11.902 -4.666 -5.765 59 HB2 LYS 30 1HB LYS 30 -13.645 -5.701 -7.961 60 HB3 LYS 30 2HB LYS 30 -12.035 -5.118 -8.352 61 HG2 LYS 30 1HG LYS 30 -11.034 -6.747 -6.898 62 HG3 LYS 30 2HG LYS 30 -12.620 -7.266 -6.324 63 HD2 LYS 30 1HD LYS 30 -13.192 -8.060 -8.547 64 HD3 LYS 30 2HD LYS 30 -11.655 -7.469 -9.176 65 HE2 LYS 30 1HE LYS 30 -11.906 -9.549 -7.011 66 HE3 LYS 30 2HE LYS 30 -11.726 -9.930 -8.723 67 HZ1 LYS 30 1HZ LYS 30 -9.611 -8.759 -8.716 68 HZ2 LYS 30 2HZ LYS 30 -9.608 -10.005 -7.580 69 HZ3 LYS 30 3HZ LYS 30 -9.785 -8.405 -7.074 70 H ALA 31 H ALA 31 -14.484 -3.280 -7.868 71 HA ALA 31 HA ALA 31 -12.982 -1.240 -8.939 72 HB1 ALA 31 1HB ALA 31 -15.213 -1.887 -9.716 73 HB2 ALA 31 2HB ALA 31 -15.086 -0.150 -9.441 74 HB3 ALA 31 3HB ALA 31 -15.916 -1.169 -8.265 75 H ALA 32 H ALA 32 -14.678 -1.337 -5.849 76 HA ALA 32 HA ALA 32 -14.388 1.421 -5.255 77 HB1 ALA 32 1HB ALA 32 -16.002 -0.011 -4.090 78 HB2 ALA 32 2HB ALA 32 -14.922 0.797 -2.955 79 HB3 ALA 32 3HB ALA 32 -14.674 -0.905 -3.349 80 H LEU 33 H LEU 33 -12.475 -1.440 -4.512 81 HA LEU 33 HA LEU 33 -10.473 -0.094 -3.013 82 HB2 LEU 33 1HB LEU 33 -10.266 -2.694 -4.536 83 HB3 LEU 33 2HB LEU 33 -9.186 -2.149 -3.265 84 HG LEU 33 HG LEU 33 -12.097 -2.883 -2.941 85 HD11 LEU 33 1HD1 LEU 33 -11.218 -4.725 -1.578 86 HD12 LEU 33 2HD1 LEU 33 -9.579 -4.255 -2.028 87 HD13 LEU 33 3HD1 LEU 33 -10.704 -4.822 -3.262 88 HD21 LEU 33 1HD2 LEU 33 -10.089 -1.948 -0.900 89 HD22 LEU 33 2HD2 LEU 33 -11.692 -2.588 -0.537 90 HD23 LEU 33 3HD2 LEU 33 -11.528 -1.080 -1.436 91 H THR 34 H THR 34 -10.880 -0.888 -6.409 92 HA THR 34 HA THR 34 -8.276 -0.154 -7.241 93 HB THR 34 HB THR 34 -10.822 -0.118 -8.880 94 HG1 THR 34 HG1 THR 34 -10.228 -2.171 -7.806 95 HG21 THR 34 1HG2 THR 34 -8.943 1.063 -9.927 96 HG22 THR 34 2HG2 THR 34 -9.324 -0.429 -10.788 97 HG23 THR 34 3HG2 THR 34 -7.927 -0.363 -9.712 98 H ASP 35 H ASP 35 -11.311 1.598 -6.884 99 HA ASP 35 HA ASP 35 -10.407 4.033 -8.039 100 HB2 ASP 35 1HB ASP 35 -12.819 3.400 -7.684 101 HB3 ASP 35 2HB ASP 35 -12.580 3.694 -5.962 102 H MET 36 H MET 36 -10.519 2.747 -4.768 103 HA MET 36 HA MET 36 -9.492 4.950 -3.371 104 HB2 MET 36 1HB MET 36 -10.393 3.078 -2.157 105 HB3 MET 36 2HB MET 36 -9.237 1.972 -2.885 106 HG2 MET 36 1HG MET 36 -7.430 3.285 -1.719 107 HG3 MET 36 2HG MET 36 -8.721 4.104 -0.837 108 HE1 MET 36 1HE MET 36 -6.311 2.439 0.527 109 HE2 MET 36 2HE MET 36 -7.201 1.620 1.811 110 HE3 MET 36 3HE MET 36 -7.550 3.307 1.434 111 H LEU 37 H LEU 37 -7.853 2.199 -4.885 112 HA LEU 37 HA LEU 37 -5.216 2.998 -4.349 113 HB2 LEU 37 1HB LEU 37 -5.827 0.743 -5.061 114 HB3 LEU 37 2HB LEU 37 -6.340 1.362 -6.626 115 HG LEU 37 HG LEU 37 -3.937 2.101 -6.985 116 HD11 LEU 37 1HD1 LEU 37 -2.232 0.944 -5.665 117 HD12 LEU 37 2HD1 LEU 37 -3.489 0.292 -4.615 118 HD13 LEU 37 3HD1 LEU 37 -3.199 2.030 -4.667 119 HD21 LEU 37 1HD2 LEU 37 -4.906 0.151 -8.074 120 HD22 LEU 37 2HD2 LEU 37 -4.511 -0.844 -6.672 121 HD23 LEU 37 3HD2 LEU 37 -3.219 -0.140 -7.647 122 H GLN 38 H GLN 38 -7.389 3.659 -7.036 123 HA GLN 38 HA GLN 38 -5.548 4.979 -8.703 124 HB2 GLN 38 1HB GLN 38 -7.749 4.089 -9.435 125 HB3 GLN 38 2HB GLN 38 -8.543 5.370 -8.532 126 HG2 GLN 38 1HG GLN 38 -8.467 5.919 -10.877 127 HG3 GLN 38 2HG GLN 38 -7.458 7.035 -9.959 128 HE21 GLN 38 1HE2 GLN 38 -6.509 3.751 -10.738 129 HE22 GLN 38 2HE2 GLN 38 -5.248 4.177 -11.840 130 H THR 39 H THR 39 -7.485 6.072 -6.004 131 HA THR 39 HA THR 39 -7.009 8.868 -6.425 132 HB THR 39 HB THR 39 -7.801 7.456 -3.867 133 HG1 THR 39 HG1 THR 39 -9.365 6.977 -5.364 134 HG21 THR 39 1HG2 THR 39 -8.227 10.316 -4.751 135 HG22 THR 39 2HG2 THR 39 -7.028 9.785 -3.571 136 HG23 THR 39 3HG2 THR 39 -8.750 9.608 -3.222 137 H PHE 40 H PHE 40 -5.419 6.265 -4.742 138 HA PHE 40 HA PHE 40 -3.637 7.882 -3.225 139 HB2 PHE 40 1HB PHE 40 -4.193 5.554 -2.604 140 HB3 PHE 40 2HB PHE 40 -3.348 4.987 -4.044 141 HD1 PHE 40 HD1 PHE 40 -1.344 4.019 -3.562 142 HD2 PHE 40 HD2 PHE 40 -2.566 7.424 -1.321 143 HE1 PHE 40 HE1 PHE 40 0.783 3.972 -2.338 144 HE2 PHE 40 HE2 PHE 40 -0.441 7.386 -0.093 145 HZ PHE 40 HZ PHE 40 1.241 5.657 -0.597 146 H VAL 41 H VAL 41 -3.531 6.450 -6.421 147 HA VAL 41 HA VAL 41 -0.869 6.449 -7.011 148 HB VAL 41 HB VAL 41 -3.145 7.142 -8.859 149 HG11 VAL 41 1HG1 VAL 41 -1.063 8.004 -9.783 150 HG12 VAL 41 2HG1 VAL 41 -1.622 6.602 -10.697 151 HG13 VAL 41 3HG1 VAL 41 -0.297 6.433 -9.544 152 HG21 VAL 41 1HG2 VAL 41 -3.266 4.923 -7.865 153 HG22 VAL 41 2HG2 VAL 41 -1.618 4.589 -8.391 154 HG23 VAL 41 3HG2 VAL 41 -2.895 4.819 -9.585 155 HA PRO 42 HA PRO 42 -1.044 11.170 -8.422 156 HB2 PRO 42 1HB PRO 42 -3.095 12.078 -6.477 157 HB3 PRO 42 2HB PRO 42 -2.768 12.644 -8.118 158 HG2 PRO 42 1HG PRO 42 -4.876 11.100 -7.595 159 HG3 PRO 42 2HG PRO 42 -3.950 10.913 -9.096 160 HD2 PRO 42 1HD PRO 42 -3.947 9.223 -6.637 161 HD3 PRO 42 2HD PRO 42 -3.782 8.748 -8.336 162 H TYR 43 H TYR 43 -1.784 10.194 -5.038 163 HA TYR 43 HA TYR 43 -0.186 12.220 -3.871 164 HB2 TYR 43 1HB TYR 43 -1.307 9.612 -2.860 165 HB3 TYR 43 2HB TYR 43 -0.235 10.592 -1.862 166 HD1 TYR 43 HD1 TYR 43 -0.946 13.013 -1.393 167 HD2 TYR 43 HD2 TYR 43 -3.616 10.064 -2.919 168 HE1 TYR 43 HE1 TYR 43 -2.853 14.342 -0.610 169 HE2 TYR 43 HE2 TYR 43 -5.529 11.393 -2.136 170 HH TYR 43 HH TYR 43 -5.291 14.599 -1.194 171 H ARG 44 H ARG 44 0.544 9.118 -5.241 172 HA ARG 44 HA ARG 44 2.915 8.523 -3.886 173 HB2 ARG 44 1HB ARG 44 2.274 7.935 -6.777 174 HB3 ARG 44 2HB ARG 44 3.541 7.169 -5.829 175 HG2 ARG 44 1HG ARG 44 1.756 6.339 -4.285 176 HG3 ARG 44 2HG ARG 44 0.571 6.931 -5.455 177 HD2 ARG 44 1HD ARG 44 2.657 4.788 -5.835 178 HD3 ARG 44 2HD ARG 44 0.903 4.622 -5.942 179 HE ARG 44 HE ARG 44 1.683 6.469 -7.878 180 HH11 ARG 44 1HH1 ARG 44 2.143 3.078 -7.169 181 HH12 ARG 44 2HH1 ARG 44 2.380 2.627 -8.824 182 HH21 ARG 44 1HH2 ARG 44 2.009 5.880 -10.072 183 HH22 ARG 44 2HH2 ARG 44 2.321 4.222 -10.475 184 H THR 45 H THR 45 2.408 10.388 -6.858 185 HA THR 45 HA THR 45 4.951 11.093 -7.488 186 HB THR 45 HB THR 45 2.594 12.981 -7.529 187 HG1 THR 45 HG1 THR 45 3.501 11.217 -9.581 188 HG21 THR 45 1HG2 THR 45 4.688 14.126 -7.989 189 HG22 THR 45 2HG2 THR 45 3.747 13.973 -9.472 190 HG23 THR 45 3HG2 THR 45 5.119 12.904 -9.183 191 H ALA 46 H ALA 46 2.982 12.596 -4.940 192 HA ALA 46 HA ALA 46 4.808 14.638 -4.256 193 HB1 ALA 46 1HB ALA 46 2.768 13.242 -2.525 194 HB2 ALA 46 2HB ALA 46 2.482 14.671 -3.519 195 HB3 ALA 46 3HB ALA 46 3.575 14.762 -2.136 196 H VAL 47 H VAL 47 4.452 11.318 -3.296 197 HA VAL 47 HA VAL 47 6.498 11.343 -1.277 198 HB VAL 47 HB VAL 47 5.190 9.035 -2.735 199 HG11 VAL 47 1HG1 VAL 47 6.148 7.600 -0.983 200 HG12 VAL 47 2HG1 VAL 47 7.041 8.981 -0.349 201 HG13 VAL 47 3HG1 VAL 47 7.399 8.367 -1.964 202 HG21 VAL 47 1HG2 VAL 47 3.669 10.305 -1.314 203 HG22 VAL 47 2HG2 VAL 47 4.775 10.121 0.049 204 HG23 VAL 47 3HG2 VAL 47 3.977 8.706 -0.636 205 H GLU 48 H GLU 48 6.298 10.431 -4.676 206 HA GLU 48 HA GLU 48 8.860 9.309 -4.946 207 HB2 GLU 48 1HB GLU 48 7.171 10.706 -7.035 208 HB3 GLU 48 2HB GLU 48 8.570 9.699 -7.372 209 HG2 GLU 48 1HG GLU 48 7.430 7.756 -6.514 210 HG3 GLU 48 2HG GLU 48 6.049 8.743 -6.029 211 H LEU 49 H LEU 49 7.685 12.615 -5.474 212 HA LEU 49 HA LEU 49 10.065 13.708 -6.449 213 HB2 LEU 49 1HB LEU 49 7.597 14.751 -5.210 214 HB3 LEU 49 2HB LEU 49 8.998 15.803 -5.089 215 HG LEU 49 HG LEU 49 7.570 16.318 -7.037 216 HD11 LEU 49 1HD1 LEU 49 10.304 15.279 -7.758 217 HD12 LEU 49 2HD1 LEU 49 9.946 16.863 -7.071 218 HD13 LEU 49 3HD1 LEU 49 9.358 16.446 -8.679 219 HD21 LEU 49 1HD2 LEU 49 7.507 14.816 -8.945 220 HD22 LEU 49 2HD2 LEU 49 6.805 14.039 -7.525 221 HD23 LEU 49 3HD2 LEU 49 8.434 13.612 -8.049 222 H CYS 50 H CYS 50 8.887 13.377 -3.143 223 HA CYS 50 HA CYS 50 11.091 14.602 -1.882 224 HB2 CYS 50 1HB CYS 50 9.079 14.326 -0.643 225 HB3 CYS 50 2HB CYS 50 9.038 12.597 -0.954 226 H ALA 51 H ALA 51 10.344 11.189 -2.542 227 HA ALA 51 HA ALA 51 12.707 10.094 -1.490 228 HB1 ALA 51 1HB ALA 51 10.698 8.777 -1.990 229 HB2 ALA 51 2HB ALA 51 12.144 8.086 -2.725 230 HB3 ALA 51 3HB ALA 51 10.999 8.992 -3.715 231 H LEU 52 H LEU 52 12.109 11.677 -4.510 232 HA LEU 52 HA LEU 52 14.540 10.713 -5.739 233 HB2 LEU 52 1HB LEU 52 12.548 12.827 -6.556 234 HB3 LEU 52 2HB LEU 52 13.985 12.460 -7.486 235 HG LEU 52 HG LEU 52 11.792 10.470 -6.882 236 HD11 LEU 52 1HD1 LEU 52 10.977 12.265 -8.318 237 HD12 LEU 52 2HD1 LEU 52 11.145 10.758 -9.218 238 HD13 LEU 52 3HD1 LEU 52 12.350 12.032 -9.399 239 HD21 LEU 52 1HD2 LEU 52 14.182 10.349 -8.716 240 HD22 LEU 52 2HD2 LEU 52 12.884 9.157 -8.661 241 HD23 LEU 52 3HD2 LEU 52 13.924 9.391 -7.259 242 H GLU 53 H GLU 53 13.386 13.773 -4.373 243 HA GLU 53 HA GLU 53 15.729 15.220 -5.064 244 HB2 GLU 53 1HB GLU 53 13.470 16.215 -4.757 245 HB3 GLU 53 2HB GLU 53 13.617 15.929 -3.030 246 HG2 GLU 53 1HG GLU 53 15.402 17.482 -2.841 247 HG3 GLU 53 2HG GLU 53 15.545 17.619 -4.593 248 H HIS 54 H HIS 54 14.742 13.477 -2.211 249 HA HIS 54 HA HIS 54 17.222 14.348 -0.851 250 HB2 HIS 54 1HB HIS 54 15.070 14.745 0.366 251 HB3 HIS 54 2HB HIS 54 14.808 13.006 0.393 252 HD1 HIS 54 HD1 HIS 54 17.097 15.657 1.799 253 HD2 HIS 54 HD2 HIS 54 16.126 11.658 2.410 254 HE1 HIS 54 HE1 HIS 54 18.251 14.998 3.934 255 HE2 HIS 54 HE2 HIS 54 17.523 12.625 4.365 256 H GLY 55 H GLY 55 15.759 11.846 -2.488 257 HA2 GLY 55 1HA GLY 55 16.416 9.764 -3.104 258 HA3 GLY 55 2HA GLY 55 17.960 10.089 -2.342 259 H GLY 56 H GLY 56 16.783 10.426 0.396 260 HA2 GLY 56 1HA GLY 56 15.544 7.804 0.729 261 HA3 GLY 56 2HA GLY 56 16.293 8.759 1.999 262 H LEU 57 H LEU 57 13.732 7.471 1.981 263 HA LEU 57 HA LEU 57 11.649 9.391 1.643 264 HB2 LEU 57 1HB LEU 57 11.714 6.758 3.114 265 HB3 LEU 57 2HB LEU 57 10.267 7.696 2.799 266 HG LEU 57 HG LEU 57 11.999 6.783 0.529 267 HD11 LEU 57 1HD1 LEU 57 10.522 4.798 0.363 268 HD12 LEU 57 2HD1 LEU 57 9.887 5.190 1.962 269 HD13 LEU 57 3HD1 LEU 57 11.588 4.776 1.765 270 HD21 LEU 57 1HD2 LEU 57 10.243 8.433 0.086 271 HD22 LEU 57 2HD2 LEU 57 9.044 7.342 0.779 272 HD23 LEU 57 3HD2 LEU 57 9.896 6.893 -0.698 273 H ASP 58 H ASP 58 14.027 9.227 3.872 274 HA ASP 58 HA ASP 58 12.914 9.445 6.371 275 HB2 ASP 58 1HB ASP 58 15.290 10.983 5.311 276 HB3 ASP 58 2HB ASP 58 14.918 10.711 7.010 277 H THR 59 H THR 59 13.247 11.985 3.930 278 HA THR 59 HA THR 59 12.040 13.939 5.700 279 HB THR 59 HB THR 59 12.269 15.433 3.650 280 HG1 THR 59 HG1 THR 59 12.459 13.963 1.996 281 HG21 THR 59 1HG2 THR 59 13.873 15.477 5.490 282 HG22 THR 59 2HG2 THR 59 14.696 15.681 3.944 283 HG23 THR 59 3HG2 THR 59 14.749 14.125 4.775 284 H CYS 60 H CYS 60 10.691 11.495 4.133 285 HA CYS 60 HA CYS 60 8.554 13.043 2.849 286 HB2 CYS 60 1HB CYS 60 8.967 10.055 2.750 287 HB3 CYS 60 2HB CYS 60 7.975 11.037 1.681 288 H ASP 61 H ASP 61 8.261 13.431 5.394 289 HA ASP 61 HA ASP 61 6.506 11.313 6.446 290 HB2 ASP 61 1HB ASP 61 8.616 12.015 7.727 291 HB3 ASP 61 2HB ASP 61 7.757 13.520 8.070 292 H GLY 62 H GLY 62 4.426 11.765 6.958 293 HA2 GLY 62 1HA GLY 62 3.308 14.143 5.801 294 HA3 GLY 62 2HA GLY 62 2.422 12.853 6.600 295 H GLY 63 H GLY 63 3.350 16.039 6.797 296 HA2 GLY 63 1HA GLY 63 2.240 17.327 8.563 297 HA3 GLY 63 2HA GLY 63 2.746 16.073 9.690 298 H SER 64 H SER 64 5.284 16.352 7.699 299 HA SER 64 HA SER 64 6.472 18.702 8.916 300 HB2 SER 64 1HB SER 64 8.457 17.317 9.679 301 HB3 SER 64 2HB SER 64 6.979 17.086 10.612 302 HG SER 64 HG SER 64 6.597 15.182 9.463 303 H ASN 65 H ASN 65 8.863 18.863 8.091 304 HA ASN 65 HA ASN 65 10.320 19.049 6.368 305 HB2 ASN 65 1HB ASN 65 9.080 16.452 5.438 306 HB3 ASN 65 2HB ASN 65 10.586 17.134 4.840 307 HD21 ASN 65 1HD2 ASN 65 9.033 15.457 7.448 308 HD22 ASN 65 2HD2 ASN 65 10.476 15.083 8.338 309 H GLY 66 H GLY 66 7.649 20.237 6.117 310 HA2 GLY 66 1HA GLY 66 6.827 21.680 4.484 311 HA3 GLY 66 2HA GLY 66 7.845 20.877 3.296 312 H ILE 67 H ILE 67 6.481 18.357 4.708 313 HA ILE 67 HA ILE 67 4.383 18.203 2.700 314 HB ILE 67 HB ILE 67 5.453 16.064 4.550 315 HG12 ILE 67 1HG1 ILE 67 5.991 16.644 1.628 316 HG13 ILE 67 2HG1 ILE 67 7.145 16.788 2.951 317 HG21 ILE 67 1HG2 ILE 67 4.254 14.498 3.090 318 HG22 ILE 67 2HG2 ILE 67 3.598 15.854 2.176 319 HG23 ILE 67 3HG2 ILE 67 3.148 15.631 3.868 320 HD11 ILE 67 1HD1 ILE 67 7.547 14.778 1.672 321 HD12 ILE 67 2HD1 ILE 67 5.892 14.241 1.958 322 HD13 ILE 67 3HD1 ILE 67 7.019 14.373 3.306 323 HA PRO 68 HA PRO 68 1.430 19.318 5.867 324 HB2 PRO 68 1HB PRO 68 -0.568 18.441 3.893 325 HB3 PRO 68 2HB PRO 68 -0.341 20.030 4.629 326 HG2 PRO 68 1HG PRO 68 0.254 19.566 2.051 327 HG3 PRO 68 2HG PRO 68 1.192 20.699 3.049 328 HD2 PRO 68 1HD PRO 68 1.844 17.887 2.237 329 HD3 PRO 68 2HD PRO 68 2.912 19.307 2.344 330 H SER 69 H SER 69 0.329 18.207 7.378 331 HA SER 69 HA SER 69 0.422 15.531 7.821 332 HB2 SER 69 1HB SER 69 -1.947 17.278 8.526 333 HB3 SER 69 2HB SER 69 -1.391 15.841 9.387 334 HG SER 69 HG SER 69 -0.579 18.402 9.637 335 HA PRO 70 HA PRO 70 -1.566 13.431 4.605 336 HB2 PRO 70 1HB PRO 70 -2.884 11.465 6.114 337 HB3 PRO 70 2HB PRO 70 -1.246 11.366 5.463 338 HG2 PRO 70 1HG PRO 70 -2.161 12.106 8.200 339 HG3 PRO 70 2HG PRO 70 -0.717 11.206 7.702 340 HD2 PRO 70 1HD PRO 70 -0.538 13.754 8.486 341 HD3 PRO 70 2HD PRO 70 0.448 13.143 7.141 342 H THR 71 H THR 71 -3.265 14.000 3.500 343 HA THR 71 HA THR 71 -5.625 14.975 4.884 344 HB THR 71 HB THR 71 -6.254 15.791 2.567 345 HG1 THR 71 HG1 THR 71 -4.866 14.301 1.426 346 HG21 THR 71 1HG2 THR 71 -5.228 17.290 4.191 347 HG22 THR 71 2HG2 THR 71 -4.603 17.624 2.575 348 HG23 THR 71 3HG2 THR 71 -3.624 16.718 3.728 349 H THR 72 H THR 72 -7.559 14.057 4.778 350 HA THR 72 HA THR 72 -7.788 11.553 3.265 351 HB THR 72 HB THR 72 -9.878 11.234 4.727 352 HG1 THR 72 HG1 THR 72 -10.051 12.472 6.528 353 HG21 THR 72 1HG2 THR 72 -7.839 9.935 5.014 354 HG22 THR 72 2HG2 THR 72 -8.548 10.329 6.580 355 HG23 THR 72 3HG2 THR 72 -7.141 11.222 5.999 356 H THR 73 H THR 73 -9.017 11.468 1.552 357 HA THR 73 HA THR 73 -10.471 13.755 0.648 358 HB THR 73 HB THR 73 -10.984 12.447 -1.328 359 HG1 THR 73 HG1 THR 73 -10.503 10.237 -1.414 360 HG21 THR 73 1HG2 THR 73 -8.723 11.832 -2.061 361 HG22 THR 73 2HG2 THR 73 -8.163 11.905 -0.391 362 HG23 THR 73 3HG2 THR 73 -8.724 13.370 -1.198 363 H ARG 74 H ARG 74 -12.801 13.177 -0.324 364 HA ARG 74 HA ARG 74 -14.510 12.899 1.852 365 HB2 ARG 74 1HB ARG 74 -15.292 13.966 -0.144 366 HB3 ARG 74 2HB ARG 74 -15.016 12.512 -1.096 367 HG2 ARG 74 1HG ARG 74 -16.782 11.361 0.092 368 HG3 ARG 74 2HG ARG 74 -17.036 12.770 1.121 369 HD2 ARG 74 1HD ARG 74 -17.637 14.088 -0.872 370 HD3 ARG 74 2HD ARG 74 -17.432 12.647 -1.867 371 HE ARG 74 HE ARG 74 -19.304 12.346 0.310 372 HH11 ARG 74 1HH1 ARG 74 -18.861 13.261 -3.039 373 HH12 ARG 74 2HH1 ARG 74 -20.522 13.002 -3.466 374 HH21 ARG 74 1HH2 ARG 74 -21.503 12.011 -0.247 375 HH22 ARG 74 2HH2 ARG 74 -22.023 12.291 -1.879 376 H TYR 75 H TYR 75 -13.440 10.454 -0.494 377 HA TYR 75 HA TYR 75 -15.098 8.476 0.823 378 HB2 TYR 75 1HB TYR 75 -13.394 8.344 -1.662 379 HB3 TYR 75 2HB TYR 75 -14.273 6.961 -1.004 380 HD1 TYR 75 HD1 TYR 75 -14.471 9.743 -3.195 381 HD2 TYR 75 HD2 TYR 75 -16.817 7.305 -0.627 382 HE1 TYR 75 HE1 TYR 75 -16.500 10.456 -4.385 383 HE2 TYR 75 HE2 TYR 75 -18.852 8.004 -1.808 384 HH TYR 75 HH TYR 75 -19.650 9.814 -3.184 385 H VAL 76 H VAL 76 -11.798 9.491 0.956 386 HA VAL 76 HA VAL 76 -10.839 6.913 1.862 387 HB VAL 76 HB VAL 76 -9.506 9.620 1.729 388 HG11 VAL 76 1HG1 VAL 76 -7.433 8.549 2.450 389 HG12 VAL 76 2HG1 VAL 76 -8.287 7.022 2.678 390 HG13 VAL 76 3HG1 VAL 76 -8.666 8.404 3.704 391 HG21 VAL 76 1HG2 VAL 76 -9.029 7.023 0.268 392 HG22 VAL 76 2HG2 VAL 76 -8.094 8.503 0.058 393 HG23 VAL 76 3HG2 VAL 76 -9.799 8.464 -0.397 394 H SER 77 H SER 77 -10.635 6.221 3.876 395 HA SER 77 HA SER 77 -12.142 7.673 5.875 396 HB2 SER 77 1HB SER 77 -12.581 5.279 5.552 397 HB3 SER 77 2HB SER 77 -10.905 4.907 5.970 398 HG SER 77 HG SER 77 -12.442 4.668 7.716 399 H ALA 78 H ALA 78 -8.872 6.250 5.653 400 HA ALA 78 HA ALA 78 -7.815 8.250 7.400 401 HB1 ALA 78 1HB ALA 78 -7.112 6.737 9.193 402 HB2 ALA 78 2HB ALA 78 -8.006 5.422 8.428 403 HB3 ALA 78 3HB ALA 78 -8.868 6.820 9.067 404 H MET 79 H MET 79 -5.628 8.384 7.276 405 HA MET 79 HA MET 79 -4.001 6.245 6.315 406 HB2 MET 79 1HB MET 79 -3.176 7.415 4.290 407 HB3 MET 79 2HB MET 79 -4.856 6.915 4.161 408 HG2 MET 79 1HG MET 79 -5.608 9.169 4.556 409 HG3 MET 79 2HG MET 79 -3.953 9.705 4.845 410 HE1 MET 79 1HE MET 79 -2.360 8.097 2.539 411 HE2 MET 79 2HE MET 79 -2.080 9.783 2.974 412 HE3 MET 79 3HE MET 79 -2.346 9.340 1.288 413 H SER 80 H SER 80 -1.854 6.587 6.709 414 HA SER 80 HA SER 80 -1.072 9.194 7.807 415 HB2 SER 80 1HB SER 80 -1.568 7.822 9.738 416 HB3 SER 80 2HB SER 80 -0.640 6.477 9.080 417 HG SER 80 HG SER 80 1.150 7.371 9.748 418 H VAL 81 H VAL 81 1.096 9.725 7.504 419 HA VAL 81 HA VAL 81 2.582 7.912 5.716 420 HB VAL 81 HB VAL 81 2.676 10.934 5.654 421 HG11 VAL 81 1HG1 VAL 81 3.905 10.608 3.550 422 HG12 VAL 81 2HG1 VAL 81 3.873 8.864 3.813 423 HG13 VAL 81 3HG1 VAL 81 4.750 9.910 4.929 424 HG21 VAL 81 1HG2 VAL 81 0.510 10.157 4.887 425 HG22 VAL 81 2HG2 VAL 81 1.290 9.037 3.770 426 HG23 VAL 81 3HG2 VAL 81 1.461 10.777 3.539 427 H ALA 82 H ALA 82 4.374 7.176 6.674 428 HA ALA 82 HA ALA 82 5.766 8.938 8.563 429 HB1 ALA 82 1HB ALA 82 4.454 7.278 9.835 430 HB2 ALA 82 2HB ALA 82 6.193 7.053 10.037 431 HB3 ALA 82 3HB ALA 82 5.284 5.983 8.968 432 H LYS 83 H LYS 83 7.535 9.366 7.614 433 HA LYS 83 HA LYS 83 9.360 9.300 6.194 434 HB2 LYS 83 1HB LYS 83 9.683 6.542 7.398 435 HB3 LYS 83 2HB LYS 83 10.949 7.525 6.680 436 HG2 LYS 83 1HG LYS 83 9.428 8.134 9.205 437 HG3 LYS 83 2HG LYS 83 11.105 7.600 9.089 438 HD2 LYS 83 1HD LYS 83 11.591 9.674 7.783 439 HD3 LYS 83 2HD LYS 83 9.946 10.211 8.120 440 HE2 LYS 83 1HE LYS 83 11.422 11.244 9.698 441 HE3 LYS 83 2HE LYS 83 10.450 10.044 10.547 442 HZ1 LYS 83 1HZ LYS 83 13.224 9.603 9.590 443 HZ2 LYS 83 2HZ LYS 83 12.296 8.525 10.502 444 HZ3 LYS 83 3HZ LYS 83 12.802 9.990 11.180 445 H GLY 84 H GLY 84 7.162 8.816 4.736 446 HA2 GLY 84 1HA GLY 84 6.771 8.217 2.527 447 HA3 GLY 84 2HA GLY 84 8.168 7.151 2.592 448 H VAL 85 H VAL 85 7.133 5.849 5.020 449 HA VAL 85 HA VAL 85 5.509 3.833 3.851 450 HB VAL 85 HB VAL 85 5.962 4.358 6.794 451 HG11 VAL 85 1HG1 VAL 85 5.109 1.860 5.340 452 HG12 VAL 85 2HG1 VAL 85 4.102 2.850 6.397 453 HG13 VAL 85 3HG1 VAL 85 5.477 1.968 7.060 454 HG21 VAL 85 1HG2 VAL 85 7.765 2.694 6.607 455 HG22 VAL 85 2HG2 VAL 85 8.079 4.132 5.636 456 HG23 VAL 85 3HG2 VAL 85 7.523 2.649 4.860 457 H VAL 86 H VAL 86 3.260 3.513 3.915 458 HA VAL 86 HA VAL 86 1.740 5.725 5.087 459 HB VAL 86 HB VAL 86 1.329 4.665 2.282 460 HG11 VAL 86 1HG1 VAL 86 -0.114 6.846 3.787 461 HG12 VAL 86 2HG1 VAL 86 -0.769 5.259 3.380 462 HG13 VAL 86 3HG1 VAL 86 -0.379 6.407 2.101 463 HG21 VAL 86 1HG2 VAL 86 3.278 6.111 2.393 464 HG22 VAL 86 2HG2 VAL 86 2.341 7.340 3.240 465 HG23 VAL 86 3HG2 VAL 86 1.957 6.937 1.568 466 H SER 87 H SER 87 0.513 4.789 6.536 467 HA SER 87 HA SER 87 -0.715 2.192 5.948 468 HB2 SER 87 1HB SER 87 -0.499 3.672 8.582 469 HB3 SER 87 2HB SER 87 -1.134 2.042 8.362 470 HG SER 87 HG SER 87 0.840 1.389 8.561 471 H LEU 88 H LEU 88 -2.755 2.075 5.392 472 HA LEU 88 HA LEU 88 -4.567 4.302 6.074 473 HB2 LEU 88 1HB LEU 88 -4.857 2.298 3.826 474 HB3 LEU 88 2HB LEU 88 -5.913 3.665 4.148 475 HG LEU 88 HG LEU 88 -3.646 5.024 3.822 476 HD11 LEU 88 1HD1 LEU 88 -2.209 3.117 3.506 477 HD12 LEU 88 2HD1 LEU 88 -2.315 4.031 2.002 478 HD13 LEU 88 3HD1 LEU 88 -3.221 2.529 2.186 479 HD21 LEU 88 1HD2 LEU 88 -4.281 5.387 1.497 480 HD22 LEU 88 2HD2 LEU 88 -5.700 5.344 2.542 481 HD23 LEU 88 3HD2 LEU 88 -5.300 3.948 1.542 482 H THR 89 H THR 89 -6.722 3.704 6.818 483 HA THR 89 HA THR 89 -6.913 0.920 7.718 484 HB THR 89 HB THR 89 -7.249 3.232 9.634 485 HG1 THR 89 HG1 THR 89 -4.990 1.829 8.814 486 HG21 THR 89 1HG2 THR 89 -8.465 1.184 10.241 487 HG22 THR 89 2HG2 THR 89 -7.128 1.485 11.348 488 HG23 THR 89 3HG2 THR 89 -6.973 0.255 10.095 489 H GLY 90 H GLY 90 -8.936 0.202 8.246 490 HA2 GLY 90 1HA GLY 90 -11.222 -0.010 8.015 491 HA3 GLY 90 2HA GLY 90 -11.220 1.543 8.826 492 H GLN 91 H GLN 91 -10.308 0.627 5.503 493 HA GLN 91 HA GLN 91 -11.823 2.930 4.585 494 HB2 GLN 91 1HB GLN 91 -9.540 2.486 3.753 495 HB3 GLN 91 2HB GLN 91 -10.110 0.985 3.033 496 HG2 GLN 91 1HG GLN 91 -9.905 2.714 1.365 497 HG3 GLN 91 2HG GLN 91 -11.596 2.253 1.574 498 HE21 GLN 91 1HE2 GLN 91 -13.041 3.735 2.339 499 HE22 GLN 91 2HE2 GLN 91 -12.660 5.406 2.546 500 H GLU 92 H GLU 92 -13.813 2.808 3.862 501 HA GLU 92 HA GLU 92 -15.837 1.997 3.268 502 HB2 GLU 92 1HB GLU 92 -14.083 0.568 1.280 503 HB3 GLU 92 2HB GLU 92 -15.830 0.707 1.142 504 HG2 GLU 92 1HG GLU 92 -13.786 2.894 1.012 505 HG3 GLU 92 2HG GLU 92 -14.913 2.376 -0.235 506 H SER 93 H SER 93 -15.187 -0.966 1.907 507 HA SER 93 HA SER 93 -16.722 -2.315 3.903 508 HB2 SER 93 1HB SER 93 -16.803 -2.753 1.413 509 HB3 SER 93 2HB SER 93 -15.235 -3.540 1.575 510 HG SER 93 HG SER 93 -17.598 -4.288 2.964 511 H LEU 94 H LEU 94 -13.449 -1.638 3.580 512 HA LEU 94 HA LEU 94 -12.504 -4.108 4.796 513 HB2 LEU 94 1HB LEU 94 -10.945 -1.657 3.973 514 HB3 LEU 94 2HB LEU 94 -10.278 -3.217 4.426 515 HG LEU 94 HG LEU 94 -11.914 -2.627 1.956 516 HD11 LEU 94 1HD1 LEU 94 -9.001 -3.265 2.371 517 HD12 LEU 94 2HD1 LEU 94 -9.688 -1.754 1.773 518 HD13 LEU 94 3HD1 LEU 94 -9.804 -3.222 0.802 519 HD21 LEU 94 1HD2 LEU 94 -10.675 -5.218 2.885 520 HD22 LEU 94 2HD2 LEU 94 -11.410 -4.940 1.309 521 HD23 LEU 94 3HD2 LEU 94 -12.399 -4.866 2.767 522 H ASN 95 H ASN 95 -14.241 -2.445 6.319 523 HA ASN 95 HA ASN 95 -13.037 -0.907 8.275 524 HB2 ASN 95 1HB ASN 95 -15.452 -1.159 8.132 525 HB3 ASN 95 2HB ASN 95 -15.326 -2.867 8.541 526 HD21 ASN 95 1HD2 ASN 95 -15.051 0.398 9.766 527 HD22 ASN 95 2HD2 ASN 95 -15.159 -0.021 11.440 528 H GLY 96 H GLY 96 -11.811 -1.289 10.037 529 HA2 GLY 96 1HA GLY 96 -10.658 -2.497 11.660 530 HA3 GLY 96 2HA GLY 96 -11.352 -3.977 11.011 531 H LEU 97 H LEU 97 -10.346 -2.942 8.279 532 HA LEU 97 HA LEU 97 -7.878 -4.444 8.460 533 HB2 LEU 97 1HB LEU 97 -9.556 -4.938 6.737 534 HB3 LEU 97 2HB LEU 97 -9.379 -3.314 6.102 535 HG LEU 97 HG LEU 97 -6.964 -5.069 6.174 536 HD11 LEU 97 1HD1 LEU 97 -7.574 -6.051 4.038 537 HD12 LEU 97 2HD1 LEU 97 -9.135 -5.235 4.089 538 HD13 LEU 97 3HD1 LEU 97 -8.759 -6.490 5.267 539 HD21 LEU 97 1HD2 LEU 97 -6.819 -2.720 5.458 540 HD22 LEU 97 2HD2 LEU 97 -8.006 -3.043 4.196 541 HD23 LEU 97 3HD2 LEU 97 -6.430 -3.835 4.149 542 H SER 98 H SER 98 -5.859 -3.690 7.955 543 HA SER 98 HA SER 98 -5.607 -0.804 7.424 544 HB2 SER 98 1HB SER 98 -3.683 -2.471 9.064 545 HB3 SER 98 2HB SER 98 -3.674 -0.717 8.860 546 HG SER 98 HG SER 98 -6.040 -1.749 9.815 547 H VAL 99 H VAL 99 -4.494 -0.317 5.642 548 HA VAL 99 HA VAL 99 -2.893 -2.425 4.345 549 HB VAL 99 HB VAL 99 -3.861 0.194 3.166 550 HG11 VAL 99 1HG1 VAL 99 -2.611 -2.214 1.853 551 HG12 VAL 99 2HG1 VAL 99 -1.845 -0.643 2.099 552 HG13 VAL 99 3HG1 VAL 99 -3.230 -0.791 1.018 553 HG21 VAL 99 1HG2 VAL 99 -4.970 -2.582 2.784 554 HG22 VAL 99 2HG2 VAL 99 -5.488 -1.135 1.921 555 HG23 VAL 99 3HG2 VAL 99 -5.749 -1.265 3.659 556 H VAL 100 H VAL 100 -0.671 -2.164 4.204 557 HA VAL 100 HA VAL 100 0.353 0.415 5.173 558 HB VAL 100 HB VAL 100 1.575 -2.279 5.784 559 HG11 VAL 100 1HG1 VAL 100 2.165 0.473 6.865 560 HG12 VAL 100 2HG1 VAL 100 3.165 -0.434 5.732 561 HG13 VAL 100 3HG1 VAL 100 2.939 -1.026 7.377 562 HG21 VAL 100 1HG2 VAL 100 -0.085 -0.517 7.582 563 HG22 VAL 100 2HG2 VAL 100 0.770 -1.978 8.072 564 HG23 VAL 100 3HG2 VAL 100 -0.567 -2.083 6.928 565 H MET 101 H MET 101 1.219 1.313 3.450 566 HA MET 101 HA MET 101 2.737 -0.314 1.543 567 HB2 MET 101 1HB MET 101 1.199 1.503 0.717 568 HB3 MET 101 2HB MET 101 2.281 2.676 1.463 569 HG2 MET 101 1HG MET 101 4.126 1.698 0.064 570 HG3 MET 101 2HG MET 101 2.884 0.795 -0.797 571 HE1 MET 101 1HE MET 101 4.496 4.231 -0.055 572 HE2 MET 101 2HE MET 101 2.893 4.511 0.622 573 HE3 MET 101 3HE MET 101 3.398 5.373 -0.830 574 H THR 102 H THR 102 4.768 -0.753 2.075 575 HA THR 102 HA THR 102 6.293 1.293 3.558 576 HB THR 102 HB THR 102 6.832 -1.679 3.575 577 HG1 THR 102 HG1 THR 102 4.726 -0.851 4.527 578 HG21 THR 102 1HG2 THR 102 8.150 -1.165 5.564 579 HG22 THR 102 2HG2 THR 102 7.723 0.541 5.425 580 HG23 THR 102 3HG2 THR 102 8.721 -0.222 4.187 581 HA PRO 103 HA PRO 103 8.348 0.866 -0.579 582 HB2 PRO 103 1HB PRO 103 9.196 3.476 -0.620 583 HB3 PRO 103 2HB PRO 103 7.647 2.927 -1.276 584 HG2 PRO 103 1HG PRO 103 8.233 4.240 1.345 585 HG3 PRO 103 2HG PRO 103 6.856 4.473 0.255 586 HD2 PRO 103 1HD PRO 103 6.722 2.984 2.515 587 HD3 PRO 103 2HD PRO 103 5.744 2.629 1.072 588 H GLY 104 H GLY 104 10.356 0.115 -0.657 589 HA2 GLY 104 1HA GLY 104 12.744 0.530 -0.391 590 HA3 GLY 104 2HA GLY 104 12.386 1.277 1.161 591 H TRP 105 H TRP 105 14.046 -1.131 0.204 592 HA TRP 105 HA TRP 105 14.507 -3.283 0.757 593 HB2 TRP 105 1HB TRP 105 14.465 -2.392 3.086 594 HB3 TRP 105 2HB TRP 105 12.745 -2.756 3.177 595 HD1 TRP 105 HD1 TRP 105 15.966 -4.799 2.374 596 HE1 TRP 105 HE1 TRP 105 15.758 -7.083 3.545 597 HE3 TRP 105 HE3 TRP 105 11.360 -4.198 4.508 598 HZ2 TRP 105 HZ2 TRP 105 13.893 -8.441 5.170 599 HZ3 TRP 105 HZ3 TRP 105 10.436 -6.035 5.857 600 HH2 TRP 105 HH2 TRP 105 11.678 -8.114 6.182 601 H ASP 106 H ASP 106 12.571 -2.766 -1.067 602 HA ASP 106 HA ASP 106 10.091 -4.070 -0.562 603 HB2 ASP 106 1HB ASP 106 11.279 -3.447 -3.266 604 HB3 ASP 106 2HB ASP 106 9.578 -3.623 -2.857 605 H ASN 107 H ASN 107 13.137 -5.238 -1.077 606 HA ASN 107 HA ASN 107 12.927 -7.368 -2.818 607 HB2 ASN 107 1HB ASN 107 15.052 -6.690 -1.856 608 HB3 ASN 107 2HB ASN 107 14.512 -7.169 -0.251 609 HD21 ASN 107 1HD2 ASN 107 15.528 -8.295 -3.386 610 HD22 ASN 107 2HD2 ASN 107 15.870 -9.921 -2.909 611 H ALA 108 H ALA 108 11.718 -7.107 0.457 612 HA ALA 108 HA ALA 108 11.329 -9.875 0.912 613 HB1 ALA 108 1HB ALA 108 9.844 -7.578 2.169 614 HB2 ALA 108 2HB ALA 108 11.413 -8.176 2.705 615 HB3 ALA 108 3HB ALA 108 9.990 -9.216 2.802 616 H ASN 109 H ASN 109 9.565 -7.519 -0.876 617 HA ASN 109 HA ASN 109 7.291 -9.365 -1.136 618 HB2 ASN 109 1HB ASN 109 7.560 -6.402 -1.589 619 HB3 ASN 109 2HB ASN 109 6.237 -7.306 -2.318 620 HD21 ASN 109 1HD2 ASN 109 7.657 -6.199 0.673 621 HD22 ASN 109 2HD2 ASN 109 6.271 -6.505 1.661 622 H GLY 110 H GLY 110 9.877 -7.816 -2.864 623 HA2 GLY 110 1HA GLY 110 10.836 -8.747 -4.815 624 HA3 GLY 110 2HA GLY 110 9.313 -9.558 -5.151 625 H VAL 111 H VAL 111 8.272 -6.660 -4.351 626 HA VAL 111 HA VAL 111 8.290 -5.724 -7.133 627 HB VAL 111 HB VAL 111 6.415 -4.913 -4.906 628 HG11 VAL 111 1HG1 VAL 111 6.285 -4.452 -7.883 629 HG12 VAL 111 2HG1 VAL 111 6.609 -3.231 -6.652 630 HG13 VAL 111 3HG1 VAL 111 5.031 -4.015 -6.723 631 HG21 VAL 111 1HG2 VAL 111 6.088 -6.956 -7.092 632 HG22 VAL 111 2HG2 VAL 111 4.760 -6.327 -6.119 633 HG23 VAL 111 3HG2 VAL 111 6.062 -7.234 -5.349 634 H THR 112 H THR 112 10.101 -4.501 -7.262 635 HA THR 112 HA THR 112 11.152 -2.832 -5.282 636 HB THR 112 HB THR 112 12.288 -1.675 -7.262 637 HG1 THR 112 HG1 THR 112 10.384 -3.015 -8.562 638 HG21 THR 112 1HG2 THR 112 13.339 -3.488 -5.982 639 HG22 THR 112 2HG2 THR 112 13.750 -3.585 -7.694 640 HG23 THR 112 3HG2 THR 112 12.541 -4.675 -7.015 641 H GLY 113 H GLY 113 10.573 -0.895 -4.538 642 HA2 GLY 113 1HA GLY 113 10.054 1.429 -5.331 643 HA3 GLY 113 2HA GLY 113 8.695 0.696 -6.172 644 H TRP 114 H TRP 114 7.319 -0.733 -4.617 645 HA TRP 114 HA TRP 114 6.998 0.594 -2.029 646 HB2 TRP 114 1HB TRP 114 4.748 0.226 -4.024 647 HB3 TRP 114 2HB TRP 114 4.580 0.851 -2.385 648 HD1 TRP 114 HD1 TRP 114 5.674 3.322 -1.926 649 HE1 TRP 114 HE1 TRP 114 5.994 5.311 -3.530 650 HE3 TRP 114 HE3 TRP 114 5.229 0.853 -6.378 651 HZ2 TRP 114 HZ2 TRP 114 6.049 5.770 -6.316 652 HZ3 TRP 114 HZ3 TRP 114 5.429 2.137 -8.465 653 HH2 TRP 114 HH2 TRP 114 5.831 4.546 -8.433 654 H ALA 115 H ALA 115 6.841 -0.952 -0.507 655 HA ALA 115 HA ALA 115 6.036 -3.635 -1.269 656 HB1 ALA 115 1HB ALA 115 6.898 -2.573 1.418 657 HB2 ALA 115 2HB ALA 115 7.952 -3.340 0.231 658 HB3 ALA 115 3HB ALA 115 6.661 -4.268 0.996 659 H ARG 116 H ARG 116 4.124 -4.535 -0.825 660 HA ARG 116 HA ARG 116 2.104 -2.742 0.353 661 HB2 ARG 116 1HB ARG 116 1.300 -5.044 -1.343 662 HB3 ARG 116 2HB ARG 116 0.593 -3.439 -1.228 663 HG2 ARG 116 1HG ARG 116 3.233 -3.984 -2.563 664 HG3 ARG 116 2HG ARG 116 1.692 -4.018 -3.420 665 HD2 ARG 116 1HD ARG 116 2.561 -1.633 -1.816 666 HD3 ARG 116 2HD ARG 116 3.052 -1.851 -3.496 667 HE ARG 116 HE ARG 116 0.251 -2.164 -3.232 668 HH11 ARG 116 1HH1 ARG 116 2.749 0.287 -3.272 669 HH12 ARG 116 2HH1 ARG 116 1.708 1.520 -3.903 670 HH21 ARG 116 1HH2 ARG 116 -1.122 -0.537 -4.056 671 HH22 ARG 116 2HH2 ARG 116 -0.489 1.049 -4.355 672 H ASN 117 H ASN 117 1.331 -3.352 2.259 673 HA ASN 117 HA ASN 117 1.143 -6.230 2.864 674 HB2 ASN 117 1HB ASN 117 2.257 -3.998 4.512 675 HB3 ASN 117 2HB ASN 117 1.381 -5.271 5.342 676 HD21 ASN 117 1HD2 ASN 117 3.158 -6.051 2.459 677 HD22 ASN 117 2HD2 ASN 117 4.454 -6.881 3.251 678 H CYS 118 H CYS 118 -0.792 -6.902 3.681 679 HA CYS 118 HA CYS 118 -2.763 -4.809 4.330 680 HB2 CYS 118 1HB CYS 118 -3.208 -5.850 2.114 681 HB3 CYS 118 2HB CYS 118 -3.310 -7.424 2.903 682 H ASN 119 H ASN 119 -3.619 -4.988 6.313 683 HA ASN 119 HA ASN 119 -3.323 -7.580 7.692 684 HB2 ASN 119 1HB ASN 119 -1.605 -6.081 8.515 685 HB3 ASN 119 2HB ASN 119 -2.797 -4.818 8.805 686 HD21 ASN 119 1HD2 ASN 119 -4.074 -4.909 10.619 687 HD22 ASN 119 2HD2 ASN 119 -3.810 -6.038 11.904 688 H ILE 120 H ILE 120 -5.307 -8.339 7.895 689 HA ILE 120 HA ILE 120 -7.189 -6.725 9.448 690 HB ILE 120 HB ILE 120 -8.122 -6.644 7.266 691 HG12 ILE 120 1HG1 ILE 120 -10.199 -8.053 7.478 692 HG13 ILE 120 2HG1 ILE 120 -9.477 -8.779 8.906 693 HG21 ILE 120 1HG2 ILE 120 -6.829 -8.356 6.192 694 HG22 ILE 120 2HG2 ILE 120 -8.545 -8.641 5.899 695 HG23 ILE 120 3HG2 ILE 120 -7.681 -9.613 7.091 696 HD11 ILE 120 1HD1 ILE 120 -10.113 -5.859 8.554 697 HD12 ILE 120 2HD1 ILE 120 -9.443 -6.608 10.002 698 HD13 ILE 120 3HD1 ILE 120 -11.070 -7.022 9.467 699 H GLN 121 H GLN 121 -7.418 -7.724 11.356 700 HA GLN 121 HA GLN 121 -6.172 -10.251 11.752 701 HB2 GLN 121 1HB GLN 121 -6.753 -9.910 14.121 702 HB3 GLN 121 2HB GLN 121 -6.011 -8.482 13.410 703 HG2 GLN 121 1HG GLN 121 -8.230 -7.471 13.150 704 HG3 GLN 121 2HG GLN 121 -8.955 -8.895 13.887 705 HE21 GLN 121 1HE2 GLN 121 -9.846 -7.723 15.550 706 HE22 GLN 121 2HE2 GLN 121 -8.898 -7.060 16.837 707 H SER 122 H SER 122 -9.575 -9.250 11.706 708 HA SER 122 HA SER 122 -10.277 -11.979 12.543 709 HB2 SER 122 1HB SER 122 -11.944 -9.468 12.736 710 HB3 SER 122 2HB SER 122 -12.373 -11.056 13.374 711 HG SER 122 HG SER 122 -10.151 -10.742 14.474 712 H ASP 123 H ASP 123 -9.907 -10.704 9.680 713 HA ASP 123 HA ASP 123 -12.111 -12.189 8.543 714 HB2 ASP 123 1HB ASP 123 -11.982 -9.212 8.384 715 HB3 ASP 123 2HB ASP 123 -12.559 -10.108 6.985 716 H SER 124 H SER 124 -10.547 -13.511 7.656 717 HA SER 124 HA SER 124 -8.339 -12.680 6.148 718 HB2 SER 124 1HB SER 124 -9.919 -15.237 5.806 719 HB3 SER 124 2HB SER 124 -8.232 -14.968 5.372 720 HG SER 124 HG SER 124 -8.267 -14.324 7.841 721 H ALA 125 H ALA 125 -11.712 -12.941 5.294 722 HA ALA 125 HA ALA 125 -11.394 -13.137 2.483 723 HB1 ALA 125 1HB ALA 125 -13.759 -12.613 2.356 724 HB2 ALA 125 2HB ALA 125 -13.753 -12.090 4.041 725 HB3 ALA 125 3HB ALA 125 -13.457 -13.784 3.641 726 H LEU 126 H LEU 126 -11.706 -10.403 4.692 727 HA LEU 126 HA LEU 126 -11.997 -8.419 2.716 728 HB2 LEU 126 1HB LEU 126 -10.848 -8.257 5.497 729 HB3 LEU 126 2HB LEU 126 -11.136 -6.859 4.480 730 HG LEU 126 HG LEU 126 -13.232 -8.747 5.558 731 HD11 LEU 126 1HD1 LEU 126 -12.334 -7.229 7.235 732 HD12 LEU 126 2HD1 LEU 126 -13.987 -6.789 6.813 733 HD13 LEU 126 3HD1 LEU 126 -12.635 -5.856 6.170 734 HD21 LEU 126 1HD2 LEU 126 -14.853 -7.180 4.570 735 HD22 LEU 126 2HD2 LEU 126 -13.873 -7.990 3.348 736 HD23 LEU 126 3HD2 LEU 126 -13.524 -6.320 3.793 737 H GLN 127 H GLN 127 -9.203 -10.007 4.128 738 HA GLN 127 HA GLN 127 -7.268 -8.356 2.879 739 HB2 GLN 127 1HB GLN 127 -6.582 -9.751 4.728 740 HB3 GLN 127 2HB GLN 127 -7.064 -11.204 3.861 741 HG2 GLN 127 1HG GLN 127 -5.322 -10.915 2.259 742 HG3 GLN 127 2HG GLN 127 -4.917 -9.326 2.901 743 HE21 GLN 127 1HE2 GLN 127 -5.672 -12.074 4.920 744 HE22 GLN 127 2HE2 GLN 127 -4.080 -12.290 5.551 745 H GLN 128 H GLN 128 -8.979 -11.273 1.911 746 HA GLN 128 HA GLN 128 -7.516 -11.977 -0.338 747 HB2 GLN 128 1HB GLN 128 -10.496 -12.159 0.124 748 HB3 GLN 128 2HB GLN 128 -9.661 -12.932 -1.216 749 HG2 GLN 128 1HG GLN 128 -8.345 -14.244 0.382 750 HG3 GLN 128 2HG GLN 128 -9.223 -13.483 1.708 751 HE21 GLN 128 1HE2 GLN 128 -9.048 -16.292 0.950 752 HE22 GLN 128 2HE2 GLN 128 -10.674 -16.816 0.677 753 H ALA 129 H ALA 129 -10.145 -9.634 -0.032 754 HA ALA 129 HA ALA 129 -10.039 -8.844 -2.772 755 HB1 ALA 129 1HB ALA 129 -11.232 -7.409 -0.405 756 HB2 ALA 129 2HB ALA 129 -12.069 -8.577 -1.428 757 HB3 ALA 129 3HB ALA 129 -11.531 -7.036 -2.102 758 H CYS 130 H CYS 130 -8.805 -7.523 0.254 759 HA CYS 130 HA CYS 130 -7.844 -5.090 -0.771 760 HB2 CYS 130 1HB CYS 130 -8.173 -5.095 1.513 761 HB3 CYS 130 2HB CYS 130 -7.437 -6.678 1.723 762 H GLU 131 H