NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
561633 | 2luy | 18546 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H MET 31 HT1 MET 31 2.171 28.274 -6.047 2 HA MET 31 HA MET 31 4.304 27.142 -6.114 3 HB2 MET 31 HB2 MET 31 4.261 26.379 -3.660 4 HB3 MET 31 HB1 MET 31 3.745 28.038 -3.980 5 HG2 MET 31 HG2 MET 31 1.742 25.779 -3.907 6 HG3 MET 31 HG1 MET 31 2.256 26.590 -2.427 7 HE1 MET 31 HE1 MET 31 -1.367 27.750 -3.985 8 HE2 MET 31 HE2 MET 31 -0.641 26.665 -2.801 9 HE3 MET 31 HE3 MET 31 -0.489 26.311 -4.521 10 H GLY 32 HN GLY 32 1.996 25.310 -7.179 11 HA2 GLY 32 HA2 GLY 32 3.100 23.066 -7.923 12 HA3 GLY 32 HA1 GLY 32 2.974 22.702 -6.203 13 H LYS 33 HN LYS 33 0.646 24.548 -8.119 14 HA LYS 33 HA LYS 33 -1.585 23.137 -7.124 15 HB2 LYS 33 HB2 LYS 33 -1.678 25.431 -8.084 16 HB3 LYS 33 HB1 LYS 33 -1.398 24.742 -9.684 17 HG2 LYS 33 HG2 LYS 33 -3.450 23.415 -9.503 18 HG3 LYS 33 HG1 LYS 33 -3.722 24.026 -7.870 19 HD2 LYS 33 HD2 LYS 33 -3.878 26.326 -8.761 20 HD3 LYS 33 HD1 LYS 33 -3.628 25.706 -10.393 21 HE2 LYS 33 HE2 LYS 33 -5.673 24.342 -10.194 22 HE3 LYS 33 HE1 LYS 33 -5.924 24.956 -8.560 23 HZ1 LYS 33 HZ1 LYS 33 -5.712 26.719 -10.931 24 HZ2 LYS 33 HZ2 LYS 33 -6.250 27.130 -9.373 25 HZ3 LYS 33 HZ3 LYS 33 -7.193 26.119 -10.361 26 H ASN 34 HN ASN 34 0.170 22.888 -10.207 27 HA ASN 34 HA ASN 34 -0.478 20.100 -10.453 28 HB2 ASN 34 HB2 ASN 34 -1.736 20.289 -12.566 29 HB3 ASN 34 HB1 ASN 34 -2.604 21.038 -11.223 30 HD21 ASN 34 HD21 ASN 34 -3.647 22.209 -13.212 31 HD22 ASN 34 HD22 ASN 34 -2.888 23.638 -13.725 32 H ASP 35 HN ASP 35 1.425 22.715 -10.989 33 HA ASP 35 HA ASP 35 2.639 21.840 -13.493 34 HB2 ASP 35 HB2 ASP 35 4.211 23.744 -13.041 35 HB3 ASP 35 HB1 ASP 35 2.513 24.217 -13.142 36 H ASN 36 HN ASN 36 2.749 20.701 -10.443 37 HA ASN 36 HA ASN 36 5.642 20.297 -10.260 38 HB2 ASN 36 HB2 ASN 36 5.116 19.172 -8.142 39 HB3 ASN 36 HB1 ASN 36 4.377 20.773 -8.212 40 HD21 ASN 36 HD21 ASN 36 3.587 18.039 -6.872 41 HD22 ASN 36 HD22 ASN 36 1.950 17.879 -7.291 42 H ASP 37 HN ASP 37 3.379 18.977 -12.130 43 HA ASP 37 HA ASP 37 4.044 16.161 -11.695 44 HB2 ASP 37 HB2 ASP 37 2.215 17.524 -13.682 45 HB3 ASP 37 HB1 ASP 37 2.447 15.780 -13.571 46 H ALA 38 HN ALA 38 5.774 18.502 -12.884 47 HA ALA 38 HA ALA 38 6.414 17.750 -15.545 48 HB1 ALA 38 HB1 ALA 38 7.976 19.253 -13.442 49 HB2 ALA 38 HB2 ALA 38 7.067 19.927 -14.795 50 HB3 ALA 38 HB3 ALA 38 8.550 19.019 -15.093 51 H LEU 39 HN LEU 39 7.863 16.310 -16.364 52 HA LEU 39 HA LEU 39 9.370 14.638 -14.434 53 HB2 LEU 39 HB2 LEU 39 8.067 13.769 -17.011 54 HB3 LEU 39 HB1 LEU 39 9.009 12.751 -15.933 55 HG LEU 39 HG LEU 39 6.728 14.237 -14.682 56 HD11 LEU 39 HD11 LEU 39 6.397 11.924 -16.602 57 HD12 LEU 39 HD12 LEU 39 5.579 13.486 -16.635 58 HD13 LEU 39 HD13 LEU 39 5.199 12.319 -15.368 59 HD21 LEU 39 HD21 LEU 39 8.107 12.808 -13.305 60 HD22 LEU 39 HD22 LEU 39 7.894 11.447 -14.407 61 HD23 LEU 39 HD23 LEU 39 6.525 12.053 -13.473 62 H ILE 40 HN ILE 40 11.465 14.933 -14.652 63 HA ILE 40 HA ILE 40 12.542 15.873 -17.227 64 HB ILE 40 HB ILE 40 14.065 15.534 -14.643 65 HG12 ILE 40 HG12 ILE 40 12.139 16.898 -14.117 66 HG13 ILE 40 HG11 ILE 40 13.542 17.959 -14.260 67 HG21 ILE 40 HG21 ILE 40 15.351 17.454 -15.675 68 HG22 ILE 40 HG22 ILE 40 14.410 17.215 -17.142 69 HG23 ILE 40 HG23 ILE 40 15.472 15.934 -16.558 70 HD11 ILE 40 HD11 ILE 40 11.827 19.058 -15.483 71 HD12 ILE 40 HD12 ILE 40 11.283 17.556 -16.225 72 HD13 ILE 40 HD13 ILE 40 12.812 18.278 -16.720 73 H MET 41 HN MET 41 13.611 14.611 -18.555 74 HA MET 41 HA MET 41 13.978 11.808 -17.955 75 HB2 MET 41 HB2 MET 41 13.321 12.556 -20.214 76 HB3 MET 41 HB1 MET 41 14.853 13.415 -20.370 77 HG2 MET 41 HG2 MET 41 16.099 11.331 -20.187 78 HG3 MET 41 HG1 MET 41 14.613 10.434 -19.867 79 HE1 MET 41 HE1 MET 41 14.812 8.702 -21.832 80 HE2 MET 41 HE2 MET 41 16.439 9.378 -21.825 81 HE3 MET 41 HE3 MET 41 15.592 9.156 -23.355 82 H CYS 42 HN CYS 42 15.793 10.778 -17.355 83 HA CYS 42 HA CYS 42 18.157 12.406 -16.738 84 HB2 CYS 42 HB2 CYS 42 17.461 10.979 -14.942 85 HB3 CYS 42 HB1 CYS 42 17.327 9.585 -16.018 86 H MET 43 HN MET 43 20.059 12.234 -17.839 87 HA MET 43 HA MET 43 20.031 10.643 -20.308 88 HB2 MET 43 HB2 MET 43 22.331 11.843 -20.574 89 HB3 MET 43 HB1 MET 43 20.858 12.807 -20.690 90 HG2 MET 43 HG2 MET 43 21.085 13.573 -18.416 91 HG3 MET 43 HG1 MET 43 22.414 12.448 -18.114 92 HE1 MET 43 HE1 MET 43 24.131 14.206 -17.282 93 HE2 MET 43 HE2 MET 43 22.705 15.241 -17.278 94 HE3 MET 43 HE3 MET 43 24.215 15.836 -17.963 95 H ARG 44 HN ARG 44 20.969 10.164 -17.149 96 HA ARG 44 HA ARG 44 23.357 8.609 -17.717 97 HB2 ARG 44 HB2 ARG 44 22.985 9.973 -15.599 98 HB3 ARG 44 HB1 ARG 44 21.834 8.728 -15.120 99 HG2 ARG 44 HG2 ARG 44 23.757 7.880 -14.134 100 HG3 ARG 44 HG1 ARG 44 23.841 7.082 -15.704 101 HD2 ARG 44 HD2 ARG 44 25.276 8.983 -16.515 102 HD3 ARG 44 HD1 ARG 44 25.282 9.610 -14.870 103 HE ARG 44 HE ARG 44 26.106 6.937 -14.768 104 HH11 ARG 44 HH21 ARG 44 27.093 9.993 -16.056 105 HH12 ARG 44 HH22 ARG 44 28.786 9.640 -15.965 106 HH21 ARG 44 HH11 ARG 44 28.321 6.466 -14.647 107 HH22 ARG 44 HH12 ARG 44 29.481 7.642 -15.166 108 H CYS 45 HN CYS 45 20.234 7.852 -16.147 109 HA CYS 45 HA CYS 45 20.552 5.048 -17.053 110 HB2 CYS 45 HB2 CYS 45 19.018 4.470 -15.246 111 HB3 CYS 45 HB1 CYS 45 20.385 5.387 -14.614 112 H ARG 46 HN ARG 46 19.405 7.506 -18.495 113 HA ARG 46 HA ARG 46 17.516 8.063 -19.731 114 HB2 ARG 46 HB2 ARG 46 17.751 5.086 -20.133 115 HB3 ARG 46 HB1 ARG 46 16.726 6.143 -21.110 116 HG2 ARG 46 HG2 ARG 46 18.738 7.504 -21.686 117 HG3 ARG 46 HG1 ARG 46 19.735 6.357 -20.790 118 HD2 ARG 46 HD2 ARG 46 17.933 5.568 -23.085 119 HD3 ARG 46 HD1 ARG 46 19.643 5.943 -23.276 120 HE ARG 46 HE ARG 46 19.375 3.996 -21.253 121 HH11 ARG 46 HH21 ARG 46 18.923 4.421 -24.659 122 HH12 ARG 46 HH22 ARG 46 19.243 2.764 -25.048 123 HH21 ARG 46 HH11 ARG 46 19.796 1.822 -21.757 124 HH22 ARG 46 HH12 ARG 46 19.737 1.292 -23.405 125 H LYS 47 HN LYS 47 16.913 7.699 -16.954 126 HA LYS 47 HA LYS 47 14.242 6.412 -17.048 127 HB2 LYS 47 HB2 LYS 47 15.955 5.672 -15.324 128 HB3 LYS 47 HB1 LYS 47 15.757 7.259 -14.578 129 HG2 LYS 47 HG2 LYS 47 13.285 6.827 -14.468 130 HG3 LYS 47 HG1 LYS 47 13.595 5.183 -15.027 131 HD2 LYS 47 HD2 LYS 47 14.864 6.395 -12.555 132 HD3 LYS 47 HD1 LYS 47 13.418 5.388 -12.523 133 HE2 LYS 47 HE2 LYS 47 14.842 3.645 -13.812 134 HE3 LYS 47 HE1 LYS 47 16.228 4.609 -13.300 135 HZ1 LYS 47 HZ1 LYS 47 14.210 3.337 -11.544 136 HZ2 LYS 47 HZ2 LYS 47 15.435 4.383 -11.003 137 HZ3 LYS 47 HZ3 LYS 47 15.838 2.894 -11.712 138 H VAL 48 HN VAL 48 12.447 7.601 -16.779 139 HA VAL 48 HA VAL 48 12.795 10.511 -16.431 140 HB VAL 48 HB VAL 48 10.203 9.216 -17.237 141 HG11 VAL 48 HG11 VAL 48 9.727 11.314 -18.130 142 HG12 VAL 48 HG12 VAL 48 11.421 11.682 -18.454 143 HG13 VAL 48 HG13 VAL 48 10.800 11.779 -16.813 144 HG21 VAL 48 HG21 VAL 48 11.678 8.086 -18.717 145 HG22 VAL 48 HG22 VAL 48 12.686 9.516 -18.930 146 HG23 VAL 48 HG23 VAL 48 11.072 9.464 -19.636 147 H LYS 49 HN LYS 49 12.134 11.496 -14.644 148 HA LYS 49 HA LYS 49 10.097 10.280 -12.926 149 HB2 LYS 49 HB2 LYS 49 12.929 10.865 -12.104 150 HB3 LYS 49 HB1 LYS 49 11.612 10.775 -10.937 151 HG2 LYS 49 HG2 LYS 49 12.240 8.546 -12.895 152 HG3 LYS 49 HG1 LYS 49 12.909 8.610 -11.269 153 HD2 LYS 49 HD2 LYS 49 10.397 8.876 -10.522 154 HD3 LYS 49 HD1 LYS 49 10.039 8.216 -12.116 155 HE2 LYS 49 HE2 LYS 49 10.151 6.439 -10.443 156 HE3 LYS 49 HE1 LYS 49 11.437 6.265 -11.638 157 HZ1 LYS 49 HZ1 LYS 49 12.262 7.933 -9.498 158 HZ2 LYS 49 HZ2 LYS 49 12.963 6.494 -10.068 159 HZ3 LYS 49 HZ3 LYS 49 11.727 6.438 -8.904 160 H GLY 50 HN GLY 50 9.596 11.779 -11.052 161 HA2 GLY 50 HA2 GLY 50 9.315 14.495 -12.139 162 HA3 GLY 50 HA1 GLY 50 8.377 13.795 -10.823 163 H ILE 51 HN ILE 51 9.067 16.100 -10.074 164 HA ILE 51 HA ILE 51 11.662 16.691 -9.255 165 HB ILE 51 HB ILE 51 9.711 18.252 -9.184 166 HG12 ILE 51 HG12 ILE 51 11.026 18.030 -6.465 167 HG13 ILE 51 HG11 ILE 51 11.906 18.579 -7.893 168 HG21 ILE 51 HG21 ILE 51 8.121 18.141 -7.410 169 HG22 ILE 51 HG22 ILE 51 9.050 16.908 -6.557 170 HG23 ILE 51 HG23 ILE 51 8.221 16.506 -8.061 171 HD11 ILE 51 HD11 ILE 51 10.923 20.433 -6.511 172 HD12 ILE 51 HD12 ILE 51 9.323 19.813 -6.921 173 HD13 ILE 51 HD13 ILE 51 10.384 20.427 -8.189 174 H ASP 52 HN ASP 52 9.823 14.078 -8.255 175 HA ASP 52 HA ASP 52 10.594 13.954 -5.504 176 HB2 ASP 52 HB2 ASP 52 9.472 11.927 -7.443 177 HB3 ASP 52 HB1 ASP 52 9.832 11.546 -5.759 178 H SER 53 HN SER 53 11.569 12.123 -8.381 179 HA SER 53 HA SER 53 13.931 11.082 -6.995 180 HB2 SER 53 HB2 SER 53 12.367 9.962 -8.890 181 HB3 SER 53 HB1 SER 53 13.643 10.617 -9.911 182 HG SER 53 HG SER 53 13.694 8.460 -8.374 183 H TYR 54 HN TYR 54 13.334 13.990 -8.106 184 HA TYR 54 HA TYR 54 16.051 14.367 -9.253 185 HB2 TYR 54 HB2 TYR 54 13.385 15.337 -10.171 186 HB3 TYR 54 HB1 TYR 54 14.687 16.529 -10.226 187 HD1 TYR 54 HD2 TYR 54 13.711 13.107 -11.352 188 HD2 TYR 54 HD1 TYR 54 16.379 16.420 -11.876 189 HE1 TYR 54 HE2 TYR 54 14.596 12.063 -13.410 190 HE2 TYR 54 HE1 TYR 54 17.271 15.375 -13.918 191 HH TYR 54 HH TYR 54 16.962 13.754 -15.440 192 H SER 55 HN SER 55 17.336 15.649 -8.150 193 HA SER 55 HA SER 55 16.633 16.798 -5.693 194 HB2 SER 55 HB2 SER 55 18.943 16.274 -6.212 195 HB3 SER 55 HB1 SER 55 18.934 17.407 -7.565 196 HG SER 55 HG SER 55 18.232 18.281 -4.988 197 H LYS 56 HN LYS 56 16.277 18.944 -5.079 198 HA LYS 56 HA LYS 56 14.618 20.478 -6.742 199 HB2 LYS 56 HB2 LYS 56 16.176 21.217 -4.259 200 HB3 LYS 56 HB1 LYS 56 15.015 22.295 -5.033 201 HG2 LYS 56 HG2 LYS 56 13.247 20.595 -4.757 202 HG3 LYS 56 HG1 LYS 56 14.407 19.515 -3.982 203 HD2 LYS 56 HD2 LYS 56 14.784 21.223 -2.215 204 HD3 LYS 56 HD1 LYS 56 13.557 22.245 -2.969 205 HE2 LYS 56 HE2 LYS 56 13.043 19.422 -1.991 206 HE3 LYS 56 HE1 LYS 56 12.677 20.874 -1.057 207 HZ1 LYS 56 HZ1 LYS 56 10.763 20.027 -2.323 208 HZ2 LYS 56 HZ2 LYS 56 11.611 20.303 -3.769 209 HZ3 LYS 56 HZ3 LYS 56 11.189 21.608 -2.767 210 H THR 57 HN THR 57 18.080 20.722 -6.045 211 HA THR 57 HA THR 57 18.540 23.151 -7.419 212 HB THR 57 HB THR 57 20.920 22.364 -7.483 213 HG1 THR 57 HG1 THR 57 19.655 20.021 -7.091 214 HG21 THR 57 HG21 THR 57 19.429 22.039 -4.864 215 HG22 THR 57 HG22 THR 57 20.051 23.551 -5.525 216 HG23 THR 57 HG23 THR 57 21.169 22.286 -5.014 217 H GLN 58 HN GLN 58 18.821 19.752 -8.458 218 HA GLN 58 HA GLN 58 19.670 20.347 -11.101 219 HB2 GLN 58 HB2 GLN 58 18.360 17.895 -9.912 220 HB3 GLN 58 HB1 GLN 58 18.991 17.978 -11.555 221 HG2 GLN 58 HG2 GLN 58 21.227 18.501 -10.699 222 HG3 GLN 58 HG1 GLN 58 20.612 18.499 -9.048 223 HE21 GLN 58 HE21 GLN 58 22.209 16.562 -11.262 224 HE22 GLN 58 HE22 GLN 58 21.798 15.039 -10.625 225 H TRP 59 HN TRP 59 16.489 19.693 -9.664 226 HA TRP 59 HA TRP 59 15.016 19.669 -12.059 227 HB2 TRP 59 HB2 TRP 59 14.110 18.840 -9.932 228 HB3 TRP 59 HB1 TRP 59 14.138 20.480 -9.273 229 HD1 TRP 59 HD1 TRP 59 12.504 18.475 -12.138 230 HE1 TRP 59 HE1 TRP 59 10.234 19.569 -12.698 231 HE3 TRP 59 HE3 TRP 59 12.686 22.526 -9.031 232 HZ2 TRP 59 HZ2 TRP 59 8.705 21.859 -11.931 233 HZ3 TRP 59 HZ3 TRP 59 10.810 24.144 -8.964 234 HH2 TRP 59 HH2 TRP 59 8.821 23.815 -10.408 235 H SER 60 HN SER 60 16.047 22.281 -9.929 236 HA SER 60 HA SER 60 14.466 24.350 -11.004 237 HB2 SER 60 HB2 SER 60 17.150 24.359 -9.624 238 HB3 SER 60 HB1 SER 60 16.335 25.838 -10.124 239 HG SER 60 HG SER 60 15.400 25.605 -8.243 240 H LYS 61 HN LYS 61 17.437 22.865 -12.100 241 HA LYS 61 HA LYS 61 18.267 24.878 -13.912 242 HB2 LYS 61 HB2 LYS 61 18.753 21.891 -13.934 243 HB3 LYS 61 HB1 LYS 61 19.584 23.049 -14.970 244 HG2 LYS 61 HG2 LYS 61 20.463 24.217 -13.003 245 HG3 LYS 61 HG1 LYS 61 19.594 23.111 -11.942 246 HD2 LYS 61 HD2 LYS 61 20.874 21.211 -12.919 247 HD3 LYS 61 HD1 LYS 61 21.792 22.365 -13.888 248 HE2 LYS 61 HE2 LYS 61 22.589 23.467 -11.844 249 HE3 LYS 61 HE1 LYS 61 21.645 22.345 -10.864 250 HZ1 LYS 61 HZ1 LYS 61 23.346 20.943 -10.942 251 HZ2 LYS 61 HZ2 LYS 61 24.216 21.983 -11.965 252 HZ3 LYS 61 HZ3 LYS 61 23.166 20.821 -12.624 253 H THR 62 HN THR 62 15.547 22.961 -13.927 254 HA THR 62 HA THR 62 15.312 22.389 -16.715 255 HB THR 62 HB THR 62 12.930 21.959 -16.199 256 HG1 THR 62 HG1 THR 62 13.705 23.290 -13.871 257 HG21 THR 62 HG21 THR 62 15.092 20.856 -14.410 258 HG22 THR 62 HG22 THR 62 14.306 20.095 -15.794 259 HG23 THR 62 HG23 THR 62 13.426 20.292 -14.279 260 H PHE 63 HN PHE 63 14.914 25.224 -14.850 261 HA PHE 63 HA PHE 63 13.969 26.695 -17.201 262 HB2 PHE 63 HB2 PHE 63 12.350 27.948 -15.757 263 HB3 PHE 63 HB1 PHE 63 11.908 26.263 -16.030 264 HD1 PHE 63 HD2 PHE 63 13.508 28.588 -13.598 265 HD2 PHE 63 HD1 PHE 63 11.744 24.726 -14.229 266 HE1 PHE 63 HE2 PHE 63 13.517 28.184 -11.151 267 HE2 PHE 63 HE1 PHE 63 11.758 24.316 -11.788 268 HZ PHE 63 HZ PHE 63 12.641 26.048 -10.243 269 H THR 64 HN THR 64 14.441 28.919 -17.150 270 HA THR 64 HA THR 64 16.372 29.754 -15.054 271 HB THR 64 HB THR 64 17.557 30.995 -16.901 272 HG1 THR 64 HG1 THR 64 17.106 30.400 -18.982 273 HG21 THR 64 HG21 THR 64 18.586 28.849 -17.846 274 HG22 THR 64 HG22 THR 64 17.412 27.984 -16.854 275 HG23 THR 64 HG23 THR 64 18.608 29.031 -16.093 276 H PHE 65 HN PHE 65 16.733 32.199 -15.207 277 HA PHE 65 HA PHE 65 14.073 33.477 -15.413 278 HB2 PHE 65 HB2 PHE 65 15.959 33.454 -13.341 279 HB3 PHE 65 HB1 PHE 65 16.173 35.040 -14.072 280 HD1 PHE 65 HD2 PHE 65 13.304 32.746 -13.282 281 HD2 PHE 65 HD1 PHE 65 14.886 36.737 -13.109 282 HE1 PHE 65 HE2 PHE 65 11.224 33.522 -12.184 283 HE2 PHE 65 HE1 PHE 65 12.807 37.509 -12.007 284 HZ PHE 65 HZ PHE 65 10.978 35.908 -11.553 285 H VAL 66 HN VAL 66 13.710 34.791 -17.033 286 HA VAL 66 HA VAL 66 15.976 36.282 -18.229 287 HB VAL 66 HB VAL 66 13.786 34.767 -19.658 288 HG11 VAL 66 HG11 VAL 66 15.689 36.914 -20.612 289 HG12 VAL 66 HG12 VAL 66 13.938 36.839 -20.820 290 HG13 VAL 66 HG13 VAL 66 14.981 35.737 -21.719 291 HG21 VAL 66 HG21 VAL 66 16.811 34.670 -19.885 292 HG22 VAL 66 HG22 VAL 66 15.663 33.614 -20.707 293 HG23 VAL 66 HG23 VAL 66 15.847 33.524 -18.956 294 H ARG 67 HN ARG 67 15.616 38.387 -18.554 295 HA ARG 67 HA ARG 67 14.581 40.431 -18.279 296 HB2 ARG 67 HB2 ARG 67 12.554 38.852 -19.875 297 HB3 ARG 67 HB1 ARG 67 12.407 40.587 -19.572 298 HG2 ARG 67 HG2 ARG 67 14.584 40.976 -20.640 299 HG3 ARG 67 HG1 ARG 67 14.777 39.243 -20.908 300 HD2 ARG 67 HD2 ARG 67 12.745 39.237 -22.313 301 HD3 ARG 67 HD1 ARG 67 12.564 40.972 -22.052 302 HE ARG 67 HE ARG 67 15.145 40.312 -23.119 303 HH11 ARG 67 HH21 ARG 67 11.797 40.768 -23.868 304 HH12 ARG 67 HH22 ARG 67 12.085 41.223 -25.514 305 HH21 ARG 67 HH11 ARG 67 15.530 40.906 -25.278 306 HH22 ARG 67 HH12 ARG 67 14.198 41.301 -26.313 307 H GLY 68 HN GLY 68 14.118 38.370 -16.163 308 HA2 GLY 68 HA2 GLY 68 13.033 38.419 -14.132 309 HA3 GLY 68 HA1 GLY 68 12.133 39.830 -14.688 310 H ARG 69 HN ARG 69 12.205 36.881 -16.546 311 HA ARG 69 HA ARG 69 9.473 36.184 -15.641 312 HB2 ARG 69 HB2 ARG 69 9.334 37.491 -17.739 313 HB3 ARG 69 HB1 ARG 69 10.388 36.314 -18.525 314 HG2 ARG 69 HG2 ARG 69 8.770 34.540 -18.151 315 HG3 ARG 69 HG1 ARG 69 7.741 35.626 -17.216 316 HD2 ARG 69 HD2 ARG 69 7.407 37.038 -19.200 317 HD3 ARG 69 HD1 ARG 69 8.462 35.985 -20.138 318 HE ARG 69 HE ARG 69 6.741 34.399 -20.236 319 HH11 ARG 69 HH21 ARG 69 6.013 36.979 -18.049 320 HH12 ARG 69 HH22 ARG 69 4.348 36.539 -17.865 321 HH21 ARG 69 HH11 ARG 69 4.557 33.815 -20.002 322 HH22 ARG 69 HH12 ARG 69 3.524 34.748 -18.970 323 H THR 70 HN THR 70 9.145 34.077 -15.315 324 HA THR 70 HA THR 70 11.307 32.253 -15.327 325 HB THR 70 HB THR 70 8.356 31.587 -15.255 326 HG1 THR 70 HG1 THR 70 8.461 32.777 -13.525 327 HG21 THR 70 HG21 THR 70 9.683 29.609 -15.522 328 HG22 THR 70 HG22 THR 70 9.258 29.702 -13.813 329 HG23 THR 70 HG23 THR 70 10.872 30.173 -14.346 330 H VAL 71 HN VAL 71 12.058 30.912 -16.853 331 HA VAL 71 HA VAL 71 10.396 30.326 -19.225 332 HB VAL 71 HB VAL 71 12.494 30.659 -20.616 333 HG11 VAL 71 HG11 VAL 71 12.190 33.161 -20.655 334 HG12 VAL 71 HG12 VAL 71 11.172 33.005 -19.224 335 HG13 VAL 71 HG13 VAL 71 10.678 32.256 -20.742 336 HG21 VAL 71 HG21 VAL 71 13.367 32.357 -18.261 337 HG22 VAL 71 HG22 VAL 71 14.277 31.977 -19.723 338 HG23 VAL 71 HG23 VAL 71 13.975 30.721 -18.526 339 H SER 72 HN SER 72 10.680 28.319 -20.081 340 HA SER 72 HA SER 72 12.106 26.399 -18.443 341 HB2 SER 72 HB2 SER 72 10.463 26.060 -20.955 342 HB3 SER 72 HB1 SER 72 11.146 24.737 -20.006 343 HG SER 72 HG SER 72 9.727 25.101 -18.458 344 H VAL 73 HN VAL 73 14.073 25.486 -18.885 345 HA VAL 73 HA VAL 73 15.767 26.604 -20.816 346 HB VAL 73 HB VAL 73 15.954 24.002 -19.286 347 HG11 VAL 73 HG11 VAL 73 17.437 23.756 -21.123 348 HG12 VAL 73 HG12 VAL 73 18.454 24.350 -19.810 349 HG13 VAL 73 HG13 VAL 73 17.910 25.454 -21.072 350 HG21 VAL 73 HG21 VAL 73 17.707 25.467 -18.041 351 HG22 VAL 73 HG22 VAL 73 16.005 25.770 -17.720 352 HG23 VAL 73 HG23 VAL 73 16.895 26.834 -18.804 353 H SER 74 HN SER 74 16.394 25.945 -22.833 354 HA SER 74 HA SER 74 14.556 24.499 -24.416 355 HB2 SER 74 HB2 SER 74 16.080 26.200 -25.341 356 HB3 SER 74 HB1 SER 74 17.456 25.158 -24.988 357 HG SER 74 HG SER 74 15.263 24.582 -26.703 358 H ASP 75 HN ASP 75 17.663 23.594 -22.963 359 HA ASP 75 HA ASP 75 16.910 20.772 -23.169 360 HB2 ASP 75 HB2 ASP 75 19.053 20.142 -24.167 361 HB3 ASP 75 HB1 ASP 75 18.107 21.172 -25.245 362 HA PRO 76 HA PRO 76 19.150 21.790 -19.271 363 HB2 PRO 76 HB2 PRO 76 17.335 20.692 -17.545 364 HB3 PRO 76 HB1 PRO 76 17.169 22.333 -18.195 365 HG2 PRO 76 HG2 PRO 76 15.726 19.851 -18.949 366 HG3 PRO 76 HG1 PRO 76 15.166 21.531 -18.967 367 HD2 PRO 76 HD2 PRO 76 16.027 20.063 -21.209 368 HD3 PRO 76 HD1 PRO 76 15.828 21.826 -21.146 369 H LYS 77 HN LYS 77 20.822 20.443 -18.951 370 HA LYS 77 HA LYS 77 20.412 17.526 -19.126 371 HB2 LYS 77 HB2 LYS 77 22.903 19.236 -19.126 372 HB3 LYS 77 HB1 LYS 77 22.903 17.472 -19.150 373 HG2 LYS 77 HG2 LYS 77 21.658 17.453 -21.248 374 HG3 LYS 77 HG1 LYS 77 21.508 19.209 -21.207 375 HD2 LYS 77 HD2 LYS 77 23.332 18.901 -22.656 376 HD3 LYS 77 HD1 LYS 77 24.128 19.194 -21.111 377 HE2 LYS 77 HE2 LYS 77 25.107 17.246 -22.297 378 HE3 LYS 77 HE1 LYS 77 24.382 16.772 -20.763 379 HZ1 LYS 77 HZ1 LYS 77 22.398 16.677 -22.725 380 HZ2 LYS 77 HZ2 LYS 77 23.075 15.384 -21.853 381 HZ3 LYS 77 HZ3 LYS 77 23.754 15.861 -23.337 382 H VAL 78 HN VAL 78 19.981 16.539 -17.278 383 HA VAL 78 HA VAL 78 21.624 17.115 -14.914 384 HB VAL 78 HB VAL 78 19.392 16.888 -13.563 385 HG11 VAL 78 HG11 VAL 78 19.066 19.367 -13.740 386 HG12 VAL 78 HG12 VAL 78 20.162 19.376 -15.120 387 HG13 VAL 78 HG13 VAL 78 20.753 18.904 -13.526 388 HG21 VAL 78 HG21 VAL 78 18.300 18.134 -16.088 389 HG22 VAL 78 HG22 VAL 78 17.419 17.573 -14.666 390 HG23 VAL 78 HG23 VAL 78 18.148 16.404 -15.774 391 H ILE 79 HN ILE 79 21.301 15.449 -13.221 392 HA ILE 79 HA ILE 79 20.596 12.812 -14.378 393 HB ILE 79 HB ILE 79 22.499 11.899 -13.005 394 HG12 ILE 79 HG12 ILE 79 23.159 14.857 -12.814 395 HG13 ILE 79 HG11 ILE 79 22.779 13.780 -11.470 396 HG21 ILE 79 HG21 ILE 79 23.343 13.933 -15.089 397 HG22 ILE 79 HG22 ILE 79 22.579 12.396 -15.497 398 HG23 ILE 79 HG23 ILE 79 24.144 12.416 -14.690 399 HD11 ILE 79 HD11 ILE 79 25.185 13.630 -13.302 400 HD12 ILE 79 HD12 ILE 79 24.761 12.377 -12.137 401 HD13 ILE 79 HD13 ILE 79 25.180 13.995 -11.577 402 H CYS 80 HN CYS 80 20.428 11.128 -12.602 403 HA CYS 80 HA CYS 80 18.426 12.038 -10.741 404 HB2 CYS 80 HB2 CYS 80 19.711 9.306 -10.806 405 HB3 CYS 80 HB1 CYS 80 18.120 9.745 -10.187 406 H ARG 81 HN ARG 81 18.524 11.466 -8.422 407 HA ARG 81 HA ARG 81 20.763 12.649 -7.166 408 HB2 ARG 81 HB2 ARG 81 18.516 10.953 -6.056 409 HB3 ARG 81 HB1 ARG 81 19.712 11.778 -5.055 410 HG2 ARG 81 HG2 ARG 81 19.051 13.940 -5.990 411 HG3 ARG 81 HG1 ARG 81 17.901 13.146 -7.066 412 HD2 ARG 81 HD2 ARG 81 16.689 12.267 -5.085 413 HD3 ARG 81 HD1 ARG 81 17.814 13.125 -4.035 414 HE ARG 81 HE ARG 81 16.723 14.994 -5.819 415 HH11 ARG 81 HH21 ARG 81 15.749 12.869 -3.267 416 HH12 ARG 81 HH22 ARG 81 14.433 13.870 -2.750 417 HH21 ARG 81 HH11 ARG 81 14.995 16.309 -5.147 418 HH22 ARG 81 HH12 ARG 81 14.006 15.816 -3.813 419 H THR 82 HN THR 82 19.868 9.308 -7.793 420 HA THR 82 HA THR 82 22.093 8.245 -6.243 421 HB THR 82 HB THR 82 20.202 6.845 -6.206 422 HG1 THR 82 HG1 THR 82 21.945 5.571 -6.599 423 HG21 THR 82 HG21 THR 82 20.063 7.409 -9.170 424 HG22 THR 82 HG22 THR 82 18.846 7.742 -7.937 425 HG23 THR 82 HG23 THR 82 19.169 6.080 -8.430 426 H CYS 83 HN CYS 83 21.408 9.132 -9.529 427 HA CYS 83 HA CYS 83 23.431 7.595 -10.802 428 HB2 CYS 83 HB2 CYS 83 21.793 9.991 -11.561 429 HB3 CYS 83 HB1 CYS 83 23.174 9.541 -12.567 430 H GLN 84 HN GLN 84 23.407 10.696 -9.165 431 HA GLN 84 HA GLN 84 25.974 11.492 -10.141 432 HB2 GLN 84 HB2 GLN 84 25.778 13.238 -8.314 433 HB3 GLN 84 HB1 GLN 84 24.468 13.232 -9.494 434 HG2 GLN 84 HG2 GLN 84 22.979 12.168 -8.005 435 HG3 GLN 84 HG1 GLN 84 24.281 11.671 -6.921 436 HE21 GLN 84 HE21 GLN 84 23.689 14.908 -8.373 437 HE22 GLN 84 HE22 GLN 84 23.532 15.708 -6.884 438 HA PRO 85 HA PRO 85 28.497 9.261 -7.258 439 HB2 PRO 85 HB2 PRO 85 30.658 10.964 -7.070 440 HB3 PRO 85 HB1 PRO 85 30.342 9.933 -8.484 441 HG2 PRO 85 HG2 PRO 85 29.750 12.837 -8.090 442 HG3 PRO 85 HG1 PRO 85 30.385 12.001 -9.518 443 HD2 PRO 85 HD2 PRO 85 27.779 12.734 -9.311 444 HD3 PRO 85 HD1 PRO 85 28.289 11.285 -10.202 445 H LYS 86 HN LYS 86 29.184 9.238 -5.072 446 HA LYS 86 HA LYS 86 28.875 11.610 -3.426 447 HB2 LYS 86 HB2 LYS 86 26.554 10.738 -3.625 448 HB3 LYS 86 HB1 LYS 86 27.103 9.205 -2.945 449 HG2 LYS 86 HG2 LYS 86 27.803 10.329 -0.889 450 HG3 LYS 86 HG1 LYS 86 27.356 11.894 -1.568 451 HD2 LYS 86 HD2 LYS 86 25.008 11.134 -1.759 452 HD3 LYS 86 HD1 LYS 86 25.461 9.587 -1.043 453 HE2 LYS 86 HE2 LYS 86 25.942 12.236 0.337 454 HE3 LYS 86 HE1 LYS 86 24.479 11.282 0.579 455 HZ1 LYS 86 HZ1 LYS 86 27.271 10.552 1.229 456 HZ2 LYS 86 HZ2 LYS 86 26.039 9.387 1.124 457 HZ3 LYS 86 HZ3 LYS 86 25.937 10.635 2.272 458 H GLN 87 HN GLN 87 30.895 11.422 -2.599 459 HA GLN 87 HA GLN 87 31.411 9.106 -0.855 460 HB2 GLN 87 HB2 GLN 87 33.260 10.085 -3.041 461 HB3 GLN 87 HB1 GLN 87 33.786 9.051 -1.708 462 HG2 GLN 87 HG2 GLN 87 32.108 7.360 -2.359 463 HG3 GLN 87 HG1 GLN 87 31.586 8.390 -3.690 464 HE21 GLN 87 HE21 GLN 87 33.574 5.786 -3.002 465 HE22 GLN 87 HE22 GLN 87 34.662 5.936 -4.296 466 H HIS 88 HN HIS 88 32.835 9.536 0.852 467 HA HIS 88 HA HIS 88 33.919 12.240 1.142 468 HB2 HIS 88 HB2 HIS 88 31.628 12.436 2.019 469 HB3 HIS 88 HB1 HIS 88 31.929 11.078 3.109 470 HD2 HIS 88 HD2 HIS 88 32.858 11.921 5.562 471 HE1 HIS 88 HE1 HIS 88 34.459 15.640 4.368 472 HE2 HIS 88 HE2 HIS 88 34.038 14.112 6.351 473 H ASP 89 HN ASP 89 35.693 12.322 2.432 474 HA ASP 89 HA ASP 89 36.989 9.858 3.085 475 HB2 ASP 89 HB2 ASP 89 37.661 12.745 3.653 476 HB3 ASP 89 HB1 ASP 89 38.693 11.405 4.150 477 H SER 90 HN SER 90 37.481 9.010 5.102 478 HA SER 90 HA SER 90 36.283 10.213 7.491 479 HB2 SER 90 HB2 SER 90 35.255 7.980 8.080 480 HB3 SER 90 HB1 SER 90 34.464 8.838 6.756 481 HG SER 90 HG SER 90 36.114 6.564 6.718 482 H ILE 91 HN ILE 91 36.871 8.934 9.478 483 HA ILE 91 HA ILE 91 39.522 7.626 9.153 484 HB ILE 91 HB ILE 91 38.724 9.619 11.287 485 HG12 ILE 91 HG12 ILE 91 40.853 9.855 9.142 486 HG13 ILE 91 HG11 ILE 91 39.219 10.500 8.943 487 HG21 ILE 91 HG21 ILE 91 41.159 9.400 11.882 488 HG22 ILE 91 HG22 ILE 91 41.258 8.042 10.761 489 HG23 ILE 91 HG23 ILE 91 40.220 7.938 12.183 490 HD11 ILE 91 HD11 ILE 91 40.786 12.224 9.787 491 HD12 ILE 91 HD12 ILE 91 41.112 11.221 11.199 492 HD13 ILE 91 HD13 ILE 91 39.501 11.883 10.939 493 H TRP 92 HN TRP 92 39.753 5.758 10.197 494 HA TRP 92 HA TRP 92 37.492 4.656 11.612 495 HB2 TRP 92 HB2 TRP 92 38.701 3.145 10.197 496 HB3 TRP 92 HB1 TRP 92 40.240 3.577 10.947 497 HD1 TRP 92 HD1 TRP 92 36.967 2.754 12.808 498 HE1 TRP 92 HE1 TRP 92 37.388 0.737 14.349 499 HE3 TRP 92 HE3 TRP 92 41.744 1.591 11.429 500 HZ2 TRP 92 HZ2 TRP 92 39.476 -1.136 14.910 501 HZ3 TRP 92 HZ3 TRP 92 42.924 -0.315 12.484 502 HH2 TRP 92 HH2 TRP 92 41.797 -1.679 14.221 503 H CYS 93 HN CYS 93 37.167 4.676 13.750 504 HA CYS 93 HA CYS 93 39.353 5.598 15.521 505 HB2 CYS 93 HB2 CYS 93 37.412 6.972 15.701 506 HB3 CYS 93 HB1 CYS 93 36.348 5.578 15.841 507 H THR 94 HN THR 94 40.109 4.319 17.120 508 HA THR 94 HA THR 94 39.030 1.572 17.269 509 HB THR 94 HB THR 94 41.144 0.867 17.893 510 HG1 THR 94 HG1 THR 94 41.944 3.462 18.643 511 HG21 THR 94 HG21 THR 94 41.907 3.443 16.506 512 HG22 THR 94 HG22 THR 94 41.160 2.091 15.654 513 HG23 THR 94 HG23 THR 94 42.731 1.886 16.429 514 H ALA 95 HN ALA 95 38.726 4.485 18.842 515 HA ALA 95 HA ALA 95 38.811 3.595 21.569 516 HB1 ALA 95 HB1 ALA 95 39.070 5.995 20.689 517 HB2 ALA 95 HB2 ALA 95 38.091 5.754 22.135 518 HB3 ALA 95 HB3 ALA 95 37.311 6.005 20.572 519 H CYS 96 HN CYS 96 36.293 4.024 19.118 520 HA CYS 96 HA CYS 96 34.394 2.605 20.904 521 HB2 CYS 96 HB2 CYS 96 32.587 3.902 19.834 522 HB3 CYS 96 HB1 CYS 96 33.726 4.944 20.694 523 H GLN 97 HN GLN 97 36.182 2.488 18.101 524 HA GLN 97 HA GLN 97 36.167 1.077 16.289 525 HB2 GLN 97 HB2 GLN 97 34.203 -0.416 18.042 526 HB3 GLN 97 HB1 GLN 97 34.857 -1.043 16.531 527 HG2 GLN 97 HG2 GLN 97 37.127 -0.887 17.406 528 HG3 GLN 97 HG1 GLN 97 36.529 -0.149 18.892 529 HE21 GLN 97 HE21 GLN 97 37.901 -2.364 19.460 530 HE22 GLN 97 HE22 GLN 97 36.899 -3.705 19.740 531 H GLN 98 HN GLN 98 34.645 3.352 15.988 532 HA GLN 98 HA GLN 98 32.473 2.368 14.237 533 HB2 GLN 98 HB2 GLN 98 32.339 4.681 16.188 534 HB3 GLN 98 HB1 GLN 98 31.157 4.404 14.909 535 HG2 GLN 98 HG2 GLN 98 30.640 2.191 15.841 536 HG3 GLN 98 HG1 GLN 98 31.848 2.430 17.102 537 HE21 GLN 98 HE21 GLN 98 29.598 2.014 18.338 538 HE22 GLN 98 HE22 GLN 98 28.764 3.427 18.773 539 H THR 99 HN THR 99 32.203 3.466 12.332 540 HA THR 99 HA THR 99 34.471 4.966 11.395 541 HB THR 99 HB THR 99 31.823 4.541 10.000 542 HG1 THR 99 HG1 THR 99 32.447 2.530 10.259 543 HG21 THR 99 HG21 THR 99 34.637 5.137 9.046 544 HG22 THR 99 HG22 THR 99 33.237 6.204 8.936 545 HG23 THR 99 HG23 THR 99 33.294 4.724 7.980 546 H LYS 100 HN LYS 100 34.701 7.107 11.207 547 HA LYS 100 HA LYS 100 32.350 8.869 11.516 548 HB2 LYS 100 HB2 LYS 100 