GLU 131 -6.034 -8.082 0.021 763 HA GLU 131 HA GLU 131 -3.546 -6.936 -0.734 764 HB2 GLU 131 1HB GLU 131 -2.574 -9.068 -0.323 765 HB3 GLU 131 2HB GLU 131 -3.829 -8.837 0.885 766 HG2 GLU 131 1HG GLU 131 -4.342 -10.957 0.334 767 HG3 GLU 131 2HG GLU 131 -5.233 -10.172 -0.972 768 H ASP 132 H ASP 132 -6.055 -8.563 -2.435 769 HA ASP 132 HA ASP 132 -4.560 -9.363 -4.711 770 HB2 ASP 132 1HB ASP 132 -6.802 -10.274 -4.109 771 HB3 ASP 132 2HB ASP 132 -7.508 -8.724 -4.546 772 H VAL 133 H VAL 133 -6.381 -6.440 -3.900 773 HA VAL 133 HA VAL 133 -5.951 -5.303 -6.517 774 HB VAL 133 HB VAL 133 -7.114 -4.058 -4.020 775 HG11 VAL 133 1HG1 VAL 133 -7.121 -3.039 -6.863 776 HG12 VAL 133 2HG1 VAL 133 -6.190 -2.362 -5.525 777 HG13 VAL 133 3HG1 VAL 133 -7.953 -2.299 -5.494 778 HG21 VAL 133 1HG2 VAL 133 -8.453 -5.172 -6.484 779 HG22 VAL 133 2HG2 VAL 133 -9.266 -4.369 -5.142 780 HG23 VAL 133 3HG2 VAL 133 -8.450 -5.909 -4.883 781 H PHE 134 H PHE 134 -4.611 -4.876 -3.264 782 HA PHE 134 HA PHE 134 -3.045 -2.623 -4.149 783 HB2 PHE 134 1HB PHE 134 -3.343 -4.016 -1.512 784 HB3 PHE 134 2HB PHE 134 -2.040 -2.862 -1.776 785 HD1 PHE 134 HD1 PHE 134 -2.484 -0.517 -2.032 786 HD2 PHE 134 HD2 PHE 134 -5.673 -3.291 -1.522 787 HE1 PHE 134 HE1 PHE 134 -4.033 1.346 -1.600 788 HE2 PHE 134 HE2 PHE 134 -7.226 -1.435 -1.090 789 HZ PHE 134 HZ PHE 134 -6.406 0.887 -1.131 790 H ARG 135 H ARG 135 -2.549 -6.027 -4.056 791 HA ARG 135 HA ARG 135 0.325 -5.536 -4.479 792 HB2 ARG 135 1HB ARG 135 -1.145 -7.910 -3.403 793 HB3 ARG 135 2HB ARG 135 0.407 -8.133 -4.192 794 HG2 ARG 135 1HG ARG 135 1.339 -6.458 -2.563 795 HG3 ARG 135 2HG ARG 135 -0.194 -6.579 -1.694 796 HD2 ARG 135 1HD ARG 135 1.482 -8.075 -0.727 797 HD3 ARG 135 2HD ARG 135 0.152 -8.992 -1.435 798 HE ARG 135 HE ARG 135 2.219 -8.661 -3.330 799 HH11 ARG 135 1HH1 ARG 135 1.465 -10.450 -0.423 800 HH12 ARG 135 2HH1 ARG 135 2.503 -11.780 -0.820 801 HH21 ARG 135 1HH2 ARG 135 3.583 -10.417 -3.872 802 HH22 ARG 135 2HH2 ARG 135 3.695 -11.773 -2.785 803 H PHE 136 H PHE 136 0.416 -5.185 -6.728 804 HA PHE 136 HA PHE 136 -0.086 -7.704 -8.167 805 HB2 PHE 136 1HB PHE 136 0.452 -4.945 -9.302 806 HB3 PHE 136 2HB PHE 136 0.210 -6.405 -10.252 807 HD1 PHE 136 HD1 PHE 136 -2.045 -7.642 -9.900 808 HD2 PHE 136 HD2 PHE 136 -1.361 -3.576 -8.825 809 HE1 PHE 136 HE1 PHE 136 -4.466 -7.220 -9.954 810 HE2 PHE 136 HE2 PHE 136 -3.782 -3.153 -8.879 811 HZ PHE 136 HZ PHE 136 -5.337 -4.974 -9.445 812 H ASP 137 H ASP 137 1.700 -8.879 -7.698 813 HA ASP 137 HA ASP 137 4.319 -7.916 -7.733 814 HB2 ASP 137 1HB ASP 137 3.403 -10.729 -8.355 815 HB3 ASP 137 2HB ASP 137 5.002 -10.240 -7.804 816 H ASP 138 H ASP 138 5.576 -7.287 -9.320 817 HA ASP 138 HA ASP 138 4.894 -7.384 -12.038 818 HB2 ASP 138 1HB ASP 138 7.467 -6.818 -10.588 819 HB3 ASP 138 2HB ASP 138 7.430 -6.901 -12.344 820 H ALA 139 H ALA 139 6.151 -9.744 -9.988 821 HA ALA 139 HA ALA 139 7.504 -11.318 -11.963 822 HB1 ALA 139 1HB ALA 139 8.134 -11.463 -9.621 823 HB2 ALA 139 2HB ALA 139 7.581 -13.031 -10.211 824 HB3 ALA 139 3HB ALA 139 6.520 -12.039 -9.209 825 H ASN 140 H ASN 140 4.282 -11.100 -10.633 826 HA ASN 140 HA ASN 140 3.360 -13.475 -12.001 827 HB2 ASN 140 1HB ASN 140 1.797 -11.308 -10.561 828 HB3 ASN 140 2HB ASN 140 1.113 -12.802 -11.189 829 HD21 ASN 140 1HD2 ASN 140 1.016 -11.898 -8.505 830 HD22 ASN 140 2HD2 ASN 140 1.862 -13.055 -7.537 831 H LEU 141 H LEU 141 3.823 -10.186 -12.650 832 HA LEU 141 HA LEU 141 1.903 -10.059 -14.822 833 HB2 LEU 141 1HB LEU 141 4.016 -8.043 -14.044 834 HB3 LEU 141 2HB LEU 141 2.650 -7.770 -15.107 835 HG LEU 141 HG LEU 141 2.546 -8.228 -12.122 836 HD11 LEU 141 1HD1 LEU 141 1.726 -5.945 -12.038 837 HD12 LEU 141 2HD1 LEU 141 1.866 -5.809 -13.790 838 HD13 LEU 141 3HD1 LEU 141 3.313 -6.004 -12.800 839 HD21 LEU 141 1HD2 LEU 141 0.287 -7.780 -14.070 840 HD22 LEU 141 2HD2 LEU 141 0.140 -7.823 -12.314 841 HD23 LEU 141 3HD2 LEU 141 0.621 -9.273 -13.194 842 H VAL 142 H VAL 142 2.693 -9.352 -16.979 843 HA VAL 142 HA VAL 142 5.125 -10.803 -17.699 844 HB VAL 142 HB VAL 142 3.032 -9.541 -19.479 845 HG11 VAL 142 1HG1 VAL 142 5.310 -11.393 -20.170 846 HG12 VAL 142 2HG1 VAL 142 5.227 -9.672 -20.546 847 HG13 VAL 142 3HG1 VAL 142 4.085 -10.791 -21.289 848 HG21 VAL 142 1HG2 VAL 142 3.473 -12.433 -18.744 849 HG22 VAL 142 2HG2 VAL 142 2.293 -11.836 -19.912 850 HG23 VAL 142 3HG2 VAL 142 2.136 -11.418 -18.205 851 HA PRO 143 HA PRO 143 7.268 -6.885 -17.714 852 HB2 PRO 143 1HB PRO 143 9.570 -7.790 -18.879 853 HB3 PRO 143 2HB PRO 143 9.199 -7.989 -17.166 854 HG2 PRO 143 1HG PRO 143 8.948 -9.953 -19.401 855 HG3 PRO 143 2HG PRO 143 9.486 -10.211 -17.730 856 HD2 PRO 143 1HD PRO 143 6.997 -10.868 -18.598 857 HD3 PRO 143 2HD PRO 143 7.333 -10.369 -16.928 858 H ARG 144 H ARG 144 7.217 -5.286 -19.158 859 HA ARG 144 HA ARG 144 7.109 -5.994 -22.010 860 HB2 ARG 144 1HB ARG 144 5.460 -3.967 -20.503 861 HB3 ARG 144 2HB ARG 144 5.621 -3.946 -22.249 862 HG2 ARG 144 1HG ARG 144 4.495 -6.216 -20.625 863 HG3 ARG 144 2HG ARG 144 3.557 -5.032 -21.539 864 HD2 ARG 144 1HD ARG 144 5.404 -7.167 -22.585 865 HD3 ARG 144 2HD ARG 144 3.689 -6.946 -22.914 866 HE ARG 144 HE ARG 144 4.980 -4.660 -23.816 867 HH11 ARG 144 1HH1 ARG 144 4.896 -8.076 -24.586 868 HH12 ARG 144 2HH1 ARG 144 5.376 -7.837 -26.235 869 HH21 ARG 144 1HH2 ARG 144 5.624 -4.353 -25.972 870 HH22 ARG 144 2HH2 ARG 144 5.821 -5.725 -27.016 871 H GLY 145 H GLY 145 8.846 -5.270 -23.008 872 HA2 GLY 145 1HA GLY 145 9.638 -2.554 -22.918 873 HA3 GLY 145 2HA GLY 145 10.720 -3.516 -21.925 874 H SER 146 H SER 146 11.307 -2.039 -24.340 875 HA SER 146 HA SER 146 11.798 -3.805 -26.489 876 HB2 SER 146 1HB SER 146 13.416 -1.374 -25.676 877 HB3 SER 146 2HB SER 146 13.370 -2.119 -27.276 878 HG SER 146 HG SER 146 11.013 -1.655 -27.155 879 H GLY 147 H GLY 147 14.103 -4.507 -27.150 880 HA2 GLY 147 1HA GLY 147 16.232 -5.301 -26.401 881 HA3 GLY 147 2HA GLY 147 15.597 -5.346 -24.762 882 H LEU 148 H LEU 148 13.837 -6.586 -27.515 883 HA LEU 148 HA LEU 148 13.625 -9.157 -26.272 884 HB2 LEU 148 1HB LEU 148 12.664 -8.080 -28.921 885 HB3 LEU 148 2HB LEU 148 12.454 -9.758 -28.467 886 HG LEU 148 HG LEU 148 11.150 -8.943 -26.454 887 HD11 LEU 148 1HD1 LEU 148 10.214 -6.697 -26.559 888 HD12 LEU 148 2HD1 LEU 148 11.207 -6.341 -27.972 889 HD13 LEU 148 3HD1 LEU 148 11.971 -6.646 -26.412 890 HD21 LEU 148 1HD2 LEU 148 10.075 -8.264 -29.187 891 HD22 LEU 148 2HD2 LEU 148 9.114 -8.565 -27.740 892 HD23 LEU 148 3HD2 LEU 148 10.079 -9.862 -28.446 893 H GLU 149 H GLU 149 15.272 -10.524 -26.291 894 HA GLU 149 HA GLU 149 17.162 -10.514 -28.498 895 HB2 GLU 149 1HB GLU 149 18.503 -12.023 -27.168 896 HB3 GLU 149 2HB GLU 149 17.970 -10.700 -26.146 897 HG2 GLU 149 1HG GLU 149 16.645 -13.399 -26.224 898 HG3 GLU 149 2HG GLU 149 17.912 -12.954 -25.085 899 H HIS 150 H HIS 150 14.498 -12.346 -27.283 900 HA HIS 150 HA HIS 150 14.963 -14.682 -28.875 901 HB2 HIS 150 1HB HIS 150 12.475 -13.707 -27.459 902 HB3 HIS 150 2HB HIS 150 12.606 -15.260 -28.274 903 HD1 HIS 150 HD1 HIS 150 14.617 -16.846 -27.249 904 HD2 HIS 150 HD2 HIS 150 13.151 -13.792 -24.839 905 HE1 HIS 150 HE1 HIS 150 15.301 -17.443 -24.908 906 HE2 HIS 150 HE2 HIS 150 14.301 -15.648 -23.453 907 H HIS 151 H HIS 151 15.158 -14.218 -30.982 908 HA HIS 151 HA HIS 151 13.700 -12.402 -32.490 909 HB2 HIS 151 1HB HIS 151 14.887 -15.036 -33.385 910 HB3 HIS 151 2HB HIS 151 14.319 -13.775 -34.470 911 HD1 HIS 151 HD1 HIS 151 17.287 -14.902 -32.727 912 HD2 HIS 151 HD2 HIS 151 15.836 -11.268 -34.124 913 HE1 HIS 151 HE1 HIS 151 19.274 -13.364 -32.813 914 HE2 HIS 151 HE2 HIS 151 18.399 -11.227 -33.804 915 H HIS 152 H HIS 152 11.741 -12.351 -33.381 916 HA HIS 152 HA HIS 152 9.837 -14.251 -32.328 917 HB2 HIS 152 1HB HIS 152 9.563 -11.711 -32.345 918 HB3 HIS 152 2HB HIS 152 9.235 -11.858 -34.067 919 HD1 HIS 152 HD1 HIS 152 6.922 -12.694 -34.760 920 HD2 HIS 152 HD2 HIS 152 7.565 -12.792 -30.652 921 HE1 HIS 152 HE1 HIS 152 4.671 -13.147 -33.731 922 HE2 HIS 152 HE2 HIS 152 5.100 -13.293 -31.254 923 H HIS 153 H HIS 153 11.299 -15.642 -34.063 924 HA HIS 153 HA HIS 153 9.301 -16.263 -36.091 925 HB2 HIS 153 1HB HIS 153 10.997 -14.883 -37.258 926 HB3 HIS 153 2HB HIS 153 12.248 -16.018 -36.757 927 HD1 HIS 153 HD1 HIS 153 12.882 -16.870 -39.059 928 HD2 HIS 153 HD2 HIS 153 8.816 -17.180 -38.276 929 HE1 HIS 153 HE1 HIS 153 11.940 -18.267 -40.921 930 HE2 HIS 153 HE2 HIS 153 9.535 -18.653 -40.270 931 H HIS 154 H HIS 154 8.695 -18.150 -35.297 932 HA HIS 154 HA HIS 154 10.739 -20.224 -34.960 933 HB2 HIS 154 1HB HIS 154 9.387 -21.140 -33.040 934 HB3 HIS 154 2HB HIS 154 10.199 -19.617 -32.709 935 HD1 HIS 154 HD1 HIS 154 6.905 -21.221 -32.681 936 HD2 HIS 154 HD2 HIS 154 8.402 -17.341 -32.676 937 HE1 HIS 154 HE1 HIS 154 4.996 -19.757 -31.950 938 HE2 HIS 154 HE2 HIS 154 5.952 -17.431 -31.851 939 H HIS 155 H HIS 155 9.541 -19.973 -37.278 940 HA HIS 155 HA HIS 155 8.081 -22.372 -37.628 941 HB2 HIS 155 1HB HIS 155 6.278 -20.880 -36.720 942 HB3 HIS 155 2HB HIS 155 6.511 -19.830 -38.112 943 HD1 HIS 155 HD1 HIS 155 4.812 -20.232 -39.856 944 HD2 HIS 155 HD2 HIS 155 5.708 -23.706 -37.752 945 HE1 HIS 155 HE1 HIS 155 3.348 -22.019 -40.844 946 HE2 HIS 155 HE2 HIS 155 3.791 -24.071 -39.453 Start of MODEL 19 1 H1 MET 24 1H MET 24 -19.169 -14.967 -1.008 2 H2 MET 24 2H MET 24 -20.133 -13.755 -1.683 3 H3 MET 24 3H MET 24 -18.487 -13.474 -1.423 4 HA MET 24 HA MET 24 -17.927 -15.205 -3.014 5 HB2 MET 24 1HB MET 24 -19.672 -16.117 -4.464 6 HB3 MET 24 2HB MET 24 -19.976 -16.533 -2.784 7 HG2 MET 24 1HG MET 24 -21.650 -14.782 -2.634 8 HG3 MET 24 2HG MET 24 -21.323 -14.313 -4.300 9 HE1 MET 24 1HE MET 24 -20.957 -17.170 -5.724 10 HE2 MET 24 2HE MET 24 -21.863 -15.814 -6.395 11 HE3 MET 24 3HE MET 24 -22.603 -17.413 -6.306 12 H GLU 25 H GLU 25 -19.851 -12.346 -2.892 13 HA GLU 25 HA GLU 25 -18.956 -11.643 -5.601 14 HB2 GLU 25 1HB GLU 25 -21.293 -10.633 -3.990 15 HB3 GLU 25 2HB GLU 25 -20.745 -9.871 -5.475 16 HG2 GLU 25 1HG GLU 25 -21.141 -11.985 -6.671 17 HG3 GLU 25 2HG GLU 25 -21.772 -12.680 -5.179 18 H ASN 26 H ASN 26 -16.915 -10.957 -5.005 19 HA ASN 26 HA ASN 26 -16.858 -8.495 -3.386 20 HB2 ASN 26 1HB ASN 26 -14.675 -10.520 -3.941 21 HB3 ASN 26 2HB ASN 26 -14.376 -8.956 -3.191 22 HD21 ASN 26 1HD2 ASN 26 -15.670 -12.131 -2.783 23 HD22 ASN 26 2HD2 ASN 26 -15.944 -12.029 -1.079 24 H TYR 27 H TYR 27 -17.282 -9.216 -6.407 25 HA TYR 27 HA TYR 27 -15.043 -8.300 -7.836 26 HB2 TYR 27 1HB TYR 27 -17.922 -8.179 -8.754 27 HB3 TYR 27 2HB TYR 27 -16.489 -8.203 -9.769 28 HD1 TYR 27 HD1 TYR 27 -18.926 -10.188 -8.013 29 HD2 TYR 27 HD2 TYR 27 -15.078 -10.301 -9.839 30 HE1 TYR 27 HE1 TYR 27 -19.063 -12.638 -8.141 31 HE2 TYR 27 HE2 TYR 27 -15.208 -12.753 -9.968 32 HH TYR 27 HH TYR 27 -16.432 -14.598 -8.724 33 H LEU 28 H LEU 28 -17.987 -6.599 -6.813 34 HA LEU 28 HA LEU 28 -17.149 -4.109 -7.951 35 HB2 LEU 28 1HB LEU 28 -19.304 -4.742 -5.934 36 HB3 LEU 28 2HB LEU 28 -19.048 -3.158 -6.636 37 HG LEU 28 HG LEU 28 -19.860 -5.652 -8.135 38 HD11 LEU 28 1HD1 LEU 28 -21.658 -4.740 -6.791 39 HD12 LEU 28 2HD1 LEU 28 -21.954 -4.424 -8.501 40 HD13 LEU 28 3HD1 LEU 28 -21.367 -3.133 -7.454 41 HD21 LEU 28 1HD2 LEU 28 -18.436 -4.253 -9.516 42 HD22 LEU 28 2HD2 LEU 28 -19.401 -2.835 -9.113 43 HD23 LEU 28 3HD2 LEU 28 -20.109 -4.142 -10.060 44 H ARG 29 H ARG 29 -17.015 -5.607 -4.784 45 HA ARG 29 HA ARG 29 -15.993 -3.463 -3.312 46 HB2 ARG 29 1HB ARG 29 -16.658 -5.384 -2.104 47 HB3 ARG 29 2HB ARG 29 -15.668 -6.449 -3.090 48 HG2 ARG 29 1HG ARG 29 -13.659 -5.612 -2.083 49 HG3 ARG 29 2HG ARG 29 -14.568 -4.385 -1.198 50 HD2 ARG 29 1HD ARG 29 -15.048 -7.338 -0.860 51 HD3 ARG 29 2HD ARG 29 -13.890 -6.438 0.119 52 HE ARG 29 HE ARG 29 -16.072 -4.980 0.492 53 HH11 ARG 29 1HH1 ARG 29 -15.799 -8.479 0.429 54 HH12 ARG 29 2HH1 ARG 29 -16.974 -8.709 1.687 55 HH21 ARG 29 1HH2 ARG 29 -17.602 -5.292 2.150 56 HH22 ARG 29 2HH2 ARG 29 -18.007 -6.906 2.646 57 H LYS 30 H LYS 30 -14.400 -5.881 -5.317 58 HA LYS 30 HA LYS 30 -11.753 -5.119 -4.918 59 HB2 LYS 30 1HB LYS 30 -13.156 -6.325 -7.303 60 HB3 LYS 30 2HB LYS 30 -11.418 -6.053 -7.272 61 HG2 LYS 30 1HG LYS 30 -12.732 -7.620 -5.091 62 HG3 LYS 30 2HG LYS 30 -12.365 -8.379 -6.640 63 HD2 LYS 30 1HD LYS 30 -10.288 -6.867 -5.086 64 HD3 LYS 30 2HD LYS 30 -10.626 -8.569 -4.770 65 HE2 LYS 30 1HE LYS 30 -9.766 -7.381 -7.407 66 HE3 LYS 30 2HE LYS 30 -8.756 -8.330 -6.316 67 HZ1 LYS 30 1HZ LYS 30 -9.526 -9.757 -8.029 68 HZ2 LYS 30 2HZ LYS 30 -11.127 -9.260 -7.834 69 HZ3 LYS 30 3HZ LYS 30 -10.377 -10.178 -6.629 70 H ALA 31 H ALA 31 -14.065 -3.989 -7.443 71 HA ALA 31 HA ALA 31 -12.298 -2.138 -8.575 72 HB1 ALA 31 1HB ALA 31 -14.270 -3.002 -9.730 73 HB2 ALA 31 2HB ALA 31 -14.273 -1.238 -9.683 74 HB3 ALA 31 3HB ALA 31 -15.312 -2.151 -8.588 75 H ALA 32 H ALA 32 -14.521 -1.899 -5.860 76 HA ALA 32 HA ALA 32 -14.529 0.915 -5.624 77 HB1 ALA 32 1HB ALA 32 -15.221 0.535 -3.300 78 HB2 ALA 32 2HB ALA 32 -14.799 -1.170 -3.454 79 HB3 ALA 32 3HB ALA 32 -16.118 -0.500 -4.413 80 H LEU 33 H LEU 33 -12.476 -1.599 -4.277 81 HA LEU 33 HA LEU 33 -10.712 0.130 -2.885 82 HB2 LEU 33 1HB LEU 33 -10.150 -2.617 -4.021 83 HB3 LEU 33 2HB LEU 33 -9.253 -1.812 -2.742 84 HG LEU 33 HG LEU 33 -12.126 -2.736 -2.562 85 HD11 LEU 33 1HD1 LEU 33 -11.294 -4.406 -1.010 86 HD12 LEU 33 2HD1 LEU 33 -9.644 -3.848 -1.272 87 HD13 LEU 33 3HD1 LEU 33 -10.544 -4.591 -2.595 88 HD21 LEU 33 1HD2 LEU 33 -10.327 -1.474 -0.501 89 HD22 LEU 33 2HD2 LEU 33 -11.907 -2.186 -0.175 90 HD23 LEU 33 3HD2 LEU 33 -11.777 -0.767 -1.213 91 H THR 34 H THR 34 -10.914 -1.049 -6.158 92 HA THR 34 HA THR 34 -8.338 -0.292 -7.036 93 HB THR 34 HB THR 34 -10.873 -0.428 -8.686 94 HG1 THR 34 HG1 THR 34 -9.970 -2.374 -7.354 95 HG21 THR 34 1HG2 THR 34 -7.966 -0.697 -9.462 96 HG22 THR 34 2HG2 THR 34 -9.011 0.679 -9.820 97 HG23 THR 34 3HG2 THR 34 -9.344 -0.894 -10.545 98 H ASP 35 H ASP 35 -11.442 1.377 -6.912 99 HA ASP 35 HA ASP 35 -10.615 3.671 -8.356 100 HB2 ASP 35 1HB ASP 35 -12.981 3.083 -8.115 101 HB3 ASP 35 2HB ASP 35 -12.882 3.356 -6.376 102 H MET 36 H MET 36 -10.771 2.913 -4.898 103 HA MET 36 HA MET 36 -9.861 5.436 -3.999 104 HB2 MET 36 1HB MET 36 -10.800 3.941 -2.371 105 HB3 MET 36 2HB MET 36 -9.618 2.693 -2.746 106 HG2 MET 36 1HG MET 36 -9.093 3.808 -0.651 107 HG3 MET 36 2HG MET 36 -7.837 4.086 -1.860 108 HE1 MET 36 1HE MET 36 -7.418 7.533 -0.381 109 HE2 MET 36 2HE MET 36 -6.658 6.209 -1.261 110 HE3 MET 36 3HE MET 36 -7.359 5.920 0.331 111 H LEU 37 H LEU 37 -8.167 2.472 -4.905 112 HA LEU 37 HA LEU 37 -5.550 3.296 -4.433 113 HB2 LEU 37 1HB LEU 37 -6.105 1.005 -4.977 114 HB3 LEU 37 2HB LEU 37 -6.675 1.489 -6.571 115 HG LEU 37 HG LEU 37 -4.303 2.216 -7.079 116 HD11 LEU 37 1HD1 LEU 37 -3.443 2.403 -4.831 117 HD12 LEU 37 2HD1 LEU 37 -2.535 1.174 -5.711 118 HD13 LEU 37 3HD1 LEU 37 -3.759 0.694 -4.536 119 HD21 LEU 37 1HD2 LEU 37 -3.564 -0.054 -7.564 120 HD22 LEU 37 2HD2 LEU 37 -5.280 0.145 -7.926 121 HD23 LEU 37 3HD2 LEU 37 -4.781 -0.695 -6.459 122 H GLN 38 H GLN 38 -7.632 3.801 -7.246 123 HA GLN 38 HA GLN 38 -5.724 4.951 -8.948 124 HB2 GLN 38 1HB GLN 38 -8.715 5.357 -8.811 125 HB3 GLN 38 2HB GLN 38 -7.701 5.965 -10.111 126 HG2 GLN 38 1HG GLN 38 -8.062 3.069 -9.374 127 HG3 GLN 38 2HG GLN 38 -8.838 3.898 -10.722 128 HE21 GLN 38 1HE2 GLN 38 -5.860 2.599 -9.485 129 HE22 GLN 38 2HE2 GLN 38 -4.980 2.654 -10.978 130 H THR 39 H THR 39 -7.705 6.359 -6.410 131 HA THR 39 HA THR 39 -6.984 9.068 -7.013 132 HB THR 39 HB THR 39 -8.095 7.918 -4.442 133 HG1 THR 39 HG1 THR 39 -9.430 9.047 -6.708 134 HG21 THR 39 1HG2 THR 39 -8.193 10.739 -5.531 135 HG22 THR 39 2HG2 THR 39 -7.138 10.194 -4.228 136 HG23 THR 39 3HG2 THR 39 -8.889 10.180 -4.010 137 H PHE 40 H PHE 40 -5.715 6.515 -4.994 138 HA PHE 40 HA PHE 40 -3.957 8.153 -3.467 139 HB2 PHE 40 1HB PHE 40 -4.744 5.923 -2.721 140 HB3 PHE 40 2HB PHE 40 -3.781 5.186 -3.997 141 HD1 PHE 40 HD1 PHE 40 -1.929 4.140 -3.184 142 HD2 PHE 40 HD2 PHE 40 -3.138 7.823 -1.427 143 HE1 PHE 40 HE1 PHE 40 0.031 4.075 -1.707 144 HE2 PHE 40 HE2 PHE 40 -1.181 7.765 0.056 145 HZ PHE 40 HZ PHE 40 0.411 5.888 -0.081 146 H VAL 41 H VAL 41 -3.666 6.434 -6.509 147 HA VAL 41 HA VAL 41 -0.948 6.222 -6.812 148 HB VAL 41 HB VAL 41 -2.995 6.801 -8.949 149 HG11 VAL 41 1HG1 VAL 41 -0.158 5.842 -9.282 150 HG12 VAL 41 2HG1 VAL 41 -0.744 7.454 -9.693 151 HG13 VAL 41 3HG1 VAL 41 -1.353 6.045 -10.564 152 HG21 VAL 41 1HG2 VAL 41 -3.347 4.716 -7.758 153 HG22 VAL 41 2HG2 VAL 41 -1.668 4.256 -8.032 154 HG23 VAL 41 3HG2 VAL 41 -2.776 4.397 -9.396 155 HA PRO 42 HA PRO 42 -0.769 10.736 -8.795 156 HB2 PRO 42 1HB PRO 42 -2.865 11.974 -7.093 157 HB3 PRO 42 2HB PRO 42 -2.420 12.323 -8.766 158 HG2 PRO 42 1HG PRO 42 -4.634 10.953 -8.199 159 HG3 PRO 42 2HG PRO 42 -3.636 10.549 -9.607 160 HD2 PRO 42 1HD PRO 42 -3.868 9.153 -6.982 161 HD3 PRO 42 2HD PRO 42 -3.622 8.481 -8.603 162 H TYR 43 H TYR 43 -1.620 10.084 -5.382 163 HA TYR 43 HA TYR 43 0.009 12.214 -4.391 164 HB2 TYR 43 1HB TYR 43 -1.342 9.841 -3.106 165 HB3 TYR 43 2HB TYR 43 -0.288 10.920 -2.190 166 HD1 TYR 43 HD1 TYR 43 -1.077 12.976 -1.377 167 HD2 TYR 43 HD2 TYR 43 -3.409 10.834 -4.222 168 HE1 TYR 43 HE1 TYR 43 -2.940 14.535 -1.014 169 HE2 TYR 43 HE2 TYR 43 -5.278 12.390 -3.867 170 HH TYR 43 HH TYR 43 -6.100 13.948 -2.222 171 H ARG 44 H ARG 44 0.519 8.899 -5.278 172 HA ARG 44 HA ARG 44 2.880 8.408 -3.837 173 HB2 ARG 44 1HB ARG 44 2.120 7.308 -6.543 174 HB3 ARG 44 2HB ARG 44 3.351 6.653 -5.475 175 HG2 ARG 44 1HG ARG 44 1.556 6.257 -3.784 176 HG3 ARG 44 2HG ARG 44 0.382 6.717 -5.024 177 HD2 ARG 44 1HD ARG 44 2.288 4.380 -5.043 178 HD3 ARG 44 2HD ARG 44 0.526 4.334 -5.063 179 HE ARG 44 HE ARG 44 1.444 5.726 -7.334 180 HH11 ARG 44 1HH1 ARG 44 1.382 2.486 -6.016 181 HH12 ARG 44 2HH1 ARG 44 1.408 1.713 -7.564 182 HH21 ARG 44 1HH2 ARG 44 1.496 4.709 -9.381 183 HH22 ARG 44 2HH2 ARG 44 1.477 2.974 -9.478 184 H THR 45 H THR 45 2.334 9.800 -7.054 185 HA THR 45 HA THR 45 4.881 10.312 -7.858 186 HB THR 45 HB THR 45 2.677 12.361 -8.045 187 HG1 THR 45 HG1 THR 45 3.094 9.939 -9.494 188 HG21 THR 45 1HG2 THR 45 3.720 12.857 -10.209 189 HG22 THR 45 2HG2 THR 45 4.952 11.637 -9.895 190 HG23 THR 45 3HG2 THR 45 4.859 13.076 -8.882 191 H ALA 46 H ALA 46 2.993 12.289 -5.573 192 HA ALA 46 HA ALA 46 4.956 14.271 -5.161 193 HB1 ALA 46 1HB ALA 46 3.711 14.804 -3.108 194 HB2 ALA 46 2HB ALA 46 2.791 13.308 -3.287 195 HB3 ALA 46 3HB ALA 46 2.634 14.590 -4.488 196 H VAL 47 H VAL 47 4.359 11.163 -3.779 197 HA VAL 47 HA VAL 47 6.300 11.265 -1.696 198 HB VAL 47 HB VAL 47 5.142 8.854 -3.112 199 HG11 VAL 47 1HG1 VAL 47 6.634 9.041 -0.497 200 HG12 VAL 47 2HG1 VAL 47 7.219 8.290 -1.984 201 HG13 VAL 47 3HG1 VAL 47 5.844 7.594 -1.124 202 HG21 VAL 47 1HG2 VAL 47 4.328 10.221 -0.549 203 HG22 VAL 47 2HG2 VAL 47 3.673 8.694 -1.139 204 HG23 VAL 47 3HG2 VAL 47 3.412 10.178 -2.057 205 H GLU 48 H GLU 48 6.362 10.151 -5.055 206 HA GLU 48 HA GLU 48 8.995 9.167 -5.090 207 HB2 GLU 48 1HB GLU 48 7.411 10.459 -7.327 208 HB3 GLU 48 2HB GLU 48 8.908 9.567 -7.545 209 HG2 GLU 48 1HG GLU 48 6.399 8.389 -6.380 210 HG3 GLU 48 2HG GLU 48 6.848 8.291 -8.081 211 H LEU 49 H LEU 49 7.679 12.396 -5.579 212 HA LEU 49 HA LEU 49 10.042 13.665 -6.404 213 HB2 LEU 49 1HB LEU 49 7.428 14.534 -5.327 214 HB3 LEU 49 2HB LEU 49 8.746 15.679 -5.168 215 HG LEU 49 HG LEU 49 7.417 16.105 -7.179 216 HD11 LEU 49 1HD1 LEU 49 9.231 16.233 -8.778 217 HD12 LEU 49 2HD1 LEU 49 10.172 15.081 -7.834 218 HD13 LEU 49 3HD1 LEU 49 9.796 16.668 -7.166 219 HD21 LEU 49 1HD2 LEU 49 7.446 14.541 -9.055 220 HD22 LEU 49 2HD2 LEU 49 6.664 13.835 -7.641 221 HD23 LEU 49 3HD2 LEU 49 8.311 13.366 -8.065 222 H CYS 50 H CYS 50 8.644 13.271 -3.150 223 HA CYS 50 HA CYS 50 10.839 14.678 -1.936 224 HB2 CYS 50 1HB CYS 50 9.831 13.955 0.211 225 HB3 CYS 50 2HB CYS 50 8.682 14.763 -0.847 226 H ALA 51 H ALA 51 10.274 11.495 -2.989 227 HA ALA 51 HA ALA 51 11.994 10.134 -1.134 228 HB1 ALA 51 1HB ALA 51 10.205 8.949 -2.355 229 HB2 ALA 51 2HB ALA 51 11.791 8.219 -2.601 230 HB3 ALA 51 3HB ALA 51 11.078 9.223 -3.861 231 H LEU 52 H LEU 52 12.294 11.389 -4.424 232 HA LEU 52 HA LEU 52 15.031 10.496 -4.654 233 HB2 LEU 52 1HB LEU 52 13.339 12.232 -6.459 234 HB3 LEU 52 2HB LEU 52 14.953 11.677 -6.851 235 HG LEU 52 HG LEU 52 12.566 9.874 -6.408 236 HD11 LEU 52 1HD1 LEU 52 12.660 9.495 -8.815 237 HD12 LEU 52 2HD1 LEU 52 13.950 10.687 -8.959 238 HD13 LEU 52 3HD1 LEU 52 12.339 11.189 -8.445 239 HD21 LEU 52 1HD2 LEU 52 14.031 8.129 -7.335 240 HD22 LEU 52 2HD2 LEU 52 14.637 8.771 -5.810 241 HD23 LEU 52 3HD2 LEU 52 15.373 9.274 -7.331 242 H GLU 53 H GLU 53 13.436 13.222 -3.435 243 HA GLU 53 HA GLU 53 15.378 15.220 -3.950 244 HB2 GLU 53 1HB GLU 53 13.037 15.699 -3.333 245 HB3 GLU 53 2HB GLU 53 13.334 15.047 -1.729 246 HG2 GLU 53 1HG GLU 53 14.701 16.836 -1.127 247 HG3 GLU 53 2HG GLU 53 14.921 17.346 -2.800 248 H HIS 54 H HIS 54 14.920 12.877 -1.403 249 HA HIS 54 HA HIS 54 17.471 13.714 -0.169 250 HB2 HIS 54 1HB HIS 54 15.548 13.654 1.358 251 HB3 HIS 54 2HB HIS 54 15.218 11.990 0.908 252 HD1 HIS 54 HD1 HIS 54 17.422 14.093 3.057 253 HD2 HIS 54 HD2 HIS 54 16.890 10.077 2.121 254 HE1 HIS 54 HE1 HIS 54 18.685 12.814 4.812 255 HE2 HIS 54 HE2 HIS 54 18.547 10.413 4.077 256 H GLY 55 H GLY 55 16.003 11.470 -2.173 257 HA2 GLY 55 1HA GLY 55 16.885 9.717 -3.366 258 HA3 GLY 55 2HA GLY 55 18.337 9.790 -2.376 259 H GLY 56 H GLY 56 16.895 9.620 0.159 260 HA2 GLY 56 1HA GLY 56 15.392 7.121 -0.141 261 HA3 GLY 56 2HA GLY 56 16.070 7.725 1.364 262 H LEU 57 H LEU 57 13.437 6.814 1.040 263 HA LEU 57 HA LEU 57 11.582 8.955 0.704 264 HB2 LEU 57 1HB LEU 57 11.321 6.220 1.949 265 HB3 LEU 57 2HB LEU 57 9.979 7.329 1.732 266 HG LEU 57 HG LEU 57 11.487 6.845 -0.728 267 HD11 LEU 57 1HD1 LEU 57 10.063 4.572 0.638 268 HD12 LEU 57 2HD1 LEU 57 11.765 4.639 0.186 269 HD13 LEU 57 3HD1 LEU 57 10.521 4.593 -1.062 270 HD21 LEU 57 1HD2 LEU 57 9.246 6.587 -1.630 271 HD22 LEU 57 2HD2 LEU 57 9.347 8.031 -0.623 272 HD23 LEU 57 3HD2 LEU 57 8.574 6.573 0.001 273 H ASP 58 H ASP 58 13.769 8.466 3.064 274 HA ASP 58 HA ASP 58 12.574 8.656 5.515 275 HB2 ASP 58 1HB ASP 58 15.033 10.190 4.659 276 HB3 ASP 58 2HB ASP 58 14.606 9.735 6.304 277 H THR 59 H THR 59 13.005 11.232 3.148 278 HA THR 59 HA THR 59 12.023 13.250 4.968 279 HB THR 59 HB THR 59 12.192 14.685 2.848 280 HG1 THR 59 HG1 THR 59 12.410 13.386 1.146 281 HG21 THR 59 1HG2 THR 59 14.655 14.807 3.041 282 HG22 THR 59 2HG2 THR 59 14.632 13.320 3.988 283 HG23 THR 59 3HG2 THR 59 13.853 14.776 4.611 284 H CYS 60 H CYS 60 10.384 10.905 3.559 285 HA CYS 60 HA CYS 60 8.181 12.625 2.654 286 HB2 CYS 60 1HB CYS 60 8.630 9.666 2.224 287 HB3 CYS 60 2HB CYS 60 7.260 10.586 1.608 288 H ASP 61 H ASP 61 8.248 12.904 5.178 289 HA ASP 61 HA ASP 61 6.610 10.818 6.441 290 HB2 ASP 61 1HB ASP 61 8.769 11.343 7.524 291 HB3 ASP 61 2HB ASP 61 8.252 13.018 7.714 292 H GLY 62 H GLY 62 4.665 11.306 7.388 293 HA2 GLY 62 1HA GLY 62 3.337 13.630 6.323 294 HA3 GLY 62 2HA GLY 62 2.611 12.372 7.316 295 H GLY 63 H GLY 63 3.902 15.513 7.237 296 HA2 GLY 63 1HA GLY 63 3.215 17.018 9.030 297 HA3 GLY 63 2HA GLY 63 3.568 15.718 10.163 298 H SER 64 H SER 64 5.874 15.748 7.745 299 HA SER 64 HA SER 64 7.607 17.658 9.072 300 HB2 SER 64 1HB SER 64 7.883 15.610 10.387 301 HB3 SER 64 2HB SER 64 8.253 14.703 8.924 302 HG SER 64 HG SER 64 9.932 15.989 10.474 303 H ASN 65 H ASN 65 9.640 17.961 7.916 304 HA ASN 65 HA ASN 65 10.856 18.400 6.054 305 HB2 ASN 65 1HB ASN 65 9.702 15.777 5.084 306 HB3 ASN 65 2HB ASN 65 11.042 16.633 4.330 307 HD21 ASN 65 1HD2 ASN 65 10.058 14.602 6.943 308 HD22 ASN 65 2HD2 ASN 65 11.637 14.326 7.604 309 H GLY 66 H GLY 66 8.293 19.600 6.194 310 HA2 GLY 66 1HA GLY 66 7.343 21.160 4.731 311 HA3 GLY 66 2HA GLY 66 8.057 20.293 3.376 312 H ILE 67 H ILE 67 6.861 17.764 4.678 313 HA ILE 67 HA ILE 67 4.359 17.918 3.229 314 HB ILE 67 HB ILE 67 5.643 15.591 4.675 315 HG12 ILE 67 1HG1 ILE 67 5.562 16.329 1.741 316 HG13 ILE 67 2HG1 ILE 67 6.985 16.348 2.778 317 HG21 ILE 67 1HG2 ILE 67 3.214 15.344 4.485 318 HG22 ILE 67 2HG2 ILE 67 4.058 14.191 3.452 319 HG23 ILE 67 3HG2 ILE 67 3.321 15.628 2.747 320 HD11 ILE 67 1HD1 ILE 67 6.772 13.916 3.056 321 HD12 ILE 67 2HD1 ILE 67 7.012 14.396 1.377 322 HD13 ILE 67 3HD1 ILE 67 5.406 13.931 1.941 323 HA PRO 68 HA PRO 68 2.244 18.864 7.007 324 HB2 PRO 68 1HB PRO 68 -0.290 18.800 6.074 325 HB3 PRO 68 2HB PRO 68 0.825 20.122 5.703 326 HG2 PRO 68 1HG PRO 68 0.048 17.771 4.026 327 HG3 PRO 68 2HG PRO 68 0.275 19.469 3.549 328 HD2 PRO 68 1HD PRO 68 2.155 17.513 3.152 329 HD3 PRO 68 2HD PRO 68 2.556 19.232 3.363 330 H SER 69 H SER 69 0.860 17.894 8.524 331 HA SER 69 HA SER 69 0.852 15.259 9.048 332 HB2 SER 69 1HB SER 69 -0.069 16.931 10.589 333 HB3 SER 69 2HB SER 69 -1.466 17.153 9.538 334 HG SER 69 HG SER 69 -0.843 15.076 11.290 335 HA PRO 70 HA PRO 70 -0.823 12.924 5.849 336 HB2 PRO 70 1HB PRO 70 -2.380 11.148 7.396 337 HB3 PRO 70 2HB PRO 70 -0.712 10.925 6.872 338 HG2 PRO 70 1HG PRO 70 -1.768 11.891 9.473 339 HG3 PRO 70 2HG PRO 70 -0.302 10.956 9.129 340 HD2 PRO 70 1HD PRO 70 -0.169 13.554 9.751 341 HD3 PRO 70 2HD PRO 70 0.914 12.847 8.531 342 H THR 71 H THR 71 -2.534 12.772 4.528 343 HA THR 71 HA THR 71 -4.864 14.375 5.275 344 HB THR 71 HB THR 71 -4.103 13.447 2.500 345 HG1 THR 71 HG1 THR 71 -2.620 14.975 4.017 346 HG21 THR 71 1HG2 THR 71 -6.365 14.371 2.777 347 HG22 THR 71 2HG2 THR 71 -5.352 15.418 1.784 348 HG23 THR 71 3HG2 THR 71 -5.673 15.843 3.463 349 H THR 72 H THR 72 -6.936 13.546 5.230 350 HA THR 72 HA THR 72 -7.248 10.702 4.680 351 HB THR 72 HB THR 72 -9.631 11.423 5.688 352 HG1 THR 72 HG1 THR 72 -9.559 13.290 6.660 353 HG21 THR 72 1HG2 THR 72 -8.828 10.700 7.882 354 HG22 THR 72 2HG2 THR 72 -7.164 10.924 7.347 355 HG23 THR 72 3HG2 THR 72 -8.170 9.683 6.601 356 H THR 73 H THR 73 -9.715 10.361 4.010 357 HA THR 73 HA THR 73 -10.452 12.063 1.798 358 HB THR 73 HB THR 73 -10.564 10.306 0.129 359 HG1 THR 73 HG1 THR 73 -9.783 8.211 0.581 360 HG21 THR 73 1HG2 THR 73 -7.828 10.321 1.403 361 HG22 THR 73 2HG2 THR 73 -8.435 11.502 0.243 362 HG23 THR 73 3HG2 THR 73 -8.190 9.825 -0.251 363 H ARG 74 H ARG 74 -12.618 10.990 0.838 364 HA ARG 74 HA ARG 74 -14.393 10.682 2.997 365 HB2 ARG 74 1HB ARG 74 -15.131 11.441 0.775 366 HB3 ARG 74 2HB ARG 74 -14.795 9.847 0.118 367 HG2 ARG 74 1HG ARG 74 -16.526 8.865 1.432 368 HG3 ARG 74 2HG ARG 74 -16.780 10.370 2.316 369 HD2 ARG 74 1HD ARG 74 -18.520 10.150 0.675 370 HD3 ARG 74 2HD ARG 74 -17.437 11.442 0.161 371 HE ARG 74 HE ARG 74 -16.583 9.070 -1.042 372 HH11 ARG 74 1HH1 ARG 74 -19.279 11.290 -1.140 373 HH12 ARG 74 2HH1 ARG 74 -19.726 10.887 -2.765 374 HH21 ARG 74 1HH2 ARG 74 -17.170 8.520 -3.199 375 HH22 ARG 74 2HH2 ARG 74 -18.524 9.319 -3.935 376 H TYR 75 H TYR 75 -12.804 8.307 0.896 377 HA TYR 75 HA TYR 75 -14.140 6.094 2.121 378 HB2 TYR 75 1HB TYR 75 -11.806 6.167 0.202 379 HB3 TYR 75 2HB TYR 75 -12.750 4.740 0.621 380 HD1 TYR 75 HD1 TYR 75 -12.239 6.123 -2.139 381 HD2 TYR 75 HD2 TYR 75 -15.478 6.187 0.618 382 HE1 TYR 75 HE1 TYR 75 -13.792 6.624 -3.977 383 HE2 TYR 75 HE2 TYR 75 -17.032 6.686 -1.214 384 HH TYR 75 HH TYR 75 -16.179 6.397 -4.481 385 H VAL 76 H VAL 76 -11.240 7.829 2.811 386 HA VAL 76 HA VAL 76 -10.100 5.585 4.296 387 HB VAL 76 HB VAL 76 -9.032 8.346 3.695 388 HG11 VAL 76 1HG1 VAL 76 -8.382 7.671 5.986 389 HG12 VAL 76 2HG1 VAL 76 -7.005 7.746 4.887 390 HG13 VAL 76 3HG1 VAL 76 -7.698 6.184 5.331 391 HG21 VAL 76 1HG2 VAL 76 -8.081 5.583 2.950 392 HG22 VAL 76 2HG2 VAL 76 -7.317 7.104 2.482 393 HG23 VAL 76 3HG2 VAL 76 -8.928 6.705 1.884 394 H SER 77 H SER 77 -10.373 5.307 6.385 395 HA SER 77 HA SER 77 -11.810 7.342 7.895 396 HB2 SER 77 1HB SER 77 -12.566 4.964 7.954 397 HB3 SER 77 2HB SER 77 -11.035 4.527 8.717 398 HG SER 77 HG SER 77 -12.969 6.334 9.761 399 H ALA 78 H ALA 78 -8.700 5.709 7.824 400 HA ALA 78 HA ALA 78 -7.588 7.731 9.579 401 HB1 ALA 78 1HB ALA 78 -7.605 4.804 10.283 402 HB2 ALA 78 2HB ALA 78 -8.271 6.138 11.222 403 HB3 ALA 78 3HB ALA 78 -6.526 5.981 11.025 404 H MET 79 H MET 79 -5.256 7.764 9.513 405 HA MET 79 HA MET 79 -3.990 6.166 7.454 406 HB2 MET 79 1HB MET 79 -3.158 8.412 6.402 407 HB3 MET 79 2HB MET 79 -4.706 7.727 5.929 408 HG2 MET 79 1HG MET 79 -4.735 10.180 6.307 409 HG3 MET 79 2HG MET 79 -5.899 9.285 7.279 410 HE1 MET 79 1HE MET 79 -5.315 12.220 7.944 411 HE2 MET 79 2HE MET 79 -4.922 12.247 9.662 412 HE3 MET 79 3HE MET 79 -6.271 11.270 9.082 413 H SER 80 H SER 80 -1.723 6.740 7.168 414 HA SER 80 HA SER 80 -0.368 8.361 9.114 415 HB2 SER 80 1HB SER 80 -0.741 6.396 10.511 416 HB3 SER 80 2HB SER 80 -0.102 5.341 9.256 417 HG SER 80 HG SER 80 1.912 6.043 9.652 418 H VAL 81 H VAL 81 1.555 9.013 8.338 419 HA VAL 81 HA VAL 81 2.740 7.527 6.089 420 HB VAL 81 HB VAL 81 2.572 10.544 6.271 421 HG11 VAL 81 1HG1 VAL 81 3.690 8.765 4.107 422 HG12 VAL 81 2HG1 VAL 81 4.621 9.791 5.196 423 HG13 VAL 81 3HG1 VAL 81 3.533 10.519 4.016 424 HG21 VAL 81 1HG2 VAL 81 0.414 9.508 5.720 425 HG22 VAL 81 2HG2 VAL 81 1.174 8.685 4.360 426 HG23 VAL 81 3HG2 VAL 81 1.070 10.446 4.381 427 H ALA 82 H ALA 82 4.702 6.847 6.697 428 HA ALA 82 HA ALA 82 6.334 8.598 8.379 429 HB1 ALA 82 1HB ALA 82 5.886 5.668 8.935 430 HB2 ALA 82 2HB ALA 82 5.208 7.000 9.871 431 HB3 ALA 82 3HB ALA 82 6.955 6.751 9.829 432 H LYS 83 H LYS 83 7.971 8.974 7.193 433 HA LYS 83 HA LYS 83 9.749 8.796 5.722 434 HB2 LYS 83 1HB LYS 83 9.936 5.963 6.769 435 HB3 LYS 83 2HB LYS 83 11.237 6.934 6.098 436 HG2 LYS 83 1HG LYS 83 9.786 7.563 8.661 437 HG3 LYS 83 2HG LYS 83 11.325 6.709 8.562 438 HD2 LYS 83 1HD LYS 83 12.320 8.678 7.471 439 HD3 LYS 83 2HD LYS 83 10.784 9.531 7.629 440 HE2 LYS 83 1HE LYS 83 10.928 9.318 10.068 441 HE3 LYS 83 2HE LYS 83 12.466 8.476 9.901 442 HZ1 LYS 83 1HZ LYS 83 12.810 10.790 10.434 443 HZ2 LYS 83 2HZ LYS 83 11.922 11.277 9.078 444 HZ3 LYS 83 3HZ LYS 83 13.395 10.468 8.881 445 H GLY 84 H GLY 84 7.354 8.443 4.462 446 HA2 GLY 84 1HA GLY 84 6.738 7.898 2.288 447 HA3 GLY 84 2HA GLY 84 8.066 6.747 2.222 448 H VAL 85 H VAL 85 7.161 5.498 4.752 449 HA VAL 85 HA VAL 85 5.374 3.566 3.679 450 HB VAL 85 HB VAL 85 6.054 4.037 6.587 451 HG11 VAL 85 1HG1 VAL 85 4.938 1.610 5.189 452 HG12 VAL 85 2HG1 VAL 85 4.072 2.659 6.313 453 HG13 VAL 85 3HG1 VAL 85 5.428 1.683 6.882 454 HG21 VAL 85 1HG2 VAL 85 7.721 2.251 6.262 455 HG22 VAL 85 2HG2 VAL 85 8.064 3.677 5.283 456 HG23 VAL 85 3HG2 VAL 85 7.354 2.246 4.537 457 H VAL 86 H VAL 86 3.132 3.404 3.788 458 HA VAL 86 HA VAL 86 1.771 5.615 5.147 459 HB VAL 86 HB VAL 86 1.180 4.722 2.312 460 HG11 VAL 86 1HG1 VAL 86 -0.825 5.372 3.527 461 HG12 VAL 86 2HG1 VAL 86 -0.423 6.576 2.304 462 HG13 VAL 86 3HG1 VAL 86 -0.062 6.890 4.001 463 HG21 VAL 86 1HG2 VAL 86 1.906 6.969 1.654 464 HG22 VAL 86 2HG2 VAL 86 3.218 6.062 2.411 465 HG23 VAL 86 3HG2 VAL 86 2.364 7.308 3.322 466 H SER 87 H SER 87 0.580 4.632 6.592 467 HA SER 87 HA SER 87 -0.745 2.101 5.924 468 HB2 SER 87 1HB SER 87 0.673 2.146 7.954 469 HB3 SER 87 2HB SER 87 -0.351 3.412 8.626 470 HG SER 87 HG SER 87 -1.803 1.975 9.136 471 H LEU 88 H LEU 88 -2.813 2.088 5.433 472 HA LEU 88 HA LEU 88 -4.494 4.356 6.292 473 HB2 LEU 88 1HB LEU 88 -4.919 2.586 3.880 474 HB3 LEU 88 2HB LEU 88 -5.865 3.995 4.329 475 HG LEU 88 HG LEU 88 -3.525 5.216 4.073 476 HD11 LEU 88 1HD1 LEU 88 -3.252 2.800 2.294 477 HD12 LEU 88 2HD1 LEU 88 -2.188 3.274 3.619 478 HD13 LEU 88 3HD1 LEU 88 -2.276 4.261 2.161 479 HD21 LEU 88 1HD2 LEU 88 -5.526 5.778 2.830 480 HD22 LEU 88 2HD2 LEU 88 -5.276 4.397 1.761 481 HD23 LEU 88 3HD2 LEU 88 -4.130 5.737 1.754 482 H THR 89 H THR 89 -6.153 3.845 7.599 483 HA THR 89 HA THR 89 -6.666 0.971 7.979 484 HB THR 89 HB THR 89 -6.761 3.145 10.082 485 HG1 THR 89 HG1 THR 89 -4.854 1.062 9.989 486 HG21 THR 89 1HG2 THR 89 -6.861 1.279 11.672 487 HG22 THR 89 2HG2 THR 89 -6.914 0.138 10.330 488 HG23 THR 89 3HG2 THR 89 -8.246 1.267 10.582 489 H GLY 90 H GLY 90 -8.732 0.318 8.519 490 HA2 GLY 90 1HA GLY 90 -11.009 0.221 8.168 491 HA3 GLY 90 2HA GLY 90 -11.001 1.780 8.966 492 H GLN 91 H GLN 91 -9.854 0.777 5.749 493 HA GLN 91 HA GLN 91 -11.057 3.131 4.590 494 HB2 GLN 91 1HB GLN 91 -8.841 1.922 3.962 495 HB3 GLN 91 2HB GLN 91 -9.865 0.811 3.071 496 HG2 GLN 91 1HG GLN 91 -10.009 3.755 2.571 497 HG3 GLN 91 2HG GLN 91 -8.733 2.776 1.848 498 HE21 GLN 91 1HE2 GLN 91 -12.096 3.548 1.851 499 HE22 GLN 91 2HE2 GLN 91 -12.513 2.668 0.417 500 H GLU 92 H GLU 92 -13.091 3.236 3.879 501 HA GLU 92 HA GLU 92 -15.294 2.591 3.849 502 HB2 GLU 92 1HB GLU 92 -14.010 1.178 1.538 503 HB3 GLU 92 2HB GLU 92 -15.744 1.101 1.809 504 HG2 GLU 92 1HG GLU 92 -15.826 3.566 1.734 505 HG3 GLU 92 2HG GLU 92 -14.114 3.575 1.333 506 H SER 93 H SER 93 -15.016 -0.429 2.409 507 HA SER 93 HA SER 93 -16.483 -1.663 4.525 508 HB2 SER 93 1HB SER 93 -16.766 -2.045 2.023 509 HB3 SER 93 2HB SER 93 -15.300 -3.023 2.102 510 HG SER 93 HG SER 93 -17.636 -3.470 3.657 511 H LEU 94 H LEU 94 -13.197 -1.272 3.942 512 HA LEU 94 HA LEU 94 -12.331 -3.817 5.020 513 HB2 LEU 94 1HB LEU 94 -10.697 -1.376 4.324 514 HB3 LEU 94 2HB LEU 94 -10.076 -2.982 4.667 515 HG LEU 94 HG LEU 94 -11.712 -2.167 2.263 516 HD11 LEU 94 1HD1 LEU 94 -9.651 -2.756 1.037 517 HD12 LEU 94 2HD1 LEU 94 -8.831 -2.991 2.581 518 HD13 LEU 94 3HD1 LEU 94 -9.433 -1.395 2.137 519 HD21 LEU 94 1HD2 LEU 94 -11.336 -4.451 1.460 520 HD22 LEU 94 2HD2 LEU 94 -12.293 -4.429 2.939 521 HD23 LEU 94 3HD2 LEU 94 -10.587 -4.867 3.001 522 H ASN 95 H ASN 95 -13.958 -2.235 6.718 523 HA ASN 95 HA ASN 95 -12.584 -0.837 8.688 524 HB2 ASN 95 1HB ASN 95 -15.075 -1.035 8.490 525 HB3 ASN 95 2HB ASN 95 -14.948 -2.665 9.142 526 HD21 ASN 95 1HD2 ASN 95 -14.548 0.730 9.833 527 HD22 ASN 95 2HD2 ASN 95 -14.578 0.586 11.560 528 H GLY 96 H GLY 96 -11.421 -1.403 10.462 529 HA2 GLY 96 1HA GLY 96 -10.302 -2.790 11.963 530 HA3 GLY 96 2HA GLY 96 -11.101 -4.174 11.227 531 H LEU 97 H LEU 97 -9.991 -2.735 8.619 532 HA LEU 97 HA LEU 97 -7.560 -4.361 8.617 533 HB2 LEU 97 1HB LEU 97 -9.303 -4.829 6.945 534 HB3 LEU 97 2HB LEU 97 -9.188 -3.182 6.366 535 HG LEU 97 HG LEU 97 -6.780 -4.970 6.238 536 HD11 LEU 97 1HD1 LEU 97 -8.588 -6.255 5.230 537 HD12 LEU 97 2HD1 LEU 97 -7.496 -5.650 3.987 538 HD13 LEU 97 3HD1 LEU 97 -9.050 -4.864 4.253 539 HD21 LEU 97 1HD2 LEU 97 -6.534 -2.580 5.740 540 HD22 LEU 97 2HD2 LEU 97 -7.789 -2.712 4.508 541 HD23 LEU 97 3HD2 LEU 97 -6.263 -3.572 4.309 542 H SER 98 H SER 98 -5.582 -3.506 8.297 543 HA SER 98 HA SER 98 -5.418 -0.640 7.642 544 HB2 SER 98 1HB SER 98 -3.516 -2.302 9.314 545 HB3 SER 98 2HB SER 98 -3.254 -0.618 8.860 546 HG SER 98 HG SER 98 -5.383 -1.640 10.442 547 H VAL 99 H VAL 99 -4.625 -0.246 5.701 548 HA VAL 99 HA VAL 99 -3.045 -2.268 4.295 549 HB VAL 99 HB VAL 99 -3.816 0.486 3.306 550 HG11 VAL 99 1HG1 VAL 99 -2.028 -0.593 2.063 551 HG12 VAL 99 2HG1 VAL 99 -3.497 -0.489 1.090 552 HG13 VAL 99 3HG1 VAL 99 -3.037 -2.023 1.831 553 HG21 VAL 99 1HG2 VAL 99 -5.705 -0.558 2.152 554 HG22 VAL 99 2HG2 VAL 99 -5.859 -0.685 3.905 555 HG23 VAL 99 3HG2 VAL 99 -5.349 -2.084 2.959 556 H VAL 100 H VAL 100 -0.813 -2.200 4.403 557 HA VAL 100 HA VAL 100 0.344 0.352 5.279 558 HB VAL 100 HB VAL 100 1.505 -2.406 5.704 559 HG11 VAL 100 1HG1 VAL 100 2.294 0.291 6.797 560 HG12 VAL 100 2HG1 VAL 100 3.179 -0.653 5.599 561 HG13 VAL 100 3HG1 VAL 100 3.023 -1.249 7.251 562 HG21 VAL 100 1HG2 VAL 100 -0.523 -2.188 7.022 563 HG22 VAL 100 2HG2 VAL 100 0.038 -0.645 7.665 564 HG23 VAL 100 3HG2 VAL 100 0.893 -2.133 8.071 565 H MET 101 H MET 101 0.984 1.268 3.441 566 HA MET 101 HA MET 101 2.271 -0.334 1.369 567 HB2 MET 101 1HB MET 101 0.734 1.523 0.723 568 HB3 MET 101 2HB MET 101 1.864 2.666 1.440 569 HG2 MET 101 1HG MET 101 3.605 1.809 -0.128 570 HG3 MET 101 2HG MET 101 2.344 0.868 -0.918 571 HE1 MET 101 1HE MET 101 2.736 5.455 -0.950 572 HE2 MET 101 2HE MET 101 3.957 4.329 -0.355 573 HE3 MET 101 3HE MET 101 2.459 4.560 0.542 574 H THR 102 H THR 102 4.299 -0.890 1.743 575 HA THR 102 HA THR 102 6.092 1.084 2.975 576 HB THR 102 HB THR 102 6.556 -1.886 2.633 577 HG1 THR 102 HG1 THR 102 6.057 -0.728 5.139 578 HG21 THR 102 1HG2 THR 102 8.599 -0.534 2.853 579 HG22 THR 102 2HG2 THR 102 8.338 -1.557 4.265 580 HG23 THR 102 3HG2 THR 102 7.967 0.165 4.343 581 HA PRO 103 HA PRO 103 7.541 1.113 -1.379 582 HB2 PRO 103 1HB PRO 103 8.230 3.730 -1.413 583 HB3 PRO 103 2HB PRO 103 6.575 3.175 -1.715 584 HG2 PRO 103 1HG PRO 103 7.760 4.333 0.774 585 HG3 PRO 103 2HG PRO 103 6.160 4.603 0.058 586 HD2 PRO 103 1HD PRO 103 6.640 2.919 2.172 587 HD3 PRO 103 2HD PRO 103 5.275 2.733 1.045 588 H GLY 104 H GLY 104 9.589 0.815 -2.003 589 HA2 GLY 104 1HA GLY 104 11.829 2.128 -0.831 590 HA3 GLY 104 2HA GLY 104 11.694 0.487 -0.220 591 H TRP 105 H TRP 105 13.710 0.045 -1.174 592 HA TRP 105 HA TRP 105 13.501 -0.505 -4.055 593 HB2 TRP 105 1HB TRP 105 15.900 0.017 -4.294 594 HB3 TRP 105 2HB TRP 105 14.982 1.419 -3.758 595 HD1 TRP 105 HD1 TRP 105 15.165 1.900 -0.981 596 HE1 TRP 105 HE1 TRP 105 17.237 1.679 0.529 597 HE3 TRP 105 HE3 TRP 105 18.016 -1.134 -3.949 598 HZ2 TRP 105 HZ2 TRP 105 19.752 0.403 0.462 599 HZ3 TRP 105 HZ3 TRP 105 20.245 -1.800 -3.154 600 HH2 TRP 105 HH2 TRP 105 21.095 -1.048 -0.995 601 H ASP 106 H ASP 106 12.978 -2.124 -1.676 602 HA ASP 106 HA ASP 106 15.160 -3.945 -1.355 603 HB2 ASP 106 1HB ASP 106 12.279 -4.036 -0.466 604 HB3 ASP 106 2HB ASP 106 13.414 -5.341 -0.140 605 H ASN 107 H ASN 107 15.420 -4.268 -3.686 606 HA ASN 107 HA ASN 107 13.544 -5.661 -5.258 607 HB2 ASN 107 1HB ASN 107 16.545 -5.419 -5.476 608 HB3 ASN 107 2HB ASN 107 15.569 -6.269 -6.665 609 HD21 ASN 107 1HD2 ASN 107 16.480 -3.189 -5.378 610 HD22 ASN 107 2HD2 ASN 107 15.728 -2.228 -6.603 611 H ALA 108 H ALA 108 15.836 -6.712 -2.879 612 HA ALA 108 HA ALA 108 15.948 -9.447 -3.583 613 HB1 ALA 108 1HB ALA 108 17.552 -8.363 -2.062 614 HB2 ALA 108 2HB ALA 108 16.830 -9.809 -1.357 615 HB3 ALA 108 3HB ALA 108 16.276 -8.213 -0.853 616 H ASN 109 H ASN 109 13.634 -7.526 -1.822 617 HA ASN 109 HA ASN 109 12.151 -9.771 -0.783 618 HB2 ASN 109 1HB ASN 109 11.565 -6.815 -1.006 619 HB3 ASN 109 2HB ASN 109 10.354 -7.953 -0.434 620 HD21 ASN 109 1HD2 ASN 109 13.719 -8.446 0.281 621 HD22 ASN 109 2HD2 ASN 109 13.621 -8.037 1.958 622 H GLY 110 H GLY 110 12.376 -8.036 -3.671 623 HA2 GLY 110 1HA GLY 110 11.505 -8.580 -5.772 624 HA3 GLY 110 2HA GLY 110 10.488 -9.787 -4.999 625 H VAL 111 H VAL 111 10.321 -6.744 -3.535 626 HA VAL 111 HA VAL 111 7.622 -6.383 -4.493 627 HB VAL 111 HB VAL 111 7.578 -4.433 -2.925 628 HG11 VAL 111 1HG1 VAL 111 7.646 -5.799 -0.878 629 HG12 VAL 111 2HG1 VAL 111 8.459 -7.078 -1.777 630 HG13 VAL 111 3HG1 VAL 111 6.812 -6.613 -2.200 631 HG21 VAL 111 1HG2 VAL 111 10.360 -5.375 -2.233 632 HG22 VAL 111 2HG2 VAL 111 9.420 -4.203 -1.311 633 HG23 VAL 111 3HG2 VAL 111 9.927 -3.826 -2.957 634 H THR 112 H THR 112 6.957 -4.969 -5.977 635 HA THR 112 HA THR 112 8.953 -3.673 -7.583 636 HB THR 112 HB THR 112 6.764 -2.953 -8.844 637 HG1 THR 112 HG1 THR 112 5.600 -5.263 -7.879 638 HG21 THR 112 1HG2 THR 112 7.739 -5.805 -8.668 639 HG22 THR 112 2HG2 THR 112 8.375 -4.540 -9.719 640 HG23 THR 112 3HG2 THR 112 6.742 -5.156 -9.970 641 H GLY 113 H GLY 113 9.520 -2.249 -5.684 642 HA2 GLY 113 1HA GLY 113 9.749 -0.007 -5.140 643 HA3 GLY 113 2HA GLY 113 8.385 0.357 -6.189 644 H TRP 114 H TRP 114 6.263 -0.706 -5.277 645 HA TRP 114 HA TRP 114 6.043 0.227 -2.501 646 HB2 TRP 114 1HB TRP 114 3.871 -0.185 -4.573 647 HB3 TRP 114 2HB TRP 114 3.642 0.473 -2.955 648 HD1 TRP 114 HD1 TRP 114 4.609 2.963 -2.503 649 HE1 TRP 114 HE1 TRP 114 5.062 4.916 -4.120 650 HE3 TRP 114 HE3 TRP 114 4.615 0.377 -6.913 651 HZ2 TRP 114 HZ2 TRP 114 5.374 5.306 -6.896 652 HZ3 TRP 114 HZ3 TRP 114 4.997 1.618 -9.005 653 HH2 TRP 114 HH2 TRP 114 5.367 4.029 -8.995 654 H ALA 115 H ALA 115 5.848 -1.267 -0.964 655 HA ALA 115 HA ALA 115 4.927 -3.943 -1.674 656 HB1 ALA 115 1HB ALA 115 6.964 -3.741 -0.311 657 HB2 ALA 115 2HB ALA 115 5.684 -4.605 0.538 658 HB3 ALA 115 3HB ALA 115 6.030 -2.925 0.943 659 H ARG 116 H ARG 116 3.018 -4.744 -1.047 660 HA ARG 116 HA ARG 116 1.253 -2.920 0.445 661 HB2 ARG 116 1HB ARG 116 0.527 -4.976 -1.637 662 HB3 ARG 116 2HB ARG 116 -0.629 -4.007 -0.731 663 HG2 ARG 116 1HG ARG 116 1.458 -2.959 -2.634 664 HG3 ARG 116 2HG ARG 116 -0.271 -3.101 -2.954 665 HD2 ARG 116 1HD ARG 116 -0.664 -1.566 -1.014 666 HD3 ARG 116 2HD ARG 116 1.080 -1.316 -0.936 667 HE ARG 116 HE ARG 116 0.473 -0.758 -3.521 668 HH11 ARG 116 1HH1 ARG 116 -0.770 0.398 -0.458 669 HH12 ARG 116 2HH1 ARG 116 -1.175 1.965 -1.071 670 HH21 ARG 116 1HH2 ARG 116 -0.076 1.282 -4.338 671 HH22 ARG 116 2HH2 ARG 116 -0.777 2.472 -3.288 672 H ASN 117 H ASN 117 0.680 -3.541 2.364 673 HA ASN 117 HA ASN 117 0.264 -6.403 2.886 674 HB2 ASN 117 1HB ASN 117 2.398 -5.694 3.928 675 HB3 ASN 117 2HB ASN 117 1.542 -4.420 4.786 676 HD21 ASN 117 1HD2 ASN 117 0.348 -7.688 4.249 677 HD22 ASN 117 2HD2 ASN 117 0.355 -8.147 5.913 678 H CYS 118 H CYS 118 -1.855 -6.610 3.234 679 HA CYS 118 HA CYS 118 -3.264 -4.417 4.589 680 HB2 CYS 118 1HB CYS 118 -4.395 -6.753 3.026 681 HB3 CYS 118 2HB CYS 118 -5.319 -5.412 3.701 682 H ASN 119 H ASN 119 -3.549 -4.683 6.705 683 HA ASN 119 HA ASN 119 -3.395 -7.423 7.755 684 HB2 ASN 119 1HB ASN 119 -1.689 -5.762 8.530 685 HB3 ASN 119 2HB ASN 119 -2.994 -4.829 9.258 686 HD21 ASN 119 1HD2 ASN 119 -2.874 -8.339 9.191 687 HD22 ASN 119 2HD2 ASN 119 -2.649 -8.543 10.892 688 H ILE 120 H ILE 120 -5.354 -8.217 7.910 689 HA ILE 120 HA ILE 120 -7.255 -6.820 9.632 690 HB ILE 120 HB ILE 120 -8.121 -6.414 7.451 691 HG12 ILE 120 1HG1 ILE 120 -10.251 -7.668 7.443 692 HG13 ILE 120 2HG1 ILE 120 -9.593 -8.763 8.647 693 HG21 ILE 120 1HG2 ILE 120 -7.730 -9.342 6.891 694 HG22 ILE 120 2HG2 ILE 120 -6.852 -7.992 6.173 695 HG23 ILE 120 3HG2 ILE 120 -8.567 -8.215 5.826 696 HD11 ILE 120 1HD1 ILE 120 -10.029 -5.810 9.026 697 HD12 ILE 120 2HD1 ILE 120 -9.447 -6.945 10.244 698 HD13 ILE 120 3HD1 ILE 120 -11.085 -7.092 9.614 699 H GLN 121 H GLN 121 -7.074 -8.116 11.400 700 HA GLN 121 HA GLN 121 -6.141 -10.817 11.081 701 HB2 GLN 121 1HB GLN 121 -6.853 -9.273 13.577 702 HB3 GLN 121 2HB GLN 121 -6.042 -10.832 13.540 703 HG2 GLN 121 1HG GLN 121 -4.182 -9.808 12.297 704 HG3 GLN 121 2HG GLN 121 -4.986 -8.244 12.429 705 HE21 GLN 121 1HE2 GLN 121 -3.232 -10.715 14.100 706 HE22 GLN 121 2HE2 GLN 121 -2.941 -9.815 15.550 707 H SER 122 H SER 122 -9.216 -9.352 11.462 708 HA SER 122 HA SER 122 -10.373 -11.790 12.593 709 HB2 SER 122 1HB SER 122 -12.418 -10.371 12.870 710 HB3 SER 122 2HB SER 122 -11.004 -9.750 13.723 711 HG SER 122 HG SER 122 -12.238 -8.795 11.364 712 H ASP 123 H ASP 123 -9.942 -10.360 9.564 713 HA ASP 123 HA ASP 123 -12.074 -11.948 8.376 714 HB2 ASP 123 1HB ASP 123 -11.900 -8.947 8.012 715 HB3 ASP 123 2HB ASP 123 -12.934 -10.015 7.071 716 H SER 124 H SER 124 -10.226 -13.084 7.566 717 HA SER 124 HA SER 124 -8.146 -11.938 6.095 718 HB2 SER 124 1HB SER 124 -9.274 -14.712 5.694 719 HB3 SER 124 2HB SER 124 -7.624 -14.174 5.391 720 HG SER 124 HG SER 124 -8.901 -14.768 7.798 721 H ALA 125 H ALA 125 -11.411 -12.676 5.159 722 HA ALA 125 HA ALA 125 -11.114 -12.864 2.381 723 HB1 ALA 125 1HB ALA 125 -13.183 -13.440 3.563 724 HB2 ALA 125 2HB ALA 125 -13.476 -12.303 2.247 725 HB3 ALA 125 3HB ALA 125 -13.450 -11.733 3.916 726 H LEU 126 H LEU 126 -11.322 -10.077 4.507 727 HA LEU 126 HA LEU 126 -11.659 -8.138 2.468 728 HB2 LEU 126 1HB LEU 126 -10.557 -7.886 5.265 729 HB3 LEU 126 2HB LEU 126 -10.918 -6.525 4.220 730 HG LEU 126 HG LEU 126 -12.918 -8.515 5.299 731 HD11 LEU 126 1HD1 LEU 126 -12.117 -6.994 7.006 732 HD12 LEU 126 2HD1 LEU 126 -13.770 -6.583 6.555 733 HD13 LEU 126 3HD1 LEU 126 -12.424 -5.615 5.954 734 HD21 LEU 126 1HD2 LEU 126 -13.585 -7.769 3.096 735 HD22 LEU 126 2HD2 LEU 126 -13.303 -6.089 3.551 736 HD23 LEU 126 3HD2 LEU 126 -14.602 -7.004 4.315 737 H GLN 127 H GLN 127 -8.884 -9.686 3.930 738 HA GLN 127 HA GLN 127 -6.913 -7.968 2.834 739 HB2 GLN 127 1HB GLN 127 -6.311 -9.403 4.672 740 HB3 GLN 127 2HB GLN 127 -6.755 -10.838 3.758 741 HG2 GLN 127 1HG GLN 127 -4.944 -10.434 2.199 742 HG3 GLN 127 2HG GLN 127 -4.508 -8.960 3.057 743 HE21 GLN 127 1HE2 GLN 127 -2.896 -11.295 2.529 744 HE22 GLN 127 2HE2 GLN 127 -2.399 -11.907 4.069 745 H GLN 128 H GLN 128 -8.444 -10.936 1.741 746 HA GLN 128 HA GLN 128 -6.847 -11.544 -0.444 747 HB2 GLN 128 1HB GLN 128 -9.834 -11.890 -0.159 748 HB3 GLN 128 2HB GLN 128 -8.837 -12.697 -1.363 749 HG2 GLN 128 1HG GLN 128 -7.634 -13.867 0.383 750 HG3 GLN 128 2HG GLN 128 -8.559 -13.015 1.617 751 HE21 GLN 128 1HE2 GLN 128 -11.013 -13.175 -0.014 752 HE22 GLN 128 2HE2 GLN 128 -11.572 -14.801 0.149 753 H ALA 129 H ALA 129 -9.605 -9.357 -0.229 754 HA ALA 129 HA ALA 129 -9.485 -8.588 -2.976 755 HB1 ALA 129 1HB ALA 129 -10.852 -7.250 -0.645 756 HB2 ALA 129 2HB ALA 129 -11.570 -8.448 -1.722 757 HB3 ALA 129 3HB ALA 129 -11.108 -6.865 -2.348 758 H CYS 130 H CYS 130 -8.427 -7.126 0.071 759 HA CYS 130 HA CYS 130 -7.641 -4.646 -0.989 760 HB2 CYS 130 1HB CYS 130 -8.054 -4.949 1.378 761 HB3 CYS 130 2HB CYS 130 -6.728 -6.104 1.498 762 H GLU 131 H GLU 131 -5.672 -7.493 -0.168 763 HA GLU 131 HA GLU 131 -3.211 -6.286 -0.872 764 HB2 GLU 131 1HB GLU 131 -3.461 -8.193 0.690 765 HB3 GLU 131 2HB GLU 131 -3.931 -9.214 -0.659 766 HG2 GLU 131 1HG GLU 131 -1.739 -8.909 -1.672 767 HG3 GLU 131 2HG GLU 131 -1.262 -7.863 -0.332 768 H ASP 132 H ASP 132 -5.574 -8.171 -2.605 769 HA ASP 132 HA ASP 132 -3.977 -8.742 -4.886 770 HB2 ASP 132 1HB ASP 132 -6.038 -10.003 -4.256 771 HB3 ASP 132 2HB ASP 132 -6.992 -8.593 -4.704 772 H VAL 133 H VAL 133 -6.180 -6.116 -4.040 773 HA VAL 133 HA VAL 133 -6.099 -4.998 -6.695 774 HB VAL 133 HB VAL 133 -7.269 -3.931 -4.123 775 HG11 VAL 133 1HG1 VAL 133 -6.581 -2.082 -5.578 776 HG12 VAL 133 2HG1 VAL 133 -8.335 -2.208 -5.476 777 HG13 VAL 133 3HG1 VAL 133 -7.492 -2.794 -6.910 778 HG21 VAL 133 1HG2 VAL 133 -8.561 -5.055 -6.606 779 HG22 VAL 133 2HG2 VAL 133 -9.408 -4.428 -5.190 780 HG23 VAL 133 3HG2 VAL 133 -8.413 -5.878 -5.054 781 H PHE 134 H PHE 134 -4.687 -4.163 -3.539 782 HA PHE 134 HA PHE 134 -3.747 -1.652 -4.486 783 HB2 PHE 134 1HB PHE 134 -3.420 -3.177 -1.942 784 HB3 PHE 134 2HB PHE 134 -2.324 -1.842 -2.277 785 HD1 PHE 134 HD1 PHE 134 -3.022 0.403 -2.088 786 HD2 PHE 134 HD2 PHE 134 -5.879 -2.743 -1.842 787 HE1 PHE 134 HE1 PHE 134 -4.724 2.011 -1.339 788 HE2 PHE 134 HE2 PHE 134 -7.584 -1.140 -1.092 789 HZ PHE 134 HZ PHE 134 -7.010 1.244 -0.844 790 H ARG 135 H ARG 135 -2.468 -4.811 -4.785 791 HA ARG 135 HA ARG 135 0.140 -3.618 -5.426 792 HB2 ARG 135 1HB ARG 135 0.440 -5.265 -3.692 793 HB3 ARG 135 2HB ARG 135 -0.483 -6.457 -4.605 794 HG2 ARG 135 1HG ARG 135 1.217 -6.496 -6.329 795 HG3 ARG 135 2HG ARG 135 2.129 -5.243 -5.495 796 HD2 ARG 135 1HD ARG 135 2.489 -6.756 -3.615 797 HD3 ARG 135 2HD ARG 135 1.562 -8.012 -4.440 798 HE ARG 135 HE ARG 135 3.410 -7.478 -6.275 799 HH11 ARG 135 1HH1 ARG 135 3.756 -8.013 -2.826 800 HH12 ARG 135 2HH1 ARG 135 5.372 -8.630 -2.964 801 HH21 ARG 135 1HH2 ARG 135 5.532 -8.230 -6.449 802 HH22 ARG 135 2HH2 ARG 135 6.390 -8.754 -5.028 803 H PHE 136 H PHE 136 0.171 -3.212 -7.568 804 HA PHE 136 HA PHE 136 -0.318 -5.564 -9.273 805 HB2 PHE 136 1HB PHE 136 -0.611 -2.631 -9.940 806 HB3 PHE 136 2HB PHE 136 -0.585 -3.900 -11.157 807 HD1 PHE 136 HD1 PHE 136 -2.717 -1.794 -9.563 808 HD2 PHE 136 HD2 PHE 136 -2.268 -5.958 -10.335 809 HE1 PHE 136 HE1 PHE 136 -5.143 -2.100 -9.315 810 HE2 PHE 136 HE2 PHE 136 -4.693 -6.268 -10.083 811 HZ PHE 136 HZ PHE 136 -6.135 -4.339 -9.577 812 H ASP 137 H ASP 137 1.702 -6.433 -9.422 813 HA ASP 137 HA ASP 137 4.000 -4.871 -10.060 814 HB2 ASP 137 1HB ASP 137 3.559 -7.839 -10.495 815 HB3 ASP 137 2HB ASP 137 5.104 -7.006 -10.518 816 H ASP 138 H ASP 138 4.321 -3.892 -11.918 817 HA ASP 138 HA ASP 138 2.728 -4.262 -14.203 818 HB2 ASP 138 1HB ASP 138 3.814 -2.138 -13.769 819 HB3 ASP 138 2HB ASP 138 5.404 -2.884 -13.875 820 H ALA 139 H ALA 139 5.629 -5.789 -13.132 821 HA ALA 139 HA ALA 139 6.424 -6.832 -15.674 822 HB1 ALA 139 1HB ALA 139 7.189 -7.685 -12.884 823 HB2 ALA 139 2HB ALA 139 8.053 -6.529 -13.896 824 HB3 ALA 139 3HB ALA 139 7.972 -8.227 -14.368 825 H ASN 140 H ASN 140 4.187 -7.763 -13.220 826 HA ASN 140 HA ASN 140 3.885 -10.461 -14.263 827 HB2 ASN 140 1HB ASN 140 3.681 -10.228 -11.866 828 HB3 ASN 140 2HB ASN 140 2.463 -8.968 -12.041 829 HD21 ASN 140 1HD2 ASN 140 3.116 -12.382 -12.235 830 HD22 ASN 140 2HD2 ASN 140 1.465 -12.894 -12.271 831 H LEU 141 H LEU 141 2.436 -7.339 -14.508 832 HA LEU 141 HA LEU 141 0.063 -8.339 -15.844 833 HB2 LEU 141 1HB LEU 141 0.991 -5.519 -15.305 834 HB3 LEU 141 2HB LEU 141 -0.547 -5.947 -16.025 835 HG LEU 141 HG LEU 141 0.326 -6.656 -13.222 836 HD11 LEU 141 1HD1 LEU 141 -0.081 -4.294 -13.419 837 HD12 LEU 141 2HD1 LEU 141 -1.426 -5.051 -12.562 838 HD13 LEU 141 3HD1 LEU 141 -1.607 -4.591 -14.254 839 HD21 LEU 141 1HD2 LEU 141 -2.032 -7.330 -12.941 840 HD22 LEU 141 2HD2 LEU 141 -1.170 -8.335 -14.102 841 HD23 LEU 141 3HD2 LEU 141 -2.283 -7.090 -14.670 842 H VAL 142 H VAL 142 0.416 -9.046 -17.863 843 HA VAL 142 HA VAL 142 2.112 -7.403 -19.597 844 HB VAL 142 HB VAL 142 2.819 -9.710 -19.539 845 HG11 VAL 142 1HG1 VAL 142 1.393 -11.536 -20.357 846 HG12 VAL 142 2HG1 VAL 142 0.035 -10.417 -20.444 847 HG13 VAL 142 3HG1 VAL 142 0.761 -10.801 -18.884 848 HG21 VAL 142 1HG2 VAL 142 2.804 -10.218 -21.904 849 HG22 VAL 142 2HG2 VAL 142 3.001 -8.483 -21.656 850 HG23 VAL 142 3HG2 VAL 142 1.438 -9.133 -22.152 851 HA PRO 143 HA PRO 143 -1.782 -5.987 -21.224 852 HB2 PRO 143 1HB PRO 143 -0.770 -4.030 -22.788 853 HB3 PRO 143 2HB PRO 143 -0.896 -3.872 -21.036 854 HG2 PRO 143 1HG