34.924 9.061 13.076 549 HB3 LYS 100 HB1 LYS 100 33.691 10.316 13.043 550 HG2 LYS 100 HG2 LYS 100 33.182 7.461 13.925 551 HG3 LYS 100 HG1 LYS 100 33.537 8.785 15.034 552 HD2 LYS 100 HD2 LYS 100 31.536 9.997 13.842 553 HD3 LYS 100 HD1 LYS 100 31.099 8.378 13.297 554 HE2 LYS 100 HE2 LYS 100 31.530 9.160 16.179 555 HE3 LYS 100 HE1 LYS 100 29.961 9.002 15.392 556 HZ1 LYS 100 HZ1 LYS 100 31.119 6.677 14.752 557 HZ2 LYS 100 HZ2 LYS 100 30.101 6.895 16.095 558 HZ3 LYS 100 HZ3 LYS 100 31.789 6.948 16.287 559 H GLY 101 HN GLY 101 32.504 10.868 10.568 560 HA2 GLY 101 HA2 GLY 101 34.277 10.995 8.302 561 HA3 GLY 101 HA1 GLY 101 33.082 12.206 8.754 562 H ILE 102 HN ILE 102 35.386 13.184 7.859 563 HA ILE 102 HA ILE 102 37.300 13.633 9.972 564 HB ILE 102 HB ILE 102 38.337 15.196 8.338 565 HG12 ILE 102 HG12 ILE 102 36.079 14.218 6.566 566 HG13 ILE 102 HG11 ILE 102 36.235 15.858 7.209 567 HG21 ILE 102 HG21 ILE 102 39.073 13.433 6.835 568 HG22 ILE 102 HG22 ILE 102 37.645 12.469 7.211 569 HG23 ILE 102 HG23 ILE 102 38.867 12.755 8.449 570 HD11 ILE 102 HD11 ILE 102 38.576 15.862 6.105 571 HD12 ILE 102 HD12 ILE 102 37.171 15.995 5.040 572 HD13 ILE 102 HD13 ILE 102 38.003 14.449 5.213 573 H ASN 103 HN ASN 103 34.298 14.927 9.161 574 HA ASN 103 HA ASN 103 34.695 17.668 9.809 575 HB2 ASN 103 HB2 ASN 103 32.284 15.863 9.705 576 HB3 ASN 103 HB1 ASN 103 32.147 17.532 10.255 577 HD21 ASN 103 HD21 ASN 103 31.252 16.075 7.659 578 HD22 ASN 103 HD22 ASN 103 31.843 17.088 6.421 579 H GLU 104 HN GLU 104 33.620 14.867 11.712 580 HA GLU 104 HA GLU 104 33.637 16.464 14.180 581 HB2 GLU 104 HB2 GLU 104 32.811 13.614 13.613 582 HB3 GLU 104 HB1 GLU 104 32.778 14.361 15.210 583 HG2 GLU 104 HG2 GLU 104 31.244 16.099 14.376 584 HG3 GLU 104 HG1 GLU 104 31.280 15.366 12.772 585 H PHE 105 HN PHE 105 36.020 15.395 12.464 586 HA PHE 105 HA PHE 105 37.502 14.258 14.777 587 HB2 PHE 105 HB2 PHE 105 37.115 13.202 12.133 588 HB3 PHE 105 HB1 PHE 105 38.823 13.597 12.309 589 HD1 PHE 105 HD2 PHE 105 40.167 12.528 14.057 590 HD2 PHE 105 HD1 PHE 105 36.056 11.499 13.434 591 HE1 PHE 105 HE2 PHE 105 40.460 10.493 15.431 592 HE2 PHE 105 HE1 PHE 105 36.354 9.472 14.810 593 HZ PHE 105 HZ PHE 105 38.564 8.968 15.820 594 H SER 106 HN SER 106 39.074 15.471 15.516 595 HA SER 106 HA SER 106 39.759 17.968 14.420 596 HB2 SER 106 HB2 SER 106 40.079 17.430 16.790 597 HB3 SER 106 HB1 SER 106 41.295 16.229 16.360 598 HG SER 106 HG SER 106 42.287 18.149 15.211 599 H LYS 107 HN LYS 107 41.715 18.673 13.453 600 HA LYS 107 HA LYS 107 42.641 17.056 11.338 601 HB2 LYS 107 HB2 LYS 107 42.674 19.617 11.523 602 HB3 LYS 107 HB1 LYS 107 44.154 19.414 12.459 603 HG2 LYS 107 HG2 LYS 107 45.221 18.241 10.609 604 HG3 LYS 107 HG1 LYS 107 43.721 18.286 9.676 605 HD2 LYS 107 HD2 LYS 107 43.802 20.767 9.705 606 HD3 LYS 107 HD1 LYS 107 45.338 20.690 10.568 607 HE2 LYS 107 HE2 LYS 107 44.859 19.394 7.872 608 HE3 LYS 107 HE1 LYS 107 45.581 20.990 8.077 609 HZ1 LYS 107 HZ1 LYS 107 47.520 20.022 8.449 610 HZ2 LYS 107 HZ2 LYS 107 46.821 18.485 8.264 611 HZ3 LYS 107 HZ3 LYS 107 46.885 19.214 9.798 612 H ALA 108 HN ALA 108 44.073 17.884 14.477 613 HA ALA 108 HA ALA 108 46.543 16.570 14.087 614 HB1 ALA 108 HB1 ALA 108 45.007 17.200 16.615 615 HB2 ALA 108 HB2 ALA 108 46.291 18.162 15.885 616 HB3 ALA 108 HB3 ALA 108 46.661 16.588 16.590 617 H GLN 109 HN GLN 109 43.410 15.462 15.262 618 HA GLN 109 HA GLN 109 44.233 12.928 16.208 619 HB2 GLN 109 HB2 GLN 109 41.597 14.033 15.251 620 HB3 GLN 109 HB1 GLN 109 41.769 12.345 15.738 621 HG2 GLN 109 HG2 GLN 109 42.505 12.973 17.943 622 HG3 GLN 109 HG1 GLN 109 42.578 14.677 17.492 623 HE21 GLN 109 HE21 GLN 109 39.924 13.710 15.858 624 HE22 GLN 109 HE22 GLN 109 38.727 13.955 17.036 625 H ARG 110 HN ARG 110 43.718 14.165 13.027 626 HA ARG 110 HA ARG 110 43.454 11.579 11.763 627 HB2 ARG 110 HB2 ARG 110 42.388 13.601 10.787 628 HB3 ARG 110 HB1 ARG 110 43.990 14.292 10.524 629 HG2 ARG 110 HG2 ARG 110 44.587 12.421 9.058 630 HG3 ARG 110 HG1 ARG 110 43.016 11.669 9.356 631 HD2 ARG 110 HD2 ARG 110 41.933 13.743 8.433 632 HD3 ARG 110 HD1 ARG 110 43.538 14.325 7.991 633 HE ARG 110 HE ARG 110 43.132 11.718 6.940 634 HH11 ARG 110 HH21 ARG 110 42.166 15.021 6.582 635 HH12 ARG 110 HH22 ARG 110 41.830 14.883 4.888 636 HH21 ARG 110 HH11 ARG 110 42.691 11.528 4.720 637 HH22 ARG 110 HH12 ARG 110 42.127 12.906 3.834 638 H HIS 111 HN HIS 111 46.003 13.914 12.417 639 HA HIS 111 HA HIS 111 47.960 12.779 10.700 640 HB2 HIS 111 HB2 HIS 111 48.141 15.064 11.581 641 HB3 HIS 111 HB1 HIS 111 48.320 14.422 13.216 642 HD2 HIS 111 HD2 HIS 111 50.334 14.017 9.789 643 HE1 HIS 111 HE1 HIS 111 53.014 13.714 13.037 644 HE2 HIS 111 HE2 HIS 111 52.829 13.730 10.505 645 H VAL 112 HN VAL 112 47.290 12.371 14.169 646 HA VAL 112 HA VAL 112 49.416 10.707 14.834 647 HB VAL 112 HB VAL 112 47.852 9.801 16.608 648 HG11 VAL 112 HG11 VAL 112 49.222 11.787 17.019 649 HG12 VAL 112 HG12 VAL 112 47.624 12.024 17.726 650 HG13 VAL 112 HG13 VAL 112 48.036 12.805 16.199 651 HG21 VAL 112 HG21 VAL 112 45.652 10.919 16.775 652 HG22 VAL 112 HG22 VAL 112 45.779 9.989 15.277 653 HG23 VAL 112 HG23 VAL 112 45.976 11.740 15.252 654 H LEU 113 HN LEU 113 49.408 8.377 15.237 655 HA LEU 113 HA LEU 113 48.435 6.944 12.913 656 HB2 LEU 113 HB2 LEU 113 49.954 5.941 15.334 657 HB3 LEU 113 HB1 LEU 113 49.705 5.064 13.820 658 HG LEU 113 HG LEU 113 51.136 7.729 14.057 659 HD11 LEU 113 HD11 LEU 113 53.189 6.524 13.807 660 HD12 LEU 113 HD12 LEU 113 52.341 5.016 13.467 661 HD13 LEU 113 HD13 LEU 113 52.296 5.706 15.090 662 HD21 LEU 113 HD21 LEU 113 51.906 6.882 11.681 663 HD22 LEU 113 HD22 LEU 113 50.333 7.651 11.852 664 HD23 LEU 113 HD23 LEU 113 50.447 5.892 11.762 665 H ASP 114 HN ASP 114 47.214 7.661 15.989 666 HA ASP 114 HA ASP 114 45.207 5.502 15.714 667 HB2 ASP 114 HB2 ASP 114 46.964 5.072 17.527 668 HB3 ASP 114 HB1 ASP 114 46.253 6.440 18.381 669 HA PRO 115 HA PRO 115 43.322 9.753 15.892 670 HB2 PRO 115 HB2 PRO 115 41.341 8.325 14.172 671 HB3 PRO 115 HB1 PRO 115 42.115 9.904 13.923 672 HG2 PRO 115 HG2 PRO 115 42.826 7.771 12.483 673 HG3 PRO 115 HG1 PRO 115 44.025 8.968 13.012 674 HD2 PRO 115 HD2 PRO 115 43.455 6.241 14.135 675 HD3 PRO 115 HD1 PRO 115 45.015 7.063 13.906 676 H ARG 116 HN ARG 116 41.673 10.385 17.212 677 HA ARG 116 HA ARG 116 39.812 8.319 18.255 678 HB2 ARG 116 HB2 ARG 116 41.370 10.354 19.866 679 HB3 ARG 116 HB1 ARG 116 40.045 9.374 20.502 680 HG2 ARG 116 HG2 ARG 116 41.282 7.321 19.917 681 HG3 ARG 116 HG1 ARG 116 42.606 8.295 19.283 682 HD2 ARG 116 HD2 ARG 116 42.918 9.310 21.517 683 HD3 ARG 116 HD1 ARG 116 41.604 8.314 22.144 684 HE ARG 116 HE ARG 116 43.670 6.748 20.894 685 HH11 ARG 116 HH21 ARG 116 42.696 8.439 23.753 686 HH12 ARG 116 HH22 ARG 116 43.662 7.474 24.819 687 HH21 ARG 116 HH11 ARG 116 44.938 5.479 22.287 688 HH22 ARG 116 HH12 ARG 116 44.931 5.798 23.989 689 H CYS 117 HN CYS 117 37.749 8.906 18.155 690 HA CYS 117 HA CYS 117 36.788 11.193 16.950 691 HB2 CYS 117 HB2 CYS 117 35.317 9.807 19.191 692 HB3 CYS 117 HB1 CYS 117 34.636 10.606 17.773 693 H GLN 118 HN GLN 118 36.032 13.192 17.611 694 HA GLN 118 HA GLN 118 37.425 14.481 19.679 695 HB2 GLN 118 HB2 GLN 118 34.872 15.207 18.240 696 HB3 GLN 118 HB1 GLN 118 35.678 16.284 19.386 697 HG2 GLN 118 HG2 GLN 118 37.726 16.215 18.030 698 HG3 GLN 118 HG1 GLN 118 36.955 15.106 16.898 699 HE21 GLN 118 HE21 GLN 118 37.743 18.293 17.196 700 HE22 GLN 118 HE22 GLN 118 36.497 18.982 16.277 701 H ILE 119 HN ILE 119 34.633 12.489 19.776 702 HA ILE 119 HA ILE 119 33.748 13.494 22.384 703 HB ILE 119 HB ILE 119 32.704 11.312 20.569 704 HG12 ILE 119 HG12 ILE 119 30.759 12.883 20.435 705 HG13 ILE 119 HG11 ILE 119 31.667 14.040 21.410 706 HG21 ILE 119 HG21 ILE 119 31.878 12.183 23.344 707 HG22 ILE 119 HG22 ILE 119 32.213 10.552 22.764 708 HG23 ILE 119 HG23 ILE 119 30.751 11.389 22.243 709 HD11 ILE 119 HD11 ILE 119 32.980 12.953 18.936 710 HD12 ILE 119 HD12 ILE 119 33.146 14.536 19.698 711 HD13 ILE 119 HD13 ILE 119 31.709 14.164 18.753 712 H CYS 120 HN CYS 120 35.363 10.717 20.948 713 HA CYS 120 HA CYS 120 35.355 9.071 23.258 714 HB2 CYS 120 HB2 CYS 120 37.133 9.102 20.806 715 HB3 CYS 120 HB1 CYS 120 37.269 7.902 22.092 716 H VAL 121 HN VAL 121 37.567 11.529 22.069 717 HA VAL 121 HA VAL 121 39.684 11.040 23.882 718 HB VAL 121 HB VAL 121 40.365 13.384 23.345 719 HG11 VAL 121 HG11 VAL 121 39.480 11.706 20.975 720 HG12 VAL 121 HG12 VAL 121 40.978 11.488 21.878 721 HG13 VAL 121 HG13 VAL 121 40.719 12.961 20.943 722 HG21 VAL 121 HG21 VAL 121 37.721 13.327 21.886 723 HG22 VAL 121 HG22 VAL 121 38.964 14.530 21.574 724 HG23 VAL 121 HG23 VAL 121 38.195 14.443 23.160 725 H HIS 122 HN HIS 122 36.774 13.036 24.075 726 HA HIS 122 HA HIS 122 37.508 14.152 26.647 727 HB2 HIS 122 HB2 HIS 122 36.165 15.482 25.101 728 HB3 HIS 122 HB1 HIS 122 34.909 14.240 25.096 729 HD2 HIS 122 HD2 HIS 122 33.040 14.554 27.112 730 HE1 HIS 122 HE1 HIS 122 35.218 17.261 29.513 731 HE2 HIS 122 HE2 HIS 122 32.991 16.069 29.240 732 H SER 123 HN SER 123 36.645 11.147 25.793 733 HA SER 123 HA SER 123 34.946 10.684 28.184 734 HB2 SER 123 HB2 SER 123 35.332 8.772 25.885 735 HB3 SER 123 HB1 SER 123 34.075 8.760 27.119 736 HG SER 123 HG SER 123 33.149 9.700 25.377 737 H GLN 124 HN GLN 124 37.922 9.833 26.543 738 HA GLN 124 HA GLN 124 38.552 7.806 28.581 739 HB2 GLN 124 HB2 GLN 124 38.965 7.510 26.042 740 HB3 GLN 124 HB1 GLN 124 40.324 8.609 26.275 741 HG2 GLN 124 HG2 GLN 124 41.304 7.119 27.939 742 HG3 GLN 124 HG1 GLN 124 39.902 6.057 27.859 743 HE21 GLN 124 HE21 GLN 124 40.990 4.207 27.028 744 HE22 GLN 124 HE22 GLN 124 41.716 4.182 25.495 745 H ARG 125 HN ARG 125 38.699 11.043 28.418 746 HA ARG 125 HA ARG 125 39.935 12.662 29.492 747 HB2 ARG 125 HB2 ARG 125 41.039 10.326 31.070 748 HB3 ARG 125 HB1 ARG 125 41.027 12.020 31.560 749 HG2 ARG 125 HG2 ARG 125 38.500 10.455 30.958 750 HG3 ARG 125 HG1 ARG 125 39.177 10.601 32.578 751 HD2 ARG 125 HD2 ARG 125 39.104 13.144 32.205 752 HD3 ARG 125 HD1 ARG 125 38.096 12.798 30.805 753 HE ARG 125 HE ARG 125 36.356 12.249 32.233 754 HH11 ARG 125 HH21 ARG 125 39.369 12.474 33.919 755 HH12 ARG 125 HH22 ARG 125 38.653 12.386 35.495 756 HH21 ARG 125 HH11 ARG 125 35.409 12.137 34.293 757 HH22 ARG 125 HH12 ARG 125 36.410 12.196 35.705 758 H ASN 126 HN ASN 126 41.218 10.483 27.476 759 HA ASN 126 HA ASN 126 43.269 10.166 26.473 760 HB2 ASN 126 HB2 ASN 126 42.589 12.420 25.677 761 HB3 ASN 126 HB1 ASN 126 43.470 13.134 27.026 762 HD21 ASN 126 HD21 ASN 126 44.315 13.866 24.488 763 HD22 ASN 126 HD22 ASN 126 45.789 13.110 24.119 Start of MODEL 2 1 H MET 31 HT1 MET 31 5.177 21.349 -22.349 2 HA MET 31 HA MET 31 3.809 23.180 -22.397 3 HB2 MET 31 HB2 MET 31 1.532 22.197 -23.326 4 HB3 MET 31 HB1 MET 31 3.033 21.953 -24.226 5 HG2 MET 31 HG2 MET 31 3.284 19.729 -23.407 6 HG3 MET 31 HG1 MET 31 2.045 19.963 -22.174 7 HE1 MET 31 HE1 MET 31 3.014 20.010 -25.712 8 HE2 MET 31 HE2 MET 31 1.714 21.129 -26.116 9 HE3 MET 31 HE3 MET 31 1.632 19.459 -26.669 10 H GLY 32 HN GLY 32 0.993 21.338 -21.715 11 HA2 GLY 32 HA2 GLY 32 -0.017 23.125 -19.803 12 HA3 GLY 32 HA1 GLY 32 -0.627 21.498 -20.094 13 H LYS 33 HN LYS 33 2.133 20.426 -19.491 14 HA LYS 33 HA LYS 33 1.703 19.874 -16.726 15 HB2 LYS 33 HB2 LYS 33 4.177 19.407 -18.405 16 HB3 LYS 33 HB1 LYS 33 3.799 18.629 -16.870 17 HG2 LYS 33 HG2 LYS 33 2.046 18.425 -19.334 18 HG3 LYS 33 HG1 LYS 33 3.264 17.228 -18.902 19 HD2 LYS 33 HD2 LYS 33 2.052 17.094 -16.617 20 HD3 LYS 33 HD1 LYS 33 0.731 17.944 -17.414 21 HE2 LYS 33 HE2 LYS 33 1.930 15.381 -18.488 22 HE3 LYS 33 HE1 LYS 33 0.515 15.434 -17.441 23 HZ1 LYS 33 HZ1 LYS 33 0.632 15.849 -20.204 24 HZ2 LYS 33 HZ2 LYS 33 0.159 17.309 -19.477 25 HZ3 LYS 33 HZ3 LYS 33 -0.728 15.890 -19.191 26 H ASN 34 HN ASN 34 2.783 20.578 -14.927 27 HA ASN 34 HA ASN 34 3.856 23.244 -15.056 28 HB2 ASN 34 HB2 ASN 34 2.442 22.379 -13.171 29 HB3 ASN 34 HB1 ASN 34 3.806 21.360 -12.691 30 HD21 ASN 34 HD21 ASN 34 3.147 23.095 -10.746 31 HD22 ASN 34 HD22 ASN 34 4.186 24.436 -10.700 32 H ASP 35 HN ASP 35 5.945 23.915 -14.693 33 HA ASP 35 HA ASP 35 8.039 22.198 -15.528 34 HB2 ASP 35 HB2 ASP 35 7.896 24.971 -14.370 35 HB3 ASP 35 HB1 ASP 35 9.465 24.177 -14.537 36 H ASN 36 HN ASN 36 6.879 23.219 -12.361 37 HA ASN 36 HA ASN 36 9.048 22.204 -10.849 38 HB2 ASN 36 HB2 ASN 36 6.159 22.737 -10.157 39 HB3 ASN 36 HB1 ASN 36 7.350 22.190 -8.969 40 HD21 ASN 36 HD21 ASN 36 9.627 23.653 -9.815 41 HD22 ASN 36 HD22 ASN 36 9.320 25.310 -9.616 42 H ASP 37 HN ASP 37 5.990 20.769 -11.910 43 HA ASP 37 HA ASP 37 6.759 18.172 -10.747 44 HB2 ASP 37 HB2 ASP 37 4.153 19.130 -11.949 45 HB3 ASP 37 HB1 ASP 37 4.428 17.519 -11.287 46 H ALA 38 HN ALA 38 7.722 19.594 -13.329 47 HA ALA 38 HA ALA 38 6.852 18.086 -15.528 48 HB1 ALA 38 HB1 ALA 38 8.020 19.978 -16.187 49 HB2 ALA 38 HB2 ALA 38 9.250 18.740 -16.415 50 HB3 ALA 38 HB3 ALA 38 9.273 19.750 -14.973 51 H LEU 39 HN LEU 39 8.647 16.757 -16.811 52 HA LEU 39 HA LEU 39 9.995 14.863 -14.985 53 HB2 LEU 39 HB2 LEU 39 8.090 14.140 -17.205 54 HB3 LEU 39 HB1 LEU 39 9.201 12.993 -16.477 55 HG LEU 39 HG LEU 39 7.232 14.622 -14.849 56 HD11 LEU 39 HD11 LEU 39 5.936 13.290 -16.407 57 HD12 LEU 39 HD12 LEU 39 5.837 12.553 -14.809 58 HD13 LEU 39 HD13 LEU 39 6.893 11.855 -16.036 59 HD21 LEU 39 HD21 LEU 39 8.819 13.769 -13.350 60 HD22 LEU 39 HD22 LEU 39 9.082 12.304 -14.292 61 HD23 LEU 39 HD23 LEU 39 7.614 12.490 -13.340 62 H ILE 40 HN ILE 40 12.031 15.105 -15.474 63 HA ILE 40 HA ILE 40 12.845 15.434 -18.308 64 HB ILE 40 HB ILE 40 14.429 15.920 -15.777 65 HG12 ILE 40 HG12 ILE 40 12.628 17.559 -16.077 66 HG13 ILE 40 HG11 ILE 40 14.191 18.308 -16.395 67 HG21 ILE 40 HG21 ILE 40 15.912 15.297 -17.582 68 HG22 ILE 40 HG22 ILE 40 16.004 17.045 -17.385 69 HG23 ILE 40 HG23 ILE 40 15.061 16.357 -18.705 70 HD11 ILE 40 HD11 ILE 40 11.976 17.635 -18.304 71 HD12 ILE 40 HD12 ILE 40 13.629 17.609 -18.912 72 HD13 ILE 40 HD13 ILE 40 12.972 19.084 -18.215 73 H MET 41 HN MET 41 14.347 14.117 -19.257 74 HA MET 41 HA MET 41 14.475 11.426 -18.201 75 HB2 MET 41 HB2 MET 41 15.258 12.774 -20.772 76 HB3 MET 41 HB1 MET 41 15.940 11.192 -20.395 77 HG2 MET 41 HG2 MET 41 13.780 10.185 -20.266 78 HG3 MET 41 HG1 MET 41 12.980 11.750 -20.274 79 HE1 MET 41 HE1 MET 41 14.980 9.510 -23.711 80 HE2 MET 41 HE2 MET 41 14.949 9.128 -21.993 81 HE3 MET 41 HE3 MET 41 16.021 10.394 -22.585 82 H CYS 42 HN CYS 42 16.254 10.340 -17.527 83 HA CYS 42 HA CYS 42 18.440 11.980 -16.511 84 HB2 CYS 42 HB2 CYS 42 17.476 10.206 -15.108 85 HB3 CYS 42 HB1 CYS 42 17.962 8.995 -16.302 86 H MET 43 HN MET 43 20.215 12.405 -17.655 87 HA MET 43 HA MET 43 20.773 11.424 -20.194 88 HB2 MET 43 HB2 MET 43 22.931 12.293 -18.271 89 HB3 MET 43 HB1 MET 43 22.868 12.511 -20.021 90 HG2 MET 43 HG2 MET 43 20.739 13.905 -19.585 91 HG3 MET 43 HG1 MET 43 21.262 13.921 -17.896 92 HE1 MET 43 HE1 MET 43 24.480 15.779 -17.746 93 HE2 MET 43 HE2 MET 43 24.486 14.049 -18.082 94 HE3 MET 43 HE3 MET 43 23.275 14.726 -16.996 95 H ARG 44 HN ARG 44 20.848 9.666 -17.376 96 HA ARG 44 HA ARG 44 22.932 7.803 -18.388 97 HB2 ARG 44 HB2 ARG 44 22.166 8.710 -15.662 98 HB3 ARG 44 HB1 ARG 44 22.538 7.000 -15.813 99 HG2 ARG 44 HG2 ARG 44 24.553 8.244 -15.234 100 HG3 ARG 44 HG1 ARG 44 24.705 7.589 -16.863 101 HD2 ARG 44 HD2 ARG 44 24.185 9.713 -17.852 102 HD3 ARG 44 HD1 ARG 44 23.730 10.396 -16.291 103 HE ARG 44 HE ARG 44 26.299 9.695 -15.865 104 HH11 ARG 44 HH21 ARG 44 24.711 11.352 -18.455 105 HH12 ARG 44 HH22 ARG 44 26.085 12.327 -18.855 106 HH21 ARG 44 HH11 ARG 44 28.098 10.966 -16.379 107 HH22 ARG 44 HH12 ARG 44 28.006 12.107 -17.679 108 H CYS 45 HN CYS 45 20.439 7.165 -15.982 109 HA CYS 45 HA CYS 45 19.721 4.730 -17.349 110 HB2 CYS 45 HB2 CYS 45 18.268 4.341 -15.434 111 HB3 CYS 45 HB1 CYS 45 19.864 4.848 -14.890 112 H ARG 46 HN ARG 46 18.882 7.847 -17.934 113 HA ARG 46 HA ARG 46 17.017 8.899 -18.862 114 HB2 ARG 46 HB2 ARG 46 17.019 6.168 -20.152 115 HB3 ARG 46 HB1 ARG 46 16.013 7.514 -20.699 116 HG2 ARG 46 HG2 ARG 46 18.003 8.884 -21.096 117 HG3 ARG 46 HG1 ARG 46 19.037 7.602 -20.464 118 HD2 ARG 46 HD2 ARG 46 17.186 7.204 -22.821 119 HD3 ARG 46 HD1 ARG 46 18.864 7.710 -23.000 120 HE ARG 46 HE ARG 46 18.935 5.443 -21.410 121 HH11 ARG 46 HH21 ARG 46 17.779 6.332 -24.547 122 HH12 ARG 46 HH22 ARG 46 18.036 4.764 -25.238 123 HH21 ARG 46 HH11 ARG 46 19.281 3.388 -22.308 124 HH22 ARG 46 HH12 ARG 46 18.888 3.097 -23.970 125 H LYS 47 HN LYS 47 16.401 8.038 -16.329 126 HA LYS 47 HA LYS 47 13.719 6.814 -16.559 127 HB2 LYS 47 HB2 LYS 47 15.616 7.193 -14.243 128 HB3 LYS 47 HB1 LYS 47 13.917 6.785 -14.000 129 HG2 LYS 47 HG2 LYS 47 14.196 4.786 -15.428 130 HG3 LYS 47 HG1 LYS 47 15.900 5.187 -15.647 131 HD2 LYS 47 HD2 LYS 47 16.348 4.896 -13.296 132 HD3 LYS 47 HD1 LYS 47 14.628 4.739 -12.935 133 HE2 LYS 47 HE2 LYS 47 15.643 2.520 -12.976 134 HE3 LYS 47 HE1 LYS 47 14.554 2.690 -14.353 135 HZ1 LYS 47 HZ1 LYS 47 17.493 2.682 -14.304 136 HZ2 LYS 47 HZ2 LYS 47 16.676 3.492 -15.553 137 HZ3 LYS 47 HZ3 LYS 47 16.435 1.827 -15.316 138 H VAL 48 HN VAL 48 12.366 8.420 -17.149 139 HA VAL 48 HA VAL 48 12.454 11.111 -16.570 140 HB VAL 48 HB VAL 48 9.768 10.728 -16.561 141 HG11 VAL 48 HG11 VAL 48 9.889 10.712 -19.054 142 HG12 VAL 48 HG12 VAL 48 11.618 10.393 -18.937 143 HG13 VAL 48 HG13 VAL 48 10.958 11.908 -18.321 144 HG21 VAL 48 HG21 VAL 48 10.795 8.287 -18.018 145 HG22 VAL 48 HG22 VAL 48 9.128 8.687 -17.596 146 HG23 VAL 48 HG23 VAL 48 10.265 8.210 -16.337 147 H LYS 49 HN LYS 49 12.368 12.246 -14.779 148 HA LYS 49 HA LYS 49 10.869 11.252 -12.443 149 HB2 LYS 49 HB2 LYS 49 13.800 11.934 -12.542 150 HB3 LYS 49 HB1 LYS 49 12.884 12.041 -11.054 151 HG2 LYS 49 HG2 LYS 49 12.509 9.740 -10.936 152 HG3 LYS 49 HG1 LYS 49 12.727 9.511 -12.665 153 HD2 LYS 49 HD2 LYS 49 15.103 9.795 -12.494 154 HD3 LYS 49 HD1 LYS 49 14.983 10.308 -10.816 155 HE2 LYS 49 HE2 LYS 49 14.085 7.592 -11.808 156 HE3 LYS 49 HE1 LYS 49 15.675 7.896 -11.110 157 HZ1 LYS 49 HZ1 LYS 49 13.038 8.236 -9.794 158 HZ2 LYS 49 HZ2 LYS 49 14.500 8.785 -9.126 159 HZ3 LYS 49 HZ3 LYS 49 14.253 7.124 -9.388 160 H GLY 50 HN GLY 50 10.150 12.872 -11.072 161 HA2 GLY 50 HA2 GLY 50 10.230 15.591 -12.214 162 HA3 GLY 50 HA1 GLY 50 9.014 14.970 -11.111 163 H ILE 51 HN ILE 51 9.836 17.281 -10.320 164 HA ILE 51 HA ILE 51 12.225 17.664 -9.001 165 HB ILE 51 HB ILE 51 10.561 19.429 -9.235 166 HG12 ILE 51 HG12 ILE 51 10.940 18.904 -6.277 167 HG13 ILE 51 HG11 ILE 51 12.273 19.403 -7.322 168 HG21 ILE 51 HG21 ILE 51 8.996 17.872 -7.155 169 HG22 ILE 51 HG22 ILE 51 8.568 18.001 -8.860 170 HG23 ILE 51 HG23 ILE 51 8.544 19.435 -7.834 171 HD11 ILE 51 HD11 ILE 51 11.144 21.453 -7.902 172 HD12 ILE 51 HD12 ILE 51 11.109 21.309 -6.145 173 HD13 ILE 51 HD13 ILE 51 9.668 20.930 -7.089 174 H ASP 52 HN ASP 52 9.830 15.342 -8.216 175 HA ASP 52 HA ASP 52 10.322 15.183 -5.398 176 HB2 ASP 52 HB2 ASP 52 8.226 14.395 -6.357 177 HB3 ASP 52 HB1 ASP 52 9.093 13.216 -7.341 178 H SER 53 HN SER 53 11.303 13.252 -8.200 179 HA SER 53 HA SER 53 13.240 11.763 -6.573 180 HB2 SER 53 HB2 SER 53 11.879 11.325 -9.132 181 HB3 SER 53 HB1 SER 53 13.573 10.853 -9.148 182 HG SER 53 HG SER 53 11.453 9.725 -7.895 183 H TYR 54 HN TYR 54 13.279 14.696 -7.838 184 HA TYR 54 HA TYR 54 16.162 14.587 -8.516 185 HB2 TYR 54 HB2 TYR 54 13.896 15.667 -10.071 186 HB3 TYR 54 HB1 TYR 54 15.222 16.816 -9.881 187 HD1 TYR 54 HD1 TYR 54 14.811 13.131 -10.525 188 HD2 TYR 54 HD2 TYR 54 16.827 16.770 -11.565 189 HE1 TYR 54 HE1 TYR 54 16.104 11.922 -12.264 190 HE2 TYR 54 HE2 TYR 54 18.105 15.576 -13.278 191 HH TYR 54 HH TYR 54 18.496 12.378 -13.405 192 H SER 55 HN SER 55 17.451 16.083 -7.628 193 HA SER 55 HA SER 55 16.599 17.448 -5.312 194 HB2 SER 55 HB2 SER 55 19.097 17.554 -6.998 195 HB3 SER 55 HB1 SER 55 18.884 18.603 -5.592 196 HG SER 55 HG SER 55 18.951 16.893 -4.296 197 H LYS 56 HN LYS 56 16.392 19.675 -4.939 198 HA LYS 56 HA LYS 56 14.958 21.120 -6.888 199 HB2 LYS 56 HB2 LYS 56 14.778 21.489 -4.433 200 HB3 LYS 56 HB1 LYS 56 16.387 22.211 -4.452 201 HG2 LYS 56 HG2 LYS 56 15.620 23.944 -6.008 202 HG3 LYS 56 HG1 LYS 56 14.019 23.205 -6.065 203 HD2 LYS 56 HD2 LYS 56 13.753 23.593 -3.639 204 HD3 LYS 56 HD1 LYS 56 15.346 24.350 -3.591 205 HE2 LYS 56 HE2 LYS 56 13.813 26.159 -3.769 206 HE3 LYS 56 HE1 LYS 56 14.466 25.953 -5.394 207 HZ1 LYS 56 HZ1 LYS 56 12.521 24.582 -5.928 208 HZ2 LYS 56 HZ2 LYS 56 12.087 26.165 -5.492 209 HZ3 LYS 56 HZ3 LYS 56 11.882 24.891 -4.387 210 H THR 57 HN THR 57 18.362 21.127 -5.963 211 HA THR 57 HA THR 57 19.152 23.453 -7.350 212 HB THR 57 HB THR 57 20.833 20.976 -6.923 213 HG1 THR 57 HG1 THR 57 20.879 21.458 -4.884 214 HG21 THR 57 HG21 THR 57 21.539 23.922 -7.026 215 HG22 THR 57 HG22 THR 57 21.765 22.787 -8.357 216 HG23 THR 57 HG23 THR 57 22.671 22.579 -6.858 217 H GLN 58 HN GLN 58 19.171 20.026 -8.365 218 HA GLN 58 HA GLN 58 20.158 20.540 -10.979 219 HB2 GLN 58 HB2 GLN 58 18.624 18.208 -9.817 220 HB3 GLN 58 HB1 GLN 58 19.289 18.225 -11.450 221 HG2 GLN 58 HG2 GLN 58 21.545 18.615 -10.532 222 HG3 GLN 58 HG1 GLN 58 20.884 18.596 -8.898 223 HE21 GLN 58 HE21 GLN 58 20.335 16.539 -7.962 224 HE22 GLN 58 HE22 GLN 58 20.692 15.064 -8.736 225 H TRP 59 HN TRP 59 16.901 20.139 -9.650 226 HA TRP 59 HA TRP 59 15.514 20.170 -12.085 227 HB2 TRP 59 HB2 TRP 59 14.704 19.749 -9.573 228 HB3 TRP 59 HB1 TRP 59 14.268 21.456 -9.659 229 HD1 TRP 59 HD1 TRP 59 11.859 21.811 -10.504 230 HE1 TRP 59 HE1 TRP 59 10.243 20.507 -12.039 231 HE3 TRP 59 HE3 TRP 59 14.853 17.917 -11.878 232 HZ2 TRP 59 HZ2 TRP 59 10.231 18.189 -13.590 233 HZ3 TRP 59 HZ3 TRP 59 13.994 16.166 -13.408 234 HH2 TRP 59 HH2 TRP 59 11.676 16.315 -14.271 235 H SER 60 HN SER 60 16.656 22.788 -10.005 236 HA SER 60 HA SER 60 15.298 24.936 -11.217 237 HB2 SER 60 HB2 SER 60 16.638 24.950 -9.045 238 HB3 SER 60 HB1 SER 60 18.075 25.101 -10.052 239 HG SER 60 HG SER 60 16.681 26.894 -11.053 240 H LYS 61 HN LYS 61 17.933 23.007 -12.316 241 HA LYS 61 HA LYS 61 19.000 24.960 -14.156 242 HB2 LYS 61 HB2 LYS 61 19.404 21.963 -14.013 243 HB3 LYS 61 HB1 LYS 61 20.338 23.076 -15.006 244 HG2 LYS 61 HG2 LYS 61 21.055 24.285 -12.972 245 HG3 LYS 61 HG1 LYS 61 20.147 23.142 -11.983 246 HD2 LYS 61 HD2 LYS 61 21.522 21.287 -12.879 247 HD3 LYS 61 HD1 LYS 61 22.454 22.450 -13.825 248 HE2 LYS 61 HE2 LYS 61 23.113 23.605 -11.740 249 HE3 LYS 61 HE1 LYS 61 22.205 22.415 -10.807 250 HZ1 LYS 61 HZ1 LYS 61 24.013 21.210 -12.670 251 HZ2 LYS 61 HZ2 LYS 61 23.833 20.931 -11.004 252 HZ3 LYS 61 HZ3 LYS 61 24.815 22.203 -11.552 253 H THR 62 HN THR 62 16.370 22.783 -14.122 254 HA THR 62 HA THR 62 16.197 22.255 -16.927 255 HB THR 62 HB THR 62 13.943 21.458 -16.450 256 HG1 THR 62 HG1 THR 62 14.077 23.276 -14.548 257 HG21 THR 62 HG21 THR 62 14.510 19.838 -14.637 258 HG22 THR 62 HG22 THR 62 15.964 20.776 -14.302 259 HG23 THR 62 HG23 THR 62 15.773 19.973 -15.860 260 H PHE 63 HN PHE 63 15.445 24.975 -14.985 261 HA PHE 63 HA PHE 63 14.396 26.402 -17.307 262 HB2 PHE 63 HB2 PHE 63 12.468 27.265 -16.099 263 HB3 PHE 63 HB1 PHE 63 12.402 25.504 -16.105 264 HD1 PHE 63 HD1 PHE 63 13.307 28.472 -14.064 265 HD2 PHE 63 HD2 PHE 63 12.528 24.250 -14.073 266 HE1 PHE 63 HE1 PHE 63 13.268 28.474 -11.584 267 HE2 PHE 63 HE2 PHE 63 12.493 24.250 -11.594 268 HZ PHE 63 HZ PHE 63 12.862 26.363 -10.349 269 H THR 64 HN THR 64 14.442 28.705 -17.022 270 HA THR 64 HA THR 64 16.165 29.664 -14.809 271 HB THR 64 HB THR 64 17.315 31.126 -16.442 272 HG1 THR 64 HG1 THR 64 16.754 31.126 -18.476 273 HG21 THR 64 HG21 THR 64 17.387 28.143 -16.801 274 HG22 THR 64 HG22 THR 64 18.511 29.164 -15.919 275 HG23 THR 64 HG23 THR 64 18.490 29.192 -17.683 276 H PHE 65 HN PHE 65 16.152 32.139 -14.782 277 HA PHE 65 HA PHE 65 13.367 33.071 -15.224 278 HB2 PHE 65 HB2 PHE 65 14.597 32.853 -12.821 279 HB3 PHE 65 HB1 PHE 65 15.153 34.461 -13.266 280 HD1 PHE 65 HD1 PHE 65 12.012 32.432 -13.419 281 HD2 PHE 65 HD2 PHE 65 13.783 36.256 -12.590 282 HE1 PHE 65 HE1 PHE 65 9.785 33.327 -12.813 283 HE2 PHE 65 HE2 PHE 65 11.550 37.150 -11.975 284 HZ PHE 65 HZ PHE 65 9.553 35.687 -12.094 285 H VAL 66 HN VAL 66 13.235 34.358 -16.903 286 HA VAL 66 HA VAL 66 15.297 36.439 -17.291 287 HB VAL 66 HB VAL 66 15.352 36.076 -19.649 288 HG11 VAL 66 HG11 VAL 66 16.803 34.577 -18.380 289 HG12 VAL 66 HG12 VAL 66 16.144 33.707 -19.764 290 HG13 VAL 66 HG13 VAL 66 15.481 33.434 -18.155 291 HG21 VAL 66 HG21 VAL 66 13.084 35.566 -20.170 292 HG22 VAL 66 HG22 VAL 66 13.067 34.183 -19.081 293 HG23 VAL 66 HG23 VAL 66 13.985 34.108 -20.584 294 H ARG 67 HN ARG 67 14.578 38.369 -18.149 295 HA ARG 67 HA ARG 67 13.088 40.102 -18.360 296 HB2 ARG 67 HB2 ARG 67 11.435 37.905 -19.627 297 HB3 ARG 67 HB1 ARG 67 11.122 39.639 -19.784 298 HG2 ARG 67 HG2 ARG 67 13.383 39.925 -20.787 299 HG3 ARG 67 HG1 ARG 67 13.622 38.179 -20.697 300 HD2 ARG 67 HD2 ARG 67 11.365 39.533 -22.201 301 HD3 ARG 67 HD1 ARG 67 12.844 38.924 -22.947 302 HE ARG 67 HE ARG 67 10.617 37.334 -21.946 303 HH11 ARG 67 HH21 ARG 67 13.930 37.464 -22.938 304 HH12 ARG 67 HH22 ARG 67 14.031 35.774 -23.299 305 HH21 ARG 67 HH11 ARG 67 10.743 35.118 -22.417 306 HH22 ARG 67 HH12 ARG 67 12.226 34.444 -23.005 307 H GLY 68 HN GLY 68 12.898 38.121 -16.020 308 HA2 GLY 68 HA2 GLY 68 11.717 38.183 -14.035 309 HA3 GLY 68 HA1 GLY 68 10.680 39.425 -14.737 310 H ARG 69 HN ARG 69 11.167 36.414 -16.403 311 HA ARG 69 HA ARG 69 8.554 35.383 -15.477 312 HB2 ARG 69 HB2 ARG 69 8.206 36.639 -17.588 313 HB3 ARG 69 HB1 ARG 69 9.391 35.600 -18.380 314 HG2 ARG 69 HG2 ARG 69 8.017 33.625 -17.889 315 HG3 ARG 69 HG1 ARG 69 6.841 34.639 -17.050 316 HD2 ARG 69 HD2 ARG 69 6.517 35.921 -19.178 317 HD3 ARG 69 HD1 ARG 69 7.573 34.766 -19.987 318 HE ARG 69 HE ARG 69 4.839 34.295 -19.096 319 HH11 ARG 69 HH21 ARG 69 7.876 32.981 -20.109 320 HH12 ARG 69 HH22 ARG 69 7.209 31.466 -20.617 321 HH21 ARG 69 HH11 ARG 69 3.956 32.309 -19.758 322 HH22 ARG 69 HH12 ARG 69 4.989 31.084 -20.417 323 H THR 70 HN THR 70 8.377 33.184 -15.421 324 HA THR 70 HA THR 70 10.788 31.674 -15.274 325 HB THR 70 HB THR 70 7.971 30.589 -15.457 326 HG1 THR 70 HG1 THR 70 9.427 31.429 -13.174 327 HG21 THR 70 