PRO 143 1.484 -4.495 -22.717 855 HG3 PRO 143 2HG PRO 143 1.371 -3.500 -21.257 856 HD2 PRO 143 1HD PRO 143 2.295 -6.099 -21.309 857 HD3 PRO 143 2HD PRO 143 1.625 -5.299 -19.874 858 H ARG 144 H ARG 144 -2.924 -6.687 -22.906 859 HA ARG 144 HA ARG 144 -1.457 -7.656 -25.271 860 HB2 ARG 144 1HB ARG 144 -4.106 -8.643 -24.185 861 HB3 ARG 144 2HB ARG 144 -3.270 -9.272 -25.596 862 HG2 ARG 144 1HG ARG 144 -2.135 -9.340 -22.811 863 HG3 ARG 144 2HG ARG 144 -3.051 -10.659 -23.535 864 HD2 ARG 144 1HD ARG 144 -0.445 -9.515 -24.539 865 HD3 ARG 144 2HD ARG 144 -0.674 -11.073 -23.749 866 HE ARG 144 HE ARG 144 -2.333 -10.973 -26.003 867 HH11 ARG 144 1HH1 ARG 144 1.063 -11.129 -25.193 868 HH12 ARG 144 2HH1 ARG 144 1.514 -11.907 -26.674 869 HH21 ARG 144 1HH2 ARG 144 -1.748 -11.989 -27.966 870 HH22 ARG 144 2HH2 ARG 144 -0.087 -12.400 -28.253 871 H GLY 145 H GLY 145 -1.616 -6.022 -26.720 872 HA2 GLY 145 1HA GLY 145 -2.490 -4.268 -27.929 873 HA3 GLY 145 2HA GLY 145 -3.810 -5.396 -28.176 874 H SER 146 H SER 146 -5.369 -3.843 -28.265 875 HA SER 146 HA SER 146 -5.851 -2.012 -26.112 876 HB2 SER 146 1HB SER 146 -7.716 -2.940 -28.313 877 HB3 SER 146 2HB SER 146 -7.943 -1.521 -27.288 878 HG SER 146 HG SER 146 -6.203 -0.551 -28.245 879 H GLY 147 H GLY 147 -7.922 -2.088 -24.813 880 HA2 GLY 147 1HA GLY 147 -9.707 -3.505 -23.940 881 HA3 GLY 147 2HA GLY 147 -8.650 -4.886 -24.195 882 H LEU 148 H LEU 148 -7.031 -2.175 -22.992 883 HA LEU 148 HA LEU 148 -6.744 -3.397 -20.382 884 HB2 LEU 148 1HB LEU 148 -5.421 -1.106 -21.796 885 HB3 LEU 148 2HB LEU 148 -5.281 -1.244 -20.057 886 HG LEU 148 HG LEU 148 -3.321 -2.162 -21.157 887 HD11 LEU 148 1HD1 LEU 148 -4.048 -3.166 -19.057 888 HD12 LEU 148 2HD1 LEU 148 -3.259 -4.344 -20.103 889 HD13 LEU 148 3HD1 LEU 148 -5.016 -4.340 -19.948 890 HD21 LEU 148 1HD2 LEU 148 -4.321 -2.800 -23.280 891 HD22 LEU 148 2HD2 LEU 148 -5.220 -4.092 -22.482 892 HD23 LEU 148 3HD2 LEU 148 -3.459 -4.156 -22.557 893 H GLU 149 H GLU 149 -7.908 -2.873 -18.688 894 HA GLU 149 HA GLU 149 -10.007 -0.983 -18.795 895 HB2 GLU 149 1HB GLU 149 -8.852 -2.019 -16.213 896 HB3 GLU 149 2HB GLU 149 -10.520 -1.614 -16.576 897 HG2 GLU 149 1HG GLU 149 -10.664 -3.879 -16.570 898 HG3 GLU 149 2HG GLU 149 -10.282 -3.622 -18.272 899 H HIS 150 H HIS 150 -6.756 -0.924 -17.479 900 HA HIS 150 HA HIS 150 -7.144 1.790 -16.468 901 HB2 HIS 150 1HB HIS 150 -4.844 -0.151 -16.180 902 HB3 HIS 150 2HB HIS 150 -4.823 1.491 -15.553 903 HD1 HIS 150 HD1 HIS 150 -5.711 1.806 -13.251 904 HD2 HIS 150 HD2 HIS 150 -6.949 -1.787 -14.939 905 HE1 HIS 150 HE1 HIS 150 -6.898 0.566 -11.412 906 HE2 HIS 150 HE2 HIS 150 -7.790 -1.522 -12.510 907 H HIS 151 H HIS 151 -7.405 2.545 -18.692 908 HA HIS 151 HA HIS 151 -4.919 2.729 -20.220 909 HB2 HIS 151 1HB HIS 151 -6.964 2.149 -21.462 910 HB3 HIS 151 2HB HIS 151 -7.726 3.638 -20.914 911 HD1 HIS 151 HD1 HIS 151 -7.679 5.418 -22.617 912 HD2 HIS 151 HD2 HIS 151 -4.430 2.858 -22.997 913 HE1 HIS 151 HE1 HIS 151 -6.397 6.248 -24.607 914 HE2 HIS 151 HE2 HIS 151 -4.559 4.561 -24.937 915 H HIS 152 H HIS 152 -3.692 4.486 -20.185 916 HA HIS 152 HA HIS 152 -4.087 6.527 -18.308 917 HB2 HIS 152 1HB HIS 152 -1.878 5.792 -19.244 918 HB3 HIS 152 2HB HIS 152 -2.286 6.626 -20.738 919 HD1 HIS 152 HD1 HIS 152 -1.761 9.081 -20.847 920 HD2 HIS 152 HD2 HIS 152 -1.553 7.570 -16.982 921 HE1 HIS 152 HE1 HIS 152 -0.810 10.936 -19.450 922 HE2 HIS 152 HE2 HIS 152 -0.478 9.916 -17.174 923 H HIS 153 H HIS 153 -5.640 7.971 -18.390 924 HA HIS 153 HA HIS 153 -6.860 8.827 -20.836 925 HB2 HIS 153 1HB HIS 153 -7.211 9.782 -17.986 926 HB3 HIS 153 2HB HIS 153 -8.191 10.323 -19.343 927 HD1 HIS 153 HD1 HIS 153 -7.960 7.713 -16.802 928 HD2 HIS 153 HD2 HIS 153 -9.799 8.178 -20.502 929 HE1 HIS 153 HE1 HIS 153 -9.710 5.911 -16.924 930 HE2 HIS 153 HE2 HIS 153 -10.733 6.144 -19.209 931 H HIS 154 H HIS 154 -6.027 10.306 -22.131 932 HA HIS 154 HA HIS 154 -4.147 12.277 -21.071 933 HB2 HIS 154 1HB HIS 154 -3.701 10.936 -23.195 934 HB3 HIS 154 2HB HIS 154 -4.965 11.890 -23.956 935 HD1 HIS 154 HD1 HIS 154 -1.407 11.964 -23.026 936 HD2 HIS 154 HD2 HIS 154 -4.311 14.685 -24.224 937 HE1 HIS 154 HE1 HIS 154 -0.155 14.031 -23.715 938 HE2 HIS 154 HE2 HIS 154 -1.944 15.720 -24.246 939 H HIS 155 H HIS 155 -7.372 11.928 -22.171 940 HA HIS 155 HA HIS 155 -7.755 14.804 -22.465 941 HB2 HIS 155 1HB HIS 155 -8.731 13.354 -24.181 942 HB3 HIS 155 2HB HIS 155 -9.641 12.488 -22.950 943 HD1 HIS 155 HD1 HIS 155 -9.502 15.821 -24.709 944 HD2 HIS 155 HD2 HIS 155 -12.025 13.663 -22.204 945 HE1 HIS 155 HE1 HIS 155 -11.674 17.087 -24.678 946 HE2 HIS 155 HE2 HIS 155 -13.222 15.695 -23.264 Start of MODEL 20 1 H1 MET 24 1H MET 24 -11.477 -13.677 -9.878 2 H2 MET 24 2H MET 24 -11.716 -14.585 -8.472 3 H3 MET 24 3H MET 24 -11.254 -12.961 -8.363 4 HA MET 24 HA MET 24 -13.331 -12.266 -9.348 5 HB2 MET 24 1HB MET 24 -13.956 -15.227 -9.245 6 HB3 MET 24 2HB MET 24 -15.158 -13.978 -9.525 7 HG2 MET 24 1HG MET 24 -13.877 -13.288 -11.539 8 HG3 MET 24 2HG MET 24 -12.821 -14.674 -11.282 9 HE1 MET 24 1HE MET 24 -15.312 -17.672 -11.752 10 HE2 MET 24 2HE MET 24 -14.923 -16.866 -10.233 11 HE3 MET 24 3HE MET 24 -13.649 -17.203 -11.405 12 H GLU 25 H GLU 25 -13.174 -11.213 -7.369 13 HA GLU 25 HA GLU 25 -14.686 -12.441 -5.196 14 HB2 GLU 25 1HB GLU 25 -11.889 -11.330 -4.889 15 HB3 GLU 25 2HB GLU 25 -12.958 -11.696 -3.542 16 HG2 GLU 25 1HG GLU 25 -12.902 -14.006 -3.989 17 HG3 GLU 25 2HG GLU 25 -12.180 -13.759 -5.577 18 H ASN 26 H ASN 26 -16.300 -10.961 -5.670 19 HA ASN 26 HA ASN 26 -17.509 -9.060 -5.413 20 HB2 ASN 26 1HB ASN 26 -15.245 -8.314 -3.542 21 HB3 ASN 26 2HB ASN 26 -16.761 -7.433 -3.672 22 HD21 ASN 26 1HD2 ASN 26 -18.652 -8.361 -2.877 23 HD22 ASN 26 2HD2 ASN 26 -18.619 -9.704 -1.787 24 H TYR 27 H TYR 27 -17.167 -8.483 -7.631 25 HA TYR 27 HA TYR 27 -14.906 -6.993 -8.473 26 HB2 TYR 27 1HB TYR 27 -16.354 -8.369 -9.985 27 HB3 TYR 27 2HB TYR 27 -17.597 -7.133 -9.842 28 HD1 TYR 27 HD1 TYR 27 -14.272 -7.916 -11.212 29 HD2 TYR 27 HD2 TYR 27 -17.386 -5.020 -11.010 30 HE1 TYR 27 HE1 TYR 27 -13.240 -6.679 -13.070 31 HE2 TYR 27 HE2 TYR 27 -16.360 -3.779 -12.866 32 HH TYR 27 HH TYR 27 -13.879 -5.081 -14.799 33 H LEU 28 H LEU 28 -17.995 -6.084 -7.124 34 HA LEU 28 HA LEU 28 -17.884 -3.351 -7.997 35 HB2 LEU 28 1HB LEU 28 -19.516 -4.691 -5.837 36 HB3 LEU 28 2HB LEU 28 -19.694 -3.010 -6.291 37 HG LEU 28 HG LEU 28 -20.156 -5.335 -8.162 38 HD11 LEU 28 1HD1 LEU 28 -22.137 -3.622 -6.668 39 HD12 LEU 28 2HD1 LEU 28 -21.807 -5.330 -6.375 40 HD13 LEU 28 3HD1 LEU 28 -22.536 -4.820 -7.900 41 HD21 LEU 28 1HD2 LEU 28 -21.212 -3.638 -9.583 42 HD22 LEU 28 2HD2 LEU 28 -19.507 -3.289 -9.310 43 HD23 LEU 28 3HD2 LEU 28 -20.741 -2.388 -8.433 44 H ARG 29 H ARG 29 -17.188 -5.068 -4.990 45 HA ARG 29 HA ARG 29 -16.148 -2.850 -3.580 46 HB2 ARG 29 1HB ARG 29 -16.779 -4.915 -2.439 47 HB3 ARG 29 2HB ARG 29 -15.546 -5.806 -3.322 48 HG2 ARG 29 1HG ARG 29 -13.824 -4.392 -2.237 49 HG3 ARG 29 2HG ARG 29 -15.100 -3.656 -1.267 50 HD2 ARG 29 1HD ARG 29 -14.323 -6.572 -1.301 51 HD3 ARG 29 2HD ARG 29 -13.993 -5.415 -0.011 52 HE ARG 29 HE ARG 29 -16.673 -5.310 -0.186 53 HH11 ARG 29 1HH1 ARG 29 -14.462 -8.018 0.006 54 HH12 ARG 29 2HH1 ARG 29 -15.581 -9.041 0.845 55 HH21 ARG 29 1HH2 ARG 29 -18.150 -6.651 0.917 56 HH22 ARG 29 2HH2 ARG 29 -17.688 -8.267 1.360 57 H LYS 30 H LYS 30 -14.769 -5.195 -5.791 58 HA LYS 30 HA LYS 30 -12.066 -4.618 -5.525 59 HB2 LYS 30 1HB LYS 30 -13.230 -6.444 -6.930 60 HB3 LYS 30 2HB LYS 30 -13.351 -5.217 -8.184 61 HG2 LYS 30 1HG LYS 30 -11.422 -6.419 -8.708 62 HG3 LYS 30 2HG LYS 30 -10.832 -4.949 -7.930 63 HD2 LYS 30 1HD LYS 30 -9.580 -6.631 -6.923 64 HD3 LYS 30 2HD LYS 30 -10.873 -6.336 -5.761 65 HE2 LYS 30 1HE LYS 30 -10.679 -8.686 -5.947 66 HE3 LYS 30 2HE LYS 30 -12.121 -8.243 -6.860 67 HZ1 LYS 30 1HZ LYS 30 -10.756 -9.836 -8.063 68 HZ2 LYS 30 2HZ LYS 30 -9.436 -8.773 -8.020 69 HZ3 LYS 30 3HZ LYS 30 -10.827 -8.367 -8.895 70 H ALA 31 H ALA 31 -14.486 -3.144 -7.695 71 HA ALA 31 HA ALA 31 -12.856 -1.269 -8.913 72 HB1 ALA 31 1HB ALA 31 -14.907 -0.030 -9.377 73 HB2 ALA 31 2HB ALA 31 -15.767 -0.999 -8.182 74 HB3 ALA 31 3HB ALA 31 -15.127 -1.760 -9.639 75 H ALA 32 H ALA 32 -14.478 -1.113 -5.778 76 HA ALA 32 HA ALA 32 -13.947 1.637 -5.302 77 HB1 ALA 32 1HB ALA 32 -15.678 0.405 -4.078 78 HB2 ALA 32 2HB ALA 32 -14.519 1.151 -2.978 79 HB3 ALA 32 3HB ALA 32 -14.433 -0.579 -3.308 80 H LEU 33 H LEU 33 -12.323 -1.354 -4.405 81 HA LEU 33 HA LEU 33 -10.184 -0.211 -2.961 82 HB2 LEU 33 1HB LEU 33 -10.653 -2.831 -4.339 83 HB3 LEU 33 2HB LEU 33 -9.040 -2.437 -3.780 84 HG LEU 33 HG LEU 33 -9.678 -2.495 -1.517 85 HD11 LEU 33 1HD1 LEU 33 -11.728 -1.159 -1.692 86 HD12 LEU 33 2HD1 LEU 33 -11.969 -2.611 -0.722 87 HD13 LEU 33 3HD1 LEU 33 -12.565 -2.551 -2.378 88 HD21 LEU 33 1HD2 LEU 33 -9.545 -4.704 -2.529 89 HD22 LEU 33 2HD2 LEU 33 -11.259 -4.629 -2.938 90 HD23 LEU 33 3HD2 LEU 33 -10.757 -4.672 -1.248 91 H THR 34 H THR 34 -10.622 -1.030 -6.356 92 HA THR 34 HA THR 34 -7.994 -0.413 -7.201 93 HB THR 34 HB THR 34 -10.544 -0.344 -8.827 94 HG1 THR 34 HG1 THR 34 -10.216 -2.384 -7.834 95 HG21 THR 34 1HG2 THR 34 -7.658 -0.668 -9.661 96 HG22 THR 34 2HG2 THR 34 -8.674 0.743 -9.958 97 HG23 THR 34 3HG2 THR 34 -9.053 -0.797 -10.732 98 H ASP 35 H ASP 35 -10.927 1.478 -6.821 99 HA ASP 35 HA ASP 35 -10.012 3.772 -8.230 100 HB2 ASP 35 1HB ASP 35 -12.408 3.348 -7.813 101 HB3 ASP 35 2HB ASP 35 -12.138 3.565 -6.085 102 H MET 36 H MET 36 -10.039 2.822 -4.819 103 HA MET 36 HA MET 36 -8.892 5.211 -3.840 104 HB2 MET 36 1HB MET 36 -9.945 3.651 -2.305 105 HB3 MET 36 2HB MET 36 -8.760 2.411 -2.699 106 HG2 MET 36 1HG MET 36 -8.280 3.474 -0.560 107 HG3 MET 36 2HG MET 36 -6.993 3.757 -1.735 108 HE1 MET 36 1HE MET 36 -6.764 7.116 0.135 109 HE2 MET 36 2HE MET 36 -5.883 5.765 -0.578 110 HE3 MET 36 3HE MET 36 -6.950 5.493 0.800 111 H LEU 37 H LEU 37 -7.469 2.196 -5.022 112 HA LEU 37 HA LEU 37 -4.782 2.855 -4.521 113 HB2 LEU 37 1HB LEU 37 -5.520 0.598 -5.106 114 HB3 LEU 37 2HB LEU 37 -5.972 1.154 -6.715 115 HG LEU 37 HG LEU 37 -3.531 1.738 -7.073 116 HD11 LEU 37 1HD1 LEU 37 -3.210 0.071 -4.581 117 HD12 LEU 37 2HD1 LEU 37 -2.813 1.780 -4.751 118 HD13 LEU 37 3HD1 LEU 37 -1.905 0.569 -5.656 119 HD21 LEU 37 1HD2 LEU 37 -4.214 -1.153 -6.575 120 HD22 LEU 37 2HD2 LEU 37 -2.921 -0.548 -7.610 121 HD23 LEU 37 3HD2 LEU 37 -4.607 -0.240 -8.031 122 H GLN 38 H GLN 38 -6.876 3.473 -7.312 123 HA GLN 38 HA GLN 38 -4.886 4.737 -8.885 124 HB2 GLN 38 1HB GLN 38 -7.900 4.896 -8.957 125 HB3 GLN 38 2HB GLN 38 -6.863 5.694 -10.132 126 HG2 GLN 38 1HG GLN 38 -7.098 2.736 -9.637 127 HG3 GLN 38 2HG GLN 38 -7.668 3.631 -11.045 128 HE21 GLN 38 1HE2 GLN 38 -4.930 2.268 -9.437 129 HE22 GLN 38 2HE2 GLN 38 -3.801 2.471 -10.733 130 H THR 39 H THR 39 -7.049 5.862 -6.390 131 HA THR 39 HA THR 39 -6.527 8.650 -6.799 132 HB THR 39 HB THR 39 -7.569 7.237 -4.329 133 HG1 THR 39 HG1 THR 39 -8.863 6.917 -6.240 134 HG21 THR 39 1HG2 THR 39 -6.778 9.512 -3.870 135 HG22 THR 39 2HG2 THR 39 -8.535 9.417 -3.752 136 HG23 THR 39 3HG2 THR 39 -7.782 10.132 -5.178 137 H PHE 40 H PHE 40 -5.011 6.047 -5.073 138 HA PHE 40 HA PHE 40 -3.376 7.631 -3.380 139 HB2 PHE 40 1HB PHE 40 -3.825 5.288 -2.867 140 HB3 PHE 40 2HB PHE 40 -3.006 4.790 -4.344 141 HD1 PHE 40 HD1 PHE 40 -2.126 7.163 -1.591 142 HD2 PHE 40 HD2 PHE 40 -1.044 3.718 -3.848 143 HE1 PHE 40 HE1 PHE 40 0.003 7.039 -0.372 144 HE2 PHE 40 HE2 PHE 40 1.086 3.586 -2.632 145 HZ PHE 40 HZ PHE 40 1.617 5.249 -0.891 146 H VAL 41 H VAL 41 -3.050 6.432 -6.655 147 HA VAL 41 HA VAL 41 -0.350 6.707 -7.093 148 HB VAL 41 HB VAL 41 -2.585 7.265 -9.037 149 HG11 VAL 41 1HG1 VAL 41 0.344 6.831 -9.583 150 HG12 VAL 41 2HG1 VAL 41 -0.533 8.346 -9.791 151 HG13 VAL 41 3HG1 VAL 41 -0.926 6.955 -10.802 152 HG21 VAL 41 1HG2 VAL 41 -2.093 5.005 -9.836 153 HG22 VAL 41 2HG2 VAL 41 -2.576 5.007 -8.140 154 HG23 VAL 41 3HG2 VAL 41 -0.875 4.830 -8.573 155 HA PRO 42 HA PRO 42 -0.946 11.464 -8.204 156 HB2 PRO 42 1HB PRO 42 -3.288 12.027 -6.473 157 HB3 PRO 42 2HB PRO 42 -2.859 12.710 -8.046 158 HG2 PRO 42 1HG PRO 42 -4.814 10.921 -7.833 159 HG3 PRO 42 2HG PRO 42 -3.700 10.897 -9.214 160 HD2 PRO 42 1HD PRO 42 -3.765 9.137 -6.796 161 HD3 PRO 42 2HD PRO 42 -3.412 8.729 -8.483 162 H TYR 43 H TYR 43 -1.539 9.903 -5.107 163 HA TYR 43 HA TYR 43 -0.506 12.141 -3.577 164 HB2 TYR 43 1HB TYR 43 -1.278 9.312 -2.839 165 HB3 TYR 43 2HB TYR 43 -0.440 10.372 -1.707 166 HD1 TYR 43 HD1 TYR 43 -3.616 9.546 -3.233 167 HD2 TYR 43 HD2 TYR 43 -1.553 12.478 -0.944 168 HE1 TYR 43 HE1 TYR 43 -5.764 10.502 -2.531 169 HE2 TYR 43 HE2 TYR 43 -3.703 13.445 -0.239 170 HH TYR 43 HH TYR 43 -6.639 11.847 -0.620 171 H ARG 44 H ARG 44 0.555 9.135 -4.973 172 HA ARG 44 HA ARG 44 3.076 8.924 -3.770 173 HB2 ARG 44 1HB ARG 44 2.326 8.069 -6.565 174 HB3 ARG 44 2HB ARG 44 3.696 7.489 -5.632 175 HG2 ARG 44 1HG ARG 44 2.090 6.571 -3.972 176 HG3 ARG 44 2HG ARG 44 0.781 7.019 -5.071 177 HD2 ARG 44 1HD ARG 44 2.993 5.018 -5.513 178 HD3 ARG 44 2HD ARG 44 1.253 4.727 -5.509 179 HE ARG 44 HE ARG 44 2.129 6.552 -7.562 180 HH11 ARG 44 1HH1 ARG 44 1.587 3.195 -6.740 181 HH12 ARG 44 2HH1 ARG 44 1.508 2.671 -8.390 182 HH21 ARG 44 1HH2 ARG 44 2.039 5.859 -9.739 183 HH22 ARG 44 2HH2 ARG 44 1.760 4.184 -10.092 184 H THR 45 H THR 45 1.989 10.671 -6.655 185 HA THR 45 HA THR 45 4.297 11.680 -7.630 186 HB THR 45 HB THR 45 1.842 13.368 -7.126 187 HG1 THR 45 HG1 THR 45 2.414 11.362 -9.051 188 HG21 THR 45 1HG2 THR 45 3.783 14.618 -7.954 189 HG22 THR 45 2HG2 THR 45 2.509 14.530 -9.170 190 HG23 THR 45 3HG2 THR 45 3.930 13.494 -9.305 191 H ALA 46 H ALA 46 2.642 12.831 -4.704 192 HA ALA 46 HA ALA 46 4.408 14.986 -4.172 193 HB1 ALA 46 1HB ALA 46 2.209 14.852 -3.130 194 HB2 ALA 46 2HB ALA 46 3.469 14.918 -1.895 195 HB3 ALA 46 3HB ALA 46 2.686 13.384 -2.276 196 H VAL 47 H VAL 47 4.390 11.607 -3.422 197 HA VAL 47 HA VAL 47 6.624 11.622 -1.632 198 HB VAL 47 HB VAL 47 5.404 9.339 -3.203 199 HG11 VAL 47 1HG1 VAL 47 7.381 9.259 -0.924 200 HG12 VAL 47 2HG1 VAL 47 7.715 8.840 -2.605 201 HG13 VAL 47 3HG1 VAL 47 6.594 7.860 -1.657 202 HG21 VAL 47 1HG2 VAL 47 5.060 10.177 -0.325 203 HG22 VAL 47 2HG2 VAL 47 4.372 8.730 -1.061 204 HG23 VAL 47 3HG2 VAL 47 3.858 10.326 -1.605 205 H GLU 48 H GLU 48 6.186 11.016 -5.087 206 HA GLU 48 HA GLU 48 8.837 10.251 -5.675 207 HB2 GLU 48 1HB GLU 48 6.809 11.599 -7.477 208 HB3 GLU 48 2HB GLU 48 8.274 10.794 -8.015 209 HG2 GLU 48 1HG GLU 48 5.996 9.450 -6.581 210 HG3 GLU 48 2HG GLU 48 6.250 9.440 -8.325 211 H LEU 49 H LEU 49 7.234 13.375 -5.495 212 HA LEU 49 HA LEU 49 9.300 14.972 -6.523 213 HB2 LEU 49 1HB LEU 49 7.237 15.574 -4.398 214 HB3 LEU 49 2HB LEU 49 8.272 16.789 -5.129 215 HG LEU 49 HG LEU 49 6.244 15.115 -6.617 216 HD11 LEU 49 1HD1 LEU 49 6.132 18.004 -5.771 217 HD12 LEU 49 2HD1 LEU 49 5.191 16.686 -5.076 218 HD13 LEU 49 3HD1 LEU 49 4.936 17.159 -6.754 219 HD21 LEU 49 1HD2 LEU 49 7.957 17.436 -7.494 220 HD22 LEU 49 2HD2 LEU 49 6.656 16.715 -8.442 221 HD23 LEU 49 3HD2 LEU 49 8.084 15.764 -8.042 222 H CYS 50 H CYS 50 8.595 13.900 -3.235 223 HA CYS 50 HA CYS 50 10.851 15.119 -2.032 224 HB2 CYS 50 1HB CYS 50 9.098 14.549 -0.579 225 HB3 CYS 50 2HB CYS 50 8.953 12.926 -1.239 226 H ALA 51 H ALA 51 10.225 11.836 -3.195 227 HA ALA 51 HA ALA 51 12.648 10.638 -2.588 228 HB1 ALA 51 1HB ALA 51 10.978 10.103 -5.040 229 HB2 ALA 51 2HB ALA 51 10.662 9.446 -3.434 230 HB3 ALA 51 3HB ALA 51 12.138 9.006 -4.292 231 H LEU 52 H LEU 52 11.825 12.667 -5.351 232 HA LEU 52 HA LEU 52 14.349 12.165 -6.653 233 HB2 LEU 52 1HB LEU 52 12.279 12.581 -7.935 234 HB3 LEU 52 2HB LEU 52 12.202 14.199 -7.263 235 HG LEU 52 HG LEU 52 14.316 14.763 -8.403 236 HD11 LEU 52 1HD1 LEU 52 15.344 12.586 -8.521 237 HD12 LEU 52 2HD1 LEU 52 15.163 13.239 -10.148 238 HD13 LEU 52 3HD1 LEU 52 14.054 11.997 -9.567 239 HD21 LEU 52 1HD2 LEU 52 13.401 14.860 -10.655 240 HD22 LEU 52 2HD2 LEU 52 12.162 15.238 -9.459 241 HD23 LEU 52 3HD2 LEU 52 12.191 13.652 -10.228 242 H GLU 53 H GLU 53 13.144 14.377 -4.329 243 HA GLU 53 HA GLU 53 15.016 16.475 -4.887 244 HB2 GLU 53 1HB GLU 53 12.795 16.895 -3.864 245 HB3 GLU 53 2HB GLU 53 13.316 16.030 -2.426 246 HG2 GLU 53 1HG GLU 53 13.467 18.394 -2.045 247 HG3 GLU 53 2HG GLU 53 15.087 17.704 -2.090 248 H HIS 54 H HIS 54 14.742 13.918 -2.439 249 HA HIS 54 HA HIS 54 17.444 14.672 -1.515 250 HB2 HIS 54 1HB HIS 54 15.217 13.338 0.028 251 HB3 HIS 54 2HB HIS 54 16.850 13.568 0.643 252 HD1 HIS 54 HD1 HIS 54 13.822 14.935 1.300 253 HD2 HIS 54 HD2 HIS 54 17.365 16.663 -0.023 254 HE1 HIS 54 HE1 HIS 54 13.649 17.375 1.890 255 HE2 HIS 54 HE2 HIS 54 15.855 18.378 1.190 256 H GLY 55 H GLY 55 15.660 12.225 -3.066 257 HA2 GLY 55 1HA GLY 55 16.395 10.311 -4.050 258 HA3 GLY 55 2HA GLY 55 17.973 10.572 -3.330 259 H GLY 56 H GLY 56 16.910 10.609 -0.522 260 HA2 GLY 56 1HA GLY 56 15.825 7.907 -0.379 261 HA3 GLY 56 2HA GLY 56 16.466 8.834 0.963 262 H LEU 57 H LEU 57 13.940 7.319 0.599 263 HA LEU 57 HA LEU 57 11.802 9.223 0.526 264 HB2 LEU 57 1HB LEU 57 11.855 6.344 1.435 265 HB3 LEU 57 2HB LEU 57 10.403 7.316 1.275 266 HG LEU 57 HG LEU 57 12.249 6.681 -1.028 267 HD11 LEU 57 1HD1 LEU 57 9.646 5.363 -0.272 268 HD12 LEU 57 2HD1 LEU 57 11.245 4.634 -0.117 269 HD13 LEU 57 3HD1 LEU 57 10.608 5.031 -1.712 270 HD21 LEU 57 1HD2 LEU 57 10.935 8.681 -1.373 271 HD22 LEU 57 2HD2 LEU 57 9.466 7.831 -0.894 272 HD23 LEU 57 3HD2 LEU 57 10.305 7.376 -2.377 273 H ASP 58 H ASP 58 14.056 8.477 2.865 274 HA ASP 58 HA ASP 58 12.668 8.323 5.249 275 HB2 ASP 58 1HB ASP 58 15.362 9.387 4.528 276 HB3 ASP 58 2HB ASP 58 14.753 9.644 6.158 277 H THR 59 H THR 59 13.369 11.108 3.298 278 HA THR 59 HA THR 59 12.525 12.984 5.323 279 HB THR 59 HB THR 59 12.894 14.699 3.576 280 HG1 THR 59 HG1 THR 59 12.414 12.876 1.865 281 HG21 THR 59 1HG2 THR 59 14.762 13.943 4.971 282 HG22 THR 59 2HG2 THR 59 15.306 14.366 3.350 283 HG23 THR 59 3HG2 THR 59 15.122 12.672 3.804 284 H CYS 60 H CYS 60 10.895 10.965 3.279 285 HA CYS 60 HA CYS 60 8.842 12.851 2.465 286 HB2 CYS 60 1HB CYS 60 8.965 9.872 1.968 287 HB3 CYS 60 2HB CYS 60 7.987 11.053 1.105 288 H ASP 61 H ASP 61 8.331 13.229 4.788 289 HA ASP 61 HA ASP 61 6.679 11.078 5.951 290 HB2 ASP 61 1HB ASP 61 8.783 12.197 7.134 291 HB3 ASP 61 2HB ASP 61 7.592 13.425 7.561 292 H GLY 62 H GLY 62 4.677 11.665 6.954 293 HA2 GLY 62 1HA GLY 62 3.245 13.618 5.404 294 HA3 GLY 62 2HA GLY 62 2.580 12.589 6.665 295 H GLY 63 H GLY 63 4.229 15.589 5.982 296 HA2 GLY 63 1HA GLY 63 3.320 17.499 7.317 297 HA3 GLY 63 2HA GLY 63 3.607 16.487 8.728 298 H SER 64 H SER 64 5.976 16.218 6.271 299 HA SER 64 HA SER 64 7.627 18.347 7.336 300 HB2 SER 64 1HB SER 64 8.502 15.453 7.487 301 HB3 SER 64 2HB SER 64 9.485 16.855 7.909 302 HG SER 64 HG SER 64 7.190 17.029 9.235 303 H ASN 65 H ASN 65 9.600 18.659 6.093 304 HA ASN 65 HA ASN 65 10.680 19.018 4.139 305 HB2 ASN 65 1HB ASN 65 10.038 16.091 3.882 306 HB3 ASN 65 2HB ASN 65 10.961 16.948 2.653 307 HD21 ASN 65 1HD2 ASN 65 10.986 15.706 5.909 308 HD22 ASN 65 2HD2 ASN 65 12.685 15.931 6.186 309 H GLY 66 H GLY 66 8.044 19.882 4.109 310 HA2 GLY 66 1HA GLY 66 6.874 21.012 2.446 311 HA3 GLY 66 2HA GLY 66 7.707 20.047 1.238 312 H ILE 67 H ILE 67 6.831 17.597 2.919 313 HA ILE 67 HA ILE 67 4.347 17.240 1.488 314 HB ILE 67 HB ILE 67 5.822 15.328 3.303 315 HG12 ILE 67 1HG1 ILE 67 5.713 15.597 0.292 316 HG13 ILE 67 2HG1 ILE 67 7.126 15.823 1.322 317 HG21 ILE 67 1HG2 ILE 67 3.446 14.813 3.204 318 HG22 ILE 67 2HG2 ILE 67 4.373 13.604 2.315 319 HG23 ILE 67 3HG2 ILE 67 3.493 14.858 1.441 320 HD11 ILE 67 1HD1 ILE 67 7.232 13.699 0.187 321 HD12 ILE 67 2HD1 ILE 67 5.662 13.240 0.846 322 HD13 ILE 67 3HD1 ILE 67 7.041 13.451 1.922 323 HA PRO 68 HA PRO 68 2.159 18.589 5.124 324 HB2 PRO 68 1HB PRO 68 -0.330 18.126 3.768 325 HB3 PRO 68 2HB PRO 68 0.464 19.664 4.097 326 HG2 PRO 68 1HG PRO 68 0.137 18.576 1.588 327 HG3 PRO 68 2HG PRO 68 1.368 19.780 2.021 328 HD2 PRO 68 1HD PRO 68 1.633 16.821 1.673 329 HD3 PRO 68 2HD PRO 68 2.781 18.122 1.270 330 H SER 69 H SER 69 0.831 17.717 6.722 331 HA SER 69 HA SER 69 0.791 15.000 7.186 332 HB2 SER 69 1HB SER 69 -1.166 17.085 8.181 333 HB3 SER 69 2HB SER 69 -0.907 15.498 8.905 334 HG SER 69 HG SER 69 1.456 16.428 8.826 335 HA PRO 70 HA PRO 70 -2.013 13.354 4.288 336 HB2 PRO 70 1HB PRO 70 -2.813 11.120 5.659 337 HB3 PRO 70 2HB PRO 70 -1.262 11.268 4.826 338 HG2 PRO 70 1HG PRO 70 -1.897 11.631 7.728 339 HG3 PRO 70 2HG PRO 70 -0.519 10.804 6.978 340 HD2 PRO 70 1HD PRO 70 -0.284 13.280 7.983 341 HD3 PRO 70 2HD PRO 70 0.585 12.788 6.516 342 H THR 71 H THR 71 -4.188 12.918 3.874 343 HA THR 71 HA THR 71 -6.038 14.071 5.856 344 HB THR 71 HB THR 71 -7.424 14.694 3.812 345 HG1 THR 71 HG1 THR 71 -4.954 14.357 2.435 346 HG21 THR 71 1HG2 THR 71 -4.708 15.964 4.163 347 HG22 THR 71 2HG2 THR 71 -6.178 16.375 5.045 348 HG23 THR 71 3HG2 THR 71 -6.069 16.698 3.316 349 H THR 72 H THR 72 -8.279 13.325 5.670 350 HA THR 72 HA THR 72 -8.403 10.516 4.803 351 HB THR 72 HB THR 72 -10.446 10.494 6.411 352 HG1 THR 72 HG1 THR 72 -10.518 12.697 6.902 353 HG21 THR 72 1HG2 THR 72 -7.611 10.623 7.435 354 HG22 THR 72 2HG2 THR 72 -8.439 9.197 6.812 355 HG23 THR 72 3HG2 THR 72 -8.973 9.938 8.320 356 H THR 73 H THR 73 -9.626 10.132 3.101 357 HA THR 73 HA THR 73 -11.651 12.025 2.272 358 HB THR 73 HB THR 73 -11.920 10.377 0.341 359 HG1 THR 73 HG1 THR 73 -10.831 8.580 0.454 360 HG21 THR 73 1HG2 THR 73 -9.839 11.107 -0.761 361 HG22 THR 73 2HG2 THR 73 -9.222 11.651 0.799 362 HG23 THR 73 3HG2 THR 73 -10.639 12.427 0.089 363 H ARG 74 H ARG 74 -13.703 10.666 1.321 364 HA ARG 74 HA ARG 74 -15.224 10.273 3.590 365 HB2 ARG 74 1HB ARG 74 -16.371 10.843 1.634 366 HB3 ARG 74 2HB ARG 74 -15.650 9.532 0.717 367 HG2 ARG 74 1HG ARG 74 -16.991 7.912 1.830 368 HG3 ARG 74 2HG ARG 74 -17.591 9.115 2.970 369 HD2 ARG 74 1HD ARG 74 -19.222 8.582 1.186 370 HD3 ARG 74 2HD ARG 74 -18.749 10.278 1.195 371 HE ARG 74 HE ARG 74 -17.070 9.344 -0.618 372 HH11 ARG 74 1HH1 ARG 74 -20.477 8.635 -0.200 373 HH12 ARG 74 2HH1 ARG 74 -20.759 8.379 -1.892 374 HH21 ARG 74 1HH2 ARG 74 -17.447 9.025 -2.849 375 HH22 ARG 74 2HH2 ARG 74 -19.041 8.607 -3.397 376 H TYR 75 H TYR 75 -13.720 7.739 1.555 377 HA TYR 75 HA TYR 75 -14.800 5.748 3.398 378 HB2 TYR 75 1HB TYR 75 -13.530 5.488 0.680 379 HB3 TYR 75 2HB TYR 75 -13.936 4.103 1.693 380 HD1 TYR 75 HD1 TYR 75 -16.352 3.778 2.367 381 HD2 TYR 75 HD2 TYR 75 -15.164 6.501 -0.674 382 HE1 TYR 75 HE1 TYR 75 -18.645 3.781 1.484 383 HE2 TYR 75 HE2 TYR 75 -17.455 6.515 -1.566 384 HH TYR 75 HH TYR 75 -20.097 5.283 0.137 385 H VAL 76 H VAL 76 -12.282 7.584 3.715 386 HA VAL 76 HA VAL 76 -10.466 5.404 4.507 387 HB VAL 76 HB VAL 76 -9.922 8.375 4.305 388 HG11 VAL 76 1HG1 VAL 76 -8.676 7.279 6.143 389 HG12 VAL 76 2HG1 VAL 76 -7.621 7.857 4.852 390 HG13 VAL 76 3HG1 VAL 76 -8.007 6.140 4.975 391 HG21 VAL 76 1HG2 VAL 76 -8.903 6.063 2.662 392 HG22 VAL 76 2HG2 VAL 76 -8.423 7.749 2.478 393 HG23 VAL 76 3HG2 VAL 76 -10.083 7.261 2.136 394 H SER 77 H SER 77 -10.223 4.911 6.590 395 HA SER 77 HA SER 77 -11.747 6.466 8.525 396 HB2 SER 77 1HB SER 77 -12.048 3.997 8.432 397 HB3 SER 77 2HB SER 77 -10.352 3.798 8.882 398 HG SER 77 HG SER 77 -12.224 5.242 10.452 399 H ALA 78 H ALA 78 -8.444 5.342 7.940 400 HA ALA 78 HA ALA 78 -7.407 7.558 9.472 401 HB1 ALA 78 1HB ALA 78 -6.661 4.756 10.293 402 HB2 ALA 78 2HB ALA 78 -7.793 5.776 11.174 403 HB3 ALA 78 3HB ALA 78 -6.106 6.260 11.018 404 H MET 79 H MET 79 -5.017 7.673 9.276 405 HA MET 79 HA MET 79 -3.758 6.138 7.234 406 HB2 MET 79 1HB MET 79 -3.349 8.281 5.813 407 HB3 MET 79 2HB MET 79 -4.822 7.353 5.595 408 HG2 MET 79 1HG MET 79 -5.287 9.722 5.568 409 HG3 MET 79 2HG MET 79 -6.055 8.962 6.956 410 HE1 MET 79 1HE MET 79 -5.272 9.319 9.461 411 HE2 MET 79 2HE MET 79 -6.324 10.605 8.877 412 HE3 MET 79 3HE MET 79 -4.908 10.999 9.846 413 H SER 80 H SER 80 -1.570 6.684 6.897 414 HA SER 80 HA SER 80 -0.378 8.845 8.401 415 HB2 SER 80 1HB SER 80 1.152 7.368 9.687 416 HB3 SER 80 2HB SER 80 -0.535 7.139 10.146 417 HG SER 80 HG SER 80 -0.026 5.115 9.808 418 H VAL 81 H VAL 81 1.565 9.475 7.591 419 HA VAL 81 HA VAL 81 2.779 7.794 5.494 420 HB VAL 81 HB VAL 81 2.792 10.820 5.546 421 HG11 VAL 81 1HG1 VAL 81 4.717 9.881 4.420 422 HG12 VAL 81 2HG1 VAL 81 3.624 10.609 3.243 423 HG13 VAL 81 3HG1 VAL 81 3.671 8.856 3.435 424 HG21 VAL 81 1HG2 VAL 81 0.530 9.993 5.140 425 HG22 VAL 81 2HG2 VAL 81 1.132 8.998 3.817 426 HG23 VAL 81 3HG2 VAL 81 1.209 10.756 3.704 427 H ALA 82 H ALA 82 4.791 7.158 6.043 428 HA ALA 82 HA ALA 82 6.470 8.960 7.607 429 HB1 ALA 82 1HB ALA 82 7.104 7.174 9.158 430 HB2 ALA 82 2HB ALA 82 5.925 6.100 8.405 431 HB3 ALA 82 3HB ALA 82 5.381 7.539 9.270 432 H LYS 83 H LYS 83 8.038 9.200 6.297 433 HA LYS 83 HA LYS 83 9.808 8.843 4.835 434 HB2 LYS 83 1HB LYS 83 9.840 6.112 6.146 435 HB3 LYS 83 2HB LYS 83 11.140 6.809 5.193 436 HG2 LYS 83 1HG LYS 83 11.517 8.510 6.855 437 HG3 LYS 83 2HG LYS 83 10.113 7.962 7.777 438 HD2 LYS 83 1HD LYS 83 11.192 5.801 8.142 439 HD3 LYS 83 2HD LYS 83 12.584 6.331 7.198 440 HE2 LYS 83 1HE LYS 83 11.631 7.705 9.700 441 HE3 LYS 83 2HE LYS 83 12.877 6.459 9.683 442 HZ1 LYS 83 1HZ LYS 83 12.989 9.104 8.343 443 HZ2 LYS 83 2HZ LYS 83 14.152 7.888 8.141 444 HZ3 LYS 83 3HZ LYS 83 13.912 8.593 9.664 445 H GLY 84 H GLY 84 7.304 8.505 3.729 446 HA2 GLY 84 1HA GLY 84 6.473 7.801 1.678 447 HA3 GLY 84 2HA GLY 84 7.813 6.667 1.554 448 H VAL 85 H VAL 85 7.116 5.637 4.297 449 HA VAL 85 HA VAL 85 5.385 3.524 3.500 450 HB VAL 85 HB VAL 85 6.173 4.284 6.318 451 HG11 VAL 85 1HG1 VAL 85 4.316 2.730 6.259 452 HG12 VAL 85 2HG1 VAL 85 5.775 1.906 6.808 453 HG13 VAL 85 3HG1 VAL 85 5.203 1.679 5.156 454 HG21 VAL 85 1HG2 VAL 85 7.974 2.619 6.055 455 HG22 VAL 85 2HG2 VAL 85 8.163 3.997 4.973 456 HG23 VAL 85 3HG2 VAL 85 7.555 2.465 4.350 457 H VAL 86 H VAL 86 3.175 3.213 3.854 458 HA VAL 86 HA VAL 86 1.789 5.392 5.197 459 HB VAL 86 HB VAL 86 0.113 5.509 3.360 460 HG11 VAL 86 1HG1 VAL 86 2.928 6.237 2.560 461 HG12 VAL 86 2HG1 VAL 86 1.868 7.195 3.592 462 HG13 VAL 86 3HG1 VAL 86 1.448 6.934 1.901 463 HG21 VAL 86 1HG2 VAL 86 0.677 4.681 1.150 464 HG22 VAL 86 2HG2 VAL 86 0.613 3.350 2.304 465 HG23 VAL 86 3HG2 VAL 86 2.172 3.983 1.772 466 H SER 87 H SER 87 0.585 4.507 6.667 467 HA SER 87 HA SER 87 -0.640 1.889 6.182 468 HB2 SER 87 1HB SER 87 -0.542 3.467 8.767 469 HB3 SER 87 2HB SER 87 -1.011 1.778 8.579 470 HG SER 87 HG SER 87 1.545 2.771 7.856 471 H LEU 88 H LEU 88 -2.666 1.726 5.584 472 HA LEU 88 HA LEU 88 -4.479 4.021 6.006 473 HB2 LEU 88 1HB LEU 88 -4.619 1.949 3.801 474 HB3 LEU 88 2HB LEU 88 -5.691 3.317 4.005 475 HG LEU 88 HG LEU 88 -4.289 3.888 2.221 476 HD11 LEU 88 1HD1 LEU 88 -3.021 5.797 2.970 477 HD12 LEU 88 2HD1 LEU 88 -3.039 5.193 4.625 478 HD13 LEU 88 3HD1 LEU 88 -4.544 5.692 3.851 479 HD21 LEU 88 1HD2 LEU 88 -1.896 3.062 3.852 480 HD22 LEU 88 2HD2 LEU 88 -1.877 3.698 2.208 481 HD23 LEU 88 3HD2 LEU 88 -2.616 2.130 2.540 482 H THR 89 H THR 89 -5.877 3.526 7.593 483 HA THR 89 HA THR 89 -6.685 0.712 7.876 484 HB THR 89 HB THR 89 -6.861 2.919 9.938 485 HG1 THR 89 HG1 THR 89 -4.709 2.444 9.647 486 HG21 THR 89 1HG2 THR 89 -7.249 -0.070 10.173 487 HG22 THR 89 2HG2 THR 89 -8.501 1.162 10.329 488 HG23 THR 89 3HG2 THR 89 -7.211 1.061 11.525 489 H GLY 90 H GLY 90 -8.867 0.199 8.233 490 HA2 GLY 90 1HA GLY 90 -11.092 0.283 7.635 491 HA3 GLY 90 2HA GLY 90 -11.033 1.924 8.252 492 H GLN 91 H GLN 91 -9.582 0.367 5.427 493 HA GLN 91 HA GLN 91 -10.287 2.693 3.832 494 HB2 GLN 91 1HB GLN 91 -8.008 1.581 3.830 495 HB3 GLN 91 2HB GLN 91 -8.757 0.231 2.990 496 HG2 GLN 91 1HG GLN 91 -7.583 1.740 1.473 497 HG3 GLN 91 2HG GLN 91 -9.311 1.650 1.124 498 HE21 GLN 91 1HE2 GLN 91 -10.561 3.461 1.328 499 HE22 GLN 91 2HE2 GLN 91 -9.923 5.018 1.700 500 H GLU 92 H GLU 92 -12.024 2.742 2.536 501 HA GLU 92 HA GLU 92 -13.872 2.112 1.370 502 HB2 GLU 92 1HB GLU 92 -12.192 -0.308 0.700 503 HB3 GLU 92 2HB GLU 92 -13.626 0.218 -0.169 504 HG2 GLU 92 1HG GLU 92 -10.945 1.535 -0.038 505 HG3 GLU 92 2HG GLU 92 -11.806 0.929 -1.447 506 H SER 93 H SER 93 -14.487 -0.826 0.893 507 HA SER 93 HA SER 93 -16.228 -1.325 3.045 508 HB2 SER 93 1HB SER 93 -15.124 -3.368 1.111 509 HB3 SER 93 2HB SER 93 -16.675 -3.414 1.955 510 HG SER 93 HG SER 93 -17.064 -1.339 0.763 511 H LEU 94 H LEU 94 -12.912 -1.627 2.902 512 HA LEU 94 HA LEU 94 -12.606 -4.108 4.337 513 HB2 LEU 94 1HB LEU 94 -10.516 -2.034 3.674 514 HB3 LEU 94 2HB LEU 94 -10.237 -3.702 4.150 515 HG LEU 94 HG LEU 94 -11.606 -2.876 1.586 516 HD11 LEU 94 1HD1 LEU 94 -8.750 -3.671 2.109 517 HD12 LEU 94 2HD1 LEU 94 -9.333 -2.120 1.506 518 HD13 LEU 94 3HD1 LEU 94 -9.484 -3.567 0.509 519 HD21 LEU 94 1HD2 LEU 94 -11.201 -5.203 0.925 520 HD22 LEU 94 2HD2 LEU 94 -12.243 -5.093 2.341 521 HD23 LEU 94 3HD2 LEU 94 -10.547 -5.539 2.526 522 H ASN 95 H ASN 95 -14.157 -2.269 5.756 523 HA ASN 95 HA ASN 95 -12.814 -0.717 7.638 524 HB2 ASN 95 1HB ASN 95 -14.840 -0.903 9.013 525 HB3 ASN 95 2HB ASN 95 -15.248 -0.628 7.324 526 HD21 ASN 95 1HD2 ASN 95 -15.367 -2.836 9.979 527 HD22 ASN 95 2HD2 ASN 95 -16.409 -3.996 9.234 528 H GLY 96 H GLY 96 -11.961 -1.113 9.647 529 HA2 GLY 96 1HA GLY 96 -11.033 -2.370 11.370 530 HA3 GLY 96 2HA GLY 96 -11.775 -3.806 10.678 531 H LEU 97 H LEU 97 -10.467 -2.893 8.032 532 HA LEU 97 HA LEU 97 -8.079 -4.491 8.466 533 HB2 LEU 97 1HB LEU 97 -9.621 -5.012 6.629 534 HB3 LEU 97 2HB LEU 97 -9.370 -3.413 5.960 535 HG LEU 97 HG LEU 97 -7.021 -5.250 6.248 536 HD11 LEU 97 1HD1 LEU 97 -8.748 -6.607 5.184 537 HD12 LEU 97 2HD1 LEU 97 -7.504 -6.155 4.022 538 HD13 LEU 97 3HD1 LEU 97 -9.055 -5.321 4.020 539 HD21 LEU 97 1HD2 LEU 97 -7.800 -3.166 4.206 540 HD22 LEU 97 2HD2 LEU 97 -6.271 -4.044 4.269 541 HD23 LEU 97 3HD2 LEU 97 -6.693 -2.914 5.555 542 H SER 98 H SER 98 -6.023 -3.764 8.258 543 HA SER 98 HA SER 98 -5.665 -0.921 7.582 544 HB2 SER 98 1HB SER 98 -5.239 -1.544 10.006 545 HB3 SER 98 2HB SER 98 -3.893 -2.529 9.432 546 HG SER 98 HG SER 98 -4.207 0.275 9.373 547 H VAL 99 H VAL 99 -4.534 -0.590 5.801 548 HA VAL 99 HA VAL 99 -2.869 -2.747 4.714 549 HB VAL 99 HB VAL 99 -3.530 -0.090 3.429 550 HG11 VAL 99 1HG1 VAL 99 -2.538 -2.677 2.247 551 HG12 VAL 99 2HG1 VAL 99 -1.586 -1.213 2.500 552 HG13 VAL 99 3HG1 VAL 99 -2.922 -1.208 1.349 553 HG21 VAL 99 1HG2 VAL 99 -5.609 -1.276 3.864 554 HG22 VAL 99 2HG2 VAL 99 -4.962 -2.718 3.081 555 HG23 VAL 99 3HG2 VAL 99 -5.246 -1.255 2.139 556 H VAL 100 H VAL 100 -0.651 -2.643 4.893 557 HA VAL 100 HA VAL 100 0.458 -0.039 5.693 558 HB VAL 100 HB VAL 100 1.596 -2.766 6.339 559 HG11 VAL 100 1HG1 VAL 100 3.114 -1.531 7.806 560 HG12 VAL 100 2HG1 VAL 100 2.393 -0.011 7.280 561 HG13 VAL 100 3HG1 VAL 100 3.281 -1.010 6.129 562 HG21 VAL 100 1HG2 VAL 100 0.120 -0.834 8.127 563 HG22 VAL 100 2HG2 VAL 100 0.934 -2.307 8.658 564 HG23 VAL 100 3HG2 VAL 100 -0.462 -2.410 7.586 565 H MET 101 H MET 101 1.188 0.775 3.843 566 HA MET 101 HA MET 101 2.561 -1.017 1.967 567 HB2 MET 101 1HB MET 101 0.702 0.516 1.181 568 HB3 MET 101 2HB MET 101 1.788 1.862 1.493 569 HG2 MET 101 1HG MET 101 3.344 1.070 -0.133 570 HG3 MET 101 2HG MET 101 2.425 -0.412 -0.360 571 HE1 MET 101 1HE MET 101 -0.076 -0.430 -1.363 572 HE2 MET 101 2HE MET 101 -0.868 0.998 -2.029 573 HE3 MET 101 3HE MET 101 -0.600 0.870 -0.292 574 H THR 102 H THR 102 4.638 -1.212 2.278 575 HA THR 102 HA THR 102 6.177 1.084 3.284 576 HB THR 102 HB THR 102 6.899 -1.846 3.453 577 HG1 THR 102 HG1 THR 102 6.059 -0.245 5.636 578 HG21 THR 102 1HG2 THR 102 8.054 0.558 4.870 579 HG22 THR 102 2HG2 THR 102 8.811 -0.295 3.526 580 HG23 THR 102 3HG2 THR 102 8.570 -1.117 5.067 581 HA PRO 103 HA PRO 103 7.928 0.710 -0.951 582 HB2 PRO 103 1HB PRO 103 9.054 3.214 -0.822 583 HB3 PRO 103 2HB PRO 103 7.425 2.889 -1.433 584 HG2 PRO 103 1HG PRO 103 8.277 3.876 1.262 585 HG3 PRO 103 2HG PRO 103 6.884 4.362 0.273 586 HD2 PRO 103 1HD PRO 103 6.658 2.695 2.381 587 HD3 PRO 103 2HD PRO 103 5.620 2.543 0.945 588 H GLY 104 H GLY 104 9.840 -0.205 -1.235 589 HA2 GLY 104 1HA GLY 104 11.709 -0.281 0.975 590 HA3 GLY 104 2HA GLY 104 11.808 -1.215 -0.509 591 H TRP 105 H TRP 105 11.755 0.787 -2.400 592 HA TRP 105 HA TRP 105 13.223 2.034 -3.608 593 HB2 TRP 105 1HB TRP 105 12.600 3.636 -1.680 594 HB3 TRP 105 2HB TRP 105 14.178 3.237 -1.010 595 HD1 TRP 105 HD1 TRP 105 16.244 4.479 -1.997 596 HE1 TRP 105 HE1 TRP 105 16.558 6.276 -3.811 597 HE3 TRP 105 HE3 TRP 105 11.555 4.404 -4.035 598 HZ2 TRP 105 HZ2 TRP 105 15.023 7.502 -5.833 599 HZ3 TRP 105 HZ3 TRP 105 11.063 5.924 -5.905 600 HH2 TRP 105 HH2 TRP 105 12.759 7.440 -6.786 601 H ASP 106 H ASP 106 13.969 -0.548 -2.527 602 HA ASP 106 HA ASP 106 16.846 -0.275 -2.032 603 HB2 ASP 106 1HB ASP 106 15.336 -1.631 -0.487 604 HB3 ASP 106 2HB ASP 106 15.183 -2.784 -1.806 605 H ASN 107 H ASN 107 17.367 0.188 -4.201 606 HA ASN 107 HA ASN 107 16.634 -1.423 -6.390 607 HB2 ASN 107 1HB ASN 107 18.858 0.559 -5.956 608 HB3 ASN 107 2HB ASN 107 18.678 -0.310 -7.476 609 HD21 ASN 107 1HD2 ASN 107 18.253 1.542 -8.637 610 HD22 ASN 107 2HD2 ASN 107 16.764 2.407 -8.500 611 H ALA 