HG21 THR 70 10.423 29.550 -14.017 328 HG22 THR 70 HG22 THR 70 9.917 29.001 -15.614 329 HG23 THR 70 HG23 THR 70 8.879 28.723 -14.217 330 H VAL 71 HN VAL 71 11.861 30.656 -16.842 331 HA VAL 71 HA VAL 71 10.444 29.933 -19.343 332 HB VAL 71 HB VAL 71 12.593 30.552 -20.540 333 HG11 VAL 71 HG11 VAL 71 11.984 32.899 -20.690 334 HG12 VAL 71 HG12 VAL 71 11.171 32.828 -19.126 335 HG13 VAL 71 HG13 VAL 71 10.506 31.956 -20.509 336 HG21 VAL 71 HG21 VAL 71 14.127 32.055 -19.437 337 HG22 VAL 71 HG22 VAL 71 13.961 30.638 -18.409 338 HG23 VAL 71 HG23 VAL 71 13.111 32.126 -17.999 339 H SER 72 HN SER 72 10.832 27.928 -20.069 340 HA SER 72 HA SER 72 12.402 26.145 -18.440 341 HB2 SER 72 HB2 SER 72 11.712 24.461 -20.197 342 HB3 SER 72 HB1 SER 72 10.384 25.262 -19.354 343 HG SER 72 HG SER 72 10.165 26.644 -21.116 344 H VAL 73 HN VAL 73 14.259 24.962 -19.104 345 HA VAL 73 HA VAL 73 15.910 26.392 -21.054 346 HB VAL 73 HB VAL 73 16.615 24.166 -19.130 347 HG11 VAL 73 HG11 VAL 73 18.193 25.760 -21.141 348 HG12 VAL 73 HG12 VAL 73 18.296 24.049 -20.740 349 HG13 VAL 73 HG13 VAL 73 18.979 25.243 -19.651 350 HG21 VAL 73 HG21 VAL 73 16.199 27.023 -18.705 351 HG22 VAL 73 HG22 VAL 73 17.891 26.624 -18.428 352 HG23 VAL 73 HG23 VAL 73 16.634 25.788 -17.526 353 H SER 74 HN SER 74 15.922 25.711 -23.094 354 HA SER 74 HA SER 74 14.783 23.264 -23.957 355 HB2 SER 74 HB2 SER 74 16.632 25.175 -25.398 356 HB3 SER 74 HB1 SER 74 15.743 23.860 -26.163 357 HG SER 74 HG SER 74 14.306 25.607 -24.542 358 H ASP 75 HN ASP 75 17.436 23.556 -22.192 359 HA ASP 75 HA ASP 75 18.676 21.133 -23.315 360 HB2 ASP 75 HB2 ASP 75 19.936 23.156 -24.123 361 HB3 ASP 75 HB1 ASP 75 20.296 23.532 -22.434 362 HA PRO 76 HA PRO 76 18.283 21.099 -18.693 363 HB2 PRO 76 HB2 PRO 76 16.451 19.098 -18.441 364 HB3 PRO 76 HB1 PRO 76 15.989 20.786 -18.719 365 HG2 PRO 76 HG2 PRO 76 16.028 18.499 -20.618 366 HG3 PRO 76 HG1 PRO 76 14.945 19.899 -20.560 367 HD2 PRO 76 HD2 PRO 76 17.160 19.602 -22.294 368 HD3 PRO 76 HD1 PRO 76 16.296 21.117 -21.970 369 H LYS 77 HN LYS 77 20.491 20.286 -18.915 370 HA LYS 77 HA LYS 77 20.749 17.351 -19.150 371 HB2 LYS 77 HB2 LYS 77 22.810 19.566 -19.170 372 HB3 LYS 77 HB1 LYS 77 23.179 17.843 -19.265 373 HG2 LYS 77 HG2 LYS 77 21.890 17.639 -21.329 374 HG3 LYS 77 HG1 LYS 77 21.388 19.323 -21.213 375 HD2 LYS 77 HD2 LYS 77 23.192 19.361 -22.749 376 HD3 LYS 77 HD1 LYS 77 23.899 19.898 -21.229 377 HE2 LYS 77 HE2 LYS 77 24.878 17.739 -20.824 378 HE3 LYS 77 HE1 LYS 77 23.963 17.007 -22.140 379 HZ1 LYS 77 HZ1 LYS 77 25.806 17.411 -23.312 380 HZ2 LYS 77 HZ2 LYS 77 26.384 18.577 -22.219 381 HZ3 LYS 77 HZ3 LYS 77 25.233 19.005 -23.393 382 H VAL 78 HN VAL 78 20.174 16.561 -17.174 383 HA VAL 78 HA VAL 78 21.952 17.241 -14.930 384 HB VAL 78 HB VAL 78 19.857 17.103 -13.432 385 HG11 VAL 78 HG11 VAL 78 21.146 19.177 -13.854 386 HG12 VAL 78 HG12 VAL 78 19.418 19.503 -13.727 387 HG13 VAL 78 HG13 VAL 78 20.189 19.462 -15.310 388 HG21 VAL 78 HG21 VAL 78 17.743 17.574 -14.418 389 HG22 VAL 78 HG22 VAL 78 18.443 16.311 -15.440 390 HG23 VAL 78 HG23 VAL 78 18.473 17.989 -15.972 391 H ILE 79 HN ILE 79 21.943 15.597 -13.252 392 HA ILE 79 HA ILE 79 21.383 12.911 -14.366 393 HB ILE 79 HB ILE 79 23.264 13.752 -12.145 394 HG12 ILE 79 HG12 ILE 79 23.870 12.753 -14.943 395 HG13 ILE 79 HG11 ILE 79 23.863 14.462 -14.505 396 HG21 ILE 79 HG21 ILE 79 24.097 11.381 -12.515 397 HG22 ILE 79 HG22 ILE 79 22.656 11.113 -13.495 398 HG23 ILE 79 HG23 ILE 79 22.500 11.494 -11.783 399 HD11 ILE 79 HD11 ILE 79 25.558 13.973 -12.741 400 HD12 ILE 79 HD12 ILE 79 26.138 13.619 -14.368 401 HD13 ILE 79 HD13 ILE 79 25.619 12.304 -13.311 402 H CYS 80 HN CYS 80 20.543 11.282 -12.961 403 HA CYS 80 HA CYS 80 18.543 12.323 -11.119 404 HB2 CYS 80 HB2 CYS 80 17.537 10.180 -11.223 405 HB3 CYS 80 HB1 CYS 80 18.110 10.503 -12.861 406 H ARG 81 HN ARG 81 18.178 11.224 -9.040 407 HA ARG 81 HA ARG 81 20.486 11.405 -7.412 408 HB2 ARG 81 HB2 ARG 81 17.758 10.239 -6.821 409 HB3 ARG 81 HB1 ARG 81 18.999 10.573 -5.612 410 HG2 ARG 81 HG2 ARG 81 18.985 12.949 -6.216 411 HG3 ARG 81 HG1 ARG 81 17.782 12.638 -7.468 412 HD2 ARG 81 HD2 ARG 81 16.237 11.775 -5.706 413 HD3 ARG 81 HD1 ARG 81 17.424 12.228 -4.487 414 HE ARG 81 HE ARG 81 16.881 14.483 -6.091 415 HH11 ARG 81 HH21 ARG 81 15.384 12.384 -3.782 416 HH12 ARG 81 HH22 ARG 81 14.299 13.591 -3.181 417 HH21 ARG 81 HH11 ARG 81 15.449 16.067 -5.318 418 HH22 ARG 81 HH12 ARG 81 14.339 15.677 -4.048 419 H THR 82 HN THR 82 19.031 8.785 -9.157 420 HA THR 82 HA THR 82 20.144 6.646 -7.607 421 HB THR 82 HB THR 82 19.270 6.536 -10.493 422 HG1 THR 82 HG1 THR 82 17.385 7.015 -9.743 423 HG21 THR 82 HG21 THR 82 20.466 4.572 -9.593 424 HG22 THR 82 HG22 THR 82 18.776 4.209 -9.941 425 HG23 THR 82 HG23 THR 82 19.295 4.480 -8.277 426 H CYS 83 HN CYS 83 21.082 8.275 -10.620 427 HA CYS 83 HA CYS 83 23.489 6.682 -10.901 428 HB2 CYS 83 HB2 CYS 83 22.464 9.064 -12.454 429 HB3 CYS 83 HB1 CYS 83 23.889 8.112 -12.883 430 H GLN 84 HN GLN 84 22.586 9.463 -9.201 431 HA GLN 84 HA GLN 84 24.791 11.143 -9.357 432 HB2 GLN 84 HB2 GLN 84 22.647 10.597 -7.404 433 HB3 GLN 84 HB1 GLN 84 24.106 11.239 -6.660 434 HG2 GLN 84 HG2 GLN 84 22.864 12.518 -9.102 435 HG3 GLN 84 HG1 GLN 84 22.357 12.942 -7.463 436 HE21 GLN 84 HE21 GLN 84 23.380 14.855 -6.885 437 HE22 GLN 84 HE22 GLN 84 25.011 15.215 -7.189 438 HA PRO 85 HA PRO 85 26.958 8.684 -5.794 439 HB2 PRO 85 HB2 PRO 85 25.992 6.106 -5.371 440 HB3 PRO 85 HB1 PRO 85 25.510 7.529 -4.420 441 HG2 PRO 85 HG2 PRO 85 24.120 6.242 -6.736 442 HG3 PRO 85 HG1 PRO 85 23.440 6.855 -5.214 443 HD2 PRO 85 HD2 PRO 85 23.247 8.289 -7.460 444 HD3 PRO 85 HD1 PRO 85 23.561 9.089 -5.903 445 H LYS 86 HN LYS 86 28.743 8.450 -7.046 446 HA LYS 86 HA LYS 86 29.012 5.961 -8.612 447 HB2 LYS 86 HB2 LYS 86 29.704 8.760 -9.520 448 HB3 LYS 86 HB1 LYS 86 30.307 7.308 -10.312 449 HG2 LYS 86 HG2 LYS 86 27.356 7.791 -9.864 450 HG3 LYS 86 HG1 LYS 86 28.183 8.371 -11.305 451 HD2 LYS 86 HD2 LYS 86 28.980 5.934 -11.619 452 HD3 LYS 86 HD1 LYS 86 27.765 5.507 -10.417 453 HE2 LYS 86 HE2 LYS 86 26.018 6.553 -11.791 454 HE3 LYS 86 HE1 LYS 86 27.228 6.980 -13.003 455 HZ1 LYS 86 HZ1 LYS 86 26.534 4.999 -13.835 456 HZ2 LYS 86 HZ2 LYS 86 26.125 4.362 -12.314 457 HZ3 LYS 86 HZ3 LYS 86 27.752 4.428 -12.801 458 H GLN 87 HN GLN 87 30.082 5.365 -6.583 459 HA GLN 87 HA GLN 87 32.935 6.114 -6.692 460 HB2 GLN 87 HB2 GLN 87 31.197 6.052 -4.217 461 HB3 GLN 87 HB1 GLN 87 32.966 6.088 -4.184 462 HG2 GLN 87 HG2 GLN 87 32.934 8.193 -5.491 463 HG3 GLN 87 HG1 GLN 87 31.171 8.164 -5.475 464 HE21 GLN 87 HE21 GLN 87 30.537 9.768 -4.009 465 HE22 GLN 87 HE22 GLN 87 31.184 9.956 -2.451 466 H HIS 88 HN HIS 88 34.339 4.473 -6.241 467 HA HIS 88 HA HIS 88 33.340 1.914 -5.234 468 HB2 HIS 88 HB2 HIS 88 32.999 1.858 -7.713 469 HB3 HIS 88 HB1 HIS 88 34.736 2.106 -7.915 470 HD2 HIS 88 HD2 HIS 88 32.262 -0.742 -6.866 471 HE1 HIS 88 HE1 HIS 88 36.169 -2.337 -6.801 472 HE2 HIS 88 HE2 HIS 88 33.702 -2.907 -6.626 473 H ASP 89 HN ASP 89 34.720 2.436 -3.471 474 HA ASP 89 HA ASP 89 37.482 3.011 -3.748 475 HB2 ASP 89 HB2 ASP 89 36.159 3.421 -1.676 476 HB3 ASP 89 HB1 ASP 89 36.069 1.679 -1.427 477 H SER 90 HN SER 90 39.133 1.727 -4.240 478 HA SER 90 HA SER 90 38.912 -1.193 -3.831 479 HB2 SER 90 HB2 SER 90 40.006 -1.514 -6.064 480 HB3 SER 90 HB1 SER 90 38.365 -0.866 -6.165 481 HG SER 90 HG SER 90 39.143 1.034 -6.779 482 H ILE 91 HN ILE 91 40.969 -2.273 -3.785 483 HA ILE 91 HA ILE 91 43.253 -0.492 -3.125 484 HB ILE 91 HB ILE 91 42.444 -3.073 -1.758 485 HG12 ILE 91 HG12 ILE 91 42.621 -0.255 -0.651 486 HG13 ILE 91 HG11 ILE 91 41.112 -0.979 -1.226 487 HG21 ILE 91 HG21 ILE 91 44.863 -2.885 -1.863 488 HG22 ILE 91 HG22 ILE 91 44.347 -2.469 -0.227 489 HG23 ILE 91 HG23 ILE 91 44.793 -1.196 -1.367 490 HD11 ILE 91 HD11 ILE 91 42.880 -2.155 0.937 491 HD12 ILE 91 HD12 ILE 91 41.327 -2.787 0.396 492 HD13 ILE 91 HD13 ILE 91 41.403 -1.238 1.233 493 H TRP 92 HN TRP 92 45.116 -0.939 -4.103 494 HA TRP 92 HA TRP 92 45.195 -3.050 -6.093 495 HB2 TRP 92 HB2 TRP 92 46.151 -0.740 -6.453 496 HB3 TRP 92 HB1 TRP 92 47.416 -1.157 -5.289 497 HD1 TRP 92 HD1 TRP 92 48.761 -3.563 -5.933 498 HE1 TRP 92 HE1 TRP 92 49.611 -4.310 -8.239 499 HE3 TRP 92 HE3 TRP 92 45.859 -0.607 -8.916 500 HZ2 TRP 92 HZ2 TRP 92 49.116 -3.728 -11.002 501 HZ3 TRP 92 HZ3 TRP 92 46.067 -0.726 -11.382 502 HH2 TRP 92 HH2 TRP 92 47.690 -2.281 -12.428 503 H CYS 93 HN CYS 93 46.360 -4.908 -5.995 504 HA CYS 93 HA CYS 93 47.795 -5.502 -3.464 505 HB2 CYS 93 HB2 CYS 93 45.892 -6.929 -3.638 506 HB3 CYS 93 HB1 CYS 93 46.235 -7.297 -5.328 507 H THR 94 HN THR 94 49.861 -6.093 -3.565 508 HA THR 94 HA THR 94 51.186 -6.130 -6.172 509 HB THR 94 HB THR 94 53.220 -5.882 -4.962 510 HG1 THR 94 HG1 THR 94 52.672 -7.470 -3.353 511 HG21 THR 94 HG21 THR 94 52.779 -3.911 -3.591 512 HG22 THR 94 HG22 THR 94 51.080 -4.362 -3.450 513 HG23 THR 94 HG23 THR 94 51.741 -3.887 -5.015 514 H ALA 95 HN ALA 95 50.102 -8.301 -3.726 515 HA ALA 95 HA ALA 95 51.886 -10.460 -4.303 516 HB1 ALA 95 HB1 ALA 95 50.567 -10.165 -2.159 517 HB2 ALA 95 HB2 ALA 95 50.501 -11.777 -2.870 518 HB3 ALA 95 HB3 ALA 95 49.139 -10.673 -3.061 519 H CYS 96 HN CYS 96 48.685 -9.480 -5.438 520 HA CYS 96 HA CYS 96 48.567 -11.805 -7.247 521 HB2 CYS 96 HB2 CYS 96 46.454 -9.734 -6.589 522 HB3 CYS 96 HB1 CYS 96 46.226 -11.188 -7.567 523 H GLN 97 HN GLN 97 49.094 -8.397 -7.149 524 HA GLN 97 HA GLN 97 49.755 -6.906 -8.772 525 HB2 GLN 97 HB2 GLN 97 50.980 -9.041 -9.620 526 HB3 GLN 97 HB1 GLN 97 49.691 -9.121 -10.822 527 HG2 GLN 97 HG2 GLN 97 50.231 -6.843 -11.577 528 HG3 GLN 97 HG1 GLN 97 51.498 -6.732 -10.359 529 HE21 GLN 97 HE21 GLN 97 51.972 -6.540 -13.222 530 HE22 GLN 97 HE22 GLN 97 52.947 -7.859 -13.659 531 H GLN 98 HN GLN 98 46.985 -7.411 -8.163 532 HA GLN 98 HA GLN 98 45.798 -6.278 -10.586 533 HB2 GLN 98 HB2 GLN 98 45.404 -8.698 -10.812 534 HB3 GLN 98 HB1 GLN 98 44.666 -8.731 -9.210 535 HG2 GLN 98 HG2 GLN 98 42.844 -7.353 -9.920 536 HG3 GLN 98 HG1 GLN 98 43.644 -6.961 -11.443 537 HE21 GLN 98 HE21 GLN 98 41.014 -8.132 -11.312 538 HE22 GLN 98 HE22 GLN 98 41.105 -9.689 -11.985 539 H THR 99 HN THR 99 43.648 -5.384 -10.187 540 HA THR 99 HA THR 99 43.607 -3.977 -7.663 541 HB THR 99 HB THR 99 41.579 -3.931 -9.908 542 HG1 THR 99 HG1 THR 99 43.340 -1.854 -9.576 543 HG21 THR 99 HG21 THR 99 41.191 -1.615 -8.890 544 HG22 THR 99 HG22 THR 99 42.123 -2.182 -7.505 545 HG23 THR 99 HG23 THR 99 40.617 -2.988 -7.945 546 H LYS 100 HN LYS 100 42.210 -4.262 -5.979 547 HA LYS 100 HA LYS 100 40.132 -6.356 -6.233 548 HB2 LYS 100 HB2 LYS 100 42.457 -6.948 -5.015 549 HB3 LYS 100 HB1 LYS 100 41.656 -6.164 -3.662 550 HG2 LYS 100 HG2 LYS 100 40.932 -8.357 -3.360 551 HG3 LYS 100 HG1 LYS 100 39.619 -7.724 -4.349 552 HD2 LYS 100 HD2 LYS 100 40.689 -8.616 -6.374 553 HD3 LYS 100 HD1 LYS 100 42.040 -9.216 -5.413 554 HE2 LYS 100 HE2 LYS 100 40.486 -10.659 -4.144 555 HE3 LYS 100 HE1 LYS 100 39.150 -10.074 -5.136 556 HZ1 LYS 100 HZ1 LYS 100 39.781 -11.309 -6.876 557 HZ2 LYS 100 HZ2 LYS 100 40.606 -12.235 -5.714 558 HZ3 LYS 100 HZ3 LYS 100 41.436 -11.053 -6.610 559 H GLY 101 HN GLY 101 38.258 -5.956 -5.150 560 HA2 GLY 101 HA2 GLY 101 37.614 -3.308 -4.446 561 HA3 GLY 101 HA1 GLY 101 36.636 -4.725 -4.071 562 H ILE 102 HN ILE 102 36.953 -2.495 -2.395 563 HA ILE 102 HA ILE 102 38.858 -3.010 -0.324 564 HB ILE 102 HB ILE 102 37.877 -0.762 -0.782 565 HG12 ILE 102 HG12 ILE 102 37.254 -1.697 2.032 566 HG13 ILE 102 HG11 ILE 102 38.912 -1.509 1.447 567 HG21 ILE 102 HG21 ILE 102 35.440 -1.816 0.664 568 HG22 ILE 102 HG22 ILE 102 35.533 -1.733 -1.095 569 HG23 ILE 102 HG23 ILE 102 35.637 -0.257 -0.136 570 HD11 ILE 102 HD11 ILE 102 37.905 0.509 2.663 571 HD12 ILE 102 HD12 ILE 102 36.877 0.717 1.244 572 HD13 ILE 102 HD13 ILE 102 38.630 0.824 1.088 573 H ASN 103 HN ASN 103 35.549 -3.961 -0.929 574 HA ASN 103 HA ASN 103 34.824 -4.805 1.651 575 HB2 ASN 103 HB2 ASN 103 33.984 -5.767 -1.088 576 HB3 ASN 103 HB1 ASN 103 33.247 -6.350 0.403 577 HD21 ASN 103 HD21 ASN 103 31.718 -4.904 -1.535 578 HD22 ASN 103 HD22 ASN 103 31.286 -3.395 -0.856 579 H GLU 104 HN GLU 104 36.503 -6.505 -0.970 580 HA GLU 104 HA GLU 104 36.755 -8.945 0.606 581 HB2 GLU 104 HB2 GLU 104 37.779 -8.156 -2.127 582 HB3 GLU 104 HB1 GLU 104 38.073 -9.726 -1.379 583 HG2 GLU 104 HG2 GLU 104 35.666 -10.136 -1.216 584 HG3 GLU 104 HG1 GLU 104 35.330 -8.538 -1.888 585 H PHE 105 HN PHE 105 38.013 -6.300 1.401 586 HA PHE 105 HA PHE 105 40.766 -7.344 1.754 587 HB2 PHE 105 HB2 PHE 105 39.972 -4.969 0.376 588 HB3 PHE 105 HB1 PHE 105 40.718 -4.445 1.887 589 HD1 PHE 105 HD2 PHE 105 43.035 -5.162 2.448 590 HD2 PHE 105 HD1 PHE 105 41.249 -6.003 -1.360 591 HE1 PHE 105 HE2 PHE 105 45.267 -5.666 1.511 592 HE2 PHE 105 HE1 PHE 105 43.474 -6.499 -2.296 593 HZ PHE 105 HZ PHE 105 45.492 -6.333 -0.870 594 H SER 106 HN SER 106 41.711 -7.045 3.724 595 HA SER 106 HA SER 106 39.914 -6.692 5.946 596 HB2 SER 106 HB2 SER 106 41.572 -8.373 6.213 597 HB3 SER 106 HB1 SER 106 42.866 -7.277 5.718 598 HG SER 106 HG SER 106 41.354 -6.374 7.826 599 H LYS 107 HN LYS 107 40.215 -5.172 7.646 600 HA LYS 107 HA LYS 107 40.779 -2.511 6.703 601 HB2 LYS 107 HB2 LYS 107 40.004 -3.598 9.411 602 HB3 LYS 107 HB1 LYS 107 40.244 -1.883 9.076 603 HG2 LYS 107 HG2 LYS 107 38.509 -1.932 7.359 604 HG3 LYS 107 HG1 LYS 107 38.314 -3.673 7.572 605 HD2 LYS 107 HD2 LYS 107 36.553 -2.711 8.844 606 HD3 LYS 107 HD1 LYS 107 37.778 -3.160 10.028 607 HE2 LYS 107 HE2 LYS 107 38.521 -0.902 10.265 608 HE3 LYS 107 HE1 LYS 107 37.638 -0.380 8.829 609 HZ1 LYS 107 HZ1 LYS 107 36.409 -1.393 11.335 610 HZ2 LYS 107 HZ2 LYS 107 35.569 -0.856 9.958 611 HZ3 LYS 107 HZ3 LYS 107 36.496 0.236 10.871 612 H ALA 108 HN ALA 108 42.318 -4.801 8.911 613 HA ALA 108 HA ALA 108 44.323 -3.083 9.901 614 HB1 ALA 108 HB1 ALA 108 45.415 -5.059 10.690 615 HB2 ALA 108 HB2 ALA 108 44.591 -6.065 9.500 616 HB3 ALA 108 HB3 ALA 108 43.680 -5.346 10.827 617 H GLN 109 HN GLN 109 44.144 -5.078 6.999 618 HA GLN 109 HA GLN 109 46.846 -4.983 6.246 619 HB2 GLN 109 HB2 GLN 109 44.249 -5.550 4.936 620 HB3 GLN 109 HB1 GLN 109 45.499 -4.981 3.825 621 HG2 GLN 109 HG2 GLN 109 45.460 -7.467 4.079 622 HG3 GLN 109 HG1 GLN 109 47.007 -6.747 4.543 623 HE21 GLN 109 HE21 GLN 109 47.504 -8.499 6.034 624 HE22 GLN 109 HE22 GLN 109 46.669 -8.674 7.500 625 H ARG 110 HN ARG 110 44.174 -2.841 5.237 626 HA ARG 110 HA ARG 110 45.410 -1.091 3.586 627 HB2 ARG 110 HB2 ARG 110 43.510 -0.418 5.842 628 HB3 ARG 110 HB1 ARG 110 43.945 0.697 4.546 629 HG2 ARG 110 HG2 ARG 110 43.063 -0.845 2.870 630 HG3 ARG 110 HG1 ARG 110 42.704 -2.038 4.124 631 HD2 ARG 110 HD2 ARG 110 40.663 -0.823 3.570 632 HD3 ARG 110 HD1 ARG 110 41.175 -0.390 5.204 633 HE ARG 110 HE ARG 110 42.268 1.432 3.305 634 HH11 ARG 110 HH21 ARG 110 39.339 0.501 4.893 635 HH12 ARG 110 HH22 ARG 110 38.625 2.076 4.803 636 HH21 ARG 110 HH11 ARG 110 41.339 3.501 3.182 637 HH22 ARG 110 HH12 ARG 110 39.758 3.774 3.833 638 H HIS 111 HN HIS 111 46.091 -1.552 6.941 639 HA HIS 111 HA HIS 111 47.393 0.920 7.471 640 HB2 HIS 111 HB2 HIS 111 46.577 -0.763 9.188 641 HB3 HIS 111 HB1 HIS 111 48.006 -1.727 8.790 642 HD2 HIS 111 HD2 HIS 111 47.118 1.608 10.645 643 HE1 HIS 111 HE1 HIS 111 51.269 0.958 11.050 644 HE2 HIS 111 HE2 HIS 111 49.320 2.401 11.804 645 H VAL 112 HN VAL 112 48.540 -2.225 6.315 646 HA VAL 112 HA VAL 112 51.305 -1.598 6.353 647 HB VAL 112 HB VAL 112 51.586 -3.579 5.000 648 HG11 VAL 112 HG11 VAL 112 50.590 -5.172 6.483 649 HG12 VAL 112 HG12 VAL 112 49.264 -4.076 6.879 650 HG13 VAL 112 HG13 VAL 112 50.901 -3.724 7.441 651 HG21 VAL 112 HG21 VAL 112 50.057 -4.276 3.452 652 HG22 VAL 112 HG22 VAL 112 49.068 -2.879 3.834 653 HG23 VAL 112 HG23 VAL 112 48.792 -4.400 4.665 654 H LEU 113 HN LEU 113 52.674 -1.450 4.368 655 HA LEU 113 HA LEU 113 51.611 0.612 2.601 656 HB2 LEU 113 HB2 LEU 113 54.360 -0.648 2.595 657 HB3 LEU 113 HB1 LEU 113 53.880 0.891 1.867 658 HG LEU 113 HG LEU 113 53.799 0.251 4.831 659 HD11 LEU 113 HD11 LEU 113 55.665 2.000 3.203 660 HD12 LEU 113 HD12 LEU 113 56.091 0.488 4.003 661 HD13 LEU 113 HD13 LEU 113 55.651 1.900 4.964 662 HD21 LEU 113 HD21 LEU 113 52.105 1.853 4.497 663 HD22 LEU 113 HD22 LEU 113 52.977 2.644 3.182 664 HD23 LEU 113 HD23 LEU 113 53.509 2.857 4.849 665 H ASP 114 HN ASP 114 51.707 -2.745 2.594 666 HA ASP 114 HA ASP 114 51.313 -2.811 -0.339 667 HB2 ASP 114 HB2 ASP 114 52.479 -5.067 -0.285 668 HB3 ASP 114 HB1 ASP 114 53.523 -3.661 -0.090 669 HA PRO 115 HA PRO 115 47.774 -4.623 2.119 670 HB2 PRO 115 HB2 PRO 115 46.412 -3.620 -0.347 671 HB3 PRO 115 HB1 PRO 115 45.920 -3.456 1.349 672 HG2 PRO 115 HG2 PRO 115 46.932 -1.397 -0.007 673 HG3 PRO 115 HG1 PRO 115 47.303 -1.646 1.713 674 HD2 PRO 115 HD2 PRO 115 49.036 -2.151 -0.682 675 HD3 PRO 115 HD1 PRO 115 49.494 -1.609 0.952 676 H ARG 116 HN ARG 116 47.076 -6.665 1.860 677 HA ARG 116 HA ARG 116 47.377 -7.975 -0.795 678 HB2 ARG 116 HB2 ARG 116 47.733 -9.414 1.833 679 HB3 ARG 116 HB1 ARG 116 48.247 -9.914 0.215 680 HG2 ARG 116 HG2 ARG 116 49.874 -8.052 0.165 681 HG3 ARG 116 HG1 ARG 116 49.372 -7.567 1.780 682 HD2 ARG 116 HD2 ARG 116 50.469 -10.307 1.111 683 HD3 ARG 116 HD1 ARG 116 51.449 -8.980 1.743 684 HE ARG 116 HE ARG 116 49.242 -9.320 3.450 685 HH11 ARG 116 HH21 ARG 116 52.073 -10.989 2.376 686 HH12 ARG 116 HH22 ARG 116 52.282 -11.871 3.852 687 HH21 ARG 116 HH11 ARG 116 49.507 -10.469 5.389 688 HH22 ARG 116 HH12 ARG 116 50.828 -11.576 5.559 689 H CYS 117 HN CYS 117 45.670 -9.066 -1.534 690 HA CYS 117 HA CYS 117 43.128 -8.822 -0.339 691 HB2 CYS 117 HB2 CYS 117 43.598 -11.076 -2.255 692 HB3 CYS 117 HB1 CYS 117 42.320 -9.858 -2.237 693 H GLN 118 HN GLN 118 41.764 -10.400 0.595 694 HA GLN 118 HA GLN 118 42.917 -11.989 2.580 695 HB2 GLN 118 HB2 GLN 118 40.195 -12.147 1.288 696 HB3 GLN 118 HB1 GLN 118 40.665 -13.097 2.707 697 HG2 GLN 118 HG2 GLN 118 41.213 -11.016 3.916 698 HG3 GLN 118 HG1 GLN 118 40.720 -10.073 2.511 699 HE21 GLN 118 HE21 GLN 118 39.205 -9.287 4.469 700 HE22 GLN 118 HE22 GLN 118 37.706 -10.076 4.557 701 H ILE 119 HN ILE 119 42.873 -12.536 -0.725 702 HA ILE 119 HA ILE 119 42.805 -15.450 -0.588 703 HB ILE 119 HB ILE 119 43.367 -13.614 -2.919 704 HG12 ILE 119 HG12 ILE 119 41.042 -13.517 -1.686 705 HG13 ILE 119 HG11 ILE 119 41.081 -13.647 -3.440 706 HG21 ILE 119 HG21 ILE 119 42.928 -16.587 -2.650 707 HG22 ILE 119 HG22 ILE 119 44.209 -15.734 -3.511 708 HG23 ILE 119 HG23 ILE 119 42.570 -15.748 -4.160 709 HD11 ILE 119 HD11 ILE 119 40.966 -16.134 -1.736 710 HD12 ILE 119 HD12 ILE 119 40.482 -15.920 -3.412 711 HD13 ILE 119 HD13 ILE 119 39.500 -15.240 -2.116 712 H CYS 120 HN CYS 120 45.189 -12.896 -1.175 713 HA CYS 120 HA CYS 120 47.318 -14.741 -1.757 714 HB2 CYS 120 HB2 CYS 120 48.605 -12.395 -1.125 715 HB3 CYS 120 HB1 CYS 120 47.925 -12.747 -2.716 716 H VAL 121 HN VAL 121 46.031 -13.240 1.118 717 HA VAL 121 HA VAL 121 48.319 -13.723 2.771 718 HB VAL 121 HB VAL 121 46.903 -13.100 4.618 719 HG11 VAL 121 HG11 VAL 121 45.847 -10.980 3.636 720 HG12 VAL 121 HG12 VAL 121 46.408 -11.546 2.066 721 HG13 VAL 121 HG13 VAL 121 47.572 -11.199 3.342 722 HG21 VAL 121 HG21 VAL 121 44.666 -13.580 2.647 723 HG22 VAL 121 HG22 VAL 121 44.438 -12.706 4.160 724 HG23 VAL 121 HG23 VAL 121 44.927 -14.396 4.184 725 H HIS 122 HN HIS 122 45.311 -15.454 2.114 726 HA HIS 122 HA HIS 122 45.936 -17.574 3.988 727 HB2 HIS 122 HB2 HIS 122 43.588 -16.768 3.388 728 HB3 HIS 122 HB1 HIS 122 43.802 -17.612 1.849 729 HD2 HIS 122 HD2 HIS 122 43.393 -18.481 5.664 730 HE1 HIS 122 HE1 HIS 122 43.213 -22.082 3.464 731 HE2 HIS 122 HE2 HIS 122 42.932 -21.051 5.770 732 H SER 123 HN SER 123 47.117 -16.774 1.024 733 HA SER 123 HA SER 123 47.229 -19.466 -0.101 734 HB2 SER 123 HB2 SER 123 46.973 -17.484 -1.572 735 HB3 SER 123 HB1 SER 123 48.550 -16.908 -1.040 736 HG SER 123 HG SER 123 47.977 -18.675 -2.942 737 H GLN 124 HN GLN 124 49.793 -17.044 0.448 738 HA GLN 124 HA GLN 124 51.431 -19.091 1.803 739 HB2 GLN 124 HB2 GLN 124 52.262 -17.481 -0.620 740 HB3 GLN 124 HB1 GLN 124 53.392 -18.354 0.416 741 HG2 GLN 124 HG2 GLN 124 52.194 -20.459 -0.042 742 HG3 GLN 124 HG1 GLN 124 51.055 -19.592 -1.070 743 HE21 GLN 124 HE21 GLN 124 51.579 -20.196 -3.186 744 HE22 GLN 124 HE22 GLN 124 53.149 -20.166 -3.833 745 H ARG 125 HN ARG 125 50.018 -16.861 2.881 746 HA ARG 125 HA ARG 125 50.314 -14.942 4.134 747 HB2 ARG 125 HB2 ARG 125 52.892 -16.432 4.683 748 HB3 ARG 125 HB1 ARG 125 52.294 -15.072 5.642 749 HG2 ARG 125 HG2 ARG 125 50.259 -16.320 6.191 750 HG3 ARG 125 HG1 ARG 125 50.789 -17.666 5.178 751 HD2 ARG 125 HD2 ARG 125 51.317 -18.181 7.494 752 HD3 ARG 125 HD1 ARG 125 52.819 -17.891 6.620 753 HE ARG 125 HE ARG 125 51.917 -15.468 7.783 754 HH11 ARG 125 HH21 ARG 125 53.244 -18.564 8.576 755 HH12 ARG 125 HH22 ARG 125 54.042 -18.009 10.010 756 HH21 ARG 125 HH11 ARG 125 52.959 -14.733 9.662 757 HH22 ARG 125 HH12 ARG 125 53.880 -15.839 10.625 758 H ASN 126 HN ASN 126 53.759 -15.098 3.832 759 HA ASN 126 HA ASN 126 54.046 -12.447 2.984 760 HB2 ASN 126 HB2 ASN 126 55.917 -14.813 2.797 761 HB3 ASN 126 HB1 ASN 126 56.392 -13.172 2.366 762 HD21 ASN 126 HD21 ASN 126 57.642 -14.552 4.542 763 HD22 ASN 126 HD22 ASN 126 57.206 -13.773 5.986 Start of MODEL 3 1 H MET 31 HT1 MET 31 -0.207 18.279 -20.899 2 HA MET 31 HA MET 31 -0.876 21.116 -20.943 3 HB2 MET 31 HB2 MET 31 -2.272 18.999 -22.602 4 HB3 MET 31 HB1 MET 31 -3.008 20.545 -22.169 5 HG2 MET 31 HG2 MET 31 -1.121 21.729 -23.259 6 HG3 MET 31 HG1 MET 31 -0.433 20.175 -23.730 7 HE1 MET 31 HE1 MET 31 -0.360 20.543 -26.217 8 HE2 MET 31 HE2 MET 31 -0.792 22.214 -25.864 9 HE3 MET 31 HE3 MET 31 -1.628 21.348 -27.150 10 H GLY 32 HN GLY 32 -2.247 21.517 -19.278 11 HA2 GLY 32 HA2 GLY 32 -3.737 21.131 -17.544 12 HA3 GLY 32 HA1 GLY 32 -3.941 19.485 -18.132 13 H LYS 33 HN LYS 33 -0.738 20.681 -17.553 14 HA LYS 33 HA LYS 33 -0.585 19.161 -15.005 15 HB2 LYS 33 HB2 LYS 33 1.420 19.198 -17.276 16 HB3 LYS 33 HB1 LYS 33 1.700 18.466 -15.697 17 HG2 LYS 33 HG2 LYS 33 -0.313 17.025 -16.059 18 HG3 LYS 33 HG1 LYS 33 -0.447 17.686 -17.689 19 HD2 LYS 33 HD2 LYS 33 1.988 16.235 -16.605 20 HD3 LYS 33 HD1 LYS 33 0.766 15.514 -17.653 21 HE2 LYS 33 HE2 LYS 33 2.332 16.161 -19.239 22 HE3 LYS 33 HE1 LYS 33 1.338 17.617 -19.193 23 HZ1 LYS 33 HZ1 LYS 33 2.944 18.783 -18.165 24 HZ2 LYS 33 HZ2 LYS 33 3.974 17.613 -18.837 25 HZ3 LYS 33 HZ3 LYS 33 3.468 17.474 -17.222 26 H ASN 34 HN ASN 34 0.699 20.014 -13.416 27 HA ASN 34 HA ASN 34 1.211 22.838 -13.541 28 HB2 ASN 34 HB2 ASN 34 0.476 21.583 -11.484 29 HB3 ASN 34 HB1 ASN 34 2.098 20.889 -11.406 30 HD21 ASN 34 HD21 ASN 34 0.215 23.809 -10.877 31 HD22 ASN 34 HD22 ASN 34 1.486 24.734 -10.234 32 H ASP 35 HN ASP 35 3.319 23.795 -12.995 33 HA ASP 35 HA ASP 35 5.342 22.973 -14.775 34 HB2 ASP 35 HB2 ASP 35 4.979 25.295 -13.807 35 HB3 ASP 35 HB1 ASP 35 5.757 24.706 -12.336 36 H ASN 36 HN ASN 36 4.939 22.509 -11.286 37 HA ASN 36 HA ASN 36 7.451 21.288 -10.812 38 HB2 ASN 36 HB2 ASN 36 4.820 21.085 -9.338 39 HB3 ASN 36 HB1 ASN 36 6.332 20.393 -8.751 40 HD21 ASN 36 HD21 ASN 36 7.908 22.731 -9.905 41 HD22 ASN 36 HD22 ASN 36 7.615 24.015 -8.834 42 H ASP 37 HN ASP 37 4.327 20.039 -11.840 43 HA ASP 37 HA ASP 37 4.900 17.292 -11.530 44 HB2 ASP 37 HB2 ASP 37 2.621 18.298 -11.891 45 HB3 ASP 37 HB1 ASP 37 3.060 18.525 -13.582 46 H ALA 38 HN ALA 38 6.607 19.365 -13.266 47 HA ALA 38 HA ALA 38 6.852 18.238 -15.838 48 HB1 ALA 38 HB1 ALA 38 9.081 19.351 -15.869 49 HB2 ALA 38 HB2 ALA 38 8.877 19.728 -14.158 50 HB3 ALA 38 HB3 ALA 38 7.782 20.426 -15.352 51 H LEU 39 HN LEU 39 8.274 16.697 -16.680 52 HA LEU 39 HA LEU 39 9.552 14.921 -14.675 53 HB2 LEU 39 HB2 LEU 39 8.315 14.278 -17.355 54 HB3 LEU 39 HB1 LEU 39 9.246 13.128 -16.397 55 HG LEU 39 HG LEU 39 6.869 14.587 -15.221 56 HD11 LEU 39 HD11 LEU 39 6.845 11.911 -16.658 57 HD12 LEU 39 HD12 LEU 39 6.137 13.402 -17.282 58 HD13 LEU 39 HD13 LEU 39 5.478 12.653 -15.826 59 HD21 LEU 39 HD21 LEU 39 8.096 13.525 -13.515 60 HD22 LEU 39 HD22 LEU 39 8.481 12.128 -14.521 61 HD23 LEU 39 HD23 LEU 39 6.845 12.345 -13.903 62 H ILE 40 HN ILE 40 11.671 14.712 -14.784 63 HA ILE 40 HA ILE 40 13.092 15.753 -17.169 64 HB ILE 40 HB ILE 40 14.328 15.242 -14.460 65 HG12 ILE 40 HG12 ILE 40 13.967 17.922 -14.455 66 HG13 ILE 40 HG11 ILE 40 12.525 17.474 -15.364 67 HG21 ILE 40 HG21 ILE 40 15.028 17.189 -16.681 68 HG22 ILE 40 HG22 ILE 40 15.743 15.584 -16.519 69 HG23 ILE 40 HG23 ILE 40 16.004 16.796 -15.265 70 HD11 ILE 40 HD11 ILE 40 13.244 16.864 -12.516 71 HD12 ILE 40 HD12 ILE 40 12.279 15.677 -13.394 72 HD13 ILE 40 HD13 ILE 40 11.689 17.331 -13.206 73 H MET 41 HN MET 41 14.149 14.411 -18.409 74 HA MET 41 HA MET 41 14.326 11.581 -17.705 75 HB2 MET 41 HB2 MET 41 13.569 12.254 -19.959 76 HB3 MET 41 HB1 MET 41 15.130 13.023 -20.243 77 HG2 MET 41 HG2 MET 41 16.281 10.892 -20.000 78 HG3 MET 41 HG1 MET 41 14.772 10.092 -19.557 79 HE1 MET 41 HE1 MET 41 14.655 8.380 -22.807 80 HE2 MET 41 HE2 MET 41 13.773 8.542 -21.290 81 HE3 MET 41 HE3 MET 41 15.527 8.378 -21.266 82 H CYS 42 HN CYS 42 16.129 10.556 -17.080 83 HA CYS 42 HA CYS 42 18.516 12.112 -16.553 84 HB2 CYS 42 HB2 CYS 42 17.564 10.333 -15.018 85 HB3 CYS 42 HB1 CYS 42 18.123 9.139 -16.195 86 H MET 43 HN MET 43 20.174 12.303 -17.927 87 HA MET 43 HA MET 43 20.189 10.959 -20.440 88 HB2 MET 43 HB2 MET 43 22.622 11.971 -20.458 89 HB3 MET 43 HB1 MET 43 21.224 13.043 -20.529 90 HG2 MET 43 HG2 MET 43 21.396 13.614 -18.234 91 HG3 MET 43 HG1 MET 43 22.469 12.253 -17.893 92 HE1 MET 43 HE1 MET 43 24.752 11.982 -19.418 93 HE2 MET 43 HE2 MET 43 24.823 12.384 -17.705 94 HE3 MET 43 HE3 MET 43 25.884 13.215 -18.843 95 H ARG 44 HN ARG 44 20.829 9.705 -17.483 96 HA ARG 44 HA ARG 44 22.997 7.921 -18.441 97 HB2 ARG 44 HB2 ARG 44 22.135 8.768 -15.670 98 HB3 ARG 44 HB1 ARG 44 23.244 7.424 -15.954 99 HG2 ARG 44 HG2 ARG 44 23.899 9.988 -17.354 100 HG3 ARG 44 HG1 ARG 44 24.083 9.991 -15.601 101 HD2 ARG 44 HD2 ARG 44 26.184 9.325 -16.667 102 HD3 ARG 44 HD1 ARG 44 25.513 7.979 -15.744 103 HE ARG 44 HE ARG 44 24.786 8.028 -18.563 104 HH11 ARG 44 HH21 ARG 44 26.967 6.951 -16.102 105 HH12 ARG 44 HH22 ARG 44 27.562 5.609 -17.021 106 HH21 ARG 44 HH11 ARG 44 25.557 6.270 -19.774 107 HH22 ARG 44 HH12 ARG 44 26.761 5.223 -19.102 108 H CYS 45 HN CYS 45 20.871 7.329 -15.726 109 HA CYS 45 HA CYS 45 20.325 4.673 -16.613 110 HB2 CYS 45 HB2 CYS 45 18.954 4.491 -14.605 111 HB3 CYS 45 HB1 CYS 45 20.477 5.291 -14.221 112 H ARG 46 HN ARG 46 19.295 7.224 -18.104 113 HA ARG 46 HA ARG 46 17.328 7.922 -19.147 114 HB2 ARG 46 HB2 ARG 46 17.165 4.925 -19.508 115 HB3 ARG 46 HB1 ARG 46 16.350 6.131 -20.508 116 HG2 ARG 46 HG2 ARG 46 19.350 6.164 -20.143 117 HG3 ARG 46 HG1 ARG 46 18.590 5.149 -21.371 118 HD2 ARG 46 HD2 ARG 46 17.439 7.209 -22.259 119 HD3 ARG 46 HD1 ARG 46 18.398 8.167 -21.136 120 HE ARG 46 HE ARG 46 20.017 6.452 -22.781 121 HH11 ARG 46 HH21 ARG 46 18.312 9.446 -22.571 122 HH12 ARG 46 HH22 ARG 46 19.284 10.249 -23.758 123 HH21 ARG 46 HH11 ARG 46 21.307 7.493 -24.348 124 HH22 ARG 46 HH12 ARG 46 20.981 9.143 -24.766 125 H LYS 47 HN LYS 47 16.988 7.590 -16.317 126 HA LYS 47 HA LYS 47 14.335 6.372 -16.013 127 HB2 LYS 47 HB2 LYS 47 16.087 5.993 -14.290 128 HB3 LYS 47 HB1 LYS 47 16.104 7.725 -13.959 129 HG2 LYS 47 HG2 LYS 47 13.737 7.655 -13.330 130 HG3 LYS 47 HG1 LYS 47 13.668 5.935 -13.720 131 HD2 LYS 47 HD2 LYS 47 15.366 5.477 -11.984 132 HD3 LYS 47 HD1 LYS 47 15.414 7.195 -11.585 133 HE2 LYS 47 HE2 LYS 47 13.017 7.128 -11.001 134 HE3 LYS 47 HE1 LYS 47 12.972 5.409 -11.393 135 HZ1 LYS 47 HZ1 LYS 47 13.534 5.078 -9.283 136 HZ2 LYS 47 HZ2 LYS 47 13.927 6.711 -9.033 137 HZ3 LYS 47 HZ3 LYS 47 15.079 5.647 -9.685 138 H VAL 48 HN VAL 48 12.545 7.517 -16.199 139 HA VAL 48 HA VAL 48 12.688 10.466 -16.226 140 HB VAL 48 HB VAL 48 10.504 8.573 -17.145 141 HG11 VAL 48 HG11 VAL 48 10.800 11.587 -17.240 142 HG12 VAL 48 HG12 VAL 48 9.518 10.664 -16.459 143 HG13 VAL 48 HG13 VAL 48 9.633 10.697 -18.218 144 HG21 VAL 48 HG21 VAL 48 11.232 9.163 -19.384 145 HG22 VAL 48 HG22 VAL 48 12.639 8.596 -18.486 146 HG23 VAL 48 HG23 VAL 48 12.397 10.324 -18.745 147 H LYS 49 HN LYS 49 11.828 11.647 -14.644 148 HA LYS 49 HA LYS 49 9.653 10.734 -13.012 149 HB2 LYS 49 HB2 LYS 49 12.400 10.317 -12.113 150 HB3 LYS 49 HB1 LYS 49 11.508 11.345 -10.998 151 HG2 LYS 49 HG2 LYS 49 10.336 8.744 -11.997 152 HG3 LYS 49 HG1 LYS 49 11.408 8.796 -10.591 153 HD2 LYS 49 HD2 LYS 49 9.908 10.407 -9.490 154 HD3 LYS 49 HD1 LYS 49 8.833 10.380 -10.888 155 HE2 LYS 49 HE2 LYS 49 8.447 7.962 -10.544 156 HE3 LYS 49 HE1 LYS 49 9.510 7.996 -9.135 157 HZ1 LYS 49 HZ1 LYS 49 7.762 8.599 -7.940 158 HZ2 LYS 49 HZ2 LYS 49 6.784 8.731 -9.324 159 HZ3 LYS 49 HZ3 LYS 49 7.705 10.059 -8.801 160 H GLY 50 HN GLY 50 9.277 12.359 -11.195 161 HA2 GLY 50 HA2 GLY 50 9.467 15.043 -12.348 162 HA3 GLY 50 HA1 GLY 50 8.400 14.539 -11.041 163 H ILE 51 HN ILE 51 9.338 16.690 -10.242 164 HA ILE 51 HA ILE 51 11.960 17.045 -9.415 165 HB ILE 51 HB ILE 51 10.107 18.723 -9.297 166 HG12 ILE 51 HG12 ILE 51 11.481 18.389 -6.622 167 HG13 ILE 51 HG11 ILE 51 12.345 18.908 -8.071 168 HG21 ILE 51 HG21 ILE 51 9.435 17.392 -6.666 169 HG22 ILE 51 HG22 ILE 51 8.532 17.077 -8.149 170 HG23 ILE 51 HG23 ILE 51 8.571 18.704 -7.468 171 HD11 ILE 51 HD11 ILE 51 11.444 20.780 -6.587 172 HD12 ILE 51 HD12 ILE 51 9.832 20.274 -7.096 173 HD13 ILE 51 HD13 ILE 51 10.989 20.861 -8.289 174 H ASP 52 HN ASP 52 9.965 14.532 -8.456 175 HA ASP 52 HA ASP 52 10.705 14.272 -5.708 176 HB2 ASP 52 HB2 ASP 52 8.701 13.185 -6.567 177 HB3 ASP 52 HB1 ASP 52 9.668 12.251 -7.707 178 H SER 53 HN SER 53 11.787 12.725 -8.711 179 HA SER 53 HA SER 53 14.030 11.439 -7.310 180 HB2 SER 53 HB2 SER 53 14.365 10.118 -9.191 181 HB3 SER 53 HB1 SER 53 12.625 10.393 -9.243 182 HG SER 53 HG SER 53 14.635 11.287 -10.904 183 H TYR 54 HN TYR 54 13.528 14.462 -8.342 184 HA TYR 54 HA TYR 54 16.363 14.862 -9.138 185 HB2 TYR 54 HB2 TYR 54 13.831 15.910 -10.337 186 HB3 TYR 54 HB1 TYR 54 15.174 17.048 -10.224 187 HD1 TYR 54 HD1 TYR 54 14.332 13.591 -11.422 188 HD2 TYR 54 HD2 TYR 54 16.920 16.995 -11.802 189 HE1 TYR 54 HE1 TYR 54 15.420 12.541 -13.382 190 HE2 TYR 54 HE2 TYR 54 18.005 15.945 -13.746 191 HH TYR 54 HH TYR 54 16.839 12.877 -15.095 192 H SER 55 HN SER 55 17.493 16.325 -8.018 193 HA SER 55 HA SER 55 16.463 17.377 -5.575 194 HB2 SER 55 HB2 SER 55 19.032 17.957 -7.072 195 HB3 SER 55 HB1 SER 55 18.682 18.496 -5.428 196 HG SER 55 HG SER 55 18.432 15.782 -6.154 197 H LYS 56 HN LYS 56 16.423 19.658 -5.006 198 HA LYS 56 HA LYS 56 14.844 21.199 -6.741 199 HB2 LYS 56 HB2 LYS 56 14.977 21.455 -4.261 200 HB3 LYS 56 HB1 LYS 56 16.570 22.184 -4.453 201 HG2 LYS 56 HG2 LYS 56 15.554 23.932 -5.918 202 HG3 LYS 56 HG1 LYS 56 13.964 23.240 -5.593 203 HD2 LYS 56 HD2 LYS 56 15.833 24.204 -3.409 204 HD3 LYS 56 HD1 LYS 56 14.595 25.225 -4.139 205 HE2 LYS 56 HE2 LYS 56 12.922 23.386 -3.510 206 HE3 LYS 56 HE1 LYS 56 14.206 22.709 -2.507 207 HZ1 LYS 56 HZ1 LYS 56 12.483 24.716 -1.796 208 HZ2 LYS 56 HZ2 LYS 56 13.941 25.520 -2.127 209 HZ3 LYS 56 HZ3 LYS 56 13.901 24.270 -0.978 210 H THR 57 HN THR 57 18.320 21.278 -6.042 211 HA THR 57 HA THR 57 18.941 23.567 -7.565 212 HB THR 57 HB THR 57 20.743 23.016 -6.237 213 HG1 THR 57 HG1 THR 57 21.905 21.324 -7.931 214 HG21 THR 57 HG21 THR 57 19.961 20.155 -6.798 215 HG22 THR 57 HG22 THR 57 19.982 21.007 -5.252 216 HG23 THR 57 HG23 THR 57 21.499 20.561 -6.032 217 H GLN 58 HN GLN 58 19.119 20.105 -8.424 218 HA GLN 58 HA GLN 58 19.957 20.515 -11.092 219 HB2 GLN 58 HB2 GLN 58 18.509 18.214 -9.773 220 HB3 GLN 58 HB1 GLN 58 19.108 18.171 -11.432 221 HG2 GLN 58 HG2 GLN 58 21.390 18.609 -10.642 222 HG3 GLN 58 HG1 GLN 58 20.806 18.706 -8.980 223 HE21 GLN 58 HE21 GLN 58 22.638 16.807 -9.115 224 HE22 GLN 58 HE22 GLN 58 21.981 15.246 -9.272 225 H TRP 59 HN TRP 59 16.745 20.122 -9.649 226 HA TRP 59 HA TRP 59 15.284 20.106 -12.062 227 HB2 TRP 59 HB2 TRP 59 14.325 19.363 -9.921 228 HB3 TRP 59 HB1 TRP 59 14.424 21.012 -9.298 229 HD1 TRP 59 HD1 TRP 59 12.812 19.127 -12.262 230 HE1 TRP 59 HE1 TRP 59 10.563 20.261 -12.820 231 HE3 TRP 59 HE3 TRP 59 12.938 22.994 -8.937 232 HZ2 TRP 59 HZ2 TRP 59 9.035 22.523 -11.976 233 HZ3 TRP 59 HZ3 TRP 59 11.074 24.626 -8.837 234 HH2 TRP 59 HH2 TRP 59 9.123 24.394 -10.348 235 H SER 60 HN SER 60 16.420 22.703 -9.955 236 HA SER 60 HA SER 60 14.954 24.833 -11.062 237 HB2 SER 60 HB2 SER 60 16.047 25.319 -9.042 238 HB3 SER 60 HB1 SER 60 17.580 24.662 -9.607 239 HG SER 60 HG SER 60 16.322 27.103 -10.221 240 H LYS 61 HN LYS 61 17.657 23.053 -12.278 241 HA LYS 61 HA LYS 61 18.562 25.075 -14.123 242 HB2 LYS 61 HB2 LYS 61 19.095 22.096 -13.994 243 HB3 LYS 61 HB1 LYS 61 19.917 23.224 -15.075 244 HG2 LYS 61 HG2 LYS 61 20.763 24.487 -13.160 245 HG3 LYS 61 HG1 LYS 61 19.900 23.419 -12.055 246 HD2 LYS 61 HD2 LYS 61 21.213 21.498 -12.929 247 HD3 LYS 61 HD1 LYS 61 22.124 22.615 -13.949 248 HE2 LYS 61 HE2 LYS 61 22.868 23.839 -11.949 249 HE3 LYS 61 HE1 LYS 61 21.950 22.730 -10.929 250 HZ1 LYS 61 HZ1 LYS 61 24.078 21.850 -12.796 251 HZ2 LYS 61 HZ2 LYS 61 23.309 20.927 -11.593 252 HZ3 LYS 61 HZ3 LYS 61 24.358 22.192 -11.159 253 H THR 62 HN THR 62 15.914 23.015 -14.007 254 HA THR 62 HA THR 62 15.673 22.329 -16.773 255 HB THR 62 HB THR 62 13.375 21.707 -16.220 256 HG1 THR 62 HG1 THR 62 12.421 22.410 -14.450 257 HG21 THR 62 HG21 THR 62 15.512 20.991 -14.213 258 HG22 THR 62 HG22 THR 62 14.953 20.049 -15.595 259 HG23 THR 62 HG23 THR 62 13.913 20.246 -14.184 260 H PHE 63 HN PHE 63 15.173 25.206 -15.022 261 HA PHE 63 HA PHE 63 14.065 26.534 -17.392 262 HB2 PHE 63 HB2 PHE 63 12.378 27.716 -16.047 263 HB3 PHE 63 HB1 PHE 63 12.106 25.976 -15.991 264 HD1 PHE 63 HD2 PHE 63 13.501 28.867 -14.112 265 HD2 PHE 63 HD1 PHE 63 12.286 24.751 -13.950 266 HE1 PHE 63 HE2 PHE 63 13.683 28.909 -11.639 267 HE2 PHE 63 HE1 PHE 63 12.469 24.790 -11.481 268 HZ PHE 63 HZ PHE 63 13.166 26.872 -10.323 269 H THR 64 HN THR 64 14.418 28.819 -17.385 270 HA THR 64 HA THR 64 16.535 29.717 -15.499 271 HB THR 64 HB THR 64 17.731 30.654 -17.242 272 HG1 THR 64 HG1 THR 64 16.758 31.865 -18.633 273 HG21 THR 64 HG21 THR 64 17.855 29.119 -19.063 274 HG22 THR 64 HG22 THR 64 16.169 28.641 -18.853 275 HG23 THR 64 HG23 THR 64 17.373 28.175 -17.651 276 H PHE 65 HN PHE 65 16.650 32.185 -15.461 277 HA PHE 65 HA PHE 65 13.888 33.258 -15.283 278 HB2 PHE 65 HB2 PHE 65 15.906 33.074 -13.335 279 HB3 PHE 65 HB1 PHE 65 15.948 34.764 -13.829 280 HD1 PHE 65 HD2 PHE 65 13.332 32.141 -13.221 281 HD2 PHE 65 HD1 PHE 65 14.592 36.192 -12.551 282 HE1 PHE 65 HE2 PHE 65 11.285 32.554 -11.891 283 HE2 PHE 65 HE1 PHE 65 12.538 36.608 -11.215 284 HZ PHE 65 HZ PHE 65 10.886 34.787 -10.891 285 H VAL 66 HN VAL 66 13.365 34.728 -16.735 286 HA VAL 66 HA VAL 66 15.480 36.481 -17.866 287 HB VAL 66 HB VAL 66 13.182 35.118 -19.291 288 HG11 VAL 66 HG11 VAL 66 13.216 37.327 -20.177 289 HG12 VAL 66 HG12 VAL 66 14.182 36.372 -21.303 290 HG13 VAL 66 HG13 VAL 66 14.977 37.407 -20.117 291 HG21 VAL 66 HG21 VAL 66 14.957 34.130 -20.631 292 HG22 VAL 66 HG22 VAL 66 15.313 33.841 -18.928 293 HG23 VAL 66 HG23 VAL 66 16.172 35.106 -19.805 294 H ARG 67 HN ARG 67 15.082 38.568 -17.611 295 HA ARG 67 HA ARG 67 14.013 40.460 -16.818 296 HB2 ARG 67 HB2 ARG 67 11.990 39.414 -18.813 297 HB3 ARG 67 HB1 ARG 67 12.069 41.072 -18.206 298 HG2 ARG 67 HG2 ARG 67 14.352 41.300 -19.112 299 HG3 ARG 67 HG1 ARG 67 14.278 39.645 -19.717 300 HD2 ARG 67 HD2 ARG 67 12.327 41.822 -20.510 301 HD3 ARG 67 HD1 ARG 67 13.752 41.386 -21.453 302 HE ARG 67 HE ARG 67 12.297 39.036 -20.991 303 HH11 ARG 67 HH21 ARG 67 11.971 42.090 -22.586 304 HH12 ARG 67 HH22 ARG 67 10.912 41.490 -23.818 305 HH21 ARG 67 HH11 ARG 67 10.907 38.243 -22.605 306 HH22 ARG 67 HH12 ARG 67 10.309 39.312 -23.830 307 H GLY 68 HN GLY 68 13.540 38.140 -15.159 308 HA2 GLY 68 HA2 GLY 68 12.288 37.711 -13.265 309 HA3 GLY 68 HA1 GLY 68 11.306 39.126 -13.649 310 H ARG 69 HN ARG 69 11.813 36.526 -15.938 311 HA ARG 69 HA ARG 69 9.031 35.572 -15.502 312 HB2 ARG 69 HB2 ARG 69 9.186 37.063 -17.496 313 HB3 ARG 69 HB1 ARG 69 10.387 35.971 -18.182 314 HG2 ARG 69 HG2 ARG 69 8.747 34.118 -18.110 315 HG3 ARG 69 HG1 ARG 69 7.541 35.221 -17.441 316 HD2 ARG 69 HD2 ARG 69 8.886 35.460 -20.147 317 HD3 ARG 69 HD1 ARG 69 7.211 35.005 -19.854 318 HE ARG 69 HE ARG 69 7.501 37.462 -18.636 319 HH11 ARG 69 HH21 ARG 69 8.001 36.120 -21.783 320 HH12 ARG 69 HH22 ARG 69 7.640 37.590 -22.623 321 HH21 ARG 69 HH11 ARG 69 7.026 39.399 -19.727 322 HH22 ARG 69 HH12 ARG 69 7.089 39.449 -21.456 323 H THR 70 HN THR 70 8.861 33.438 -15.278 324 HA THR 70 HA THR 70 11.161 31.749 -15.296 325 HB THR 70 HB THR 70 8.254 30.912 -15.274 326 HG1 THR 70 HG1 THR 70 8.847 30.911 -12.902 327 HG21 THR 70 HG21 THR 70 10.798 29.632 -14.238 328 HG22 THR 70 HG22 THR 70 9.841 29.085 -15.616 329 HG23 THR 70 HG23 THR 70 9.173 28.997 -13.985 330 H VAL 71 HN VAL 71 12.038 30.640 -16.932 331 HA VAL 71 HA VAL 71 10.398 30.064 -19.336 332 HB VAL 71 HB VAL 71 12.563 30.512 -20.641 333 HG11 VAL 71 HG11 VAL 71 12.089 32.929 -20.755 334 HG12 VAL 71 HG12 VAL 71 11.175 32.824 -19.251 335 HG13 VAL 71 HG13 VAL 71 10.590 32.002 -20.699 336 HG21 VAL 71 HG21 VAL 71 13.914 30.600 -18.465 337 HG22 VAL 71 HG22 VAL 71 13.221 32.201 -18.213 338 HG23 VAL 71 HG23 VAL 71 14.230 31.884 -19.626 339 H SER 72 HN SER 72 10.567 28.018 -20.054 340 HA SER 72 HA SER 72 12.128 26.129 -18.552 341 HB2 SER 72 HB2 SER 72 9.910 25.545 -19.421 342 HB3 SER 72 HB1 SER 72 10.501 25.766 -21.066 343 HG SER 72 HG SER 72 11.391 23.869 -20.961 344 H VAL 73 HN VAL 73 13.968 25.048 -19.159 345 HA VAL 73 HA VAL 73 15.666 26.290 -21.089 346 HB VAL 73 HB VAL 73 15.931 23.727 -19.518 347 HG11 VAL 73 HG11 VAL 73 18.406 24.007 -20.216 348 HG12 VAL 73 HG12 VAL 73 17.791 25.063 -21.491 349 HG13 VAL 73 HG13 VAL 73 17.295 23.371 -21.431 350 HG21 VAL 73 HG21 VAL 73 16.089 25.630 -18.079 351 HG22 VAL 73 HG22 VAL 73 17.045 26.524 -19.258 352 HG23 VAL 73 HG23 VAL 73 17.753 25.153 -18.412 353 H SER 74 HN SER 74 16.272 25.612 -23.131 354 HA SER 74 HA SER 74 14.376 24.073 -24.613 355 HB2 SER 74 HB2 SER 74 16.008 24.371 -26.484 356 HB3 SER 74 HB1 SER 74 15.557 25.881 -25.697 357 HG SER 74 HG SER 74 17.503 25.998 -24.780 358 H ASP 75 HN ASP 75 17.606 23.437 -23.321 359 HA ASP 75 HA ASP 75 17.165 20.551 -23.690 360 HB2 ASP 75 HB2 ASP 75 18.453 21.379 -25.673 361 HB3 ASP 75 HB1 ASP 75 19.720 21.914 -24.568 362 HA PRO 76 HA PRO 76 19.108 21.605 -19.635 363 HB2 PRO 76 HB2 PRO 76 17.332 20.302 -18.024 364 HB3 PRO 76 HB1 PRO 76 17.054 21.944 -18.630 365 HG2 PRO 76 HG2 PRO 76 15.877 19.373 -19.535 366 HG3 PRO 76 HG1 PRO 76 15.154 20.989 -19.490 367 HD2 PRO 76 HD2 PRO 76 16.203 19.734 -21.779 368 HD3 PRO 76 HD1 PRO 76 15.869 21.474 -21.629 369 H LYS 77 HN LYS 77 20.879 20.404 -19.306 370 HA LYS 77 HA LYS 77 20.678 17.446 -19.409 371 HB2 LYS 77 HB2 LYS 77 23.062 19.287 -19.760 372 HB3 LYS 77 HB1 LYS 77 23.144 17.525 -19.737 373 HG2 LYS 77 HG2 LYS 77 21.654 17.397 -21.680 374 HG3 LYS 77 HG1 LYS 77 21.470 19.151 -21.670 375 HD2 LYS 77 HD2 LYS 77 23.124 18.865 -23.295 376 HD3 LYS 77 HD1 LYS 77 24.097 19.165 -21.856 377 HE2 LYS 77 HE2 LYS 77 24.963 17.231 -23.112 378 HE3 LYS 77 HE1 LYS 77 24.361 16.719 -21.537 379 HZ1 LYS 77 HZ1 LYS 77 22.599 15.654 -22.449 380 HZ2 LYS 77 HZ2 LYS 77 23.671 15.510 -23.760 381 HZ3 LYS 77 HZ3 LYS 77 22.476 16.718 -23.765 382 H VAL 78 HN VAL 78 20.349 16.690 -17.419 383 HA VAL 78 HA VAL 78 22.272 17.399 -15.326 384 HB VAL 78 HB VAL 78 20.218 17.443 -13.704 385 HG11 VAL 78 HG11 VAL 78 21.666 19.379 -14.078 386 HG12 VAL 78 HG12 VAL 78 19.980 19.898 -14.075 387 HG13 VAL 78 HG13 VAL 78 20.846 19.728 -15.603 388 HG21 VAL 78 HG21 VAL 78 18.843 18.529 -16.168 389 HG22 VAL 78 HG22 VAL 78 18.135 18.093 -14.611 390 HG23 VAL 78 HG23 VAL 78 18.682 16.831 -15.721 391 H ILE 79 HN ILE 79 22.333 15.841 -13.599 392 HA ILE 79 HA ILE 79 21.567 13.144 -14.530 393 HB ILE 79 HB ILE 79 23.503 14.025 -12.372 394 HG12 ILE 79 HG12 ILE 79 24.051 12.749 -15.069 395 HG13 ILE 79 HG11 ILE 79 24.143 14.488 -14.785 396 HG21 ILE 79 HG21 ILE 79 22.674 11.889 -11.764 397 HG22 ILE 79 HG22 ILE 79 24.185 11.553 -12.605 398 HG23 ILE 79 HG23 ILE 79 22.642 11.327 -13.434 399 HD11 ILE 79 HD11 ILE 79 25.926 14.240 -13.221 400 HD12 ILE 79 HD12 ILE 79 26.343 13.196 -14.580 401 HD13 ILE 79 HD13 ILE 79 25.679 12.496 -13.102 402 H CYS 80 HN CYS 80 20.603 11.647 -13.054 403 HA CYS 80 HA CYS 80 18.658 12.900 -11.300 404 HB2 CYS 80 HB2 CYS 80 17.601 10.788 -11.215 405 HB3 CYS 80 HB1 CYS 80 18.215 10.928 -12.863 406 H ARG 81 HN ARG 81 18.234 11.804 -9.130 407 HA ARG 81 HA ARG 81 20.534 12.137 -7.493 408 HB2 ARG 81 HB2 ARG 81 17.764 11.072 -6.916 409 HB3 ARG 81 HB1 ARG 81 18.994 11.327 -5.675 410 HG2 ARG 81 HG2 ARG 81 19.130 13.695 -6.232 411 HG3 ARG 81 HG1 ARG 81 18.003 13.473 -7.572 412 HD2 ARG 81 HD2 ARG 81 16.808 14.373 -5.643 413 HD3 ARG 81 HD1 ARG 81 16.270 12.726 -5.958 414 HE ARG 81 HE ARG 81 18.404 12.691 -4.089 415 HH11 ARG 81 HH21 ARG 81 15.082 13.588 -4.452 416 HH12 ARG 81 HH22 ARG 81 14.684 13.319 -2.788 417 HH21 ARG 81 HH11 ARG 81 17.889 12.331 -1.905 418 HH22 ARG 81 HH12 ARG 81 16.273 12.607 -1.346 419 H THR 82 HN THR 82 18.846 9.302 -8.767 420 HA THR 82 HA THR 82 20.132 7.368 -7.147 421 HB THR 82 HB THR 82 19.287 5.741 -8.718 422 HG1 THR 82 HG1 THR 82 18.675 6.305 -10.738 423 HG21 THR 82 HG21 THR 82 17.310 8.029 -8.706 424 HG22 THR 82 HG22 THR 82 17.671 7.075 -7.267 425 HG23 THR 82 HG23 THR 82 16.962 6.301 -8.684 426 H CYS 83 HN CYS 83 21.013 8.887 -10.201 427 HA CYS 83 HA CYS 83 23.212 7.129 -10.757 428 HB2 CYS 83 HB2 CYS 83 22.128 9.665 -11.897 429 HB3 CYS 83 HB1 CYS 83 23.799 9.245 -12.287 430 H GLN 84 HN GLN 84 22.750 9.430 -8.408 431 HA GLN 84 HA GLN 84 25.645 10.074 -8.225 432 HB2 GLN 84 HB2 GLN 84 23.292 11.625 -7.116 433 HB3 GLN 84 HB1 GLN 84 24.993 12.080 -7.001 434 HG2 GLN 84 HG2 GLN 84 25.173 12.341 -9.382 435 HG3 GLN 84 HG1 GLN 84 23.585 11.613 -9.636 436 HE21 GLN 84 HE21 GLN 84 24.819 14.464 -10.104 437 HE22 GLN 84 HE22 GLN 84 23.621 15.493 -9.479 438 HA PRO 85 HA PRO 85 24.461 7.418 -4.584 439 HB2 PRO 85 HB2 PRO 85 26.586 5.696 -4.705 440 HB3 PRO 85 HB1 PRO 85 25.094 5.463 -5.642 441 HG2 PRO 85 HG2 PRO 85 27.729 6.543 -6.519 442 HG3 PRO 85 HG1 PRO 85 26.597 5.489 -7.384 443 HD2 PRO 85 HD2 PRO 85 26.820 8.203 -7.834 444 HD3 PRO 85 HD1 PRO 85 25.348 7.265 -8.170 445 H LYS 86 HN LYS 86 26.081 9.958 -4.867 446 HA LYS 86 HA LYS 86 28.463 9.794 -3.379 447 HB2 LYS 86 HB2 LYS 86 27.741 11.768 -4.729 448 HB3 LYS 86 HB1 LYS 86 26.540 12.130 -3.489 449 HG2 LYS 86 HG2 LYS 86 28.310 12.359 -1.806 450 HG3 LYS 86 HG1 LYS 86 29.528 11.929 -3.009 451 HD2 LYS 86 HD2 LYS 86 28.900 13.908 -4.349 452 HD3 LYS 86 HD1 LYS 86 27.704 14.347 -3.131 453 HE2 LYS 86 HE2 LYS 86 29.495 14.536 -1.441 454 HE3 LYS 86 HE1 LYS 86 30.691 14.106 -2.664 455 HZ1 LYS 86 HZ1 LYS 86 29.049 16.209 -3.597 456 HZ2 LYS 86 HZ2 LYS 86 30.733 16.188 -3.372 457 HZ3 LYS 86 HZ3 LYS 86 29.707 16.627 -2.090 458 H GLN 87 HN GLN 87 25.094 10.198 -2.381 459 HA GLN 87 HA GLN 87 25.769 10.514 0.416 460 HB2 GLN 87 HB2 GLN 87 23.132 10.066 -1.003 461 HB3 GLN 87 HB1 GLN 87 23.295 10.361 0.730 462 HG2 GLN 87 HG2 GLN 87 24.327 12.528 0.308 463 HG3 GLN 87 HG1 GLN 87 24.309 12.231 -1.430 464 HE21 GLN 87 HE21 GLN 87 22.922 14.429 0.029 465 HE22 GLN 87 HE22 GLN 87 21.270 14.243 -0.315 466 H HIS 88 HN HIS 88 25.936 8.948 1.917 467 HA HIS 88 HA HIS 88 25.778 6.165 1.063 468 HB2 HIS 88 HB2 HIS 88 26.605 7.406 3.700 469 HB3 HIS 88 HB1 HIS 88 26.731 5.692 3.297 470 HD2 HIS 88 HD2 HIS 88 28.762 8.926 2.838 471 HE1 HIS 88 HE1 HIS 88 30.485 6.062 0.259 472 HE2 HIS 88 HE2 HIS 88 30.789 8.362 1.292 473 H ASP 89 HN ASP 89 23.438 8.142 1.745 474 HA ASP 89 HA ASP 89 22.055 7.082 3.968 475 HB2 ASP 89 HB2 ASP 89 20.048 8.132 2.921 476 HB3 ASP 89 HB1 ASP 89 21.424 9.228 3.043 477 H SER 90 HN SER 90 22.427 6.000 0.693 478 HA SER 90 HA SER 90 20.835 3.595 1.312 479 HB2 SER 90 HB2 SER 90 19.876 3.707 -1.010 480 HB3 SER 90 HB1 SER 90 19.282 4.959 0.080 481 HG SER 90 HG SER 90 20.565 6.431 -0.913 482 H ILE 91 HN ILE 91 21.357 1.773 -0.026 483 HA ILE 91 HA ILE 91 23.929 1.996 -1.497 484 HB ILE 91 HB ILE 91 23.169 -0.116 0.532 485 HG12 ILE 91 HG12 ILE 91 25.522 1.790 0.435 486 HG13 ILE 91 HG11 ILE 91 24.044 2.108 1.348 487 HG21 ILE 91 HG21 ILE 91 25.467 0.071 -1.436 488 HG22 ILE 91 HG22 ILE 91 24.293 -1.233 -1.269 489 HG23 ILE 91 HG23 ILE 91 25.508 -0.977 -0.014 490 HD11 ILE 91 HD11 ILE 91 25.849 -0.301 1.715 491 HD12 ILE 91 HD12 ILE 91 24.382 0.039 2.631 492 HD13 ILE 91 HD13 ILE 91 25.781 1.098 2.786 493 H TRP 92 HN TRP 92 24.027 0.913 -3.376 494 HA TRP 92 HA TRP 92 21.587 -0.153 -4.453 495 HB2 TRP 92 HB2 TRP 92 22.916 1.033 -6.012 496 HB3 TRP 92 HB1 TRP 92 24.390 0.186 -5.531 497 HD1 TRP 92 HD1 TRP 92 20.915 -1.030 -6.746 498 HE1 TRP 92 HE1 TRP 92 21.279 -2.829 -8.555 499 HE3 TRP 92 HE3 TRP 92 26.012 -1.028 -6.960 500 HZ2 TRP 92 HZ2 TRP 92 23.453 -4.091 -9.922 501 HZ3 TRP 92 HZ3 TRP 92 27.204 -2.533 -8.527 502 HH2 TRP 92 HH2 TRP 92 25.933 -4.063 -10.007 503 H CYS 93 HN CYS 93 20.893 -2.160 -4.332 504 HA CYS 93 HA CYS 93 22.747 -4.304 -3.478 505 HB2 CYS 93 HB2 CYS 93 20.807 -4.212 -2.089 506 HB3 CYS 93 HB1 CYS 93 19.732 -4.087 -3.485 507 H THR 94 HN THR 94 23.324 -5.893 -4.841 508 HA THR 94 HA THR 94 22.267 -5.828 -7.579 509 HB THR 94 HB THR 94 24.199 -6.960 -8.220 510 HG1 THR 94 HG1 THR 94 25.453 -7.961 -6.328 511 HG21 THR 94 HG21 THR 94 26.039 -5.827 -7.183 512 HG22 THR 94 HG22 THR 94 25.148 -5.628 -5.674 513 HG23 THR 94 HG23 THR 94 24.665 -4.724 -7.110 514 H ALA 95 HN ALA 95 21.713 -7.479 -4.658 515 HA ALA 95 HA ALA 95 20.970 -10.016 -5.878 516 HB1 ALA 95 HB1 ALA 95 21.938 -9.977 -3.615 517 HB2 ALA 95 HB2 ALA 95 20.311 -10.658 -3.604 518 HB3 ALA 95 HB3 ALA 95 20.578 -9.006 -3.051 519 H CYS 96 HN CYS 96 19.442 -7.004 -4.986 520 HA CYS 96 HA CYS 96 16.753 -8.155 -5.435 521 HB2 CYS 96 HB2 CYS 96 17.633 -5.530 -4.190 522 HB3 CYS 96 HB1 CYS 96 15.952 -5.984 -4.481 523 H GLN 97 HN GLN 97 18.998 -5.633 -6.476 524 HA GLN 97 HA GLN 97 19.194 -4.614 -8.544 525 HB2 GLN 97 HB2 GLN 97 17.770 -6.770 -9.279 526 HB3 GLN 97 HB1 GLN 97 16.517 -5.553 -9.508 527 HG2 GLN 97 HG2 GLN 97 19.282 -5.560 -10.769 528 HG3 GLN 97 HG1 GLN 97 17.752 -5.844 -11.594 529 HE21 GLN 97 HE21 GLN 97 19.915 -3.383 -10.412 530 HE22 GLN 97 HE22 GLN 97 18.976 -2.051 -10.887 531 H GLN 98 HN GLN 98 18.022 -3.517 -6.164 532 HA GLN 98 HA GLN 98 16.609 -1.272 -7.373 533 HB2 GLN 98 HB2 GLN 98 15.375 -2.991 -5.213 534 HB3 GLN 98 HB1 GLN 98 14.833 -1.353 -5.575 535 HG2 GLN 98 HG2 GLN 98 14.455 -2.056 -7.948 536 HG3 GLN 98 HG1 GLN 98 14.867 -3.705 -7.489 537 HE21 GLN 98 HE21 GLN 98 12.437 -3.793 -8.405 538 HE22 GLN 98 HE22 GLN 98 11.236 -3.700 -7.210 539 H THR 99 HN THR 99 16.287 0.504 -5.771 540 HA THR 99 HA THR 99 18.739 0.927 -4.315 541 HB THR 99 HB THR 99 16.267 2.663 -4.202 542 HG1 THR 99 HG1 THR 99 18.349 2.674 -6.130 543 HG21 THR 99 HG21 THR 99 18.036 3.256 -2.649 544 HG22 THR 99 HG22 THR 99 18.022 4.434 -3.962 545 HG23 THR 99 HG23 THR 99 19.244 3.162 -3.929 546 H LYS 100 HN LYS 100 19.064 0.940 -2.119 547 HA LYS 100 HA LYS 100 16.763 0.319 -0.367 548 HB2 LYS 100 HB2 LYS 100 18.471 -1.653 -1.168 549 HB3 LYS 100 HB1 LYS 100 19.334 -1.051 0.244 550 HG2 LYS 100 HG2 LYS 100 17.943 -2.665 1.213 551 HG3 LYS 100 HG1 LYS 100 16.972 -1.202 1.415 552 HD2 LYS 100 HD2 LYS 100 15.725 -1.734 -0.649 553 HD3 LYS 100 HD1 LYS 100 16.709 -3.180 -0.874 554 HE2 LYS 100 HE2 LYS 100 15.870 -4.088 1.267 555 HE3 LYS 100 HE1 LYS 100 14.888 -2.640 1.491 556 HZ1 LYS 100 HZ1 LYS 100 14.668 -4.510 -0.801 557 HZ2 LYS 100 HZ2 LYS 100 13.701 -3.141 -0.530 558 HZ3 LYS 100 HZ3 LYS 100 13.615 -4.470 0.528 559 H GLY 101 HN GLY 101 16.851 1.243 1.624 560 HA2 GLY 101 HA2 GLY 101 18.529 3.491 2.010 561 HA3 GLY 101 HA1 GLY 101 17.477 2.774 3.224 562 H ILE 102 HN ILE 102 19.858 3.790 4.003 563 HA ILE 102 HA ILE 102 21.916 1.777 4.087 564 HB ILE 102 HB ILE 102 22.336 4.264 4.130 565 HG12 ILE 102 HG12 ILE 102 24.097 4.109 5.932 566 HG13 ILE 102 HG11 ILE 102 23.419 2.542 6.381 567 HG21 ILE 102 HG21 ILE 102 21.966 5.509 6.137 568 HG22 ILE 102 HG22 ILE 102 21.556 4.052 7.041 569 HG23 ILE 102 HG23 ILE 102 20.452 4.662 5.810 570 HD11 ILE 102 HD11 ILE 102 24.178 1.506 4.446 571 HD12 ILE 102 HD12 ILE 102 25.442 2.709 4.664 572 HD13 ILE 102 HD13 ILE 102 24.151 2.996 3.500 573 H ASN 103 HN ASN 103 19.222 2.713 6.091 574 HA ASN 103 HA ASN 103 20.068 1.649 8.556 575 HB2 ASN 103 HB2 ASN 103 17.634 1.534 9.071 576 HB3 ASN 103 HB1 ASN 103 18.122 3.091 8.404 577 HD21 ASN 103 HD21 ASN 103 15.424 2.337 8.180 578 HD22 ASN 103 HD22 ASN 103 15.075 1.969 6.554 579 H GLU 104 HN GLU 104 18.315 0.145 5.851 580 HA GLU 104 HA GLU 104 18.171 -2.419 7.197 581 HB2 GLU 104 HB2 GLU 104 17.484 -1.536 4.389 582 HB3 GLU 104 HB1 GLU 104 17.253 -3.181 4.987 583 HG2 GLU 104 HG2 GLU 104 15.779 -2.352 6.762 584 HG3 GLU 104 HG1 GLU 104 16.041 -0.692 6.225 585 H PHE 105 HN PHE 105 20.785 -1.029 6.467 586 HA PHE 105 HA PHE 105 22.061 -3.398 5.253 587 HB2 PHE 105 HB2 PHE 105 21.984 -0.650 4.198 588 HB3 PHE 105 HB1 PHE 105 23.629 -1.266 4.369 589 HD1 PHE 105 HD2 PHE 105 20.388 -1.741 2.627 590 HD2 PHE 105 HD1 PHE 105 24.389 -3.184 3.160 591 HE1 PHE 105 HE2 PHE 105 20.164 -3.139 0.585 592 HE2 PHE 105 HE1 PHE 105 24.175 -4.576 1.120 593 HZ PHE 105 HZ PHE 105 22.058 -4.548 -0.169 594 H SER 106 HN SER 106 24.135 -3.843 5.913 595 HA SER 106 HA SER 106 24.889 -2.658 8.498 596 HB2 SER 106 HB2 SER 106 25.629 -5.178 7.038 597 HB3 SER 106 HB1 SER 106 26.615 -4.596 8.380 598 HG SER 106 HG SER 106 25.141 -5.748 9.419 599 H LYS 107 HN LYS 107 27.351 -2.566 8.822 600 HA LYS 107 HA LYS 107 28.383 -0.642 6.946 601 HB2 LYS 107 HB2 LYS 107 28.735 -0.475 9.408 602 HB3 LYS 107 HB1 LYS 107 29.753 -1.913 9.320 603 HG2 LYS 107 HG2 LYS 107 31.311 -0.790 7.838 604 HG3 LYS 107 HG1 LYS 107 30.248 0.614 7.724 605 HD2 LYS 107 HD2 LYS 107 31.978 1.156 9.309 606 HD3 LYS 107 HD1 LYS 107 30.491 0.902 10.221 607 HE2 LYS 107 HE2 LYS 107 31.196 -1.232 10.984 608 HE3 LYS 107 HE1 LYS 107 32.477 -1.333 9.776 609 HZ1 LYS 107 HZ1 LYS 107 33.739 0.270 10.888 610 HZ2 LYS 107 HZ2 LYS 107 33.149 -0.726 12.130 611 HZ3 LYS 107 HZ3 LYS 107 32.434 0.787 11.839 612 H ALA 108 HN ALA 108 28.958 -4.026 7.697 613 HA ALA 108 HA ALA 108 31.400 -4.344 6.329 614 HB1 ALA 108 HB1 ALA 108 29.246 -6.441 6.633 615 HB2 ALA 108 HB2 ALA 108 30.352 -5.986 7.930 616 HB3 ALA 108 HB3 ALA 108 30.981 -6.703 6.447 617 H GLN 109 HN GLN 109 28.048 -4.532 5.228 618 HA GLN 109 HA GLN 109 28.468 -5.627 2.691 619 HB2 GLN 109 HB2 GLN 109 26.357 -4.038 4.028 620 HB3 GLN 109 HB1 GLN 109 26.349 -3.950 2.267 621 HG2 GLN 109 HG2 GLN 109 24.934 -5.813 3.175 622 HG3 GLN 109 HG1 GLN 109 26.211 -6.368 2.091 623 HE21 GLN 109 HE21 GLN 109 26.869 -8.358 2.947 624 HE22 GLN 109 HE22 GLN 109 27.294 -8.607 4.572 625 H ARG 110 HN ARG 110 29.242 -2.518 3.934 626 HA ARG 110 HA ARG 110 29.352 -1.107 1.449 627 HB2 ARG 110 HB2 ARG 110 30.753 -0.502 4.071 628 HB3 ARG 110 HB1 ARG 110 30.538 0.613 2.724 629 HG2 ARG 110 HG2 ARG 110 28.093 0.445 2.947 630 HG3 ARG 110 HG1 ARG 110 28.290 -0.686 4.289 631 HD2 ARG 110 HD2 ARG 110 29.597 1.086 5.499 632 HD3 ARG 110 HD1 ARG 110 29.180 2.207 4.204 633 HE ARG 110 HE ARG 110 26.795 1.063 5.144 634 HH11 ARG 110 HH21 ARG 110 29.389 3.081 6.222 635 HH12 ARG 110 HH22 ARG 110 28.418 3.961 7.355 636 HH21 ARG 110 HH11 ARG 110 25.516 2.207 6.633 637 HH22 ARG 110 HH12 ARG 110 26.226 3.466 7.587 638 H HIS 111 HN HIS 111 31.652 -2.942 3.401 639 HA HIS 111 HA HIS 111 34.010 -2.241 2.018 640 HB2 HIS 111 HB2 HIS 111 33.952 -3.353 4.247 641 HB3 HIS 111 HB1 HIS 111 33.421 -4.840 3.457 642 HD2 HIS 111 HD2 HIS 111 35.519 -6.389 2.509 643 HE1 HIS 111 HE1 HIS 111 38.534 -3.436 2.645 644 HE2 HIS 111 HE2 HIS 111 38.060 -5.887 2.179 645 H VAL 112 HN VAL 112 31.767 -4.972 1.569 646 HA VAL 112 HA VAL 112 33.265 -6.200 -0.512 647 HB VAL 112 HB VAL 112 31.177 -7.456 -0.957 648 HG11 VAL 112 HG11 VAL 112 32.723 -7.982 1.000 649 HG12 VAL 112 HG12 VAL 112 31.062 -8.547 1.183 650 HG13 VAL 112 HG13 VAL 112 31.594 -7.088 2.022 651 HG21 VAL 112 HG21 VAL 112 29.588 -5.615 -0.617 652 HG22 VAL 112 HG22 VAL 112 30.068 -5.528 1.076 653 HG23 VAL 112 HG23 VAL 112 29.208 -6.946 0.481 654 H LEU 113 HN LEU 113 32.918 -6.166 -2.754 655 HA LEU 113 HA LEU 113 32.194 -3.589 -3.801 656 HB2 LEU 113 HB2 LEU 113 32.864 -6.149 -5.274 657 HB3 LEU 113 HB1 LEU 113 32.894 -4.512 -5.940 658 HG LEU 113 HG LEU 113 34.632 -5.518 -3.665 659 HD11 LEU 113 HD11 LEU 113 35.200 -4.961 -6.590 660 HD12 LEU 113 HD12 LEU 113 35.339 -6.506 -5.752 661 HD13 LEU 113 HD13 LEU 113 36.458 -5.196 -5.378 662 HD21 LEU 113 HD21 LEU 113 34.422 -3.217 -3.269 663 HD22 LEU 113 HD22 LEU 113 34.259 -2.830 -4.982 664 HD23 LEU 113 HD23 LEU 113 35.835 -3.268 -4.320 665 H ASP 114 HN ASP 114 30.453 -6.390 -3.065 666 HA ASP 114 HA ASP 114 28.205 -5.512 -4.793 667 HB2 ASP 114 HB2 ASP 114 27.566 -7.930 -4.958 668 HB3 ASP 114 HB1 ASP 114 29.069 -7.531 -5.788 669 HA PRO 115 HA PRO 115 26.999 -5.457 -0.295 670 HB2 PRO 115 HB2 PRO 115 25.186 -3.357 -1.399 671 HB3 PRO 115 HB1 PRO 115 26.224 -3.301 0.040 672 HG2 PRO 115 HG2 PRO 115 26.859 -1.960 -2.172 673 HG3 PRO 115 HG1 PRO 115 28.105 -2.737 -1.176 674 HD2 PRO 115 HD2 PRO 115 26.941 -3.651 -3.793 675 HD3 PRO 115 HD1 PRO 115 28.618 -3.752 -3.210 676 H ARG 116 HN ARG 116 25.200 -6.431 0.606 677 HA ARG 116 HA ARG 116 22.873 -7.010 -1.124 678 HB2 ARG 116 HB2 ARG 116 24.090 -9.173 0.585 679 HB3 ARG 116 HB1 ARG 116 22.967 -9.326 -0.769 680 HG2 ARG 116 HG2 ARG 116 24.769 -8.480 -2.289 681 HG3 ARG 116 HG1 ARG 116 25.881 -8.513 -0.920 682 HD2 ARG 116 HD2 ARG 116 24.337 -10.909 -1.952 683 HD3 ARG 116 HD1 ARG 116 26.033 -10.574 -2.303 684 HE ARG 116 HE ARG 116 24.973 -11.657 0.143 685 HH11 ARG 116 HH21 ARG 116 27.464 -9.725 -1.282 686 HH12 ARG 116 HH22 ARG 116 28.620 -10.049 -0.033 687 HH21 ARG 116 HH11 ARG 116 26.481 -12.084 1.785 688 HH22 ARG 116 HH12 ARG 116 28.064 -11.386 1.703 689 H CYS 117 HN CYS 117 21.064 -6.475 -0.079 690 HA CYS 117 HA CYS 117 20.800 -5.415 2.410 691 HB2 CYS 117 HB2 CYS 117 18.673 -7.310 1.412 692 HB3 CYS 117 HB1 CYS 117 18.481 -5.785 2.281 693 H GLN 118 HN GLN 118 20.094 -6.184 4.464 694 HA GLN 118 HA GLN 118 21.519 -8.383 5.459 695 HB2 GLN 118 HB2 GLN 118 19.024 -7.118 6.626 696 HB3 GLN 118 HB1 GLN 118 20.204 -8.097 7.501 697 HG2 GLN 118 HG2 GLN 118 20.791 -5.462 6.116 698 HG3 GLN 118 HG1 GLN 118 20.600 -5.679 7.855 699 HE21 GLN 118 HE21 GLN 118 22.393 -6.512 9.038 700 HE22 GLN 118 HE22 GLN 118 23.880 -6.899 8.315 701 H ILE 119 HN ILE 119 18.497 -8.222 3.813 702 HA ILE 119 HA ILE 119 17.620 -10.860 4.727 703 HB ILE 119 HB ILE 119 16.398 -9.142 2.562 704 HG12 ILE 119 HG12 ILE 119 16.542 -7.749 4.540 705 HG13 ILE 119 HG11 ILE 119 14.882 -8.330 4.412 706 HG21 ILE 119 HG21 ILE 119 15.614 -11.456 2.653 707 HG22 ILE 119 HG22 ILE 119 14.349 -10.380 3.244 708 HG23 ILE 119 HG23 ILE 119 15.319 -11.313 4.385 709 HD11 ILE 119 HD11 ILE 119 15.668 -10.265 5.961 710 HD12 ILE 119 HD12 ILE 119 15.417 -8.675 6.682 711 HD13 ILE 119 HD13 ILE 119 17.050 -9.225 6.309 712 H CYS 120 HN CYS 120 19.472 -9.454 2.179 713 HA CYS 120 HA CYS 120 19.060 -11.631 0.302 714 HB2 CYS 120 HB2 CYS 120 20.906 -9.232 0.278 715 HB3 CYS 120 HB1 CYS 120 20.901 -10.468 -0.985 716 H VAL 121 HN VAL 121 21.458 -10.677 2.692 717 HA VAL 121 HA VAL 121 23.441 -12.584 1.943 718 HB VAL 121 HB VAL 121 24.370 -12.139 4.206 719 HG11 VAL 121 HG11 VAL 121 24.799 -10.612 2.282 720 HG12 VAL 121 HG12 VAL 121 24.809 -9.764 3.829 721 HG13 VAL 121 HG13 VAL 121 23.404 -9.648 2.769 722 HG21 VAL 121 HG21 VAL 121 21.805 -10.556 4.487 723 HG22 VAL 121 HG22 VAL 121 23.189 -10.377 5.564 724 HG23 VAL 121 HG23 VAL 121 22.319 -11.913 5.487 725 H HIS 122 HN HIS 122 20.726 -12.635 4.211 726 HA HIS 122 HA HIS 122 21.348 -15.338 5.109 727 HB2 HIS 122 HB2 HIS 122 19.101 -13.417 5.736 728 HB3 HIS 122 HB1 HIS 122 19.188 -15.053 6.396 729 HD2 HIS 122 HD2 HIS 122 22.048 -15.395 7.582 730 HE1 HIS 122 HE1 HIS 122 21.845 -11.452 9.077 731 HE2 HIS 122 HE2 HIS 122 23.074 -13.667 9.250 732 H SER 123 HN SER 123 20.280 -14.344 2.283 733 HA SER 123 HA SER 123 17.960 -16.130 2.024 734 HB2 SER 123 HB2 SER 123 17.820 -13.926 0.958 735 HB3 SER 123 HB1 SER 123 19.274 -14.272 0.024 736 HG SER 123 HG SER 123 16.761 -14.894 -0.543 737 H GLN 124 HN GLN 124 21.076 -15.591 0.351 738 HA GLN 124 HA GLN 124 21.353 -18.503 -0.023 739 HB2 GLN 124 HB2 GLN 124 21.947 -18.199 -2.386 740 HB3 GLN 124 HB1 GLN 124 20.299 -17.653 -2.081 741 HG2 GLN 124 HG2 GLN 124 21.146 -15.317 -1.875 742 HG3 GLN 124 HG1 GLN 124 22.759 -15.892 -2.293 743 HE21 GLN 124 HE21 GLN 124 22.210 -14.195 -4.143 744 HE22 GLN 124 HE22 GLN 124 21.499 -14.852 -5.537 745 H ARG 125 HN ARG 125 22.645 -16.255 1.568 746 HA ARG 125 HA ARG 125 24.757 -15.532 2.144 747 HB2 ARG 125 HB2 ARG 125 25.296 -18.325 1.125 748 HB3 ARG 125 HB1 ARG 125 26.516 -17.338 1.936 749 HG2 ARG 125 HG2 ARG 125 25.056 -17.144 3.910 750 HG3 ARG 125 HG1 ARG 125 23.822 -18.113 3.101 751 HD2 ARG 125 HD2 ARG 125 25.416 -19.998 2.948 752 HD3 ARG 125 HD1 ARG 125 26.629 -19.034 3.786 753 HE ARG 125 HE ARG 125 24.301 -20.312 4.972 754 HH11 ARG 125 HH21 ARG 125 26.784 -17.912 5.227 755 HH12 ARG 125 HH22 ARG 125 26.720 -17.832 6.956 756 HH21 ARG 125 HH11 ARG 125 24.211 -20.209 7.240 757 HH22 ARG 125 HH12 ARG 125 25.264 -19.132 8.095 758 H ASN 126 HN ASN 126 26.187 -17.509 -0.331 759 HA ASN 126 HA ASN 126 26.318 -15.514 -2.370 760 HB2 ASN 126 HB2 ASN 126 28.750 -15.040 -2.170 761 HB3 ASN 126 HB1 ASN 126 27.820 -14.406 -0.813 762 HD21 ASN 126 HD21 ASN 126 29.387 -14.573 0.857 763 HD22 ASN 126 HD22 ASN 126 30.095 -16.041 1.328 Start of MODEL 4 1 H MET 31 HT1 MET 31 1.803 21.298 -16.213 2 HA MET 31 HA MET 31 2.563 22.095 -18.227 3 HB2 MET 31 HB2 MET 31 1.192 21.541 -20.349 4 HB3 MET 31 HB1 MET 31 2.184 20.251 -19.666 5 HG2 MET 31 HG2 MET 31 0.236 19.319 -18.512 6 HG3 MET 31 HG1 MET 31 -0.771 20.644 -19.100 7 HE1 MET 31 HE1 MET 31 -1.503 17.506 -19.584 8 HE2 MET 31 HE2 MET 31 -2.234 17.811 -21.158 9 HE3 MET 31 HE3 MET 31 -2.416 18.995 -19.866 10 H GLY 32 HN GLY 32 0.690 22.995 -16.215 11 HA2 GLY 32 HA2 GLY 32 -0.137 25.422 -17.182 12 HA3 GLY 32 HA1 GLY 32 -1.500 24.350 -17.488 13 H LYS 33 HN LYS 33 -2.160 22.984 -15.543 14 HA LYS 33 HA LYS 33 -2.622 24.775 -13.315 15 HB2 LYS 33 HB2 LYS 33 -3.478 21.922 -13.851 16 HB3 LYS 33 HB1 LYS 33 -3.966 22.858 -12.438 17 HG2 LYS 33 HG2 LYS 33 -5.020 24.539 -13.861 18 HG3 LYS 33 HG1 LYS 33 -4.450 23.710 -15.306 19 HD2 LYS 33 HD2 LYS 33 -6.701 22.995 -15.073 20 HD3 LYS 33 HD1 LYS 33 -5.743 21.657 -14.442 21 HE2 LYS 33 HE2 LYS 33 -6.198 22.289 -12.170 22 HE3 LYS 33 HE1 LYS 33 -6.882 23.836 -12.668 23 HZ1 LYS 33 HZ1 LYS 33 -8.064 21.382 -13.733 24 HZ2 LYS 33 HZ2 LYS 33 -8.797 22.872 -13.372 25 HZ3 LYS 33 HZ3 LYS 33 -8.396 21.795 -12.122 26 H ASN 34 HN ASN 34 -0.277 22.473 -14.139 27 HA ASN 34 HA ASN 34 0.874 22.594 -11.455 28 HB2 ASN 34 HB2 ASN 34 1.162 20.164 -11.305 29 HB3 ASN 34 HB1 ASN 34 -0.550 20.586 -11.382 30 HD21 ASN 34 HD21 ASN 34 -0.035 21.218 -14.413 31 HD22 ASN 34 HD22 ASN 34 -0.091 19.680 -15.131 32 H ASP 35 HN ASP 35 2.380 23.910 -12.677 33 HA ASP 35 HA ASP 35 3.909 22.797 -14.827 34 HB2 ASP 35 HB2 ASP 35 4.332 25.199 -13.042 35 HB3 ASP 35 HB1 ASP 35 5.412 24.775 -14.373 36 H ASN 36 HN ASN 36 3.917 22.286 -11.497 37 HA ASN 36 HA ASN 36 6.770 21.748 -11.248 38 HB2 ASN 36 HB2 ASN 36 6.198 21.096 -8.943 39 HB3 ASN 36 HB1 ASN 36 5.551 22.689 -9.341 40 HD21 ASN 36 HD21 ASN 36 3.474 22.906 -8.513 41 HD22 ASN 36 HD22 ASN 36 2.309 21.673 -8.467 42 H ASP 37 HN ASP 37 4.240 20.159 -12.632 43 HA ASP 37 HA ASP 37 4.953 17.469 -11.731 44 HB2 ASP 37 HB2 ASP 37 2.570 18.157 -12.164 45 HB3 ASP 37 HB1 ASP 37 2.979 18.272 -13.875 46 H ALA 38 HN ALA 38 6.582 19.455 -13.483 47 HA ALA 38 HA ALA 38 6.915 18.262 -16.028 48 HB1 ALA 38 HB1 ALA 38 9.013 19.766 -14.468 49 HB2 ALA 38 HB2 ALA 38 7.714 20.550 -15.368 50 HB3 ALA 38 HB3 ALA 38 8.913 19.572 -16.217 51 H LEU 39 HN LEU 39 8.401 16.727 -16.782 52 HA LEU 39 HA LEU 39 9.712 15.085 -14.684 53 HB2 LEU 39 HB2 LEU 39 8.344 14.386 -17.263 54 HB3 LEU 39 HB1 LEU 39 9.644 13.354 -16.685 55 HG LEU 39 HG LEU 39 7.372 12.607 -15.924 56 HD11 LEU 39 HD11 LEU 39 8.654 13.393 -13.386 57 HD12 LEU 39 HD12 LEU 39 9.689 12.533 -14.525 58 HD13 LEU 39 HD13 LEU 39 8.184 11.803 -13.972 59 HD21 LEU 39 HD21 LEU 39 7.330 14.947 -14.033 60 HD22 LEU 39 HD22 LEU 39 6.002 13.909 -14.547 61 HD23 LEU 39 HD23 LEU 39 6.648 15.122 -15.650 62 H ILE 40 HN ILE 40 11.825 15.096 -14.686 63 HA ILE 40 HA ILE 40 13.267 16.315 -16.946 64 HB ILE 40 HB ILE 40 14.514 15.346 -14.385 65 HG12 ILE 40 HG12 ILE 40 12.619 16.644 -13.687 66 HG13 ILE 40 HG11 ILE 40 14.061 17.642 -13.500 67 HG21 ILE 40 HG21 ILE 40 16.016 17.288 -14.838 68 HG22 ILE 40 HG22 ILE 40 15.117 17.609 -16.321 69 HG23 ILE 40 HG23 ILE 40 16.035 16.111 -16.152 70 HD11 ILE 40 HD11 ILE 40 12.395 19.036 -14.518 71 HD12 ILE 40 HD12 ILE 40 11.969 17.790 -15.687 72 HD13 ILE 40 HD13 ILE 40 13.524 18.607 -15.805 73 H MET 41 HN MET 41 14.287 15.178 -18.408 74 HA MET 41 HA MET 41 14.418 12.282 -18.227 75 HB2 MET 41 HB2 MET 41 13.826 13.422 -20.348 76 HB3 MET 41 HB1 MET 41 15.436 14.141 -20.391 77 HG2 MET 41 HG2 MET 41 16.465 11.924 -20.483 78 HG3 MET 41 HG1 MET 41 14.879 11.161 -20.336 79 HE1 MET 41 HE1 MET 41 15.163 10.146 -23.863 80 HE2 MET 41 HE2 MET 41 14.038 10.026 -22.513 81 HE3 MET 41 HE3 MET 41 15.763 9.810 -22.232 82 H CYS 42 HN CYS 42 16.157 11.089 -17.671 83 HA CYS 42 HA CYS 42 18.568 12.476 -16.796 84 HB2 CYS 42 HB2 CYS 42 17.476 10.562 -15.534 85 HB3 CYS 42 HB1 CYS 42 18.087 9.498 -16.803 86 H MET 43 HN MET 43 20.346 12.701 -17.935 87 HA MET 43 HA MET 43 20.499 11.794 -20.641 88 HB2 MET 43 HB2 MET 43 22.524 12.983 -20.779 89 HB3 MET 43 HB1 MET 43 21.606 13.872 -19.567 90 HG2 MET 43 HG2 MET 43 23.661 13.671 -18.479 91 HG3 MET 43 HG1 MET 43 22.850 12.216 -17.887 92 HE1 MET 43 HE1 MET 43 26.237 10.653 -18.200 93 HE2 MET 43 HE2 MET 43 24.930 11.274 -17.196 94 HE3 MET 43 HE3 MET 43 26.119 12.388 -17.869 95 H ARG 44 HN ARG 44 20.869 10.017 -17.901 96 HA ARG 44 HA ARG 44 22.877 8.205 -19.148 97 HB2 ARG 44 HB2 ARG 44 23.606 9.281 -17.022 98 HB3 ARG 44 HB1 ARG 44 22.245 8.502 -16.210 99 HG2 ARG 44 HG2 ARG 44 23.091 6.308 -16.731 100 HG3 ARG 44 HG1 ARG 44 24.342 6.982 -17.776 101 HD2 ARG 44 HD2 ARG 44 25.391 8.081 -15.862 102 HD3 ARG 44 HD1 ARG 44 24.110 7.495 -14.802 103 HE ARG 44 HE ARG 44 25.291 5.285 -16.092 104 HH11 ARG 44 HH21 ARG 44 25.970 7.759 -13.771 105 HH12 ARG 44 HH22 ARG 44 27.127 6.812 -12.895 106 HH21 ARG 44 HH11 ARG 44 26.805 4.039 -14.954 107 HH22 ARG 44 HH12 ARG 44 27.600 4.704 -13.567 108 H CYS 45 HN CYS 45 20.588 7.732 -16.468 109 HA CYS 45 HA CYS 45 19.812 5.163 -17.571 110 HB2 CYS 45 HB2 CYS 45 18.642 4.825 -15.517 111 HB3 CYS 45 HB1 CYS 45 20.165 5.612 -15.112 112 H ARG 46 HN ARG 46 18.882 8.218 -18.280 113 HA ARG 46 HA ARG 46 16.916 9.233 -18.993 114 HB2 ARG 46 HB2 ARG 46 16.902 6.562 -20.387 115 HB3 ARG 46 HB1 ARG 46 15.868 7.921 -20.838 116 HG2 ARG 46 HG2 ARG 46 17.854 9.325 -21.224 117 HG3 ARG 46 HG1 ARG 46 18.903 7.988 -20.746 118 HD2 ARG 46 HD2 ARG 46 17.974 6.630 -22.597 119 HD3 ARG 46 HD1 ARG 46 16.989 8.002 -23.088 120 HE ARG 46 HE ARG 46 19.634 8.885 -23.015 121 HH11 ARG 46 HH21 ARG 46 17.674 6.557 -24.658 122 HH12 ARG 46 HH22 ARG 46 18.600 6.600 -26.121 123 HH21 ARG 46 HH11 ARG 46 20.859 8.949 -24.934 124 HH22 ARG 46 HH12 ARG 46 20.402 7.955 -26.278 125 H LYS 47 HN LYS 47 16.517 8.182 -16.463 126 HA LYS 47 HA LYS 47 13.855 6.901 -16.593 127 HB2 LYS 47 HB2 LYS 47 15.829 6.116 -15.057 128 HB3 LYS 47 HB1 LYS 47 15.356 7.473 -14.036 129 HG2 LYS 47 HG2 LYS 47 13.091 6.573 -13.844 130 HG3 LYS 47 HG1 LYS 47 13.482 5.272 -14.967 131 HD2 LYS 47 HD2 LYS 47 15.265 4.506 -13.377 132 HD3 LYS 47 HD1 LYS 47 14.707 5.725 -12.231 133 HE2 LYS 47 HE2 LYS 47 12.477 4.690 -12.185 134 HE3 LYS 47 HE1 LYS 47 12.992 3.500 -13.376 135 HZ1 LYS 47 HZ1 LYS 47 14.352 3.846 -10.772 136 HZ2 LYS 47 HZ2 LYS 47 14.498 2.554 -11.867 137 HZ3 LYS 47 HZ3 LYS 47 13.059 2.773 -10.992 138 H VAL 48 HN VAL 48 12.715 8.748 -17.317 139 HA VAL 48 HA VAL 48 12.753 11.315 -16.373 140 HB VAL 48 HB VAL 48 10.162 11.151 -16.797 141 HG11 VAL 48 HG11 VAL 48 11.631 12.142 -18.438 142 HG12 VAL 48 HG12 VAL 48 10.611 10.975 -19.278 143 HG13 VAL 48 HG13 VAL 48 12.279 10.562 -18.883 144 HG21 VAL 48 HG21 VAL 48 11.073 8.554 -18.032 145 HG22 VAL 48 HG22 VAL 48 9.430 9.181 -17.917 146 HG23 VAL 48 HG23 VAL 48 10.266 8.629 -16.466 147 H LYS 49 HN LYS 49 12.313 12.312 -14.520 148 HA LYS 49 HA LYS 49 10.574 11.064 -12.515 149 HB2 LYS 49 HB2 LYS 49 13.480 11.703 -12.123 150 HB3 LYS 49 HB1 LYS 49 12.369 11.717 -10.763 151 HG2 LYS 49 HG2 LYS 49 12.579 9.350 -12.624 152 HG3 LYS 49 HG1 LYS 49 13.640 9.535 -11.231 153 HD2 LYS 49 HD2 LYS 49 11.994 8.984 -9.726 154 HD3 LYS 49 HD1 LYS 49 10.762 9.905 -10.579 155 HE2 LYS 49 HE2 LYS 49 10.337 7.442 -10.561 156 HE3 LYS 49 HE1 LYS 49 10.454 8.126 -12.183 157 HZ1 LYS 49 HZ1 LYS 49 12.313 6.370 -10.766 158 HZ2 LYS 49 HZ2 LYS 49 12.966 7.512 -11.843 159 HZ3 LYS 49 HZ3 LYS 49 11.842 6.364 -12.395 160 H GLY 50 HN GLY 50 9.666 12.473 -11.085 161 HA2 GLY 50 HA2 GLY 50 9.526 15.226 -11.997 162 HA3 GLY 50 HA1 GLY 50 8.544 14.482 -10.736 163 H ILE 51 HN ILE 51 9.370 16.898 -10.124 164 HA ILE 51 HA ILE 51 11.902 17.333 -9.107 165 HB ILE 51 HB ILE 51 10.083 19.021 -9.328 166 HG12 ILE 51 HG12 ILE 51 11.226 18.920 -6.525 167 HG13 ILE 51 HG11 ILE 51 12.192 19.332 -7.942 168 HG21 ILE 51 HG21 ILE 51 8.384 19.213 -7.657 169 HG22 ILE 51 HG22 ILE 51 9.128 17.961 -6.661 170 HG23 ILE 51 HG23 ILE 51 8.362 17.532 -8.190 171 HD11 ILE 51 HD11 ILE 51 9.729 20.791 -6.954 172 HD12 ILE 51 HD12 ILE 51 10.566 21.156 -8.463 173 HD13 ILE 51 HD13 ILE 51 11.389 21.385 -6.920 174 H ASP 52 HN ASP 52 9.597 15.087 -7.883 175 HA ASP 52 HA ASP 52 10.343 15.143 -5.126 176 HB2 ASP 52 HB2 ASP 52 8.976 13.079 -6.861 177 HB3 ASP 52 HB1 ASP 52 9.232 12.864 -5.129 178 H SER 53 HN SER 53 11.249 13.152 -7.876 179 HA SER 53 HA SER 53 13.336 11.791 -6.292 180 HB2 SER 53 HB2 SER 53 13.439 10.799 -8.933 181 HB3 SER 53 HB1 SER 53 12.653 10.038 -7.547 182 HG SER 53 HG SER 53 10.768 11.033 -8.069 183 H TYR 54 HN TYR 54 13.155 14.625 -7.774 184 HA TYR 54 HA TYR 54 15.982 14.573 -8.680 185 HB2 TYR 54 HB2 TYR 54 13.543 15.621 -9.985 186 HB3 TYR 54 HB1 TYR 54 14.858 16.796 -9.934 187 HD1 TYR 54 HD1 TYR 54 14.589 13.067 -10.452 188 HD2 TYR 54 HD2 TYR 54 16.132 16.813 -11.871 189 HE1 TYR 54 HE1 TYR 54 15.735 11.899 -12.323 190 HE2 TYR 54 HE2 TYR 54 17.252 15.650 -13.721 191 HH TYR 54 HH TYR 54 16.777 12.201 -14.309 192 H SER 55 HN SER 55 17.340 15.947 -7.749 193 HA SER 55 HA SER 55 16.689 17.301 -5.393 194 HB2 SER 55 HB2 SER 55 18.978 16.608 -5.973 195 HB3 SER 55 HB1 SER 55 18.999 17.769 -7.300 196 HG SER 55 HG SER 55 18.871 18.247 -4.510 197 H LYS 56 HN LYS 56 16.385 19.481 -4.934 198 HA LYS 56 HA LYS 56 14.827 20.957 -6.752 199 HB2 LYS 56 HB2 LYS 56 16.292 21.779 -4.240 200 HB3 LYS 56 HB1 LYS 56 15.192 22.842 -5.118 201 HG2 LYS 56 HG2 LYS 56 13.371 21.207 -4.842 202 HG3 LYS 56 HG1 LYS 56 14.467 20.127 -3.978 203 HD2 LYS 56 HD2 LYS 56 14.778 21.780 -2.215 204 HD3 LYS 56 HD1 LYS 56 13.789 22.948 -3.097 205 HE2 LYS 56 HE2 LYS 56 12.445 21.879 -1.352 206 HE3 LYS 56 HE1 LYS 56 11.856 21.390 -2.941 207 HZ1 LYS 56 HZ1 LYS 56 12.215 19.296 -2.386 208 HZ2 LYS 56 HZ2 LYS 56 12.805 19.769 -0.865 209 HZ3 LYS 56 HZ3 LYS 56 13.869 19.611 -2.180 210 H THR 57 HN THR 57 18.260 21.155 -5.896 211 HA THR 57 HA THR 57 18.864 23.500 -7.342 212 HB THR 57 HB THR 57 20.733 21.168 -6.891 213 HG1 THR 57 HG1 THR 57 19.404 22.663 -5.121 214 HG21 THR 57 HG21 THR 57 21.280 24.142 -6.914 215 HG22 THR 57 HG22 THR 57 21.418 23.135 -8.355 216 HG23 THR 57 HG23 THR 57 22.457 22.829 -6.962 217 H GLN 58 HN GLN 58 19.066 20.064 -8.275 218 HA GLN 58 HA GLN 58 20.019 20.535 -10.903 219 HB2 GLN 58 HB2 GLN 58 18.523 18.194 -9.711 220 HB3 GLN 58 HB1 GLN 58 19.224 18.196 -11.329 221 HG2 GLN 58 HG2 GLN 58 21.449 18.615 -10.399 222 HG3 GLN 58 HG1 GLN 58 20.774 18.705 -8.773 223 HE21 GLN 58 HE21 GLN 58 22.564 16.823 -8.699 224 HE22 GLN 58 HE22 GLN 58 21.947 15.257 -8.942 225 H TRP 59 HN TRP 59 16.755 20.164 -9.563 226 HA TRP 59 HA TRP 59 15.351 20.137 -12.004 227 HB2 TRP 59 HB2 TRP 59 14.352 19.482 -9.836 228 HB3 TRP 59 HB1 TRP 59 14.448 21.159 -9.294 229 HD1 TRP 59 HD1 TRP 59 12.888 19.161 -12.225 230 HE1 TRP 59 HE1 TRP 59 10.645 20.265 -12.866 231 HE3 TRP 59 HE3 TRP 59 12.923 23.118 -8.997 232 HZ2 TRP 59 HZ2 TRP 59 9.088 22.537 -12.108 233 HZ3 TRP 59 HZ3 TRP 59 11.043 24.733 -8.978 234 HH2 TRP 59 HH2 TRP 59 9.128 24.447 -10.526 235 H SER 60 HN SER 60 16.526 22.763 -9.949 236 HA SER 60 HA SER 60 15.134 24.886 -11.191 237 HB2 SER 60 HB2 SER 60 16.287 25.089 -9.011 238 HB3 SER 60 HB1 SER 60 17.837 24.964 -9.836 239 HG SER 60 HG SER 60 16.111 27.076 -9.622 240 H LYS 61 HN LYS 61 17.848 23.018 -12.224 241 HA LYS 61 HA LYS 61 18.911 24.983 -14.054 242 HB2 LYS 61 HB2 LYS 61 19.344 21.993 -13.870 243 HB3 LYS 61 HB1 LYS 61 20.279 23.099 -14.877 244 HG2 LYS 61 HG2 LYS 61 21.018 24.327 -12.897 245 HG3 LYS 61 HG1 LYS 61 20.032 23.292 -11.865 246 HD2 LYS 61 HD2 LYS 61 21.347 21.319 -12.730 247 HD3 LYS 61 HD1 LYS 61 22.420 22.465 -13.535 248 HE2 LYS 61 HE2 LYS 61 21.816 22.496 -10.573 249 HE3 LYS 61 HE1 LYS 61 23.242 21.738 -11.279 250 HZ1 LYS 61 HZ1 LYS 61 23.856 23.910 -10.617 251 HZ2 LYS 61 HZ2 LYS 61 22.494 24.605 -11.356 252 HZ3 LYS 61 HZ3 LYS 61 23.736 23.943 -12.308 253 H THR 62 HN THR 62 16.231 22.966 -14.034 254 HA THR 62 HA THR 62 16.127 22.311 -16.835 255 HB THR 62 HB THR 62 13.878 21.520 -16.373 256 HG1 THR 62 HG1 THR 62 12.819 22.658 -14.983 257 HG21 THR 62 HG21 THR 62 15.450 19.917 -15.679 258 HG22 THR 62 HG22 THR 62 14.431 20.116 -14.256 259 HG23 THR 62 HG23 THR 62 16.006 20.903 -14.327 260 H PHE 63 HN PHE 63 15.480 25.120 -15.031 261 HA PHE 63 HA PHE 63 14.395 26.452 -17.382 262 HB2 PHE 63 HB2 PHE 63 12.530 27.439 -16.199 263 HB3 PHE 63 HB1 PHE 63 12.411 25.685 -16.079 264 HD1 PHE 63 HD1 PHE 63 13.312 28.786 -14.269 265 HD2 PHE 63 HD2 PHE 63 12.669 24.551 -13.970 266 HE1 PHE 63 HE1 PHE 63 13.314 28.962 -11.795 267 HE2 PHE 63 HE2 PHE 63 12.673 24.726 -11.505 268 HZ PHE 63 HZ PHE 63 12.995 26.930 -10.410 269 H THR 64 HN THR 64 14.509 28.807 -17.176 270 HA THR 64 HA THR 64 16.390 29.738 -15.073 271 HB THR 64 HB THR 64 17.761 30.800 -16.618 272 HG1 THR 64 HG1 THR 64 17.042 31.484 -18.608 273 HG21 THR 64 HG21 THR 64 18.428 29.199 -18.170 274 HG22 THR 64 HG22 THR 64 16.771 28.763 -18.569 275 HG23 THR 64 HG23 THR 64 17.484 28.206 -17.055 276 H PHE 65 HN PHE 65 16.419 32.232 -15.075 277 HA PHE 65 HA PHE 65 13.609 33.168 -15.197 278 HB2 PHE 65 HB2 PHE 65 15.428 33.172 -13.074 279 HB3 PHE 65 HB1 PHE 65 15.494 34.831 -13.656 280 HD1 PHE 65 HD2 PHE 65 12.918 32.168 -13.036 281 HD2 PHE 65 HD1 PHE 65 13.956 36.323 -12.702 282 HE1 PHE 65 HE2 PHE 65 10.749 32.621 -11.923 283 HE2 PHE 65 HE1 PHE 65 11.788 36.774 -11.591 284 HZ PHE 65 HZ PHE 65 10.187 34.927 -11.205 285 H VAL 66 HN VAL 66 13.164 34.434 -16.858 286 HA VAL 66 HA VAL 66 15.214 36.359 -17.807 287 HB VAL 66 HB VAL 66 13.352 34.632 -19.455 288 HG11 VAL 66 HG11 VAL 66 14.533 35.864 -21.382 289 HG12 VAL 66 HG12 VAL 66 14.989 37.068 -20.177 290 HG13 VAL 66 HG13 VAL 66 13.286 36.760 -20.515 291 HG21 VAL 66 HG21 VAL 66 15.546 33.676 -18.640 292 HG22 VAL 66 HG22 VAL 66 16.364 34.950 -19.544 293 HG23 VAL 66 HG23 VAL 66 15.394 33.750 -20.395 294 H ARG 67 HN ARG 67 14.523 38.403 -17.962 295 HA ARG 67 HA ARG 67 13.143 40.214 -17.588 296 HB2 ARG 67 HB2 ARG 67 11.560 38.519 -19.526 297 HB3 ARG 67 HB1 ARG 67 11.097 40.165 -19.081 298 HG2 ARG 67 HG2 ARG 67 13.256 41.013 -19.865 299 HG3 ARG 67 HG1 ARG 67 13.781 39.374 -20.250 300 HD2 ARG 67 HD2 ARG 67 11.970 39.161 -21.895 301 HD3 ARG 67 HD1 ARG 67 11.402 40.782 -21.494 302 HE ARG 67 HE ARG 67 14.065 41.070 -22.212 303 HH11 ARG 67 HH21 ARG 67 11.143 39.857 -23.612 304 HH12 ARG 67 HH22 ARG 67 11.578 40.285 -25.232 305 HH21 ARG 67 HH11 ARG 67 14.643 41.635 -24.335 306 HH22 ARG 67 HH12 ARG 67 13.560 41.290 -25.642 307 H GLY 68 HN GLY 68 12.901 38.106 -15.592 308 HA2 GLY 68 HA2 GLY 68 11.609 37.737 -13.721 309 HA3 GLY 68 HA1 GLY 68 10.541 39.024 -14.281 310 H ARG 69 HN ARG 69 11.282 36.283 -16.306 311 HA ARG 69 HA ARG 69 8.623 35.093 -15.755 312 HB2 ARG 69 HB2 ARG 69 8.518 36.512 -17.791 313 HB3 ARG 69 HB1 ARG 69 9.816 35.549 -18.500 314 HG2 ARG 69 HG2 ARG 69 8.435 33.528 -18.353 315 HG3 ARG 69 HG1 ARG 69 7.146 34.449 -17.576 316 HD2 ARG 69 HD2 ARG 69 7.032 35.905 -19.609 317 HD3 ARG 69 HD1 ARG 69 8.214 34.849 -20.381 318 HE ARG 69 HE ARG 69 6.558 33.209 -20.611 319 HH11 ARG 69 HH21 ARG 69 5.511 35.845 -18.630 320 HH12 ARG 69 HH22 ARG 69 3.847 35.365 -18.628 321 HH21 ARG 69 HH11 ARG 69 4.377 32.571 -20.612 322 HH22 ARG 69 HH12 ARG 69 3.204 33.512 -19.751 323 H THR 70 HN THR 70 8.629 32.943 -15.559 324 HA THR 70 HA THR 70 11.079 31.501 -15.470 325 HB THR 70 HB THR 70 8.274 30.375 -15.596 326 HG1 THR 70 HG1 THR 70 9.643 31.783 -13.674 327 HG21 THR 70 HG21 THR 70 9.914 28.645 -15.864 328 HG22 THR 70 HG22 THR 70 9.386 28.584 -14.183 329 HG23 THR 70 HG23 THR 70 10.931 29.327 -14.597 330 H VAL 71 HN VAL 71 12.141 30.444 -17.034 331 HA VAL 71 HA VAL 71 10.725 29.790 -19.558 332 HB VAL 71 HB VAL 71 13.007 30.295 -20.654 333 HG11 VAL 71 HG11 VAL 71 11.285 32.490 -19.468 334 HG12 VAL 71 HG12 VAL 71 11.077 31.716 -21.039 335 HG13 VAL 71 HG13 VAL 71 12.477 32.748 -20.741 336 HG21 VAL 71 HG21 VAL 71 14.131 30.470 -18.356 337 HG22 VAL 71 HG22 VAL 71 13.336 32.035 -18.193 338 HG23 VAL 71 HG23 VAL 71 14.496 31.762 -19.493 339 H SER 72 HN SER 72 10.906 27.729 -20.130 340 HA SER 72 HA SER 72 12.439 25.892 -18.544 341 HB2 SER 72 HB2 SER 72 11.641 24.219 -20.267 342 HB3 SER 72 HB1 SER 72 10.362 25.105 -19.434 343 HG SER 72 HG SER 72 10.939 26.606 -21.439 344 H VAL 73 HN VAL 73 14.194 24.564 -19.247 345 HA VAL 73 HA VAL 73 15.891 25.865 -21.267 346 HB VAL 73 HB VAL 73 16.586 23.792 -19.176 347 HG11 VAL 73 HG11 VAL 73 18.955 24.745 -19.797 348 HG12 VAL 73 HG12 VAL 73 18.171 25.243 -21.294 349 HG13 VAL 73 HG13 VAL 73 18.217 23.538 -20.846 350 HG21 VAL 73 HG21 VAL 73 17.846 26.404 -18.820 351 HG22 VAL 73 HG22 VAL 73 16.819 25.523 -17.693 352 HG23 VAL 73 HG23 VAL 73 16.097 26.595 -18.884 353 H SER 74 HN SER 74 15.853 25.016 -23.255 354 HA SER 74 HA SER 74 14.717 22.452 -23.822 355 HB2 SER 74 HB2 SER 74 14.574 24.299 -25.425 356 HB3 SER 74 HB1 SER 74 16.328 24.315 -25.582 357 HG SER 74 HG SER 74 14.528 22.228 -26.267 358 H ASP 75 HN ASP 75 17.255 22.733 -22.123 359 HA ASP 75 HA ASP 75 18.631 20.436 -23.293 360 HB2 ASP 75 HB2 ASP 75 19.707 22.627 -24.122 361 HB3 ASP 75 HB1 ASP 75 20.252 22.842 -22.457 362 HA PRO 76 HA PRO 76 18.418 20.569 -18.638 363 HB2 PRO 76 HB2 PRO 76 16.657 18.542 -18.212 364 HB3 PRO 76 HB1 PRO 76 16.124 20.202 -18.559 365 HG2 PRO 76 HG2 PRO 76 16.241 17.835 -20.375 366 HG3 PRO 76 HG1 PRO 76 15.025 19.122 -20.277 367 HD2 PRO 76 HD2 PRO 76 17.075 19.033 -22.169 368 HD3 PRO 76 HD1 PRO 76 16.208 20.510 -21.695 369 H LYS 77 HN LYS 77 20.651 19.816 -19.118 370 HA LYS 77 HA LYS 77 20.977 16.875 -19.136 371 HB2 LYS 77 HB2 LYS 77 22.645 19.185 -20.049 372 HB3 LYS 77 HB1 LYS 77 23.512 17.790 -19.413 373 HG2 LYS 77 HG2 LYS 77 23.234 17.555 -21.828 374 HG3 LYS 77 HG1 LYS 77 22.272 16.329 -21.004 375 HD2 LYS 77 HD2 LYS 77 20.262 17.728 -21.248 376 HD3 LYS 77 HD1 LYS 77 21.218 18.971 -22.057 377 HE2 LYS 77 HE2 LYS 77 20.196 17.716 -23.802 378 HE3 LYS 77 HE1 LYS 77 21.868 17.161 -23.740 379 HZ1 LYS 77 HZ1 LYS 77 20.481 15.257 -23.842 380 HZ2 LYS 77 HZ2 LYS 77 19.482 15.825 -22.591 381 HZ3 LYS 77 HZ3 LYS 77 21.079 15.343 -22.258 382 H VAL 78 HN VAL 78 20.601 16.345 -17.056 383 HA VAL 78 HA VAL 78 22.668 17.137 -15.122 384 HB VAL 78 HB VAL 78 20.906 17.325 -13.345 385 HG11 VAL 78 HG11 VAL 78 20.308 19.611 -13.932 386 HG12 VAL 78 HG12 VAL 78 20.623 19.292 -15.636 387 HG13 VAL 78 HG13 VAL 78 21.955 19.297 -14.479 388 HG21 VAL 78 HG21 VAL 78 18.975 17.667 -15.645 389 HG22 VAL 78 HG22 VAL 78 18.613 17.518 -13.925 390 HG23 VAL 78 HG23 VAL 78 19.182 16.115 -14.834 391 H ILE 79 HN ILE 79 22.699 15.651 -13.235 392 HA ILE 79 HA ILE 79 22.124 12.890 -14.125 393 HB ILE 79 HB ILE 79 23.874 13.854 -11.847 394 HG12 ILE 79 HG12 ILE 79 24.566 14.587 -14.256 395 HG13 ILE 79 HG11 ILE 79 25.768 13.787 -13.248 396 HG21 ILE 79 HG21 ILE 79 24.880 11.537 -12.199 397 HG22 ILE 79 HG22 ILE 79 23.484 11.192 -13.219 398 HG23 ILE 79 HG23 ILE 79 23.254 11.578 -11.511 399 HD11 ILE 79 HD11 ILE 79 25.631 11.777 -14.442 400 HD12 ILE 79 HD12 ILE 79 25.481 12.991 -15.708 401 HD13 ILE 79 HD13 ILE 79 24.046 12.160 -15.110 402 H CYS 80 HN CYS 80 20.465 11.827 -13.221 403 HA CYS 80 HA CYS 80 18.872 12.926 -11.158 404 HB2 CYS 80 HB2 CYS 80 17.556 10.977 -11.312 405 HB3 CYS 80 HB1 CYS 80 18.171 11.234 -12.945 406 H ARG 81 HN ARG 81 18.298 11.623 -9.153 407 HA ARG 81 HA ARG 81 20.549 11.504 -7.439 408 HB2 ARG 81 HB2 ARG 81 17.708 10.521 -7.119 409 HB3 ARG 81 HB1 ARG 81 18.903 10.484 -5.823 410 HG2 ARG 81 HG2 ARG 81 19.176 12.908 -5.953 411 HG3 ARG 81 HG1 ARG 81 18.074 12.982 -7.329 412 HD2 ARG 81 HD2 ARG 81 16.864 13.580 -5.297 413 HD3 ARG 81 HD1 ARG 81 16.271 12.036 -5.900 414 HE ARG 81 HE ARG 81 18.389 11.751 -3.962 415 HH11 ARG 81 HH21 ARG 81 15.000 12.224 -4.475 416 HH12 ARG 81 HH22 ARG 81 14.534 11.542 -2.952 417 HH21 ARG 81 HH11 ARG 81 17.786 10.854 -1.966 418 HH22 ARG 81 HH12 ARG 81 16.111 10.767 -1.532 419 H THR 82 HN THR 82 18.692 9.020 -9.137 420 HA THR 82 HA THR 82 19.784 6.749 -7.874 421 HB THR 82 HB THR 82 18.935 6.920 -10.774 422 HG1 THR 82 HG1 THR 82 16.850 6.428 -9.881 423 HG21 THR 82 HG21 THR 82 19.946 4.794 -10.069 424 HG22 THR 82 HG22 THR 82 18.216 4.589 -10.350 425 HG23 THR 82 HG23 THR 82 18.836 4.710 -8.702 426 H CYS 83 HN CYS 83 20.784 8.558 -10.739 427 HA CYS 83 HA CYS 83 23.119 6.925 -11.207 428 HB2 CYS 83 HB2 CYS 83 22.122 9.514 -12.396 429 HB3 CYS 83 HB1 CYS 83 23.632 8.746 -12.897 430 H GLN 84 HN GLN 84 22.350 9.433 -9.074 431 HA GLN 84 HA GLN 84 24.900 10.757 -9.091 432 HB2 GLN 84 HB2 GLN 84 22.765 11.849 -8.369 433 HB3 GLN 84 HB1 GLN 84 22.778 10.822 -6.937 434 HG2 GLN 84 HG2 GLN 84 25.057 11.734 -6.380 435 HG3 GLN 84 HG1 GLN 84 24.891 12.849 -7.735 436 HE21 GLN 84 HE21 GLN 84 23.586 12.036 -4.525 437 HE22 GLN 84 HE22 GLN 84 22.801 13.522 -4.288 438 HA PRO 85 HA PRO 85 26.795 7.619 -6.460 439 HB2 PRO 85 HB2 PRO 85 29.169 8.854 -5.913 440 HB3 PRO 85 HB1 PRO 85 28.805 8.137 -7.499 441 HG2 PRO 85 HG2 PRO 85 28.671 10.999 -6.643 442 HG3 PRO 85 HG1 PRO 85 29.294 10.304 -8.151 443 HD2 PRO 85 HD2 PRO 85 26.804 11.437 -7.956 444 HD3 PRO 85 HD1 PRO 85 27.180 10.134 -9.102 445 H LYS 86 HN LYS 86 27.486 7.330 -4.228 446 HA LYS 86 HA LYS 86 25.895 8.433 -2.302 447 HB2 LYS 86 HB2 LYS 86 27.532 7.672 -0.646 448 HB3 LYS 86 HB1 LYS 86 27.366 6.477 -1.932 449 HG2 LYS 86 HG2 LYS 86 29.390 7.412 -3.035 450 HG3 LYS 86 HG1 LYS 86 29.575 8.551 -1.702 451 HD2 LYS 86 HD2 LYS 86 29.786 6.668 -0.121 452 HD3 LYS 86 HD1 LYS 86 29.623 5.531 -1.459 453 HE2 LYS 86 HE2 LYS 86 31.644 6.467 -2.513 454 HE3 LYS 86 HE1 LYS 86 31.806 7.620 -1.188 455 HZ1 LYS 86 HZ1 LYS 86 31.774 5.525 0.276 456 HZ2 LYS 86 HZ2 LYS 86 33.200 5.910 -0.564 457 HZ3 LYS 86 HZ3 LYS 86 32.167 4.695 -1.149 458 H GLN 87 HN GLN 87 25.942 10.177 -0.931 459 HA GLN 87 HA GLN 87 26.850 12.622 -1.734 460 HB2 GLN 87 HB2 GLN 87 26.871 13.219 0.773 461 HB3 GLN 87 HB1 GLN 87 25.358 12.609 0.097 462 HG2 GLN 87 HG2 GLN 87 27.357 10.710 1.331 463 HG3 GLN 87 HG1 GLN 87 26.220 11.594 2.345 464 HE21 GLN 87 HE21 GLN 87 26.429 8.610 1.462 465 HE22 GLN 87 HE22 GLN 87 24.853 8.254 0.940 466 H HIS 88 HN HIS 88 28.720 13.739 -1.742 467 HA HIS 88 HA HIS 88 31.191 12.377 -1.416 468 HB2 HIS 88 HB2 HIS 88 30.479 15.291 -1.797 469 HB3 HIS 88 HB1 HIS 88 32.149 14.733 -1.657 470 HD2 HIS 88 HD2 HIS 88 33.184 13.591 -3.985 471 HE1 HIS 88 HE1 HIS 88 29.585 13.481 -6.187 472 HE2 HIS 88 HE2 HIS 88 32.090 13.086 -6.301 473 H ASP 89 HN ASP 89 29.375 14.630 0.605 474 HA ASP 89 HA ASP 89 30.883 13.766 2.944 475 HB2 ASP 89 HB2 ASP 89 32.129 15.736 1.893 476 HB3 ASP 89 HB1 ASP 89 30.733 16.718 2.332 477 H SER 90 HN SER 90 30.020 15.139 4.902 478 HA SER 90 HA SER 90 27.127 15.658 4.612 479 HB2 SER 90 HB2 SER 90 27.353 13.355 5.420 480 HB3 SER 90 HB1 SER 90 28.390 13.911 6.737 481 HG SER 90 HG SER 90 26.619 15.214 7.427 482 H ILE 91 HN ILE 91 26.217 16.916 6.343 483 HA ILE 91 HA ILE 91 28.222 18.510 7.858 484 HB ILE 91 HB ILE 91 25.736 19.533 6.480 485 HG12 ILE 91 HG12 ILE 91 28.653 20.129 5.899 486 HG13 ILE 91 HG11 ILE 91 27.721 18.916 5.014 487 HG21 ILE 91 HG21 ILE 91 26.076 20.853 8.427 488 HG22 ILE 91 HG22 ILE 91 26.872 21.758 7.136 489 HG23 ILE 91 HG23 ILE 91 27.831 20.795 8.259 490 HD11 ILE 91 HD11 ILE 91 27.256 21.899 5.136 491 HD12 ILE 91 HD12 ILE 91 26.019 20.782 4.565 492 HD13 ILE 91 HD13 ILE 91 27.557 20.901 3.717 493 H TRP 92 HN TRP 92 27.826 18.683 9.969 494 HA TRP 92 HA TRP 92 25.407 17.480 11.063 495 HB2 TRP 92 HB2 TRP 92 27.340 16.842 12.256 496 HB3 TRP 92 HB1 TRP 92 27.996 18.481 12.248 497 HD1 TRP 92 HD1 TRP 92 24.479 17.301 13.324 498 HE1 TRP 92 HE1 TRP 92 24.048 18.118 15.733 499 HE3 TRP 92 HE3 TRP 92 29.020 19.388 14.361 500 HZ2 TRP 92 HZ2 TRP 92 25.459 19.461 17.828 501 HZ3 TRP 92 HZ3 TRP 92 29.451 20.427 16.568 502 HH2 TRP 92 HH2 TRP 92 27.677 20.466 18.301 503 H CYS 93 HN CYS 93 23.691 18.558 11.789 504 HA CYS 93 HA CYS 93 23.742 21.514 11.801 505 HB2 CYS 93 HB2 CYS 93 21.981 20.331 10.467 506 HB3 CYS 93 HB1 CYS 93 21.349 19.671 11.979 507 H THR 94 HN THR 94 23.172 22.697 13.585 508 HA THR 94 HA THR 94 23.114 21.220 16.146 509 HB THR 94 HB THR 94 24.092 23.069 17.141 510 HG1 THR 94 HG1 THR 94 23.790 25.152 16.380 511 HG21 THR 94 HG21 THR 94 25.919 23.766 15.783 512 HG22 THR 94 HG22 THR 94 24.981 23.593 14.300 513 HG23 THR 94 HG23 THR 94 25.492 22.160 15.192 514 H ALA 95 HN ALA 95 21.115 22.878 13.950 515 HA ALA 95 HA ALA 95 19.178 23.746 15.976 516 HB1 ALA 95 HB1 ALA 95 18.077 24.901 14.215 517 HB2 ALA 95 HB2 ALA 95 18.914 23.964 12.977 518 HB3 ALA 95 HB3 ALA 95 19.802 25.146 13.941 519 H CYS 96 HN CYS 96 19.861 21.000 14.100 520 HA CYS 96 HA CYS 96 17.101 19.975 14.483 521 HB2 CYS 96 HB2 CYS 96 18.967 19.300 12.193 522 HB3 CYS 96 HB1 CYS 96 17.316 18.716 12.419 523 H GLN 97 HN GLN 97 20.315 19.741 15.275 524 HA GLN 97 HA GLN 97 21.650 18.116 16.224 525 HB2 GLN 97 HB2 GLN 97 19.619 18.380 17.817 526 HB3 GLN 97 HB1 GLN 97 19.090 16.828 17.172 527 HG2 GLN 97 HG2 GLN 97 21.230 15.802 17.860 528 HG3 GLN 97 HG1 GLN 97 21.781 17.357 18.477 529 HE21 GLN 97 HE21 GLN 97 21.510 17.533 20.695 530 HE22 GLN 97 HE22 GLN 97 20.275 16.785 21.589 531 H GLN 98 HN GLN 98 20.552 17.636 13.487 532 HA GLN 98 HA GLN 98 21.015 14.711 13.400 533 HB2 GLN 98 HB2 GLN 98 18.882 16.300 11.961 534 HB3 GLN 98 HB1 GLN 98 19.393 14.697 11.432 535 HG2 GLN 98 HG2 GLN 98 18.430 15.296 14.240 536 HG3 GLN 98 HG1 GLN 98 17.376 14.704 12.959 537 HE21 GLN 98 HE21 GLN 98 18.941 13.565 15.583 538 HE22 GLN 98 HE22 GLN 98 19.352 12.008 15.046 539 H THR 99 HN THR 99 22.259 13.981 11.745 540 HA THR 99 HA THR 99 23.778 16.009 10.273 541 HB THR 99 HB THR 99 24.161 13.029 10.640 542 HG1 THR 99 HG1 THR 99 24.730 14.156 12.441 543 HG21 THR 99 HG21 THR 99 25.673 15.067 9.007 544 HG22 THR 99 HG22 THR 99 25.066 13.490 8.500 545 HG23 THR 99 HG23 THR 99 26.442 13.594 9.597 546 H LYS 100 HN LYS 100 23.503 16.425 8.178 547 HA LYS 100 HA LYS 100 21.969 14.505 6.509 548 HB2 LYS 100 HB2 LYS 100 21.756 17.461 6.035 549 HB3 LYS 100 HB1 LYS 100 20.604 16.184 5.657 550 HG2 LYS 100 HG2 LYS 100 20.424 15.894 8.243 551 HG3 LYS 100 HG1 LYS 100 21.179 17.485 8.313 552 HD2 LYS 100 HD2 LYS 100 18.912 18.054 8.309 553 HD3 LYS 100 HD1 LYS 100 19.299 18.161 6.594 554 HE2 LYS 100 HE2 LYS 100 18.389 15.919 6.215 555 HE3 LYS 100 HE1 LYS 100 18.110 15.714 7.941 556 HZ1 LYS 100 HZ1 LYS 100 16.251 16.901 7.846 557 HZ2 LYS 100 HZ2 LYS 100 16.330 16.698 6.161 558 HZ3 LYS 100 HZ3 LYS 100 16.947 18.109 6.879 559 H GLY 101 HN GLY 101 22.377 14.713 4.199 560 HA2 GLY 101 HA2 GLY 101 25.170 14.896 3.635 561 HA3 GLY 101 HA1 GLY 101 23.889 14.620 2.458 562 H ILE 102 HN ILE 102 25.915 16.180 1.666 563 HA ILE 102 HA ILE 102 25.501 18.959 2.209 564 HB ILE 102 HB ILE 102 27.051 19.312 0.300 565 HG12 ILE 102 HG12 ILE 102 26.933 16.283 0.172 566 HG13 ILE 102 HG11 ILE 102 26.383 17.403 -1.080 567 HG21 ILE 102 HG21 ILE 102 28.974 18.434 1.440 568 HG22 ILE 102 HG22 ILE 102 28.020 17.155 2.187 569 HG23 ILE 102 HG23 ILE 102 27.784 18.829 2.677 570 HD11 ILE 102 HD11 ILE 102 28.551 16.775 -1.793 571 HD12 ILE 102 HD12 ILE 102 29.203 16.860 -0.155 572 HD13 ILE 102 HD13 ILE 102 28.798 18.345 -1.020 573 H ASN 103 HN ASN 103 24.069 16.669 0.094 574 HA ASN 103 HA ASN 103 23.216 18.335 -2.015 575 HB2 ASN 103 HB2 ASN 103 22.011 15.821 -0.846 576 HB3 ASN 103 HB1 ASN 103 21.424 16.592 -2.318 577 HD21 ASN 103 HD21 ASN 103 24.602 17.289 -2.510 578 HD22 ASN 103 HD22 ASN 103 25.176 15.901 -3.315 579 H GLU 104 HN GLU 104 21.698 17.545 1.096 580 HA GLU 104 HA GLU 104 19.420 19.303 0.533 581 HB2 GLU 104 HB2 GLU 104 20.089 17.551 2.910 582 HB3 GLU 104 HB1 GLU 104 18.614 18.505 2.750 583 HG2 GLU 104 HG2 GLU 104 19.505 16.373 0.782 584 HG3 GLU 104 HG1 GLU 104 18.306 16.125 2.052 585 H PHE 105 HN PHE 105 22.320 20.132 1.028 586 HA PHE 105 HA PHE 105 21.707 22.223 3.033 587 HB2 PHE 105 HB2 PHE 105 23.808 20.197 3.059 588 HB3 PHE 105 HB1 PHE 105 24.497 21.814 3.144 589 HD1 PHE 105 HD2 PHE 105 22.397 19.313 4.822 590 HD2 PHE 105 HD1 PHE 105 23.999 23.277 4.995 591 HE1 PHE 105 HE2 PHE 105 21.801 19.452 7.230 592 HE2 PHE 105 HE1 PHE 105 23.402 23.411 7.371 593 HZ PHE 105 HZ PHE 105 22.302 21.515 8.500 594 H SER 106 HN SER 106 22.547 24.224 2.684 595 HA SER 106 HA SER 106 23.010 24.934 -0.056 596 HB2 SER 106 HB2 SER 106 21.749 26.473 1.256 597 HB3 SER 106 HB1 SER 106 22.970 26.492 2.528 598 HG SER 106 HG SER 106 23.181 27.496 -0.121 599 H LYS 107 HN LYS 107 24.864 25.986 -0.876 600 HA LYS 107 HA LYS 107 27.327 24.796 -0.119 601 HB2 LYS 107 HB2 LYS 107 26.786 25.594 -2.417 602 HB3 LYS 107 HB1 LYS 107 26.903 27.252 -1.830 603 HG2 LYS 107 HG2 LYS 107 29.229 26.909 -1.188 604 HG3 LYS 107 HG1 LYS 107 29.130 25.206 -1.650 605 HD2 LYS 107 HD2 LYS 107 28.653 25.862 -3.979 606 HD3 LYS 107 HD1 LYS 107 28.769 27.563 -3.524 607 HE2 LYS 107 HE2 LYS 107 31.101 27.251 -2.853 608 HE3 LYS 107 HE1 LYS 107 30.999 25.529 -3.221 609 HZ1 LYS 107 HZ1 LYS 107 30.150 27.210 -5.388 610 HZ2 LYS 107 HZ2 LYS 107 31.247 25.912 -5.386 611 HZ3 LYS 107 HZ3 LYS 107 31.769 27.469 -4.951 612 H ALA 108 HN ALA 108 25.957 28.027 0.415 613 HA ALA 108 HA ALA 108 28.225 29.157 1.678 614 HB1 ALA 108 HB1 ALA 108 26.651 30.855 2.514 615 HB2 ALA 108 HB2 ALA 108 25.296 29.847 2.005 616 HB3 ALA 108 HB3 ALA 108 26.393 30.525 0.801 617 H GLN 109 HN GLN 109 25.467 27.328 2.921 618 HA GLN 109 HA GLN 109 25.940 27.753 5.667 619 HB2 GLN 109 HB2 GLN 109 24.561 25.544 4.147 620 HB3 GLN 109 HB1 GLN 109 24.684 25.525 5.908 621 HG2 GLN 109 HG2 GLN 109 23.527 27.848 4.331 622 HG3 GLN 109 HG1 GLN 109 22.551 26.557 5.031 623 HE21 GLN 109 HE21 GLN 109 23.222 29.643 5.665 624 HE22 GLN 109 HE22 GLN 109 23.336 29.615 7.359 625 H ARG 110 HN ARG 110 27.396 25.575 3.347 626 HA ARG 110 HA ARG 110 28.721 23.955 5.344 627 HB2 ARG 110 HB2 ARG 110 28.085 23.065 3.099 628 HB3 ARG 110 HB1 ARG 110 29.256 24.159 2.367 629 HG2 ARG 110 HG2 ARG 110 31.073 23.104 3.644 630 HG3 ARG 110 HG1 ARG 110 29.911 22.014 4.412 631 HD2 ARG 110 HD2 ARG 110 29.310 21.112 2.190 632 HD3 ARG 110 HD1 ARG 110 30.491 22.189 1.441 633 HE ARG 110 HE ARG 110 31.630 20.516 3.496 634 HH11 ARG 110 HH21 ARG 110 30.664 20.758 0.184 635 HH12 ARG 110 HH22 ARG 110 31.766 19.541 -0.370 636 HH21 ARG 110 HH11 ARG 110 33.073 18.920 2.785 637 HH22 ARG 110 HH12 ARG 110 33.132 18.498 1.106 638 H HIS 111 HN HIS 111 29.357 26.929 3.682 639 HA HIS 111 HA HIS 111 32.238 26.852 4.211 640 HB2 HIS 111 HB2 HIS 111 31.390 27.777 2.081 641 HB3 HIS 111 HB1 HIS 111 30.543 29.038 2.983 642 HD2 HIS 111 HD2 HIS 111 34.340 27.843 3.330 643 HE1 HIS 111 HE1 HIS 111 34.230 32.038 2.873 644 HE2 HIS 111 HE2 HIS 111 35.750 30.038 3.241 645 H VAL 112 HN VAL 112 29.980 27.121 6.336 646 HA VAL 112 HA VAL 112 31.274 29.346 7.806 647 HB VAL 112 HB VAL 112 29.017 29.928 8.734 648 HG11 VAL 112 HG11 VAL 112 28.361 31.247 6.823 649 HG12 VAL 112 HG12 VAL 112 29.136 30.119 5.710 650 HG13 VAL 112 HG13 VAL 112 30.121 31.119 6.779 651 HG21 VAL 112 HG21 VAL 112 27.961 27.738 8.170 652 HG22 VAL 112 HG22 VAL 112 28.075 28.166 6.464 653 HG23 VAL 112 HG23 VAL 112 27.043 29.108 7.538 654 H LEU 113 HN LEU 113 31.008 29.203 10.133 655 HA LEU 113 HA LEU 113 31.186 26.434 11.055 656 HB2 LEU 113 HB2 LEU 113 31.732 27.764 13.282 657 HB3 LEU 113 HB1 LEU 113 32.931 27.658 11.990 658 HG LEU 113 HG LEU 113 30.981 29.939 11.835 659 HD11 LEU 113 HD11 LEU 113 32.385 31.305 13.352 660 HD12 LEU 113 HD12 LEU 113 33.292 29.857 13.792 661 HD13 LEU 113 HD13 LEU 113 31.581 29.984 14.202 662 HD21 LEU 113 HD21 LEU 113 33.986 29.967 11.481 663 HD22 LEU 113 HD22 LEU 113 32.790 31.046 10.765 664 HD23 LEU 113 HD23 LEU 113 32.920 29.378 10.207 665 H ASP 114 HN ASP 114 28.598 27.343 10.236 666 HA ASP 114 HA ASP 114 27.091 26.618 12.573 667 HB2 ASP 114 HB2 ASP 114 25.645 28.743 12.393 668 HB3 ASP 114 HB1 ASP 114 27.199 28.877 13.219 669 HA PRO 115 HA PRO 115 25.404 25.855 8.238 670 HB2 PRO 115 HB2 PRO 115 25.456 23.105 8.352 671 HB3 PRO 115 HB1 PRO 115 26.816 24.083 7.756 672 HG2 PRO 115 HG2 PRO 115 26.416 22.831 10.440 673 HG3 PRO 115 HG1 PRO 115 27.885 22.925 9.449 674 HD2 PRO 115 HD2 PRO 115 27.451 24.590 11.557 675 HD3 PRO 115 HD1 PRO 115 28.359 25.105 10.118 676 H ARG 116 HN ARG 116 23.265 25.616 7.889 677 HA ARG 116 HA ARG 116 21.585 24.245 9.901 678 HB2 ARG 116 HB2 ARG 116 21.101 26.998 8.726 679 HB3 ARG 116 HB1 ARG 116 19.961 26.113 9.744 680 HG2 ARG 116 HG2 ARG 116 21.624 26.061 11.564 681 HG3 ARG 116 HG1 ARG 116 22.767 26.938 10.550 682 HD2 ARG 116 HD2 ARG 116 21.152 28.818 10.400 683 HD3 ARG 116 HD1 ARG 116 20.066 27.947 11.485 684 HE ARG 116 HE ARG 116 22.561 29.281 12.210 685 HH11 ARG 116 HH21 ARG 116 20.048 27.055 13.062 686 HH12 ARG 116 HH22 ARG 116 20.337 27.173 14.766 687 HH21 ARG 116 HH11 ARG 116 22.941 29.436 14.438 688 HH22 ARG 116 HH12 ARG 116 21.975 28.521 15.545 689 H CYS 117 HN CYS 117 20.569 22.649 8.820 690 HA CYS 117 HA CYS 117 20.397 22.184 6.137 691 HB2 CYS 117 HB2 CYS 117 17.936 21.582 7.751 692 HB3 CYS 117 HB1 CYS 117 18.816 20.552 6.619 693 H GLN 118 HN GLN 118 18.894 22.578 4.484 694 HA GLN 118 HA GLN 118 17.934 25.178 4.241 695 HB2 GLN 118 HB2 GLN 118 17.098 22.644 2.827 696 HB3 GLN 118 HB1 GLN 118 16.505 24.248 2.374 697 HG2 GLN 118 HG2 GLN 118 18.832 25.014 2.058 698 HG3 GLN 118 HG1 GLN 118 19.417 23.409 2.489 699 HE21 GLN 118 HE21 GLN 118 20.288 23.971 0.081 700 HE22 GLN 118 HE22 GLN 118 19.327 23.327 -1.158 701 H ILE 119 HN ILE 119 16.718 22.737 6.200 702 HA ILE 119 HA ILE 119 13.927 23.602 6.084 703 HB ILE 119 HB ILE 119 15.333 21.572 7.829 704 HG12 ILE 119 HG12 ILE 119 13.419 21.162 5.512 705 HG13 ILE 119 HG11 ILE 119 15.176 21.135 5.326 706 HG21 ILE 119 HG21 ILE 119 12.431 22.374 7.519 707 HG22 ILE 119 HG22 ILE 119 13.384 22.323 9.001 708 HG23 ILE 119 HG23 ILE 119 12.919 20.823 8.199 709 HD11 ILE 119 HD11 ILE 119 13.578 19.335 7.174 710 HD12 ILE 119 HD12 ILE 119 15.330 19.307 6.973 711 HD13 ILE 119 HD13 ILE 119 14.281 18.851 5.631 712 H CYS 120 HN CYS 120 16.540 23.536 8.537 713 HA CYS 120 HA CYS 120 15.078 24.899 10.539 714 HB2 CYS 120 HB2 CYS 120 17.621 25.470 11.267 715 HB3 CYS 120 HB1 CYS 120 16.905 23.870 11.487 716 H VAL 121 HN VAL 121 16.836 26.087 7.760 717 HA VAL 121 HA VAL 121 17.108 28.786 8.702 718 HB VAL 121 HB VAL 121 17.709 29.344 6.420 719 HG11 VAL 121 HG11 VAL 121 19.493 28.248 7.573 720 HG12 VAL 121 HG12 VAL 121 19.425 27.497 5.979 721 HG13 VAL 121 HG13 VAL 121 18.744 26.662 7.378 722 HG21 VAL 121 HG21 VAL 121 16.455 26.669 5.817 723 HG22 VAL 121 HG22 VAL 121 17.565 27.446 4.690 724 HG23 VAL 121 HG23 VAL 121 16.048 28.240 5.129 725 H HIS 122 HN HIS 122 14.785 27.084 6.656 726 HA HIS 122 HA HIS 122 13.127 29.425 6.277 727 HB2 HIS 122 HB2 HIS 122 12.704 26.507 5.592 728 HB3 HIS 122 HB1 HIS 122 11.557 27.790 5.195 729 HD2 HIS 122 HD2 HIS 122 12.621 29.761 3.319 730 HE1 HIS 122 HE1 HIS 122 15.768 27.265 2.020 731 HE2 HIS 122 HE2 HIS 122 14.482 29.398 1.523 732 H SER 123 HN SER 123 13.609 27.426 8.854 733 HA SER 123 HA SER 123 10.803 27.591 9.807 734 HB2 SER 123 HB2 SER 123 13.061 25.963 10.978 735 HB3 SER 123 HB1 SER 123 11.347 25.844 11.356 736 HG SER 123 HG SER 123 11.398 24.381 9.835 737 H GLN 124 HN GLN 124 14.057 27.675 11.288 738 HA GLN 124 HA GLN 124 13.106 29.635 13.253 739 HB2 GLN 124 HB2 GLN 124 15.672 28.052 13.007 740 HB3 GLN 124 HB1 GLN 124 15.382 29.255 14.263 741 HG2 GLN 124 HG2 GLN 124 13.411 28.011 15.031 742 HG3 GLN 124 HG1 GLN 124 13.642 26.825 13.749 743 HE21 GLN 124 HE21 GLN 124 14.237 27.314 16.998 744 HE22 GLN 124 HE22 GLN 124 15.570 26.282 17.187 745 H ARG 125 HN ARG 125 13.534 30.337 10.394 746 HA ARG 125 HA ARG 125 14.449 32.035 9.143 747 HB2 ARG 125 HB2 ARG 125 14.745 33.163 11.933 748 HB3 ARG 125 HB1 ARG 125 15.094 34.088 10.471 749 HG2 ARG 125 HG2 ARG 125 12.807 33.760 9.674 750 HG3 ARG 125 HG1 ARG 125 12.441 32.746 11.070 751 HD2 ARG 125 HD2 ARG 125 12.856 34.644 12.575 752 HD3 ARG 125 HD1 ARG 125 13.270 35.659 11.197 753 HE ARG 125 HE ARG 125 10.996 35.813 10.664 754 HH11 ARG 125 HH21 ARG 125 11.591 33.455 13.124 755 HH12 ARG 125 HH22 ARG 125 9.922 33.269 13.545 756 HH21 ARG 125 HH11 ARG 125 8.804 35.578 11.211 757 HH22 ARG 125 HH12 ARG 125 8.343 34.471 12.463 758 H ASN 126 HN ASN 126 16.563 33.706 9.435 759 HA ASN 126 HA ASN 126 18.813 31.869 9.239 760 HB2 ASN 126 HB2 ASN 126 18.531 33.613 7.541 761 HB3 ASN 126 HB1 ASN 126 18.638 34.858 8.786 762 HD21 ASN 126 HD21 ASN 126 20.544 35.188 6.926 763 HD22 ASN 126 HD22 ASN 126 22.053 34.602 7.436 Start of MODEL 5 1 H MET 31 HT1 MET 31 -7.844 20.670 -11.390 2 HA MET 31 HA MET 31 -9.223 21.599 -9.696 3 HB2 MET 31 HB2 MET 31 -9.806 18.689 -9.058 4 HB3 MET 31 HB1 MET 31 -10.276 20.048 -8.027 5 HG2 MET 31 HG2 MET 31 -11.592 21.002 -9.883 6 HG3 MET 31 HG1 MET 31 -11.123 19.653 -10.916 7 HE1 MET 31 HE1 MET 31 -14.183 19.816 -7.558 8 HE2 MET 31 HE2 MET 31 -13.547 21.111 -8.567 9 HE3 MET 31 HE3 MET 31 -12.530 20.400 -7.316 10 H GLY 32 HN GLY 32 -7.130 22.322 -9.188 11 HA2 GLY 32 HA2 GLY 32 -5.457 22.578 -7.586 12 HA3 GLY 32 HA1 GLY 32 -5.932 21.039 -6.874 13 H LYS 33 HN LYS 33 -5.270 21.375 -10.293 14 HA LYS 33 HA LYS 33 -3.376 19.261 -10.294 15 HB2 LYS 33 HB2 LYS 33 -4.015 21.374 -12.365 16 HB3 LYS 33 HB1 LYS 33 -2.955 19.996 -12.654 17 HG2 LYS 33 HG2 LYS 33 -4.794 18.452 -12.104 18 HG3 LYS 33 HG1 LYS 33 -5.859 19.825 -11.799 19 HD2 LYS 33 HD2 LYS 33 -5.575 20.569 -14.135 20 HD3 LYS 33 HD1 LYS 33 -4.516 19.193 -14.443 21 HE2 LYS 33 HE2 LYS 33 -6.353 17.646 -13.888 22 HE3 LYS 33 HE1 LYS 33 -7.415 19.019 -13.570 23 HZ1 LYS 33 HZ1 LYS 33 -6.615 17.867 -16.073 24 HZ2 LYS 33 HZ2 LYS 33 -6.415 19.554 -16.030 25 HZ3 LYS 33 HZ3 LYS 33 -7.937 18.868 -15.714 26 H ASN 34 HN ASN 34 -1.197 19.258 -10.146 27 HA ASN 34 HA ASN 34 0.127 21.765 -9.401 28 HB2 ASN 34 HB2 ASN 34 0.973 18.865 -9.291 29 HB3 ASN 34 HB1 ASN 34 2.044 20.207 -8.874 30 HD21 ASN 34 HD21 ASN 34 1.240 18.236 -6.932 31 HD22 ASN 34 HD22 ASN 34 0.270 19.010 -5.773 32 H ASP 35 HN ASP 35 1.623 22.781 -10.622 33 HA ASP 35 HA ASP 35 1.966 21.896 -13.381 34 HB2 ASP 35 HB2 ASP 35 2.833 24.385 -11.894 35 HB3 ASP 35 HB1 ASP 35 3.185 24.085 -13.599 36 H ASN 36 HN ASN 36 3.503 21.309 -10.493 37 HA ASN 36 HA ASN 36 6.233 21.287 -11.550 38 HB2 ASN 36 HB2 ASN 36 5.052 20.622 -8.850 39 HB3 ASN 36 HB1 ASN 36 6.757 20.385 -9.243 40 HD21 ASN 36 HD21 ASN 36 6.033 22.232 -7.217 41 HD22 ASN 36 HD22 ASN 36 6.353 23.805 -7.767 42 H ASP 37 HN ASP 37 3.731 19.398 -12.126 43 HA ASP 37 HA ASP 37 4.746 16.791 -11.476 44 HB2 ASP 37 HB2 ASP 37 2.320 17.276 -11.785 45 HB3 ASP 37 HB1 ASP 37 2.627 17.559 -13.497 46 H ALA 38 HN ALA 38 6.315 18.804 -13.164 47 HA ALA 38 HA ALA 38 6.567 17.810 -15.791 48 HB1 ALA 38 HB1 ALA 38 8.672 19.156 -14.094 49 HB2 ALA 38 HB2 ALA 38 7.466 19.994 -15.070 50 HB3 ALA 38 HB3 ALA 38 8.695 19.001 -15.851 51 H LEU 39 HN LEU 39 7.919 16.280 -16.703 52 HA LEU 39 HA LEU 39 9.432 14.550 -14.820 53 HB2 LEU 39 HB2 LEU 39 7.836 13.698 -17.240 54 HB3 LEU 39 HB1 LEU 39 8.823 12.642 -16.245 55 HG LEU 39 HG LEU 39 6.713 14.303 -14.886 56 HD11 LEU 39 HD11 LEU 39 5.041 12.531 -15.279 57 HD12 LEU 39 HD12 LEU 39 6.169 11.701 -16.352 58 HD13 LEU 39 HD13 LEU 39 5.528 13.283 -16.798 59 HD21 LEU 39 HD21 LEU 39 7.881 11.537 -14.451 60 HD22 LEU 39 HD22 LEU 39 6.596 12.242 -13.471 61 HD23 LEU 39 HD23 LEU 39 8.187 12.987 -13.499 62 H ILE 40 HN ILE 40 11.493 14.894 -15.209 63 HA ILE 40 HA ILE 40 12.412 15.272 -18.009 64 HB ILE 40 HB ILE 40 13.853 15.944 -15.436 65 HG12 ILE 40 HG12 ILE 40 13.335 18.338 -16.673 66 HG13 ILE 40 HG11 ILE 40 11.896 17.441 -17.151 67 HG21 ILE 40 HG21 ILE 40 14.460 16.347 -18.372 68 HG22 ILE 40 HG22 ILE 40 15.450 15.542 -17.155 69 HG23 ILE 40 HG23 ILE 40 15.251 17.294 -17.110 70 HD11 ILE 40 HD11 ILE 40 12.894 17.833 -14.309 71 HD12 ILE 40 HD12 ILE 40 11.481 16.878 -14.761 72 HD13 ILE 40 HD13 ILE 40 11.492 18.621 -15.036 73 H MET 41 HN MET 41 13.712 13.845 -18.933 74 HA MET 41 HA MET 41 14.283 11.370 -17.536 75 HB2 MET 41 HB2 MET 41 14.727 10.453 -19.638 76 HB3 MET 41 HB1 MET 41 13.520 11.679 -20.015 77 HG2 MET 41 HG2 MET 41 15.530 13.250 -20.427 78 HG3 MET 41 HG1 MET 41 16.504 11.785 -20.457 79 HE1 MET 41 HE1 MET 41 14.665 9.574 -21.822 80 HE2 MET 41 HE2 MET 41 16.380 9.966 -21.924 81 HE3 MET 41 HE3 MET 41 15.436 9.791 -23.401 82 H CYS 42 HN CYS 42 16.223 10.705 -16.800 83 HA CYS 42 HA CYS 42 18.378 12.668 -16.658 84 HB2 CYS 42 HB2 CYS 42 18.264 11.563 -14.633 85 HB3 CYS 42 HB1 CYS 42 17.747 10.043 -15.364 86 H MET 43 HN MET 43 19.847 12.849 -18.201 87 HA MET 43 HA MET 43 20.057 11.065 -20.397 88 HB2 MET 43 HB2 MET 43 22.218 12.391 -20.842 89 HB3 MET 43 HB1 MET 43 20.710 13.308 -20.791 90 HG2 MET 43 HG2 MET 43 21.140 14.059 -18.551 91 HG3 MET 43 HG1 MET 43 22.497 12.942 -18.375 92 HE1 MET 43 HE1 MET 43 24.476 14.307 -17.865 93 HE2 MET 43 HE2 MET 43 23.250 15.502 -17.445 94 HE3 MET 43 HE3 MET 43 24.665 15.990 -18.375 95 H ARG 44 HN ARG 44 21.074 10.560 -17.291 96 HA ARG 44 HA ARG 44 23.591 9.234 -17.944 97 HB2 ARG 44 HB2 ARG 44 22.750 10.484 -15.687 98 HB3 ARG 44 HB1 ARG 44 22.331 8.829 -15.262 99 HG2 ARG 44 HG2 ARG 44 25.065 9.751 -16.196 100 HG3 ARG 44 HG1 ARG 44 24.613 9.431 -14.521 101 HD2 ARG 44 HD2 ARG 44 24.028 7.103 -15.147 102 HD3 ARG 44 HD1 ARG 44 24.569 7.438 -16.792 103 HE ARG 44 HE ARG 44 26.777 7.354 -16.055 104 HH11 ARG 44 HH21 ARG 44 24.531 7.430 -13.423 105 HH12 ARG 44 HH22 ARG 44 25.720 7.068 -12.216 106 HH21 ARG 44 HH11 ARG 44 28.341 6.888 -14.486 107 HH22 ARG 44 HH12 ARG 44 27.883 6.761 -12.821 108 H CYS 45 HN CYS 45 20.548 8.180 -16.363 109 HA CYS 45 HA CYS 45 20.981 5.461 -17.479 110 HB2 CYS 45 HB2 CYS 45 19.546 4.675 -15.656 111 HB3 CYS 45 HB1 CYS 45 20.922 5.580 -15.024 112 H ARG 46 HN ARG 46 19.364 8.169 -18.252 113 HA ARG 46 HA ARG 46 17.465 8.653 -19.479 114 HB2 ARG 46 HB2 ARG 46 17.843 5.741 -20.185 115 HB3 ARG 46 HB1 ARG 46 16.703 6.823 -20.995 116 HG2 ARG 46 HG2 ARG 46 18.567 8.340 -21.578 117 HG3 ARG 46 HG1 ARG 46 19.699 7.240 -20.789 118 HD2 ARG 46 HD2 ARG 46 19.026 5.444 -22.343 119 HD3 ARG 46 HD1 ARG 46 17.923 6.560 -23.140 120 HE ARG 46 HE ARG 46 20.423 7.769 -23.203 121 HH11 ARG 46 HH21 ARG 46 18.925 4.848 -24.303 122 HH12 ARG 46 HH22 ARG 46 19.940 4.688 -25.698 123 HH21 ARG 46 HH11 ARG 46 21.756 7.565 -25.032 124 HH22 ARG 46 HH12 ARG 46 21.541 6.227 -26.110 125 H LYS 47 HN LYS 47 16.996 8.122 -16.761 126 HA LYS 47 HA LYS 47 14.518 6.514 -16.710 127 HB2 LYS 47 HB2 LYS 47 16.330 7.634 -14.572 128 HB3 LYS 47 HB1 LYS 47 14.701 7.082 -14.190 129 HG2 LYS 47 HG2 LYS 47 15.195 4.860 -15.083 130 HG3 LYS 47 HG1 LYS 47 16.786 5.393 -15.606 131 HD2 LYS 47 HD2 LYS 47 17.397 4.436 -13.585 132 HD3 LYS 47 HD1 LYS 47 17.008 6.047 -12.993 133 HE2 LYS 47 HE2 LYS 47 15.145 3.650 -13.000 134 HE3 LYS 47 HE1 LYS 47 15.934 4.352 -11.588 135 HZ1 LYS 47 HZ1 LYS 47 13.756 5.216 -11.662 136 HZ2 LYS 47 HZ2 LYS 47 13.870 5.590 -13.316 137 HZ3 LYS 47 HZ3 LYS 47 14.774 6.469 -12.177 138 H VAL 48 HN VAL 48 12.575 7.431 -16.672 139 HA VAL 48 HA VAL 48 12.393 10.356 -16.682 140 HB VAL 48 HB VAL 48 10.206 8.323 -17.127 141 HG11 VAL 48 HG11 VAL 48 9.312 10.322 -18.476 142 HG12 VAL 48 HG12 VAL 48 10.526 11.285 -17.630 143 HG13 VAL 48 HG13 VAL 48 9.263 10.450 -16.719 144 HG21 VAL 48 HG21 VAL 48 10.650 8.724 -19.550 145 HG22 VAL 48 HG22 VAL 48 12.002 7.933 -18.739 146 HG23 VAL 48 HG23 VAL 48 12.080 9.656 -19.102 147 H LYS 49 HN LYS 49 11.943 11.428 -14.901 148 HA LYS 49 HA LYS 49 10.079 10.365 -12.928 149 HB2 LYS 49 HB2 LYS 49 12.954 11.044 -12.253 150 HB3 LYS 49 HB1 LYS 49 11.676 10.878 -11.058 151 HG2 LYS 49 HG2 LYS 49 12.517 8.665 -12.964 152 HG3 LYS 49 HG1 LYS 49 13.090 8.823 -11.311 153 HD2 LYS 49 HD2 LYS 49 10.604 8.835 -10.631 154 HD3 LYS 49 HD1 LYS 49 10.282 8.237 -12.256 155 HE2 LYS 49 HE2 LYS 49 11.786 6.329 -11.875 156 HE3 LYS 49 HE1 LYS 49 12.121 6.918 -10.244 157 HZ1 LYS 49 HZ1 LYS 49 9.908 6.572 -9.601 158 HZ2 LYS 49 HZ2 LYS 49 10.341 5.170 -10.458 159 HZ3 LYS 49 HZ3 LYS 49 9.377 6.358 -11.198 160 H GLY 50 HN GLY 50 9.614 11.987 -11.234 161 HA2 GLY 50 HA2 GLY 50 9.552 14.685 -12.418 162 HA3 GLY 50 HA1 GLY 50 8.452 14.070 -11.189 163 H ILE 51 HN ILE 51 9.098 16.236 -10.251 164 HA ILE 51 HA ILE 51 11.634 16.836 -9.285 165 HB ILE 51 HB ILE 51 9.640 18.341 -9.256 166 HG12 ILE 51 HG12 ILE 51 10.840 18.085 -6.490 167 HG13 ILE 51 HG11 ILE 51 11.775 18.677 -7.864 168 HG21 ILE 51 HG21 ILE 51 8.906 16.929 -6.684 169 HG22 ILE 51 HG22 ILE 51 8.164 16.508 -8.229 170 HG23 ILE 51 HG23 ILE 51 7.973 18.133 -7.571 171 HD11 ILE 51 HD11 ILE 51 10.687 20.491 -6.504 172 HD12 ILE 51 HD12 ILE 51 9.122 19.841 -6.996 173 HD13 ILE 51 HD13 ILE 51 10.224 20.495 -8.206 174 H ASP 52 HN ASP 52 9.883 14.116 -8.486 175 HA ASP 52 HA ASP 52 10.511 13.920 -5.690 176 HB2 ASP 52 HB2 ASP 52 9.604 11.898 -7.746 177 HB3 ASP 52 HB1 ASP 52 9.827 11.522 -6.038 178 H SER 53 HN SER 53 11.634 12.130 -8.531 179 HA SER 53 HA SER 53 13.988 11.153 -7.118 180 HB2 SER 53 HB2 SER 53 12.554 9.998 -9.056 181 HB3 SER 53 HB1 SER 53 13.763 10.784 -10.068 182 HG SER 53 HG SER 53 14.117 8.555 -8.976 183 H TYR 54 HN TYR 54 13.319 14.070 -8.277 184 HA TYR 54 HA TYR 54 16.086 14.579 -9.234 185 HB2 TYR 54 HB2 TYR 54 13.428 15.565 -10.223 186 HB3 TYR 54 HB1 TYR 54 14.794 16.681 -10.282 187 HD1 TYR 54 HD2 TYR 54 13.480 13.459 -11.564 188 HD2 TYR 54 HD1 TYR 54 16.666 16.324 -11.737 189 HE1 TYR 54 HE2 TYR 54 14.357 12.359 -13.600 190 HE2 TYR 54 HE1 TYR 54 17.540 15.229 -13.751 191 HH TYR 54 HH TYR 54 15.796 12.596 -15.341 192 H SER 55 HN SER 55 17.249 15.858 -7.981 193 HA SER 55 HA SER 55 16.294 16.987 -5.579 194 HB2 SER 55 HB2 SER 55 18.821 17.325 -7.190 195 HB3 SER 55 HB1 SER 55 18.546 18.245 -5.707 196 HG SER 55 HG SER 55 18.725 16.458 -4.561 197 H LYS 56 HN LYS 56 16.130 19.222 -5.009 198 HA LYS 56 HA LYS 56 14.585 20.762 -6.777 199 HB2 LYS 56 HB2 LYS 56 16.113 21.520 -4.283 200 HB3 LYS 56 HB1 LYS 56 15.010 22.612 -5.122 201 HG2 LYS 56 HG2 LYS 56 13.168 21.009 -4.815 202 HG3 LYS 56 HG1 LYS 56 14.267 19.891 -4.005 203 HD2 LYS 56 HD2 LYS 56 14.704 21.597 -2.262 204 HD3 LYS 56 HD1 LYS 56 13.566 22.687 -3.060 205 HE2 LYS 56 HE2 LYS 56 12.819 19.922 -2.073 206 HE3 LYS 56 HE1 LYS 56 12.581 21.392 -1.127 207 HZ1 LYS 56 HZ1 LYS 56 11.420 20.812 -3.798 208 HZ2 LYS 56 HZ2 LYS 56 11.241 22.277 -2.955 209 HZ3 LYS 56 HZ3 LYS 56 10.581 20.845 -2.325 210 H THR 57 HN THR 57 18.031 20.896 -5.955 211 HA THR 57 HA THR 57 18.664 23.249 -7.357 212 HB THR 57 HB THR 57 20.991 22.250 -7.440 213 HG1 THR 57 