108 H ALA 108 19.047 -1.796 -3.955 612 HA ALA 108 HA ALA 108 20.832 -3.466 -5.393 613 HB1 ALA 108 1HB ALA 108 21.497 -2.266 -3.370 614 HB2 ALA 108 2HB ALA 108 21.782 -4.000 -3.213 615 HB3 ALA 108 3HB ALA 108 20.394 -3.257 -2.417 616 H ASN 109 H ASN 109 18.079 -4.093 -3.263 617 HA ASN 109 HA ASN 109 18.284 -6.966 -3.783 618 HB2 ASN 109 1HB ASN 109 16.555 -5.313 -1.942 619 HB3 ASN 109 2HB ASN 109 16.276 -7.034 -2.193 620 HD21 ASN 109 1HD2 ASN 109 17.080 -5.516 0.197 621 HD22 ASN 109 2HD2 ASN 109 18.549 -6.243 0.742 622 H GLY 110 H GLY 110 17.083 -4.430 -5.356 623 HA2 GLY 110 1HA GLY 110 15.692 -4.300 -7.206 624 HA3 GLY 110 2HA GLY 110 15.332 -6.006 -6.996 625 H VAL 111 H VAL 111 14.849 -4.289 -4.153 626 HA VAL 111 HA VAL 111 11.950 -4.362 -4.577 627 HB VAL 111 HB VAL 111 13.428 -4.099 -1.953 628 HG11 VAL 111 1HG1 VAL 111 11.156 -3.262 -1.856 629 HG12 VAL 111 2HG1 VAL 111 11.269 -4.788 -0.981 630 HG13 VAL 111 3HG1 VAL 111 10.550 -4.745 -2.592 631 HG21 VAL 111 1HG2 VAL 111 13.977 -6.224 -3.004 632 HG22 VAL 111 2HG2 VAL 111 12.264 -6.560 -3.250 633 HG23 VAL 111 3HG2 VAL 111 12.918 -6.473 -1.616 634 H THR 112 H THR 112 12.457 -2.340 -5.893 635 HA THR 112 HA THR 112 12.885 0.032 -4.265 636 HB THR 112 HB THR 112 13.935 -0.314 -6.580 637 HG1 THR 112 HG1 THR 112 14.215 1.739 -6.228 638 HG21 THR 112 1HG2 THR 112 11.156 0.487 -7.459 639 HG22 THR 112 2HG2 THR 112 11.913 -1.081 -7.739 640 HG23 THR 112 3HG2 THR 112 12.577 0.366 -8.497 641 H GLY 113 H GLY 113 10.358 -1.898 -5.267 642 HA2 GLY 113 1HA GLY 113 8.389 0.204 -5.576 643 HA3 GLY 113 2HA GLY 113 8.102 -1.526 -5.683 644 H TRP 114 H TRP 114 6.323 -1.529 -4.342 645 HA TRP 114 HA TRP 114 6.732 -0.557 -1.600 646 HB2 TRP 114 1HB TRP 114 4.159 -0.860 -3.157 647 HB3 TRP 114 2HB TRP 114 4.278 -0.313 -1.488 648 HD1 TRP 114 HD1 TRP 114 4.894 2.205 -1.077 649 HE1 TRP 114 HE1 TRP 114 5.157 4.243 -2.634 650 HE3 TRP 114 HE3 TRP 114 5.008 -0.219 -5.573 651 HZ2 TRP 114 HZ2 TRP 114 5.388 4.746 -5.393 652 HZ3 TRP 114 HZ3 TRP 114 5.251 1.114 -7.624 653 HH2 TRP 114 HH2 TRP 114 5.437 3.546 -7.534 654 H ALA 115 H ALA 115 6.570 -1.958 0.050 655 HA ALA 115 HA ALA 115 5.612 -4.661 -0.448 656 HB1 ALA 115 1HB ALA 115 6.657 -3.400 2.089 657 HB2 ALA 115 2HB ALA 115 7.612 -4.343 0.948 658 HB3 ALA 115 3HB ALA 115 6.304 -5.110 1.850 659 H ARG 116 H ARG 116 3.540 -5.165 -0.170 660 HA ARG 116 HA ARG 116 1.891 -3.288 1.382 661 HB2 ARG 116 1HB ARG 116 1.144 -5.069 -0.929 662 HB3 ARG 116 2HB ARG 116 -0.045 -4.280 0.094 663 HG2 ARG 116 1HG ARG 116 0.099 -2.869 -1.725 664 HG3 ARG 116 2HG ARG 116 1.167 -2.100 -0.552 665 HD2 ARG 116 1HD ARG 116 3.041 -2.570 -1.752 666 HD3 ARG 116 2HD ARG 116 2.379 -4.071 -2.401 667 HE ARG 116 HE ARG 116 1.018 -1.809 -3.450 668 HH11 ARG 116 1HH1 ARG 116 4.036 -3.530 -3.676 669 HH12 ARG 116 2HH1 ARG 116 4.245 -3.236 -5.381 670 HH21 ARG 116 1HH2 ARG 116 1.296 -1.365 -5.700 671 HH22 ARG 116 2HH2 ARG 116 2.702 -1.970 -6.512 672 H ASN 117 H ASN 117 0.626 -3.987 2.982 673 HA ASN 117 HA ASN 117 0.159 -6.847 3.298 674 HB2 ASN 117 1HB ASN 117 2.086 -6.424 4.740 675 HB3 ASN 117 2HB ASN 117 1.252 -5.069 5.492 676 HD21 ASN 117 1HD2 ASN 117 1.277 -8.550 5.118 677 HD22 ASN 117 2HD2 ASN 117 0.317 -8.898 6.513 678 H CYS 118 H CYS 118 -1.937 -7.162 3.608 679 HA CYS 118 HA CYS 118 -3.529 -4.930 4.663 680 HB2 CYS 118 1HB CYS 118 -4.430 -7.406 3.166 681 HB3 CYS 118 2HB CYS 118 -5.457 -6.059 3.659 682 H ASN 119 H ASN 119 -3.986 -5.070 6.767 683 HA ASN 119 HA ASN 119 -3.963 -7.747 7.993 684 HB2 ASN 119 1HB ASN 119 -2.220 -6.172 8.787 685 HB3 ASN 119 2HB ASN 119 -3.489 -5.070 9.316 686 HD21 ASN 119 1HD2 ASN 119 -2.881 -5.169 11.462 687 HD22 ASN 119 2HD2 ASN 119 -3.136 -6.573 12.440 688 H ILE 120 H ILE 120 -5.974 -8.449 8.104 689 HA ILE 120 HA ILE 120 -7.862 -6.860 9.668 690 HB ILE 120 HB ILE 120 -8.618 -6.579 7.420 691 HG12 ILE 120 1HG1 ILE 120 -10.815 -7.804 7.447 692 HG13 ILE 120 2HG1 ILE 120 -10.244 -8.656 8.873 693 HG21 ILE 120 1HG2 ILE 120 -9.134 -8.483 5.945 694 HG22 ILE 120 2HG2 ILE 120 -8.410 -9.563 7.135 695 HG23 ILE 120 3HG2 ILE 120 -7.419 -8.343 6.333 696 HD11 ILE 120 1HD1 ILE 120 -11.704 -6.805 9.454 697 HD12 ILE 120 2HD1 ILE 120 -10.622 -5.684 8.627 698 HD13 ILE 120 3HD1 ILE 120 -10.073 -6.538 10.067 699 H GLN 121 H GLN 121 -8.039 -8.007 11.518 700 HA GLN 121 HA GLN 121 -7.100 -10.704 11.572 701 HB2 GLN 121 1HB GLN 121 -7.477 -10.566 14.008 702 HB3 GLN 121 2HB GLN 121 -6.513 -9.241 13.381 703 HG2 GLN 121 1HG GLN 121 -8.521 -7.807 13.423 704 HG3 GLN 121 2HG GLN 121 -9.423 -9.139 14.143 705 HE21 GLN 121 1HE2 GLN 121 -7.126 -10.021 15.742 706 HE22 GLN 121 2HE2 GLN 121 -6.980 -8.877 17.027 707 H SER 122 H SER 122 -10.331 -9.255 11.873 708 HA SER 122 HA SER 122 -11.392 -11.908 12.507 709 HB2 SER 122 1HB SER 122 -12.710 -9.190 12.581 710 HB3 SER 122 2HB SER 122 -13.500 -10.702 13.027 711 HG SER 122 HG SER 122 -11.961 -9.146 14.533 712 H ASP 123 H ASP 123 -10.756 -10.375 9.701 713 HA ASP 123 HA ASP 123 -12.943 -11.735 8.341 714 HB2 ASP 123 1HB ASP 123 -12.455 -8.768 8.088 715 HB3 ASP 123 2HB ASP 123 -13.356 -9.694 6.897 716 H SER 124 H SER 124 -11.024 -13.050 7.818 717 HA SER 124 HA SER 124 -8.868 -12.123 6.300 718 HB2 SER 124 1HB SER 124 -10.148 -14.864 6.184 719 HB3 SER 124 2HB SER 124 -8.496 -14.456 5.714 720 HG SER 124 HG SER 124 -8.609 -15.327 7.838 721 H ALA 125 H ALA 125 -12.152 -12.639 5.366 722 HA ALA 125 HA ALA 125 -11.850 -12.977 2.594 723 HB1 ALA 125 1HB ALA 125 -14.148 -12.180 2.424 724 HB2 ALA 125 2HB ALA 125 -14.075 -11.588 4.083 725 HB3 ALA 125 3HB ALA 125 -13.975 -13.319 3.758 726 H LEU 126 H LEU 126 -11.973 -10.081 4.609 727 HA LEU 126 HA LEU 126 -11.993 -8.227 2.472 728 HB2 LEU 126 1HB LEU 126 -11.069 -7.900 5.326 729 HB3 LEU 126 2HB LEU 126 -11.295 -6.582 4.195 730 HG LEU 126 HG LEU 126 -13.464 -8.403 5.246 731 HD11 LEU 126 1HD1 LEU 126 -12.664 -6.839 6.922 732 HD12 LEU 126 2HD1 LEU 126 -14.275 -6.383 6.370 733 HD13 LEU 126 3HD1 LEU 126 -12.862 -5.502 5.791 734 HD21 LEU 126 1HD2 LEU 126 -13.917 -7.696 2.951 735 HD22 LEU 126 2HD2 LEU 126 -13.659 -6.015 3.416 736 HD23 LEU 126 3HD2 LEU 126 -15.014 -6.918 4.090 737 H GLN 127 H GLN 127 -9.476 -9.895 4.237 738 HA GLN 127 HA GLN 127 -7.258 -8.434 3.327 739 HB2 GLN 127 1HB GLN 127 -7.018 -10.056 5.115 740 HB3 GLN 127 2HB GLN 127 -7.500 -11.361 4.040 741 HG2 GLN 127 1HG GLN 127 -5.490 -10.964 2.685 742 HG3 GLN 127 2HG GLN 127 -4.998 -9.701 3.812 743 HE21 GLN 127 1HE2 GLN 127 -6.534 -12.683 4.792 744 HE22 GLN 127 2HE2 GLN 127 -5.160 -13.357 5.590 745 H GLN 128 H GLN 128 -8.891 -11.268 2.020 746 HA GLN 128 HA GLN 128 -7.152 -11.726 -0.133 747 HB2 GLN 128 1HB GLN 128 -10.054 -12.444 0.283 748 HB3 GLN 128 2HB GLN 128 -9.072 -13.060 -1.043 749 HG2 GLN 128 1HG GLN 128 -7.642 -14.228 0.439 750 HG3 GLN 128 2HG GLN 128 -8.323 -13.410 1.843 751 HE21 GLN 128 1HE2 GLN 128 -10.306 -14.052 2.632 752 HE22 GLN 128 2HE2 GLN 128 -11.055 -15.545 2.178 753 H ALA 129 H ALA 129 -9.981 -9.673 0.198 754 HA ALA 129 HA ALA 129 -10.102 -8.959 -2.562 755 HB1 ALA 129 1HB ALA 129 -11.235 -7.566 -0.142 756 HB2 ALA 129 2HB ALA 129 -12.068 -8.750 -1.150 757 HB3 ALA 129 3HB ALA 129 -11.621 -7.178 -1.818 758 H CYS 130 H CYS 130 -8.674 -7.555 0.332 759 HA CYS 130 HA CYS 130 -7.800 -5.138 -0.826 760 HB2 CYS 130 1HB CYS 130 -7.987 -5.433 1.588 761 HB3 CYS 130 2HB CYS 130 -6.724 -6.662 1.557 762 H GLU 131 H GLU 131 -6.048 -8.158 -0.144 763 HA GLU 131 HA GLU 131 -3.586 -7.334 -1.212 764 HB2 GLU 131 1HB GLU 131 -2.952 -9.674 -1.176 765 HB3 GLU 131 2HB GLU 131 -3.828 -9.261 0.293 766 HG2 GLU 131 1HG GLU 131 -5.838 -10.286 -0.582 767 HG3 GLU 131 2HG GLU 131 -5.008 -10.660 -2.096 768 H ASP 132 H ASP 132 -6.466 -8.443 -2.756 769 HA ASP 132 HA ASP 132 -5.348 -9.353 -5.182 770 HB2 ASP 132 1HB ASP 132 -7.708 -9.745 -4.438 771 HB3 ASP 132 2HB ASP 132 -8.051 -8.053 -4.769 772 H VAL 133 H VAL 133 -6.685 -6.169 -4.279 773 HA VAL 133 HA VAL 133 -5.784 -4.988 -6.769 774 HB VAL 133 HB VAL 133 -7.092 -3.745 -4.344 775 HG11 VAL 133 1HG1 VAL 133 -7.417 -1.761 -5.715 776 HG12 VAL 133 2HG1 VAL 133 -6.527 -2.513 -7.038 777 HG13 VAL 133 3HG1 VAL 133 -5.700 -2.115 -5.533 778 HG21 VAL 133 1HG2 VAL 133 -8.171 -4.459 -7.064 779 HG22 VAL 133 2HG2 VAL 133 -9.055 -3.587 -5.812 780 HG23 VAL 133 3HG2 VAL 133 -8.554 -5.258 -5.538 781 H PHE 134 H PHE 134 -5.038 -4.684 -3.341 782 HA PHE 134 HA PHE 134 -2.866 -2.840 -3.787 783 HB2 PHE 134 1HB PHE 134 -3.962 -4.120 -1.280 784 HB3 PHE 134 2HB PHE 134 -2.576 -3.038 -1.287 785 HD1 PHE 134 HD1 PHE 134 -6.197 -3.283 -1.605 786 HD2 PHE 134 HD2 PHE 134 -2.843 -0.669 -1.817 787 HE1 PHE 134 HE1 PHE 134 -7.708 -1.344 -1.503 788 HE2 PHE 134 HE2 PHE 134 -4.347 1.276 -1.709 789 HZ PHE 134 HZ PHE 134 -6.782 0.941 -1.557 790 H ARG 135 H ARG 135 -2.686 -5.450 -4.968 791 HA ARG 135 HA ARG 135 -1.400 -7.412 -3.505 792 HB2 ARG 135 1HB ARG 135 -0.625 -8.249 -5.740 793 HB3 ARG 135 2HB ARG 135 -2.349 -7.915 -5.640 794 HG2 ARG 135 1HG ARG 135 -2.112 -5.898 -6.874 795 HG3 ARG 135 2HG ARG 135 -0.351 -5.984 -6.784 796 HD2 ARG 135 1HD ARG 135 -2.116 -7.981 -8.197 797 HD3 ARG 135 2HD ARG 135 -1.235 -6.674 -8.983 798 HE ARG 135 HE ARG 135 0.038 -8.929 -7.568 799 HH11 ARG 135 1HH1 ARG 135 0.069 -6.461 -10.068 800 HH12 ARG 135 2HH1 ARG 135 1.562 -7.014 -10.757 801 HH21 ARG 135 1HH2 ARG 135 1.995 -9.632 -8.460 802 HH22 ARG 135 2HH2 ARG 135 2.659 -8.822 -9.846 803 H PHE 136 H PHE 136 0.675 -8.066 -3.294 804 HA PHE 136 HA PHE 136 2.651 -5.929 -3.255 805 HB2 PHE 136 1HB PHE 136 3.914 -8.011 -2.078 806 HB3 PHE 136 2HB PHE 136 2.867 -6.891 -1.208 807 HD1 PHE 136 HD1 PHE 136 0.849 -7.627 -0.212 808 HD2 PHE 136 HD2 PHE 136 2.987 -10.218 -2.832 809 HE1 PHE 136 HE1 PHE 136 -0.594 -9.501 0.467 810 HE2 PHE 136 HE2 PHE 136 1.547 -12.094 -2.151 811 HZ PHE 136 HZ PHE 136 -0.243 -11.735 -0.501 812 H ASP 137 H ASP 137 4.332 -5.836 -4.595 813 HA ASP 137 HA ASP 137 4.552 -7.480 -6.849 814 HB2 ASP 137 1HB ASP 137 6.569 -5.612 -5.585 815 HB3 ASP 137 2HB ASP 137 6.828 -6.424 -7.123 816 H ASP 138 H ASP 138 5.664 -9.261 -7.290 817 HA ASP 138 HA ASP 138 6.464 -10.940 -5.151 818 HB2 ASP 138 1HB ASP 138 6.884 -11.286 -8.130 819 HB3 ASP 138 2HB ASP 138 7.087 -12.547 -6.919 820 H ALA 139 H ALA 139 8.041 -8.400 -6.415 821 HA ALA 139 HA ALA 139 10.690 -9.456 -6.662 822 HB1 ALA 139 1HB ALA 139 9.753 -6.603 -6.366 823 HB2 ALA 139 2HB ALA 139 10.019 -7.455 -7.887 824 HB3 ALA 139 3HB ALA 139 11.380 -7.111 -6.820 825 H ASN 140 H ASN 140 8.694 -8.409 -4.076 826 HA ASN 140 HA ASN 140 10.992 -8.131 -2.266 827 HB2 ASN 140 1HB ASN 140 9.215 -6.352 -2.284 828 HB3 ASN 140 2HB ASN 140 8.067 -7.557 -1.711 829 HD21 ASN 140 1HD2 ASN 140 7.649 -6.564 0.222 830 HD22 ASN 140 2HD2 ASN 140 8.806 -6.430 1.497 831 H LEU 141 H LEU 141 9.481 -10.604 -3.445 832 HA LEU 141 HA LEU 141 9.214 -11.998 -0.871 833 HB2 LEU 141 1HB LEU 141 7.516 -12.437 -3.328 834 HB3 LEU 141 2HB LEU 141 7.408 -13.348 -1.836 835 HG LEU 141 HG LEU 141 6.793 -10.402 -2.107 836 HD11 LEU 141 1HD1 LEU 141 4.973 -12.796 -1.904 837 HD12 LEU 141 2HD1 LEU 141 5.156 -11.722 -3.292 838 HD13 LEU 141 3HD1 LEU 141 4.457 -11.115 -1.792 839 HD21 LEU 141 1HD2 LEU 141 5.830 -10.654 0.139 840 HD22 LEU 141 2HD2 LEU 141 7.564 -10.976 0.126 841 HD23 LEU 141 3HD2 LEU 141 6.418 -12.315 0.197 842 H VAL 142 H VAL 142 11.346 -12.824 -1.086 843 HA VAL 142 HA VAL 142 12.055 -14.503 -3.255 844 HB VAL 142 HB VAL 142 13.814 -13.608 -1.864 845 HG11 VAL 142 1HG1 VAL 142 12.591 -15.173 0.403 846 HG12 VAL 142 2HG1 VAL 142 12.679 -13.418 0.259 847 HG13 VAL 142 3HG1 VAL 142 14.155 -14.361 0.462 848 HG21 VAL 142 1HG2 VAL 142 15.098 -15.629 -1.409 849 HG22 VAL 142 2HG2 VAL 142 14.227 -15.761 -2.937 850 HG23 VAL 142 3HG2 VAL 142 13.626 -16.594 -1.503 851 HA PRO 143 HA PRO 143 9.222 -17.674 -2.013 852 HB2 PRO 143 1HB PRO 143 9.535 -19.290 -4.146 853 HB3 PRO 143 2HB PRO 143 8.661 -17.761 -4.246 854 HG2 PRO 143 1HG PRO 143 11.434 -18.420 -5.120 855 HG3 PRO 143 2HG PRO 143 10.232 -17.373 -5.894 856 HD2 PRO 143 1HD PRO 143 12.341 -16.475 -4.345 857 HD3 PRO 143 2HD PRO 143 10.852 -15.562 -4.651 858 H ARG 144 H ARG 144 9.498 -19.324 -0.676 859 HA ARG 144 HA ARG 144 12.022 -20.831 -0.787 860 HB2 ARG 144 1HB ARG 144 11.443 -19.694 1.367 861 HB3 ARG 144 2HB ARG 144 10.005 -20.697 1.469 862 HG2 ARG 144 1HG ARG 144 11.379 -22.693 1.614 863 HG3 ARG 144 2HG ARG 144 12.839 -21.711 1.451 864 HD2 ARG 144 1HD ARG 144 12.196 -20.496 3.508 865 HD3 ARG 144 2HD ARG 144 10.819 -21.581 3.686 866 HE ARG 144 HE ARG 144 12.943 -23.266 3.546 867 HH11 ARG 144 1HH1 ARG 144 12.163 -20.498 5.539 868 HH12 ARG 144 2HH1 ARG 144 13.087 -21.049 6.897 869 HH21 ARG 144 1HH2 ARG 144 14.156 -24.003 5.348 870 HH22 ARG 144 2HH2 ARG 144 14.211 -23.044 6.792 871 H GLY 145 H GLY 145 11.639 -22.422 -2.250 872 HA2 GLY 145 1HA GLY 145 10.743 -24.411 -3.045 873 HA3 GLY 145 2HA GLY 145 9.583 -24.381 -1.720 874 H SER 146 H SER 146 8.641 -25.121 -4.157 875 HA SER 146 HA SER 146 7.275 -22.712 -5.161 876 HB2 SER 146 1HB SER 146 7.526 -25.421 -6.496 877 HB3 SER 146 2HB SER 146 6.855 -23.954 -7.209 878 HG SER 146 HG SER 146 9.229 -23.278 -6.364 879 H GLY 147 H GLY 147 4.960 -22.833 -5.535 880 HA2 GLY 147 1HA GLY 147 2.901 -24.099 -5.452 881 HA3 GLY 147 2HA GLY 147 3.641 -25.131 -4.239 882 H LEU 148 H LEU 148 3.768 -21.612 -4.241 883 HA LEU 148 HA LEU 148 2.632 -21.614 -1.577 884 HB2 LEU 148 1HB LEU 148 3.877 -19.476 -3.291 885 HB3 LEU 148 2HB LEU 148 3.049 -19.085 -1.798 886 HG LEU 148 HG LEU 148 5.397 -19.149 -1.358 887 HD11 LEU 148 1HD1 LEU 148 3.934 -20.080 0.375 888 HD12 LEU 148 2HD1 LEU 148 5.535 -20.821 0.386 889 HD13 LEU 148 3HD1 LEU 148 4.166 -21.690 -0.305 890 HD21 LEU 148 1HD2 LEU 148 6.120 -20.491 -3.252 891 HD22 LEU 148 2HD2 LEU 148 5.401 -21.928 -2.525 892 HD23 LEU 148 3HD2 LEU 148 6.769 -21.136 -1.743 893 H GLU 149 H GLU 149 0.506 -22.162 -1.921 894 HA GLU 149 HA GLU 149 -1.122 -20.363 -3.556 895 HB2 GLU 149 1HB GLU 149 -1.675 -23.039 -2.280 896 HB3 GLU 149 2HB GLU 149 -2.952 -22.053 -2.977 897 HG2 GLU 149 1HG GLU 149 -0.534 -23.034 -4.481 898 HG3 GLU 149 2HG GLU 149 -2.117 -23.813 -4.491 899 H HIS 150 H HIS 150 -0.166 -20.857 -0.368 900 HA HIS 150 HA HIS 150 -2.172 -18.922 0.534 901 HB2 HIS 150 1HB HIS 150 -2.777 -21.253 1.289 902 HB3 HIS 150 2HB HIS 150 -1.270 -21.288 2.196 903 HD1 HIS 150 HD1 HIS 150 -4.714 -19.896 2.244 904 HD2 HIS 150 HD2 HIS 150 -1.240 -19.667 4.515 905 HE1 HIS 150 HE1 HIS 150 -5.393 -18.826 4.414 906 HE2 HIS 150 HE2 HIS 150 -3.300 -18.801 5.815 907 H HIS 151 H HIS 151 -1.261 -17.229 1.571 908 HA HIS 151 HA HIS 151 1.592 -17.477 2.242 909 HB2 HIS 151 1HB HIS 151 1.709 -15.006 1.886 910 HB3 HIS 151 2HB HIS 151 1.313 -15.912 0.433 911 HD1 HIS 151 HD1 HIS 151 -0.289 -13.642 3.004 912 HD2 HIS 151 HD2 HIS 151 -1.077 -15.239 -0.752 913 HE1 HIS 151 HE1 HIS 151 -2.323 -12.435 2.172 914 HE2 HIS 151 HE2 HIS 151 -2.753 -13.365 -0.132 915 H HIS 152 H HIS 152 2.364 -16.384 4.111 916 HA HIS 152 HA HIS 152 0.283 -15.551 6.011 917 HB2 HIS 152 1HB HIS 152 1.473 -16.665 7.850 918 HB3 HIS 152 2HB HIS 152 0.955 -17.821 6.633 919 HD1 HIS 152 HD1 HIS 152 2.734 -19.255 5.565 920 HD2 HIS 152 HD2 HIS 152 4.315 -16.191 7.892 921 HE1 HIS 152 HE1 HIS 152 5.195 -19.733 5.737 922 HE2 HIS 152 HE2 HIS 152 6.150 -17.812 7.049 923 H HIS 153 H HIS 153 2.227 -14.177 4.222 924 HA HIS 153 HA HIS 153 4.240 -12.992 5.832 925 HB2 HIS 153 1HB HIS 153 4.395 -13.054 3.374 926 HB3 HIS 153 2HB HIS 153 3.001 -11.985 3.258 927 HD1 HIS 153 HD1 HIS 153 3.413 -9.502 3.505 928 HD2 HIS 153 HD2 HIS 153 6.767 -11.799 4.366 929 HE1 HIS 153 HE1 HIS 153 5.318 -7.871 3.699 930 HE2 HIS 153 HE2 HIS 153 7.360 -9.303 4.061 931 H HIS 154 H HIS 154 3.848 -11.727 7.498 932 HA HIS 154 HA HIS 154 1.611 -9.818 7.315 933 HB2 HIS 154 1HB HIS 154 1.498 -9.827 9.755 934 HB3 HIS 154 2HB HIS 154 1.315 -11.464 9.136 935 HD1 HIS 154 HD1 HIS 154 3.764 -9.262 10.989 936 HD2 HIS 154 HD2 HIS 154 3.251 -13.264 9.955 937 HE1 HIS 154 HE1 HIS 154 5.477 -10.533 12.315 938 HE2 HIS 154 HE2 HIS 154 5.015 -12.956 11.819 939 H HIS 155 H HIS 155 2.035 -7.829 8.745 940 HA HIS 155 HA HIS 155 4.863 -7.055 8.493 941 HB2 HIS 155 1HB HIS 155 3.184 -5.705 7.158 942 HB3 HIS 155 2HB HIS 155 2.500 -5.174 8.691 943 HD1 HIS 155 HD1 HIS 155 5.319 -4.584 6.361 944 HD2 HIS 155 HD2 HIS 155 4.200 -3.435 10.201 945 HE1 HIS 155 HE1 HIS 155 6.817 -2.656 6.958 946 HE2 HIS 155 HE2 HIS 155 6.162 -2.010 9.300
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