HG1 THR 57 20.158 20.062 -7.497 214 HG21 THR 57 HG21 THR 57 20.121 23.610 -5.538 215 HG22 THR 57 HG22 THR 57 21.302 22.403 -5.030 216 HG23 THR 57 HG23 THR 57 19.581 22.123 -4.761 217 H GLN 58 HN GLN 58 18.767 19.840 -8.402 218 HA GLN 58 HA GLN 58 19.634 20.412 -11.047 219 HB2 GLN 58 HB2 GLN 58 18.260 18.008 -9.834 220 HB3 GLN 58 HB1 GLN 58 18.848 18.067 -11.494 221 HG2 GLN 58 HG2 GLN 58 21.125 18.515 -10.700 222 HG3 GLN 58 HG1 GLN 58 20.553 18.531 -9.034 223 HE21 GLN 58 HE21 GLN 58 22.470 16.633 -10.507 224 HE22 GLN 58 HE22 GLN 58 21.835 15.084 -10.192 225 H TRP 59 HN TRP 59 16.425 19.555 -9.714 226 HA TRP 59 HA TRP 59 14.980 19.694 -12.084 227 HB2 TRP 59 HB2 TRP 59 13.992 18.815 -10.039 228 HB3 TRP 59 HB1 TRP 59 14.117 20.392 -9.258 229 HD1 TRP 59 HD1 TRP 59 12.321 18.683 -12.211 230 HE1 TRP 59 HE1 TRP 59 10.112 19.942 -12.663 231 HE3 TRP 59 HE3 TRP 59 12.809 22.513 -8.875 232 HZ2 TRP 59 HZ2 TRP 59 8.744 22.274 -11.723 233 HZ3 TRP 59 HZ3 TRP 59 11.040 24.235 -8.669 234 HH2 TRP 59 HH2 TRP 59 9.009 24.120 -10.087 235 H SER 60 HN SER 60 16.078 22.252 -9.923 236 HA SER 60 HA SER 60 14.485 24.361 -10.896 237 HB2 SER 60 HB2 SER 60 17.206 24.302 -9.597 238 HB3 SER 60 HB1 SER 60 16.400 25.806 -10.036 239 HG SER 60 HG SER 60 14.982 25.504 -8.484 240 H LYS 61 HN LYS 61 17.504 22.973 -12.057 241 HA LYS 61 HA LYS 61 18.226 25.007 -13.878 242 HB2 LYS 61 HB2 LYS 61 18.776 22.028 -13.936 243 HB3 LYS 61 HB1 LYS 61 19.577 23.219 -14.962 244 HG2 LYS 61 HG2 LYS 61 20.440 24.377 -12.982 245 HG3 LYS 61 HG1 LYS 61 19.602 23.235 -11.934 246 HD2 LYS 61 HD2 LYS 61 20.919 21.381 -12.925 247 HD3 LYS 61 HD1 LYS 61 21.791 22.554 -13.918 248 HE2 LYS 61 HE2 LYS 61 22.579 23.695 -11.887 249 HE3 LYS 61 HE1 LYS 61 21.703 22.533 -10.892 250 HZ1 LYS 61 HZ1 LYS 61 23.505 21.265 -10.980 251 HZ2 LYS 61 HZ2 LYS 61 24.249 22.277 -12.124 252 HZ3 LYS 61 HZ3 LYS 61 23.213 21.031 -12.634 253 H THR 62 HN THR 62 15.564 23.006 -13.853 254 HA THR 62 HA THR 62 15.295 22.398 -16.623 255 HB THR 62 HB THR 62 12.950 21.906 -16.080 256 HG1 THR 62 HG1 THR 62 12.051 22.694 -14.353 257 HG21 THR 62 HG21 THR 62 15.153 20.941 -14.270 258 HG22 THR 62 HG22 THR 62 14.294 20.079 -15.538 259 HG23 THR 62 HG23 THR 62 13.497 20.397 -14.000 260 H PHE 63 HN PHE 63 14.834 25.245 -14.781 261 HA PHE 63 HA PHE 63 13.806 26.671 -17.138 262 HB2 PHE 63 HB2 PHE 63 12.282 27.971 -15.642 263 HB3 PHE 63 HB1 PHE 63 11.828 26.274 -15.800 264 HD1 PHE 63 HD1 PHE 63 13.581 28.716 -13.592 265 HD2 PHE 63 HD2 PHE 63 11.809 24.819 -13.931 266 HE1 PHE 63 HE1 PHE 63 13.764 28.417 -11.134 267 HE2 PHE 63 HE2 PHE 63 11.995 24.516 -11.483 268 HZ PHE 63 HZ PHE 63 12.971 26.316 -10.079 269 H THR 64 HN THR 64 14.417 28.809 -17.270 270 HA THR 64 HA THR 64 16.463 29.723 -15.317 271 HB THR 64 HB THR 64 17.481 30.888 -17.346 272 HG1 THR 64 HG1 THR 64 16.318 30.697 -19.065 273 HG21 THR 64 HG21 THR 64 18.505 28.685 -18.173 274 HG22 THR 64 HG22 THR 64 17.446 27.892 -17.006 275 HG23 THR 64 HG23 THR 64 18.664 29.041 -16.453 276 H PHE 65 HN PHE 65 16.764 32.108 -15.373 277 HA PHE 65 HA PHE 65 14.124 33.419 -15.570 278 HB2 PHE 65 HB2 PHE 65 16.042 33.372 -13.554 279 HB3 PHE 65 HB1 PHE 65 16.323 34.937 -14.303 280 HD1 PHE 65 HD1 PHE 65 13.393 32.788 -13.364 281 HD2 PHE 65 HD2 PHE 65 15.106 36.726 -13.391 282 HE1 PHE 65 HE1 PHE 65 11.380 33.668 -12.220 283 HE2 PHE 65 HE2 PHE 65 13.089 37.607 -12.241 284 HZ PHE 65 HZ PHE 65 11.229 36.081 -11.666 285 H VAL 66 HN VAL 66 13.733 34.748 -17.186 286 HA VAL 66 HA VAL 66 15.951 36.209 -18.481 287 HB VAL 66 HB VAL 66 13.751 34.622 -19.818 288 HG11 VAL 66 HG11 VAL 66 13.764 36.644 -21.051 289 HG12 VAL 66 HG12 VAL 66 14.871 35.598 -21.941 290 HG13 VAL 66 HG13 VAL 66 15.507 36.846 -20.869 291 HG21 VAL 66 HG21 VAL 66 15.821 33.418 -19.204 292 HG22 VAL 66 HG22 VAL 66 16.776 34.625 -20.063 293 HG23 VAL 66 HG23 VAL 66 15.677 33.574 -20.955 294 H ARG 67 HN ARG 67 15.555 38.298 -18.864 295 HA ARG 67 HA ARG 67 14.515 40.338 -18.700 296 HB2 ARG 67 HB2 ARG 67 12.290 38.637 -19.836 297 HB3 ARG 67 HB1 ARG 67 12.199 40.397 -19.694 298 HG2 ARG 67 HG2 ARG 67 14.177 40.649 -21.106 299 HG3 ARG 67 HG1 ARG 67 14.375 38.899 -21.185 300 HD2 ARG 67 HD2 ARG 67 13.268 39.686 -23.218 301 HD3 ARG 67 HD1 ARG 67 12.144 38.716 -22.263 302 HE ARG 67 HE ARG 67 10.887 40.645 -21.847 303 HH11 ARG 67 HH21 ARG 67 13.931 41.379 -23.319 304 HH12 ARG 67 HH22 ARG 67 13.530 43.031 -23.651 305 HH21 ARG 67 HH11 ARG 67 10.353 42.811 -22.278 306 HH22 ARG 67 HH12 ARG 67 11.503 43.840 -23.062 307 H GLY 68 HN GLY 68 14.326 38.383 -16.396 308 HA2 GLY 68 HA2 GLY 68 13.580 38.717 -14.220 309 HA3 GLY 68 HA1 GLY 68 12.489 39.974 -14.805 310 H ARG 69 HN ARG 69 12.402 37.004 -16.523 311 HA ARG 69 HA ARG 69 10.011 36.088 -15.016 312 HB2 ARG 69 HB2 ARG 69 10.312 36.249 -18.026 313 HB3 ARG 69 HB1 ARG 69 8.945 35.537 -17.166 314 HG2 ARG 69 HG2 ARG 69 8.499 37.710 -16.081 315 HG3 ARG 69 HG1 ARG 69 9.854 38.419 -16.963 316 HD2 ARG 69 HD2 ARG 69 7.479 37.103 -18.298 317 HD3 ARG 69 HD1 ARG 69 7.616 38.839 -18.029 318 HE ARG 69 HE ARG 69 9.930 38.203 -19.337 319 HH11 ARG 69 HH21 ARG 69 6.558 37.651 -19.882 320 HH12 ARG 69 HH22 ARG 69 6.693 37.666 -21.609 321 HH21 ARG 69 HH11 ARG 69 10.116 38.220 -21.601 322 HH22 ARG 69 HH12 ARG 69 8.708 37.987 -22.582 323 H THR 70 HN THR 70 9.630 33.845 -15.069 324 HA THR 70 HA THR 70 12.028 32.243 -15.372 325 HB THR 70 HB THR 70 10.363 31.976 -13.492 326 HG1 THR 70 HG1 THR 70 10.980 29.964 -13.387 327 HG21 THR 70 HG21 THR 70 8.268 30.935 -13.895 328 HG22 THR 70 HG22 THR 70 8.711 30.519 -15.551 329 HG23 THR 70 HG23 THR 70 8.395 32.199 -15.117 330 H VAL 71 HN VAL 71 12.523 30.943 -17.038 331 HA VAL 71 HA VAL 71 10.444 30.335 -19.062 332 HB VAL 71 HB VAL 71 12.413 30.537 -20.733 333 HG11 VAL 71 HG11 VAL 71 12.064 33.031 -20.873 334 HG12 VAL 71 HG12 VAL 71 11.200 32.941 -19.338 335 HG13 VAL 71 HG13 VAL 71 10.568 32.104 -20.756 336 HG21 VAL 71 HG21 VAL 71 14.247 31.938 -20.089 337 HG22 VAL 71 HG22 VAL 71 14.103 30.729 -18.818 338 HG23 VAL 71 HG23 VAL 71 13.486 32.362 -18.555 339 H SER 72 HN SER 72 10.280 28.245 -19.531 340 HA SER 72 HA SER 72 11.830 26.275 -18.220 341 HB2 SER 72 HB2 SER 72 10.619 24.673 -19.603 342 HB3 SER 72 HB1 SER 72 9.511 25.910 -19.004 343 HG SER 72 HG SER 72 9.854 25.225 -21.472 344 H VAL 73 HN VAL 73 13.758 25.381 -18.752 345 HA VAL 73 HA VAL 73 15.307 26.388 -20.874 346 HB VAL 73 HB VAL 73 15.631 23.893 -19.204 347 HG11 VAL 73 HG11 VAL 73 16.921 23.544 -21.194 348 HG12 VAL 73 HG12 VAL 73 18.056 24.115 -19.972 349 HG13 VAL 73 HG13 VAL 73 17.466 25.222 -21.212 350 HG21 VAL 73 HG21 VAL 73 16.678 26.726 -19.025 351 HG22 VAL 73 HG22 VAL 73 17.488 25.390 -18.207 352 HG23 VAL 73 HG23 VAL 73 15.828 25.797 -17.797 353 H SER 74 HN SER 74 15.587 25.724 -22.951 354 HA SER 74 HA SER 74 13.669 24.108 -24.217 355 HB2 SER 74 HB2 SER 74 16.435 24.901 -25.153 356 HB3 SER 74 HB1 SER 74 15.186 24.201 -26.179 357 HG SER 74 HG SER 74 15.370 26.733 -25.022 358 H ASP 75 HN ASP 75 16.963 23.377 -23.119 359 HA ASP 75 HA ASP 75 16.303 20.519 -23.133 360 HB2 ASP 75 HB2 ASP 75 17.351 21.135 -25.365 361 HB3 ASP 75 HB1 ASP 75 18.829 21.492 -24.465 362 HA PRO 76 HA PRO 76 18.899 21.824 -19.537 363 HB2 PRO 76 HB2 PRO 76 17.369 20.741 -17.559 364 HB3 PRO 76 HB1 PRO 76 17.033 22.331 -18.264 365 HG2 PRO 76 HG2 PRO 76 15.695 19.720 -18.766 366 HG3 PRO 76 HG1 PRO 76 14.999 21.347 -18.697 367 HD2 PRO 76 HD2 PRO 76 15.595 19.976 -21.051 368 HD3 PRO 76 HD1 PRO 76 15.402 21.740 -20.938 369 H LYS 77 HN LYS 77 20.443 20.596 -18.487 370 HA LYS 77 HA LYS 77 20.345 17.657 -18.923 371 HB2 LYS 77 HB2 LYS 77 22.705 19.550 -18.872 372 HB3 LYS 77 HB1 LYS 77 22.834 17.792 -18.899 373 HG2 LYS 77 HG2 LYS 77 21.643 17.690 -21.022 374 HG3 LYS 77 HG1 LYS 77 21.359 19.429 -20.975 375 HD2 LYS 77 HD2 LYS 77 23.229 19.158 -22.417 376 HD3 LYS 77 HD1 LYS 77 23.906 19.696 -20.883 377 HE2 LYS 77 HE2 LYS 77 24.630 17.484 -20.320 378 HE3 LYS 77 HE1 LYS 77 23.682 16.768 -21.624 379 HZ1 LYS 77 HZ1 LYS 77 26.263 18.072 -21.709 380 HZ2 LYS 77 HZ2 LYS 77 25.202 18.513 -22.959 381 HZ3 LYS 77 HZ3 LYS 77 25.613 16.881 -22.727 382 H VAL 78 HN VAL 78 19.994 16.613 -17.115 383 HA VAL 78 HA VAL 78 21.484 17.336 -14.696 384 HB VAL 78 HB VAL 78 19.235 16.867 -13.427 385 HG11 VAL 78 HG11 VAL 78 19.750 19.459 -14.923 386 HG12 VAL 78 HG12 VAL 78 20.428 19.015 -13.356 387 HG13 VAL 78 HG13 VAL 78 18.696 19.285 -13.524 388 HG21 VAL 78 HG21 VAL 78 18.113 18.063 -15.965 389 HG22 VAL 78 HG22 VAL 78 17.241 17.387 -14.589 390 HG23 VAL 78 HG23 VAL 78 18.114 16.321 -15.695 391 H ILE 79 HN ILE 79 21.303 15.627 -13.034 392 HA ILE 79 HA ILE 79 20.909 12.937 -14.229 393 HB ILE 79 HB ILE 79 23.125 13.918 -12.413 394 HG12 ILE 79 HG12 ILE 79 23.157 12.695 -15.190 395 HG13 ILE 79 HG11 ILE 79 23.360 14.406 -14.839 396 HG21 ILE 79 HG21 ILE 79 22.598 11.775 -11.599 397 HG22 ILE 79 HG22 ILE 79 23.917 11.479 -12.718 398 HG23 ILE 79 HG23 ILE 79 22.259 11.136 -13.204 399 HD11 ILE 79 HD11 ILE 79 25.334 13.799 -13.398 400 HD12 ILE 79 HD12 ILE 79 25.562 13.439 -15.111 401 HD13 ILE 79 HD13 ILE 79 25.178 12.139 -13.979 402 H CYS 80 HN CYS 80 20.583 11.227 -12.565 403 HA CYS 80 HA CYS 80 18.581 12.054 -10.664 404 HB2 CYS 80 HB2 CYS 80 19.782 9.289 -10.767 405 HB3 CYS 80 HB1 CYS 80 18.145 9.771 -10.322 406 H ARG 81 HN ARG 81 18.620 11.507 -8.412 407 HA ARG 81 HA ARG 81 20.959 12.415 -7.102 408 HB2 ARG 81 HB2 ARG 81 18.473 11.033 -6.086 409 HB3 ARG 81 HB1 ARG 81 19.762 11.601 -5.023 410 HG2 ARG 81 HG2 ARG 81 19.486 13.884 -5.861 411 HG3 ARG 81 HG1 ARG 81 18.251 13.338 -6.995 412 HD2 ARG 81 HD2 ARG 81 17.153 14.286 -5.044 413 HD3 ARG 81 HD1 ARG 81 16.887 12.545 -5.060 414 HE ARG 81 HE ARG 81 19.212 13.177 -3.542 415 HH11 ARG 81 HH21 ARG 81 15.755 13.303 -3.516 416 HH12 ARG 81 HH22 ARG 81 15.626 13.222 -1.791 417 HH21 ARG 81 HH11 ARG 81 19.052 13.074 -1.278 418 HH22 ARG 81 HH12 ARG 81 17.494 13.093 -0.523 419 H THR 82 HN THR 82 19.654 9.183 -7.743 420 HA THR 82 HA THR 82 21.597 7.802 -6.146 421 HB THR 82 HB THR 82 20.664 5.801 -7.070 422 HG1 THR 82 HG1 THR 82 19.124 7.215 -8.913 423 HG21 THR 82 HG21 THR 82 18.235 6.194 -6.777 424 HG22 THR 82 HG22 THR 82 18.516 7.932 -6.868 425 HG23 THR 82 HG23 THR 82 19.181 7.000 -5.525 426 H CYS 83 HN CYS 83 21.315 8.662 -9.567 427 HA CYS 83 HA CYS 83 23.407 7.111 -10.594 428 HB2 CYS 83 HB2 CYS 83 21.997 9.601 -11.418 429 HB3 CYS 83 HB1 CYS 83 23.523 9.243 -12.228 430 H GLN 84 HN GLN 84 23.409 10.101 -8.780 431 HA GLN 84 HA GLN 84 25.807 11.228 -9.340 432 HB2 GLN 84 HB2 GLN 84 24.411 10.870 -6.698 433 HB3 GLN 84 HB1 GLN 84 25.905 11.793 -6.825 434 HG2 GLN 84 HG2 GLN 84 23.556 12.363 -8.640 435 HG3 GLN 84 HG1 GLN 84 23.678 13.095 -7.036 436 HE21 GLN 84 HE21 GLN 84 25.062 14.894 -6.811 437 HE22 GLN 84 HE22 GLN 84 26.086 15.460 -8.042 438 HA PRO 85 HA PRO 85 29.223 8.506 -8.557 439 HB2 PRO 85 HB2 PRO 85 30.203 10.551 -6.589 440 HB3 PRO 85 HB1 PRO 85 31.070 9.768 -7.928 441 HG2 PRO 85 HG2 PRO 85 30.120 12.302 -8.071 442 HG3 PRO 85 HG1 PRO 85 30.276 11.245 -9.482 443 HD2 PRO 85 HD2 PRO 85 27.814 12.175 -8.137 444 HD3 PRO 85 HD1 PRO 85 28.022 11.466 -9.755 445 H LYS 86 HN LYS 86 30.191 7.186 -6.861 446 HA LYS 86 HA LYS 86 28.338 6.279 -4.929 447 HB2 LYS 86 HB2 LYS 86 31.334 5.840 -5.033 448 HB3 LYS 86 HB1 LYS 86 30.173 4.862 -4.138 449 HG2 LYS 86 HG2 LYS 86 30.141 5.232 -7.148 450 HG3 LYS 86 HG1 LYS 86 30.844 3.842 -6.323 451 HD2 LYS 86 HD2 LYS 86 28.506 3.596 -5.205 452 HD3 LYS 86 HD1 LYS 86 27.943 4.662 -6.494 453 HE2 LYS 86 HE2 LYS 86 29.428 2.055 -6.925 454 HE3 LYS 86 HE1 LYS 86 27.690 2.282 -7.123 455 HZ1 LYS 86 HZ1 LYS 86 28.079 3.856 -8.860 456 HZ2 LYS 86 HZ2 LYS 86 28.963 2.450 -9.219 457 HZ3 LYS 86 HZ3 LYS 86 29.755 3.820 -8.601 458 H GLN 87 HN GLN 87 28.052 6.744 -2.818 459 HA GLN 87 HA GLN 87 30.009 8.418 -1.401 460 HB2 GLN 87 HB2 GLN 87 28.373 9.957 -2.520 461 HB3 GLN 87 HB1 GLN 87 27.084 9.179 -1.594 462 HG2 GLN 87 HG2 GLN 87 28.202 9.804 0.507 463 HG3 GLN 87 HG1 GLN 87 29.507 10.560 -0.405 464 HE21 GLN 87 HE21 GLN 87 29.186 12.774 -0.006 465 HE22 GLN 87 HE22 GLN 87 27.726 13.590 -0.291 466 H HIS 88 HN HIS 88 27.385 6.163 -1.464 467 HA HIS 88 HA HIS 88 27.398 5.934 1.492 468 HB2 HIS 88 HB2 HIS 88 25.462 4.730 -0.505 469 HB3 HIS 88 HB1 HIS 88 25.305 4.740 1.257 470 HD2 HIS 88 HD2 HIS 88 24.459 7.216 2.362 471 HE1 HIS 88 HE1 HIS 88 23.940 9.202 -1.328 472 HE2 HIS 88 HE2 HIS 88 23.542 9.356 1.175 473 H ASP 89 HN ASP 89 29.001 4.584 2.074 474 HA ASP 89 HA ASP 89 29.633 2.215 0.483 475 HB2 ASP 89 HB2 ASP 89 31.436 1.910 2.175 476 HB3 ASP 89 HB1 ASP 89 31.498 3.480 1.378 477 H SER 90 HN SER 90 27.348 2.962 2.710 478 HA SER 90 HA SER 90 27.164 0.161 3.650 479 HB2 SER 90 HB2 SER 90 26.726 0.784 5.855 480 HB3 SER 90 HB1 SER 90 27.988 1.932 5.395 481 HG SER 90 HG SER 90 25.355 2.345 6.013 482 H ILE 91 HN ILE 91 25.086 -0.628 3.948 483 HA ILE 91 HA ILE 91 22.861 1.074 2.963 484 HB ILE 91 HB ILE 91 23.446 -1.781 2.152 485 HG12 ILE 91 HG12 ILE 91 23.281 0.724 0.457 486 HG13 ILE 91 HG11 ILE 91 24.805 0.075 1.077 487 HG21 ILE 91 HG21 ILE 91 21.078 -1.571 2.312 488 HG22 ILE 91 HG22 ILE 91 21.447 -1.297 0.609 489 HG23 ILE 91 HG23 ILE 91 21.105 0.071 1.670 490 HD11 ILE 91 HD11 ILE 91 24.386 -0.725 -1.213 491 HD12 ILE 91 HD12 ILE 91 22.845 -1.413 -0.699 492 HD13 ILE 91 HD13 ILE 91 24.358 -2.066 -0.070 493 H TRP 92 HN TRP 92 21.010 0.906 4.088 494 HA TRP 92 HA TRP 92 21.027 -0.701 6.515 495 HB2 TRP 92 HB2 TRP 92 20.199 1.521 6.794 496 HB3 TRP 92 HB1 TRP 92 19.132 1.374 5.393 497 HD1 TRP 92 HD1 TRP 92 19.545 -1.155 8.277 498 HE1 TRP 92 HE1 TRP 92 17.236 -1.525 9.366 499 HE3 TRP 92 HE3 TRP 92 16.789 2.278 5.688 500 HZ2 TRP 92 HZ2 TRP 92 14.577 -0.493 9.170 501 HZ3 TRP 92 HZ3 TRP 92 14.374 2.565 6.160 502 HH2 TRP 92 HH2 TRP 92 13.266 1.186 7.897 503 H CYS 93 HN CYS 93 20.150 -2.653 6.681 504 HA CYS 93 HA CYS 93 18.331 -3.624 4.559 505 HB2 CYS 93 HB2 CYS 93 20.202 -5.084 4.851 506 HB3 CYS 93 HB1 CYS 93 20.030 -5.062 6.608 507 H THR 94 HN THR 94 16.270 -4.213 5.018 508 HA THR 94 HA THR 94 15.276 -3.615 7.731 509 HB THR 94 HB THR 94 13.199 -3.219 6.763 510 HG1 THR 94 HG1 THR 94 13.865 -4.492 4.358 511 HG21 THR 94 HG21 THR 94 15.053 -2.698 4.426 512 HG22 THR 94 HG22 THR 94 14.986 -1.680 5.866 513 HG23 THR 94 HG23 THR 94 13.570 -1.831 4.825 514 H ALA 95 HN ALA 95 16.156 -6.251 5.785 515 HA ALA 95 HA ALA 95 14.249 -8.138 6.894 516 HB1 ALA 95 HB1 ALA 95 14.986 -8.517 4.628 517 HB2 ALA 95 HB2 ALA 95 15.634 -9.809 5.639 518 HB3 ALA 95 HB3 ALA 95 16.678 -8.486 5.124 519 H CYS 96 HN CYS 96 17.573 -7.120 7.449 520 HA CYS 96 HA CYS 96 17.934 -9.208 9.501 521 HB2 CYS 96 HB2 CYS 96 19.910 -7.247 8.302 522 HB3 CYS 96 HB1 CYS 96 20.294 -8.500 9.485 523 H GLN 97 HN GLN 97 17.596 -5.759 9.031 524 HA GLN 97 HA GLN 97 17.025 -4.106 10.535 525 HB2 GLN 97 HB2 GLN 97 15.995 -6.146 11.828 526 HB3 GLN 97 HB1 GLN 97 17.406 -5.977 12.867 527 HG2 GLN 97 HG2 GLN 97 15.676 -4.655 13.858 528 HG3 GLN 97 HG1 GLN 97 16.804 -3.525 13.112 529 HE21 GLN 97 HE21 GLN 97 15.383 -1.840 12.486 530 HE22 GLN 97 HE22 GLN 97 14.060 -2.068 11.449 531 H GLN 98 HN GLN 98 19.758 -4.958 9.717 532 HA GLN 98 HA GLN 98 21.243 -3.423 11.752 533 HB2 GLN 98 HB2 GLN 98 22.061 -6.112 10.620 534 HB3 GLN 98 HB1 GLN 98 23.153 -5.039 11.494 535 HG2 GLN 98 HG2 GLN 98 20.545 -6.108 12.616 536 HG3 GLN 98 HG1 GLN 98 22.130 -6.802 12.950 537 HE21 GLN 98 HE21 GLN 98 19.964 -5.024 14.524 538 HE22 GLN 98 HE22 GLN 98 20.966 -3.928 15.347 539 H THR 99 HN THR 99 23.210 -2.487 10.955 540 HA THR 99 HA THR 99 22.963 -1.617 8.201 541 HB THR 99 HB THR 99 25.083 -0.975 10.266 542 HG1 THR 99 HG1 THR 99 22.781 -0.412 10.663 543 HG21 THR 99 HG21 THR 99 24.319 0.296 7.626 544 HG22 THR 99 HG22 THR 99 25.843 -0.502 8.011 545 HG23 THR 99 HG23 THR 99 25.424 1.021 8.794 546 H LYS 100 HN LYS 100 23.975 -2.473 6.512 547 HA LYS 100 HA LYS 100 26.305 -4.259 6.980 548 HB2 LYS 100 HB2 LYS 100 23.819 -4.630 5.431 549 HB3 LYS 100 HB1 LYS 100 25.266 -5.014 4.506 550 HG2 LYS 100 HG2 LYS 100 24.543 -7.031 5.600 551 HG3 LYS 100 HG1 LYS 100 25.998 -6.486 6.430 552 HD2 LYS 100 HD2 LYS 100 24.582 -5.410 8.159 553 HD3 LYS 100 HD1 LYS 100 23.145 -6.023 7.340 554 HE2 LYS 100 HE2 LYS 100 25.394 -7.767 8.375 555 HE3 LYS 100 HE1 LYS 100 23.889 -7.468 9.247 556 HZ1 LYS 100 HZ1 LYS 100 22.648 -8.573 7.648 557 HZ2 LYS 100 HZ2 LYS 100 24.042 -9.537 7.773 558 HZ3 LYS 100 HZ3 LYS 100 23.863 -8.464 6.469 559 H GLY 101 HN GLY 101 28.102 -3.907 5.860 560 HA2 GLY 101 HA2 GLY 101 28.546 -1.418 4.603 561 HA3 GLY 101 HA1 GLY 101 29.642 -2.793 4.570 562 H ILE 102 HN ILE 102 29.491 -1.250 2.368 563 HA ILE 102 HA ILE 102 27.568 -2.090 0.449 564 HB ILE 102 HB ILE 102 28.859 0.012 0.271 565 HG12 ILE 102 HG12 ILE 102 29.409 -1.825 -2.072 566 HG13 ILE 102 HG11 ILE 102 27.798 -1.197 -1.701 567 HG21 ILE 102 HG21 ILE 102 31.172 0.005 -0.316 568 HG22 ILE 102 HG22 ILE 102 31.169 -1.735 -0.597 569 HG23 ILE 102 HG23 ILE 102 31.023 -1.106 1.044 570 HD11 ILE 102 HD11 ILE 102 30.273 0.465 -2.267 571 HD12 ILE 102 HD12 ILE 102 28.691 1.115 -1.832 572 HD13 ILE 102 HD13 ILE 102 28.900 0.243 -3.351 573 H ASN 103 HN ASN 103 30.709 -3.301 1.433 574 HA ASN 103 HA ASN 103 31.217 -4.997 -0.765 575 HB2 ASN 103 HB2 ASN 103 32.065 -5.124 2.131 576 HB3 ASN 103 HB1 ASN 103 32.645 -6.257 0.911 577 HD21 ASN 103 HD21 ASN 103 32.942 -4.500 -1.307 578 HD22 ASN 103 HD22 ASN 103 34.161 -3.362 -0.939 579 H GLU 104 HN GLU 104 29.460 -5.526 2.269 580 HA GLU 104 HA GLU 104 28.901 -8.300 1.662 581 HB2 GLU 104 HB2 GLU 104 27.891 -6.427 3.811 582 HB3 GLU 104 HB1 GLU 104 27.424 -8.124 3.690 583 HG2 GLU 104 HG2 GLU 104 29.764 -8.814 3.889 584 HG3 GLU 104 HG1 GLU 104 30.277 -7.127 3.928 585 H PHE 105 HN PHE 105 27.901 -5.729 0.108 586 HA PHE 105 HA PHE 105 25.122 -6.715 -0.229 587 HB2 PHE 105 HB2 PHE 105 26.094 -4.066 0.435 588 HB3 PHE 105 HB1 PHE 105 25.276 -4.004 -1.128 589 HD1 PHE 105 HD1 PHE 105 22.998 -5.274 -1.280 590 HD2 PHE 105 HD2 PHE 105 24.792 -4.008 2.410 591 HE1 PHE 105 HE1 PHE 105 20.801 -5.404 -0.162 592 HE2 PHE 105 HE2 PHE 105 22.590 -4.128 3.521 593 HZ PHE 105 HZ PHE 105 20.585 -4.833 2.241 594 H SER 106 HN SER 106 24.386 -7.053 -2.251 595 HA SER 106 HA SER 106 26.353 -7.262 -4.364 596 HB2 SER 106 HB2 SER 106 23.427 -7.969 -4.143 597 HB3 SER 106 HB1 SER 106 24.310 -8.099 -5.665 598 HG SER 106 HG SER 106 25.759 -9.503 -4.625 599 H LYS 107 HN LYS 107 25.794 -6.462 -6.570 600 HA LYS 107 HA LYS 107 25.308 -3.628 -6.470 601 HB2 LYS 107 HB2 LYS 107 26.978 -4.633 -7.991 602 HB3 LYS 107 HB1 LYS 107 25.673 -5.441 -8.860 603 HG2 LYS 107 HG2 LYS 107 24.724 -3.354 -9.556 604 HG3 LYS 107 HG1 LYS 107 25.772 -2.443 -8.465 605 HD2 LYS 107 HD2 LYS 107 26.664 -2.271 -10.719 606 HD3 LYS 107 HD1 LYS 107 27.751 -3.274 -9.758 607 HE2 LYS 107 HE2 LYS 107 26.979 -5.274 -10.774 608 HE3 LYS 107 HE1 LYS 107 25.549 -4.481 -11.437 609 HZ1 LYS 107 HZ1 LYS 107 26.692 -3.720 -13.182 610 HZ2 LYS 107 HZ2 LYS 107 27.846 -4.901 -12.777 611 HZ3 LYS 107 HZ3 LYS 107 28.047 -3.297 -12.252 612 H ALA 108 HN ALA 108 23.603 -6.450 -7.781 613 HA ALA 108 HA ALA 108 21.467 -5.024 -8.966 614 HB1 ALA 108 HB1 ALA 108 20.330 -7.170 -9.067 615 HB2 ALA 108 HB2 ALA 108 21.447 -7.850 -7.884 616 HB3 ALA 108 HB3 ALA 108 22.030 -7.388 -9.483 617 H GLN 109 HN GLN 109 22.080 -6.066 -5.690 618 HA GLN 109 HA GLN 109 19.419 -5.831 -4.725 619 HB2 GLN 109 HB2 GLN 109 22.126 -5.841 -3.390 620 HB3 GLN 109 HB1 GLN 109 20.628 -5.661 -2.471 621 HG2 GLN 109 HG2 GLN 109 21.093 -7.939 -4.410 622 HG3 GLN 109 HG1 GLN 109 21.504 -8.046 -2.695 623 HE21 GLN 109 HE21 GLN 109 18.890 -6.024 -2.734 624 HE22 GLN 109 HE22 GLN 109 17.644 -7.162 -2.553 625 H ARG 110 HN ARG 110 22.245 -3.707 -4.165 626 HA ARG 110 HA ARG 110 20.834 -1.600 -3.005 627 HB2 ARG 110 HB2 ARG 110 22.781 -0.218 -3.549 628 HB3 ARG 110 HB1 ARG 110 23.293 -1.804 -2.972 629 HG2 ARG 110 HG2 ARG 110 23.582 -2.560 -5.302 630 HG3 ARG 110 HG1 ARG 110 23.093 -0.967 -5.883 631 HD2 ARG 110 HD2 ARG 110 24.987 0.045 -4.645 632 HD3 ARG 110 HD1 ARG 110 25.498 -1.571 -4.145 633 HE ARG 110 HE ARG 110 25.288 -1.599 -6.933 634 HH11 ARG 110 HH21 ARG 110 27.076 0.001 -4.445 635 HH12 ARG 110 HH22 ARG 110 28.491 0.228 -5.415 636 HH21 ARG 110 HH11 ARG 110 27.139 -1.302 -8.216 637 HH22 ARG 110 HH12 ARG 110 28.528 -0.508 -7.550 638 H HIS 111 HN HIS 111 20.504 -2.769 -6.097 639 HA HIS 111 HA HIS 111 19.890 -0.182 -7.346 640 HB2 HIS 111 HB2 HIS 111 21.178 -1.869 -8.620 641 HB3 HIS 111 HB1 HIS 111 19.810 -2.980 -8.500 642 HD2 HIS 111 HD2 HIS 111 17.823 -2.559 -10.402 643 HE1 HIS 111 HE1 HIS 111 19.254 1.124 -11.888 644 HE2 HIS 111 HE2 HIS 111 17.517 -0.700 -12.211 645 H VAL 112 HN VAL 112 18.269 -1.667 -5.164 646 HA VAL 112 HA VAL 112 15.651 -1.452 -6.538 647 HB VAL 112 HB VAL 112 14.821 -3.371 -5.443 648 HG11 VAL 112 HG11 VAL 112 16.225 -5.114 -6.307 649 HG12 VAL 112 HG12 VAL 112 17.666 -4.107 -6.165 650 HG13 VAL 112 HG13 VAL 112 16.435 -3.720 -7.366 651 HG21 VAL 112 HG21 VAL 112 17.093 -2.890 -3.568 652 HG22 VAL 112 HG22 VAL 112 16.758 -4.588 -3.896 653 HG23 VAL 112 HG23 VAL 112 15.493 -3.546 -3.250 654 H LEU 113 HN LEU 113 13.856 -1.071 -5.003 655 HA LEU 113 HA LEU 113 14.380 1.158 -3.359 656 HB2 LEU 113 HB2 LEU 113 11.970 -0.670 -3.257 657 HB3 LEU 113 HB1 LEU 113 12.052 1.012 -2.719 658 HG LEU 113 HG LEU 113 12.474 0.061 -5.569 659 HD11 LEU 113 HD11 LEU 113 10.169 1.619 -4.364 660 HD12 LEU 113 HD12 LEU 113 10.128 -0.114 -4.683 661 HD13 LEU 113 HD13 LEU 113 10.296 1.023 -6.019 662 HD21 LEU 113 HD21 LEU 113 13.719 2.047 -5.398 663 HD22 LEU 113 HD22 LEU 113 12.630 2.749 -4.201 664 HD23 LEU 113 HD23 LEU 113 12.140 2.653 -5.892 665 H ASP 114 HN ASP 114 13.859 -2.273 -2.570 666 HA ASP 114 HA ASP 114 14.588 -1.674 0.242 667 HB2 ASP 114 HB2 ASP 114 12.297 -2.678 -0.245 668 HB3 ASP 114 HB1 ASP 114 13.159 -4.150 -0.688 669 HA PRO 115 HA PRO 115 18.084 -4.166 -1.376 670 HB2 PRO 115 HB2 PRO 115 20.045 -3.117 0.199 671 HB3 PRO 115 HB1 PRO 115 19.455 -2.308 -1.267 672 HG2 PRO 115 HG2 PRO 115 18.837 -1.744 1.593 673 HG3 PRO 115 HG1 PRO 115 19.054 -0.616 0.238 674 HD2 PRO 115 HD2 PRO 115 16.589 -1.420 1.245 675 HD3 PRO 115 HD1 PRO 115 16.836 -0.765 -0.394 676 H ARG 116 HN ARG 116 18.773 -6.106 -0.672 677 HA ARG 116 HA ARG 116 18.503 -6.761 2.219 678 HB2 ARG 116 HB2 ARG 116 17.815 -8.521 -0.150 679 HB3 ARG 116 HB1 ARG 116 17.730 -8.995 1.551 680 HG2 ARG 116 HG2 ARG 116 16.069 -7.222 1.961 681 HG3 ARG 116 HG1 ARG 116 16.155 -6.743 0.268 682 HD2 ARG 116 HD2 ARG 116 15.384 -8.990 -0.404 683 HD3 ARG 116 HD1 ARG 116 15.280 -9.459 1.295 684 HE ARG 116 HE ARG 116 13.739 -7.153 1.009 685 HH11 ARG 116 HH21 ARG 116 13.861 -10.383 -0.222 686 HH12 ARG 116 HH22 ARG 116 12.149 -10.507 -0.455 687 HH21 ARG 116 HH11 ARG 116 11.492 -7.308 0.709 688 HH22 ARG 116 HH12 ARG 116 10.808 -8.765 0.071 689 H CYS 117 HN CYS 117 20.272 -7.579 3.121 690 HA CYS 117 HA CYS 117 22.736 -7.800 1.816 691 HB2 CYS 117 HB2 CYS 117 22.231 -9.529 4.218 692 HB3 CYS 117 HB1 CYS 117 23.601 -8.471 3.859 693 H GLN 118 HN GLN 118 23.967 -9.555 1.131 694 HA GLN 118 HA GLN 118 22.690 -11.508 -0.381 695 HB2 GLN 118 HB2 GLN 118 25.473 -11.103 0.614 696 HB3 GLN 118 HB1 GLN 118 25.080 -12.731 0.052 697 HG2 GLN 118 HG2 GLN 118 25.970 -11.343 -1.789 698 HG3 GLN 118 HG1 GLN 118 24.297 -11.805 -2.096 699 HE21 GLN 118 HE21 GLN 118 22.924 -10.105 -2.642 700 HE22 GLN 118 HE22 GLN 118 23.219 -8.471 -2.290 701 H ILE 119 HN ILE 119 22.882 -11.336 2.973 702 HA ILE 119 HA ILE 119 22.813 -14.213 3.443 703 HB ILE 119 HB ILE 119 22.329 -11.992 5.425 704 HG12 ILE 119 HG12 ILE 119 24.440 -11.506 4.341 705 HG13 ILE 119 HG11 ILE 119 24.794 -12.230 5.911 706 HG21 ILE 119 HG21 ILE 119 23.402 -14.812 5.726 707 HG22 ILE 119 HG22 ILE 119 21.752 -14.311 6.101 708 HG23 ILE 119 HG23 ILE 119 23.103 -13.666 7.034 709 HD11 ILE 119 HD11 ILE 119 26.238 -13.378 4.446 710 HD12 ILE 119 HD12 ILE 119 25.026 -13.463 3.169 711 HD13 ILE 119 HD13 ILE 119 24.874 -14.484 4.598 712 H CYS 120 HN CYS 120 20.582 -11.445 3.864 713 HA CYS 120 HA CYS 120 18.402 -13.006 4.795 714 HB2 CYS 120 HB2 CYS 120 17.157 -10.805 3.746 715 HB3 CYS 120 HB1 CYS 120 17.969 -10.810 5.314 716 H VAL 121 HN VAL 121 19.529 -12.187 1.577 717 HA VAL 121 HA VAL 121 17.140 -12.921 0.202 718 HB VAL 121 HB VAL 121 18.471 -12.876 -1.812 719 HG11 VAL 121 HG11 VAL 121 19.722 -10.666 -1.436 720 HG12 VAL 121 HG12 VAL 121 19.212 -10.783 0.247 721 HG13 VAL 121 HG13 VAL 121 18.006 -10.675 -1.034 722 HG21 VAL 121 HG21 VAL 121 20.390 -14.162 -1.180 723 HG22 VAL 121 HG22 VAL 121 20.781 -13.042 0.119 724 HG23 VAL 121 HG23 VAL 121 20.986 -12.548 -1.560 725 H HIS 122 HN HIS 122 20.079 -14.664 1.096 726 HA HIS 122 HA HIS 122 19.843 -17.001 -0.301 727 HB2 HIS 122 HB2 HIS 122 21.612 -16.420 1.413 728 HB3 HIS 122 HB1 HIS 122 20.467 -16.934 2.659 729 HD2 HIS 122 HD2 HIS 122 19.392 -19.727 1.697 730 HE1 HIS 122 HE1 HIS 122 23.348 -20.772 0.663 731 HE2 HIS 122 HE2 HIS 122 21.023 -21.685 1.123 732 H SER 123 HN SER 123 18.273 -16.352 2.857 733 HA SER 123 HA SER 123 16.547 -18.689 2.500 734 HB2 SER 123 HB2 SER 123 16.008 -18.452 4.768 735 HB3 SER 123 HB1 SER 123 17.685 -17.916 4.706 736 HG SER 123 HG SER 123 16.998 -16.075 5.417 737 H GLN 124 HN GLN 124 16.164 -15.180 3.072 738 HA GLN 124 HA GLN 124 13.342 -15.326 2.306 739 HB2 GLN 124 HB2 GLN 124 14.300 -13.928 4.266 740 HB3 GLN 124 HB1 GLN 124 14.833 -12.801 3.021 741 HG2 GLN 124 HG2 GLN 124 12.678 -12.039 3.719 742 HG3 GLN 124 HG1 GLN 124 12.433 -12.814 2.157 743 HE21 GLN 124 HE21 GLN 124 10.160 -13.269 2.769 744 HE22 GLN 124 HE22 GLN 124 9.808 -14.530 3.850 745 H ARG 125 HN ARG 125 15.130 -15.949 0.217 746 HA ARG 125 HA ARG 125 16.008 -14.021 -1.503 747 HB2 ARG 125 HB2 ARG 125 15.438 -15.544 -3.350 748 HB3 ARG 125 HB1 ARG 125 16.133 -16.430 -1.986 749 HG2 ARG 125 HG2 ARG 125 13.859 -17.023 -1.218 750 HG3 ARG 125 HG1 ARG 125 13.168 -16.159 -2.589 751 HD2 ARG 125 HD2 ARG 125 14.342 -17.660 -4.145 752 HD3 ARG 125 HD1 ARG 125 15.053 -18.521 -2.782 753 HE ARG 125 HE ARG 125 12.990 -19.551 -2.396 754 HH11 ARG 125 HH21 ARG 125 12.737 -16.978 -4.697 755 HH12 ARG 125 HH22 ARG 125 11.133 -17.398 -5.197 756 HH21 ARG 125 HH11 ARG 125 10.884 -20.104 -3.042 757 HH22 ARG 125 HH12 ARG 125 10.085 -19.168 -4.260 758 H ASN 126 HN ASN 126 15.177 -12.578 -2.938 759 HA ASN 126 HA ASN 126 12.594 -11.526 -2.422 760 HB2 ASN 126 HB2 ASN 126 13.058 -10.020 -4.297 761 HB3 ASN 126 HB1 ASN 126 14.466 -10.149 -3.242 762 HD21 ASN 126 HD21 ASN 126 15.605 -9.410 -5.343 763 HD22 ASN 126 HD22 ASN 126 16.067 -10.622 -6.439 Start of MODEL 6 1 H MET 31 HT1 MET 31 4.770 26.627 -17.728 2 HA MET 31 HA MET 31 4.528 28.727 -17.036 3 HB2 MET 31 HB2 MET 31 1.942 28.288 -18.561 4 HB3 MET 31 HB1 MET 31 2.614 29.875 -18.170 5 HG2 MET 31 HG2 MET 31 3.371 29.405 -20.379 6 HG3 MET 31 HG1 MET 31 4.758 29.085 -19.336 7 HE1 MET 31 HE1 MET 31 1.539 27.555 -20.747 8 HE2 MET 31 HE2 MET 31 2.129 26.162 -21.647 9 HE3 MET 31 HE3 MET 31 2.605 27.786 -22.138 10 H GLY 32 HN GLY 32 4.046 27.370 -14.832 11 HA2 GLY 32 HA2 GLY 32 3.189 27.866 -12.720 12 HA3 GLY 32 HA1 GLY 32 2.033 28.963 -13.468 13 H LYS 33 HN LYS 33 2.143 25.938 -14.992 14 HA LYS 33 HA LYS 33 -0.089 24.869 -13.364 15 HB2 LYS 33 HB2 LYS 33 -1.017 26.033 -15.344 16 HB3 LYS 33 HB1 LYS 33 -0.036 25.005 -16.389 17 HG2 LYS 33 HG2 LYS 33 -1.165 23.006 -15.540 18 HG3 LYS 33 HG1 LYS 33 -2.100 23.989 -14.412 19 HD2 LYS 33 HD2 LYS 33 -3.133 25.184 -16.302 20 HD3 LYS 33 HD1 LYS 33 -2.196 24.209 -17.435 21 HE2 LYS 33 HE2 LYS 33 -4.418 23.241 -17.235 22 HE3 LYS 33 HE1 LYS 33 -3.259 22.158 -16.465 23 HZ1 LYS 33 HZ1 LYS 33 -4.237 24.119 -14.646 24 HZ2 LYS 33 HZ2 LYS 33 -4.245 22.425 -14.513 25 HZ3 LYS 33 HZ3 LYS 33 -5.510 23.224 -15.321 26 H ASN 34 HN ASN 34 0.383 22.901 -12.705 27 HA ASN 34 HA ASN 34 1.340 20.816 -12.559 28 HB2 ASN 34 HB2 ASN 34 0.933 21.077 -15.542 29 HB3 ASN 34 HB1 ASN 34 1.506 19.591 -14.780 30 HD21 ASN 34 HD21 ASN 34 -1.043 19.816 -16.176 31 HD22 ASN 34 HD22 ASN 34 -2.268 19.562 -15.029 32 H ASP 35 HN ASP 35 3.100 23.156 -12.713 33 HA ASP 35 HA ASP 35 5.357 22.597 -14.348 34 HB2 ASP 35 HB2 ASP 35 5.001 24.256 -11.850 35 HB3 ASP 35 HB1 ASP 35 6.530 24.155 -12.729 36 H ASN 36 HN ASN 36 4.690 21.993 -10.905 37 HA ASN 36 HA ASN 36 7.145 20.691 -10.353 38 HB2 ASN 36 HB2 ASN 36 4.451 20.670 -8.992 39 HB3 ASN 36 HB1 ASN 36 5.819 19.739 -8.381 40 HD21 ASN 36 HD21 ASN 36 4.435 22.204 -7.234 41 HD22 ASN 36 HD22 ASN 36 5.690 23.324 -7.001 42 H ASP 37 HN ASP 37 4.010 19.543 -11.482 43 HA ASP 37 HA ASP 37 4.582 16.769 -11.218 44 HB2 ASP 37 HB2 ASP 37 2.581 18.262 -12.924 45 HB3 ASP 37 HB1 ASP 37 2.640 16.505 -12.791 46 H ALA 38 HN ALA 38 6.253 18.843 -12.925 47 HA ALA 38 HA ALA 38 6.336 17.679 -15.541 48 HB1 ALA 38 HB1 ALA 38 8.218 19.521 -14.067 49 HB2 ALA 38 HB2 ALA 38 7.073 19.941 -15.344 50 HB3 ALA 38 HB3 ALA 38 8.501 18.976 -15.718 51 H LEU 39 HN LEU 39 8.073 16.444 -16.455 52 HA LEU 39 HA LEU 39 9.543 14.807 -14.469 53 HB2 LEU 39 HB2 LEU 39 8.350 14.016 -17.128 54 HB3 LEU 39 HB1 LEU 39 9.436 12.993 -16.190 55 HG LEU 39 HG LEU 39 6.910 14.156 -14.994 56 HD11 LEU 39 HD11 LEU 39 5.774 12.057 -15.518 57 HD12 LEU 39 HD12 LEU 39 7.223 11.444 -16.315 58 HD13 LEU 39 HD13 LEU 39 6.343 12.804 -17.010 59 HD21 LEU 39 HD21 LEU 39 7.224 11.964 -13.607 60 HD22 LEU 39 HD22 LEU 39 8.272 13.333 -13.262 61 HD23 LEU 39 HD23 LEU 39 8.869 11.993 -14.234 62 H ILE 40 HN ILE 40 11.671 14.873 -14.594 63 HA ILE 40 HA ILE 40 12.916 16.150 -16.954 64 HB ILE 40 HB ILE 40 14.190 15.528 -14.285 65 HG12 ILE 40 HG12 ILE 40 12.301 16.993 -13.894 66 HG13 ILE 40 HG11 ILE 40 13.774 17.961 -13.817 67 HG21 ILE 40 HG21 ILE 40 14.896 17.437 -16.533 68 HG22 ILE 40 HG22 ILE 40 15.734 15.930 -16.167 69 HG23 ILE 40 HG23 ILE 40 15.785 17.269 -15.019 70 HD11 ILE 40 HD11 ILE 40 13.303 18.393 -16.368 71 HD12 ILE 40 HD12 ILE 40 12.371 19.278 -15.162 72 HD13 ILE 40 HD13 ILE 40 11.667 17.876 -15.965 73 H MET 41 HN MET 41 14.138 15.055 -18.317 74 HA MET 41 HA MET 41 14.407 12.184 -18.014 75 HB2 MET 41 HB2 MET 41 13.881 13.214 -20.208 76 HB3 MET 41 HB1 MET 41 15.459 14.004 -20.196 77 HG2 MET 41 HG2 MET 41 16.582 11.828 -20.134 78 HG3 MET 41 HG1 MET 41 15.023 11.005 -20.048 79 HE1 MET 41 HE1 MET 41 14.489 9.716 -21.926 80 HE2 MET 41 HE2 MET 41 16.237 9.641 -22.137 81 HE3 MET 41 HE3 MET 41 15.200 9.898 -23.536 82 H CYS 42 HN CYS 42 16.162 11.101 -17.295 83 HA CYS 42 HA CYS 42 18.438 12.609 -16.330 84 HB2 CYS 42 HB2 CYS 42 17.450 10.699 -15.067 85 HB3 CYS 42 HB1 CYS 42 17.980 9.615 -16.358 86 H MET 43 HN MET 43 20.108 13.104 -17.546 87 HA MET 43 HA MET 43 20.526 12.134 -20.170 88 HB2 MET 43 HB2 MET 43 22.661 13.307 -20.071 89 HB3 MET 43 HB1 MET 43 21.387 14.298 -19.358 90 HG2 MET 43 HG2 MET 43 23.068 14.487 -17.750 91 HG3 MET 43 HG1 MET 43 22.134 13.134 -17.108 92 HE1 MET 43 HE1 MET 43 25.344 14.456 -18.507 93 HE2 MET 43 HE2 MET 43 26.461 13.233 -17.904 94 HE3 MET 43 HE3 MET 43 25.382 14.063 -16.783 95 H ARG 44 HN ARG 44 20.863 10.486 -17.359 96 HA ARG 44 HA ARG 44 23.156 8.878 -18.323 97 HB2 ARG 44 HB2 ARG 44 23.252 9.955 -16.024 98 HB3 ARG 44 HB1 ARG 44 21.987 8.835 -15.545 99 HG2 ARG 44 HG2 ARG 44 23.854 7.560 -14.984 100 HG3 ARG 44 HG1 ARG 44 23.632 7.031 -16.649 101 HD2 ARG 44 HD2 ARG 44 25.248 8.790 -17.378 102 HD3 ARG 44 HD1 ARG 44 25.505 9.210 -15.687 103 HE ARG 44 HE ARG 44 25.941 6.427 -16.112 104 HH11 ARG 44 HH21 ARG 44 27.266 9.581 -16.628 105 HH12 ARG 44 HH22 ARG 44 28.911 9.042 -16.626 106 HH21 ARG 44 HH11 ARG 44 28.092 5.711 -16.110 107 HH22 ARG 44 HH12 ARG 44 29.380 6.849 -16.332 108 H CYS 45 HN CYS 45 20.648 7.896 -16.047 109 HA CYS 45 HA CYS 45 20.328 5.398 -17.440 110 HB2 CYS 45 HB2 CYS 45 18.868 4.816 -15.586 111 HB3 CYS 45 HB1 CYS 45 20.339 5.563 -14.970 112 H ARG 46 HN ARG 46 19.056 8.413 -17.939 113 HA ARG 46 HA ARG 46 17.192 9.202 -19.045 114 HB2 ARG 46 HB2 ARG 46 17.385 6.423 -20.202 115 HB3 ARG 46 HB1 ARG 46 16.342 7.698 -20.842 116 HG2 ARG 46 HG2 ARG 46 18.341 9.145 -21.158 117 HG3 ARG 46 HG1 ARG 46 19.365 7.829 -20.579 118 HD2 ARG 46 HD2 ARG 46 17.516 7.631 -22.970 119 HD3 ARG 46 HD1 ARG 46 19.246 7.947 -23.075 120 HE ARG 46 HE ARG 46 17.975 5.406 -22.426 121 HH11 ARG 46 HH21 ARG 46 20.827 7.366 -22.402 122 HH12 ARG 46 HH22 ARG 46 21.915 6.023 -22.301 123 HH21 ARG 46 HH11 ARG 46 19.395 3.641 -22.292 124 HH22 ARG 46 HH12 ARG 46 21.105 3.913 -22.239 125 H LYS 47 HN LYS 47 16.648 8.315 -16.456 126 HA LYS 47 HA LYS 47 14.047 6.930 -16.700 127 HB2 LYS 47 HB2 LYS 47 15.853 7.469 -14.341 128 HB3 LYS 47 HB1 LYS 47 14.220 6.832 -14.177 129 HG2 LYS 47 HG2 LYS 47 14.808 4.929 -15.637 130 HG3 LYS 47 HG1 LYS 47 16.450 5.555 -15.792 131 HD2 LYS 47 HD2 LYS 47 16.807 5.309 -13.388 132 HD3 LYS 47 HD1 LYS 47 15.138 4.782 -13.169 133 HE2 LYS 47 HE2 LYS 47 15.567 2.823 -14.610 134 HE3 LYS 47 HE1 LYS 47 17.238 3.343 -14.821 135 HZ1 LYS 47 HZ1 LYS 47 17.097 3.359 -12.190 136 HZ2 LYS 47 HZ2 LYS 47 17.525 1.969 -13.069 137 HZ3 LYS 47 HZ3 LYS 47 15.936 2.162 -12.498 138 H VAL 48 HN VAL 48 12.745 8.594 -17.424 139 HA VAL 48 HA VAL 48 12.708 11.235 -16.489 140 HB VAL 48 HB VAL 48 10.166 11.015 -17.198 141 HG11 VAL 48 HG11 VAL 48 11.706 12.177 -18.601 142 HG12 VAL 48 HG12 VAL 48 10.931 10.971 -19.629 143 HG13 VAL 48 HG13 VAL 48 12.560 10.691 -19.014 144 HG21 VAL 48 HG21 VAL 48 9.623 9.078 -18.462 145 HG22 VAL 48 HG22 VAL 48 10.402 8.451 -17.011 146 HG23 VAL 48 HG23 VAL 48 11.302 8.545 -18.524 147 H LYS 49 HN LYS 49 12.295 12.005 -14.551 148 HA LYS 49 HA LYS 49 10.237 10.749 -12.860 149 HB2 LYS 49 HB2 LYS 49 13.084 11.322 -12.089 150 HB3 LYS 49 HB1 LYS 49 11.795 11.114 -10.900 151 HG2 LYS 49 HG2 LYS 49 12.257 9.026 -13.035 152 HG3 LYS 49 HG1 LYS 49 13.220 9.026 -11.563 153 HD2 LYS 49 HD2 LYS 49 11.102 8.979 -10.230 154 HD3 LYS 49 HD1 LYS 49 10.194 8.834 -11.731 155 HE2 LYS 49 HE2 LYS 49 10.529 6.625 -10.789 156 HE3 LYS 49 HE1 LYS 49 11.471 6.773 -12.272 157 HZ1 LYS 49 HZ1 LYS 49 12.651 7.409 -9.644 158 HZ2 LYS 49 HZ2 LYS 49 13.439 7.003 -11.094 159 HZ3 LYS 49 HZ3 LYS 49 12.607 5.812 -10.213 160 H GLY 50 HN GLY 50 9.624 12.134 -11.036 161 HA2 GLY 50 HA2 GLY 50 9.401 14.912 -11.947 162 HA3 GLY 50 HA1 GLY 50 8.456 14.148 -10.671 163 H ILE 51 HN ILE 51 9.147 16.419 -9.813 164 HA ILE 51 HA ILE 51 11.749 16.934 -8.946 165 HB ILE 51 HB ILE 51 9.776 18.511 -8.880 166 HG12 ILE 51 HG12 ILE 51 11.196 18.303 -6.213 167 HG13 ILE 51 HG11 ILE 51 12.010 18.854 -7.678 168 HG21 ILE 51 HG21 ILE 51 8.252 18.431 -7.038 169 HG22 ILE 51 HG22 ILE 51 9.197 17.190 -6.218 170 HG23 ILE 51 HG23 ILE 51 8.307 16.793 -7.689 171 HD11 ILE 51 HD11 ILE 51 9.451 20.079 -6.640 172 HD12 ILE 51 HD12 ILE 51 10.505 20.705 -7.907 173 HD13 ILE 51 HD13 ILE 51 11.054 20.692 -6.230 174 H ASP 52 HN ASP 52 9.850 14.335 -8.056 175 HA ASP 52 HA ASP 52 10.528 14.144 -5.283 176 HB2 ASP 52 HB2 ASP 52 9.672 11.813 -5.537 177 HB3 ASP 52 HB1 ASP 52 8.542 13.036 -6.112 178 H SER 53 HN SER 53 11.631 12.498 -8.217 179 HA SER 53 HA SER 53 13.886 11.317 -6.746 180 HB2 SER 53 HB2 SER 53 13.960 9.723 -8.370 181 HB3 SER 53 HB1 SER 53 12.357 10.322 -8.779 182 HG SER 53 HG SER 53 14.798 10.681 -10.048 183 H TYR 54 HN TYR 54 13.320 14.223 -8.075 184 HA TYR 54 HA TYR 54 16.134 14.581 -8.962 185 HB2 TYR 54 HB2 TYR 54 13.551 15.529 -10.099 186 HB3 TYR 54 HB1 TYR 54 14.853 16.719 -10.080 187 HD1 TYR 54 HD2 TYR 54 14.219 13.124 -10.976 188 HD2 TYR 54 HD1 TYR 54 16.408 16.718 -11.818 189 HE1 TYR 54 HE2 TYR 54 15.254 12.030 -12.938 190 HE2 TYR 54 HE1 TYR 54 17.442 15.625 -13.774 191 HH TYR 54 HH TYR 54 16.373 12.499 -14.914 192 H SER 55 HN SER 55 17.339 15.931 -7.843 193 HA SER 55 HA SER 55 16.491 17.093 -5.444 194 HB2 SER 55 HB2 SER 55 18.842 16.605 -5.885 195 HB3 SER 55 HB1 SER 55 18.862 17.783 -7.199 196 HG SER 55 HG SER 55 19.239 18.181 -4.593 197 H LYS 56 HN LYS 56 16.184 19.289 -4.871 198 HA LYS 56 HA LYS 56 14.478 20.751 -6.534 199 HB2 LYS 56 HB2 LYS 56 14.795 22.594 -4.925 200 HB3 LYS 56 HB1 LYS 56 14.556 21.054 -4.099 201 HG2 LYS 56 HG2 LYS 56 17.043 20.832 -3.898 202 HG3 LYS 56 HG1 LYS 56 17.206 22.442 -4.598 203 HD2 LYS 56 HD2 LYS 56 15.787 23.344 -2.752 204 HD3 LYS 56 HD1 LYS 56 15.789 21.738 -2.016 205 HE2 LYS 56 HE2 LYS 56 18.295 23.321 -2.659 206 HE3 LYS 56 HE1 LYS 56 17.542 23.259 -1.066 207 HZ1 LYS 56 HZ1 LYS 56 19.043 21.214 -2.493 208 HZ2 LYS 56 HZ2 LYS 56 17.706 20.675 -1.595 209 HZ3 LYS 56 HZ3 LYS 56 18.956 21.534 -0.829 210 H THR 57 HN THR 57 17.962 20.984 -6.043 211 HA THR 57 HA THR 57 18.347 23.357 -7.556 212 HB THR 57 HB THR 57 20.213 22.941 -6.259 213 HG1 THR 57 HG1 THR 57 21.338 23.101 -8.040 214 HG21 THR 57 HG21 THR 57 21.177 20.552 -6.113 215 HG22 THR 57 HG22 THR 57 19.663 20.035 -6.851 216 HG23 THR 57 HG23 THR 57 19.645 20.858 -5.293 217 H GLN 58 HN GLN 58 18.759 19.910 -8.385 218 HA GLN 58 HA GLN 58 19.527 20.303 -11.060 219 HB2 GLN 58 HB2 GLN 58 18.115 17.983 -9.731 220 HB3 GLN 58 HB1 GLN 58 18.771 17.938 -11.367 221 HG2 GLN 58 HG2 GLN 58 21.014 18.391 -10.532 222 HG3 GLN 58 HG1 GLN 58 20.397 18.584 -8.891 223 HE21 GLN 58 HE21 GLN 58 22.206 16.703 -8.793 224 HE22 GLN 58 HE22 GLN 58 21.576 15.126 -8.902 225 H TRP 59 HN TRP 59 16.334 19.732 -9.618 226 HA TRP 59 HA TRP 59 14.881 19.732 -12.037 227 HB2 TRP 59 HB2 TRP 59 13.931 18.865 -9.955 228 HB3 TRP 59 HB1 TRP 59 13.983 20.479 -9.241 229 HD1 TRP 59 HD1 TRP 59 12.133 18.400 -11.852 230 HE1 TRP 59 HE1 TRP 59 9.958 19.623 -12.505 231 HE3 TRP 59 HE3 TRP 59 12.841 22.821 -9.395 232 HZ2 TRP 59 HZ2 TRP 59 8.696 22.155 -12.055 233 HZ3 TRP 59 HZ3 TRP 59 11.141 24.620 -9.526 234 HH2 TRP 59 HH2 TRP 59 9.071 24.292 -10.851 235 H SER 60 HN SER 60 15.810 22.311 -9.811 236 HA SER 60 HA SER 60 14.284 24.365 -11.092 237 HB2 SER 60 HB2 SER 60 15.658 25.903 -9.729 238 HB3 SER 60 HB1 SER 60 14.992 24.587 -8.768 239 HG SER 60 HG SER 60 17.411 25.216 -8.729 240 H LYS 61 HN LYS 61 17.440 22.984 -11.591 241 HA LYS 61 HA LYS 61 18.590 25.084 -13.115 242 HB2 LYS 61 HB2 LYS 61 19.157 22.159 -12.764 243 HB3 LYS 61 HB1 LYS 61 19.962 23.028 -14.068 244 HG2 LYS 61 HG2 LYS 61 20.870 24.641 -12.487 245 HG3 LYS 61 HG1 LYS 61 19.996 23.882 -11.159 246 HD2 LYS 61 HD2 LYS 61 21.242 21.758 -11.620 247 HD3 LYS 61 HD1 LYS 61 22.182 22.621 -12.837 248 HE2 LYS 61 HE2 LYS 61 22.980 24.189 -11.143 249 HE3 LYS 61 HE1 LYS 61 21.997 23.388 -9.918 250 HZ1 LYS 61 HZ1 LYS 61 24.550 22.770 -10.424 251 HZ2 LYS 61 HZ2 LYS 61 23.759 21.648 -11.424 252 HZ3 LYS 61 HZ3 LYS 61 23.431 21.685 -9.757 253 H THR 62 HN THR 62 16.355 22.550 -13.846 254 HA THR 62 HA THR 62 16.681 22.545 -16.653 255 HB THR 62 HB THR 62 14.536 21.387 -16.739 256 HG1 THR 62 HG1 THR 62 13.603 21.117 -14.497 257 HG21 THR 62 HG21 THR 62 15.954 20.486 -14.234 258 HG22 THR 62 HG22 THR 62 16.671 20.287 -15.833 259 HG23 THR 62 HG23 THR 62 15.144 19.494 -15.444 260 H PHE 63 HN PHE 63 15.542 24.945 -14.660 261 HA PHE 63 HA PHE 63 13.939 26.187 -16.825 262 HB2 PHE 63 HB2 PHE 63 13.730 26.633 -13.830 263 HB3 PHE 63 HB1 PHE 63 12.718 27.371 -15.071 264 HD1 PHE 63 HD1 PHE 63 13.571 24.234 -13.343 265 HD2 PHE 63 HD2 PHE 63 10.985 26.132 -16.182 266 HE1 PHE 63 HE1 PHE 63 12.069 22.257 -13.277 267 HE2 PHE 63 HE2 PHE 63 9.468 24.153 -16.128 268 HZ PHE 63 HZ PHE 63 10.013 22.216 -14.672 269 H THR 64 HN THR 64 14.422 28.247 -17.379 270 HA THR 64 HA THR 64 16.756 29.528 -16.066 271 HB THR 64 HB THR 64 16.947 30.644 -18.432 272 HG1 THR 64 HG1 THR 64 14.959 28.842 -18.755 273 HG21 THR 64 HG21 THR 64 18.749 29.289 -17.849 274 HG22 THR 64 HG22 THR 64 18.112 28.429 -19.251 275 HG23 THR 64 HG23 THR 64 17.740 27.861 -17.623 276 H PHE 65 HN PHE 65 16.777 31.814 -16.099 277 HA PHE 65 HA PHE 65 14.077 32.969 -15.860 278 HB2 PHE 65 HB2 PHE 65 16.338 33.088 -14.183 279 HB3 PHE 65 HB1 PHE 65 16.238 34.690 -14.905 280 HD1 PHE 65 HD2 PHE 65 13.829 32.108 -13.629 281 HD2 PHE 65 HD1 PHE 65 15.008 36.240 -13.652 282 HE1 PHE 65 HE2 PHE 65 11.939 32.660 -12.125 283 HE2 PHE 65 HE1 PHE 65 13.118 36.782 -12.143 284 HZ PHE 65 HZ PHE 65 11.584 35.001 -11.393 285 H VAL 66 HN VAL 66 13.394 34.608 -17.085 286 HA VAL 66 HA VAL 66 15.322 36.025 -18.793 287 HB VAL 66 HB VAL 66 14.260 34.056 -20.014 288 HG11 VAL 66 HG11 VAL 66 11.836 35.861 -20.084 289 HG12 VAL 66 HG12 VAL 66 11.986 34.541 -18.925 290 HG13 VAL 66 HG13 VAL 66 11.977 34.203 -20.654 291 HG21 VAL 66 HG21 VAL 66 13.680 36.818 -21.123 292 HG22 VAL 66 HG22 VAL 66 13.980 35.352 -22.051 293 HG23 VAL 66 HG23 VAL 66 15.281 36.079 -21.111 294 H ARG 67 HN ARG 67 14.922 38.153 -18.946 295 HA ARG 67 HA ARG 67 13.984 40.176 -18.320 296 HB2 ARG 67 HB2 ARG 67 11.703 38.717 -19.669 297 HB3 ARG 67 HB1 ARG 67 11.645 40.431 -19.244 298 HG2 ARG 67 HG2 ARG 67 13.630 40.863 -20.619 299 HG3 ARG 67 HG1 ARG 67 13.750 39.148 -21.014 300 HD2 ARG 67 HD2 ARG 67 11.505 39.248 -22.062 301 HD3 ARG 67 HD1 ARG 67 11.428 40.975 -21.703 302 HE ARG 67 HE ARG 67 13.034 39.694 -23.774 303 HH11 ARG 67 HH21 ARG 67 12.415 42.486 -21.828 304 HH12 ARG 67 HH22 ARG 67 13.193 43.587 -22.916 305 HH21 ARG 67 HH11 ARG 67 14.055 41.131 -25.205 306 HH22 ARG 67 HH12 ARG 67 14.121 42.819 -24.828 307 H GLY 68 HN GLY 68 13.832 37.973 -16.294 308 HA2 GLY 68 HA2 GLY 68 13.120 38.005 -14.092 309 HA3 GLY 68 HA1 GLY 68 12.018 39.324 -14.483 310 H ARG 69 HN ARG 69 12.095 36.361 -16.341 311 HA ARG 69 HA ARG 69 9.567 35.464 -15.074 312 HB2 ARG 69 HB2 ARG 69 10.170 35.726 -18.029 313 HB3 ARG 69 HB1 ARG 69 8.799 34.826 -17.380 314 HG2 ARG 69 HG2 ARG 69 7.979 36.861 -16.259 315 HG3 ARG 69 HG1 ARG 69 9.357 37.767 -16.885 316 HD2 ARG 69 HD2 ARG 69 8.622 37.267 -19.196 317 HD3 ARG 69 HD1 ARG 69 7.232 36.395 -18.555 318 HE ARG 69 HE ARG 69 7.169 38.954 -17.438 319 HH11 ARG 69 HH21 ARG 69 7.034 37.438 -20.547 320 HH12 ARG 69 HH22 ARG 69 6.039 38.667 -21.256 321 HH21 ARG 69 HH11 ARG 69 5.865 40.569 -18.361 322 HH22 ARG 69 HH12 ARG 69 5.377 40.438 -20.018 323 H THR 70 HN THR 70 9.198 33.242 -15.102 324 HA THR 70 HA THR 70 11.623 31.631 -15.244 325 HB THR 70 HB THR 70 8.803 30.832 -14.484 326 HG1 THR 70 HG1 THR 70 10.372 32.462 -13.264 327 HG21 THR 70 HG21 THR 70 11.503 29.522 -14.068 328 HG22 THR 70 HG22 THR 70 10.196 28.927 -15.092 329 HG23 THR 70 HG23 THR 70 9.997 28.964 -13.342 330 H VAL 71 HN VAL 71 12.194 30.507 -16.979 331 HA VAL 71 HA VAL 71 10.103 29.540 -18.842 332 HB VAL 71 HB VAL 71 11.799 30.004 -20.687 333 HG11 VAL 71 HG11 VAL 71 10.975 32.189 -21.036 334 HG12 VAL 71 HG12 VAL 71 10.903 32.539 -19.310 335 HG13 VAL 71 HG13 VAL 71 9.735 31.440 -20.039 336 HG21 VAL 71 HG21 VAL 71 13.702 30.339 -19.035 337 HG22 VAL 71 HG22 VAL 71 12.973 31.887 -18.614 338 HG23 VAL 71 HG23 VAL 71 13.554 31.599 -20.253 339 H SER 72 HN SER 72 10.317 27.498 -19.506 340 HA SER 72 HA SER 72 12.130 25.767 -18.179 341 HB2 SER 72 HB2 SER 72 9.910 25.053 -19.002 342 HB3 SER 72 HB1 SER 72 10.492 25.246 -20.654 343 HG SER 72 HG SER 72 11.608 23.461 -20.471 344 H VAL 73 HN VAL 73 13.953 24.700 -18.918 345 HA VAL 73 HA VAL 73 15.552 26.106 -20.817 346 HB VAL 73 HB VAL 73 15.943 23.516 -19.336 347 HG11 VAL 73 HG11 VAL 73 18.386 23.870 -20.115 348 HG12 VAL 73 HG12 VAL 73 17.699 24.916 -21.356 349 HG13 VAL 73 HG13 VAL 73 17.253 23.212 -21.295 350 HG21 VAL 73 HG21 VAL 73 17.372 24.787 -17.926 351 HG22 VAL 73 HG22 VAL 73 15.982 25.840 -18.190 352 HG23 VAL 73 HG23 VAL 73 17.476 26.104 -19.092 353 H SER 74 HN SER 74 16.177 25.508 -22.882 354 HA SER 74 HA SER 74 14.321 23.951 -24.400 355 HB2 SER 74 HB2 SER 74 17.005 25.143 -25.108 356 HB3 SER 74 HB1 SER 74 15.950 24.339 -26.266 357 HG SER 74 HG SER 74 14.403 25.890 -25.902 358 H ASP 75 HN ASP 75 17.679 23.422 -23.349 359 HA ASP 75 HA ASP 75 17.294 20.521 -23.745 360 HB2 ASP 75 HB2 ASP 75 19.703 22.088 -24.687 361 HB3 ASP 75 HB1 ASP 75 19.525 20.330 -24.731 362 HA PRO 76 HA PRO 76 19.234 21.521 -19.684 363 HB2 PRO 76 HB2 PRO 76 17.531 20.091 -18.113 364 HB3 PRO 76 HB1 PRO 76 17.161 21.720 -18.693 365 HG2 PRO 76 HG2 PRO 76 16.134 19.105 -19.653 366 HG3 PRO 76 HG1 PRO 76 15.312 20.673 -19.551 367 HD2 PRO 76 HD2 PRO 76 16.422 19.570 -21.878 368 HD3 PRO 76 HD1 PRO 76 15.992 21.280 -21.664 369 H LYS 77 HN LYS 77 20.805 20.326 -18.698 370 HA LYS 77 HA LYS 77 20.801 17.392 -19.091 371 HB2 LYS 77 HB2 LYS 77 23.060 19.346 -19.534 372 HB3 LYS 77 HB1 LYS 77 23.321 17.616 -19.306 373 HG2 LYS 77 HG2 LYS 77 21.828 17.145 -21.219 374 HG3 LYS 77 HG1 LYS 77 21.597 18.877 -21.459 375 HD2 LYS 77 HD2 LYS 77 23.995 19.168 -21.873 376 HD3 LYS 77 HD1 LYS 77 24.270 17.450 -21.574 377 HE2 LYS 77 HE2 LYS 77 22.793 16.888 -23.469 378 HE3 LYS 77 HE1 LYS 77 22.540 18.605 -23.777 379 HZ1 LYS 77 HZ1 LYS 77 25.077 18.711 -23.908 380 HZ2 LYS 77 HZ2 LYS 77 24.248 18.021 -25.220 381 HZ3 LYS 77 HZ3 LYS 77 25.019 17.025 -24.079 382 H VAL 78 HN VAL 78 20.545 16.575 -17.143 383 HA VAL 78 HA VAL 78 22.372 17.378 -14.993 384 HB VAL 78 HB VAL 78 20.320 17.298 -13.400 385 HG11 VAL 78 HG11 VAL 78 20.718 19.615 -15.322 386 HG12 VAL 78 HG12 VAL 78 21.651 19.325 -13.855 387 HG13 VAL 78 HG13 VAL 78 19.935 19.718 -13.744 388 HG21 VAL 78 HG21 VAL 78 18.849 16.520 -15.391 389 HG22 VAL 78 HG22 VAL 78 18.881 18.208 -15.899 390 HG23 VAL 78 HG23 VAL 78 18.194 17.771 -14.334 391 H ILE 79 HN ILE 79 22.268 15.847 -13.150 392 HA ILE 79 HA ILE 79 21.725 13.103 -14.128 393 HB ILE 79 HB ILE 79 23.590 14.001 -11.915 394 HG12 ILE 79 HG12 ILE 79 24.184 13.112 -14.760 395 HG13 ILE 79 HG11 ILE 79 24.293 14.775 -14.179 396 HG21 ILE 79 HG21 ILE 79 24.424 11.692 -12.079 397 HG22 ILE 79 HG22 ILE 79 23.265 11.356 -13.363 398 HG23 ILE 79 HG23 ILE 79 22.698 11.678 -11.724 399 HD11 ILE 79 HD11 ILE 79 25.887 13.824 -12.373 400 HD12 ILE 79 HD12 ILE 79 26.506 13.977 -14.016 401 HD13 ILE 79 HD13 ILE 79 25.987 12.403 -13.415 402 H CYS 80 HN CYS 80 20.530 11.697 -12.917 403 HA CYS 80 HA CYS 80 18.723 12.855 -10.986 404 HB2 CYS 80 HB2 CYS 80 17.568 10.773 -11.067 405 HB3 CYS 80 HB1 CYS 80 18.106 11.093 -12.717 406 H ARG 81 HN ARG 81 18.291 11.657 -8.915 407 HA ARG 81 HA ARG 81 20.618 11.676 -7.295 408 HB2 ARG 81 HB2 ARG 81 17.783 10.773 -6.808 409 HB3 ARG 81 HB1 ARG 81 19.030 10.664 -5.565 410 HG2 ARG 81 HG2 ARG 81 19.440 13.069 -5.715 411 HG3 ARG 81 HG1 ARG 81 18.269 13.208 -7.028 412 HD2 ARG 81 HD2 ARG 81 16.471 12.483 -5.547 413 HD3 ARG 81 HD1 ARG 81 17.617 12.224 -4.235 414 HE ARG 81 HE ARG 81 16.585 14.781 -5.162 415 HH11 ARG 81 HH21 ARG 81 19.033 13.052 -3.432 416 HH12 ARG 81 HH22 ARG 81 19.503 14.408 -2.462 417 HH21 ARG 81 HH11 ARG 81 17.196 16.567 -3.887 418 HH22 ARG 81 HH12 ARG 81 18.465 16.396 -2.721 419 H THR 82 HN THR 82 18.999 9.180 -9.075 420 HA THR 82 HA THR 82 20.087 6.955 -7.641 421 HB THR 82 HB THR 82 19.163 6.938 -10.513 422 HG1 THR 82 HG1 THR 82 17.747 7.099 -8.091 423 HG21 THR 82 HG21 THR 82 18.694 4.644 -10.106 424 HG22 THR 82 HG22 THR 82 18.877 4.842 -8.364 425 HG23 THR 82 HG23 THR 82 20.291 4.925 -9.416 426 H CYS 83 HN CYS 83 21.020 8.712 -10.576 427 HA CYS 83 HA CYS 83 23.363 7.041 -10.990 428 HB2 CYS 83 HB2 CYS 83 22.322 9.485 -12.419 429 HB3 CYS 83 HB1 CYS 83 23.772 8.602 -12.899 430 H GLN 84 HN GLN 84 22.577 9.806 -9.185 431 HA GLN 84 HA GLN 84 24.797 11.440 -9.322 432 HB2 GLN 84 HB2 GLN 84 22.753 10.801 -7.294 433 HB3 GLN 84 HB1 GLN 84 24.254 11.387 -6.591 434 HG2 GLN 84 HG2 GLN 84 22.886 12.795 -8.885 435 HG3 GLN 84 HG1 GLN 84 22.495 13.144 -7.197 436 HE21 GLN 84 HE21 GLN 84 24.118 14.222 -5.896 437 HE22 GLN 84 HE22 GLN 84 25.507 14.909 -6.588 438 HA PRO 85 HA PRO 85 27.137 8.747 -6.075 439 HB2 PRO 85 HB2 PRO 85 26.134 6.190 -5.663 440 HB3 PRO 85 HB1 PRO 85 25.728 7.592 -4.650 441 HG2 PRO 85 HG2 PRO 85 24.193 6.392 -6.918 442 HG3 PRO 85 HG1 PRO 85 23.608 6.969 -5.346 443 HD2 PRO 85 HD2 PRO 85 23.327 8.462 -7.546 444 HD3 PRO 85 HD1 PRO 85 23.703 9.209 -5.977 445 H LYS 86 HN LYS 86 28.899 8.335 -7.278 446 HA LYS 86 HA LYS 86 29.027 5.893 -8.851 447 HB2 LYS 86 HB2 LYS 86 28.130 7.555 -10.459 448 HB3 LYS 86 HB1 LYS 86 29.536 8.576 -10.158 449 HG2 LYS 86 HG2 LYS 86 31.031 6.818 -10.966 450 HG3 LYS 86 HG1 LYS 86 29.662 5.726 -11.191 451 HD2 LYS 86 HD2 LYS 86 28.695 7.272 -12.848 452 HD3 LYS 86 HD1 LYS 86 30.056 8.371 -12.623 453 HE2 LYS 86 HE2 LYS 86 30.432 6.984 -14.606 454 HE3 LYS 86 HE1 LYS 86 31.602 6.568 -13.354 455 HZ1 LYS 86 HZ1 LYS 86 29.394 4.982 -12.890 456 HZ2 LYS 86 HZ2 LYS 86 30.893 4.492 -13.523 457 HZ3 LYS 86 HZ3 LYS 86 29.630 4.935 -14.568 458 H GLN 87 HN GLN 87 30.886 8.934 -8.779 459 HA GLN 87 HA GLN 87 33.383 7.573 -8.594 460 HB2 GLN 87 HB2 GLN 87 32.680 10.469 -8.046 461 HB3 GLN 87 HB1 GLN 87 34.319 9.834 -8.225 462 HG2 GLN 87 HG2 GLN 87 32.158 9.647 -10.346 463 HG3 GLN 87 HG1 GLN 87 33.444 10.851 -10.331 464 HE21 GLN 87 HE21 GLN 87 35.762 9.725 -10.050 465 HE22 GLN 87 HE22 GLN 87 36.010 8.358 -11.024 466 H HIS 88 HN HIS 88 32.178 9.971 -6.262 467 HA HIS 88 HA HIS 88 32.205 8.250 -4.012 468 HB2 HIS 88 HB2 HIS 88 34.248 9.132 -2.904 469 HB3 HIS 88 HB1 HIS 88 34.620 8.197 -4.356 470 HD2 HIS 88 HD2 HIS 88 35.714 11.461 -2.926 471 HE1 HIS 88 HE1 HIS 88 35.836 12.081 -7.101 472 HE2 HIS 88 HE2 HIS 88 36.563 13.007 -4.851 473 H ASP 89 HN ASP 89 30.204 9.617 -4.154 474 HA ASP 89 HA ASP 89 30.479 12.408 -3.380 475 HB2 ASP 89 HB2 ASP 89 28.092 10.609 -3.825 476 HB3 ASP 89 HB1 ASP 89 27.959 12.292 -3.316 477 H SER 90 HN SER 90 30.279 13.215 -1.376 478 HA SER 90 HA SER 90 29.242 11.512 0.798 479 HB2 SER 90 HB2 SER 90 31.177 12.214 2.225 480 HB3 SER 90 HB1 SER 90 31.627 11.143 0.898 481 HG SER 90 HG SER 90 31.644 13.915 0.483 482 H ILE 91 HN ILE 91 28.881 12.773 2.799 483 HA ILE 91 HA ILE 91 28.325 15.636 2.248 484 HB ILE 91 HB ILE 91 26.547 13.647 3.683 485 HG12 ILE 91 HG12 ILE 91 25.983 15.330 1.224 486 HG13 ILE 91 HG11 ILE 91 26.602 13.677 1.125 487 HG21 ILE 91 HG21 ILE 91 26.481 16.656 3.413 488 HG22 ILE 91 HG22 ILE 91 26.292 15.678 4.869 489 HG23 ILE 91 HG23 ILE 91 24.999 15.730 3.667 490 HD11 ILE 91 HD11 ILE 91 24.670 12.778 2.152 491 HD12 ILE 91 HD12 ILE 91 24.050 13.962 1.004 492 HD13 ILE 91 HD13 ILE 91 24.129 14.357 2.722 493 H TRP 92 HN TRP 92 29.004 17.015 3.754 494 HA TRP 92 HA TRP 92 30.562 16.008 5.968 495 HB2 TRP 92 HB2 TRP 92 31.439 17.944 4.887 496 HB3 TRP 92 HB1 TRP 92 29.890 18.787 4.983 497 HD1 TRP 92 HD1 TRP 92 31.808 16.926 7.775 498 HE1 TRP 92 HE1 TRP 92 32.150 18.558 9.745 499 HE3 TRP 92 HE3 TRP 92 29.817 21.168 5.755 500 HZ2 TRP 92 HZ2 TRP 92 31.652 21.300 10.372 501 HZ3 TRP 92 HZ3 TRP 92 29.762 23.276 7.059 502 HH2 TRP 92 HH2 TRP 92 30.676 23.347 9.363 503 H CYS 93 HN CYS 93 29.934 15.770 8.012 504 HA CYS 93 HA CYS 93 27.261 16.765 8.812 505 HB2 CYS 93 HB2 CYS 93 27.324 14.387 8.984 506 HB3 CYS 93 HB1 CYS 93 28.906 14.417 9.766 507 H THR 94 HN THR 94 27.099 18.170 10.467 508 HA THR 94 HA THR 94 29.593 19.102 11.716 509 HB THR 94 HB THR 94 28.490 21.109 12.150 510 HG1 THR 94 HG1 THR 94 26.690 19.946 13.170 511 HG21 THR 94 HG21 THR 94 26.850 20.191 9.793 512 HG22 THR 94 HG22 THR 94 28.592 20.431 9.653 513 HG23 THR 94 HG23 THR 94 27.549 21.782 10.093 514 H ALA 95 HN ALA 95 26.946 17.067 12.381 515 HA ALA 95 HA ALA 95 26.861 17.521 15.230 516 HB1 ALA 95 HB1 ALA 95 25.708 15.291 13.537 517 HB2 ALA 95 HB2 ALA 95 24.861 16.757 14.033 518 HB3 ALA 95 HB3 ALA 95 25.354 15.569 15.241 519 H CYS 96 HN CYS 96 28.600 15.473 13.002 520 HA CYS 96 HA CYS 96 29.750 13.941 15.262 521 HB2 CYS 96 HB2 CYS 96 29.718 13.293 12.303 522 HB3 CYS 96 HB1 CYS 96 30.408 12.287 13.580 523 H GLN 97 HN GLN 97 30.431 16.048 12.558 524 HA GLN 97 HA GLN 97 32.291 17.347 12.126 525 HB2 GLN 97 HB2 GLN 97 32.524 17.176 14.740 526 HB3 GLN 97 HB1 GLN 97 33.821 16.041 14.371 527 HG2 GLN 97 HG2 GLN 97 34.848 18.189 14.546 528 HG3 GLN 97 HG1 GLN 97 34.774 17.817 12.825 529 HE21 GLN 97 HE21 GLN 97 32.628 19.354 15.298 530 HE22 GLN 97 HE22 GLN 97 32.129 20.615 14.279 531 H GLN 98 HN GLN 98 31.794 14.684 11.045 532 HA GLN 98 HA GLN 98 34.510 14.124 10.070 533 HB2 GLN 98 HB2 GLN 98 32.644 12.057 11.265 534 HB3 GLN 98 HB1 GLN 98 34.052 11.655 10.282 535 HG2 GLN 98 HG2 GLN 98 34.151 13.282 12.844 536 HG3 GLN 98 HG1 GLN 98 34.531 11.566 12.732 537 HE21 GLN 98 HE21 GLN 98 36.135 14.358 13.046 538 HE22 GLN 98 HE22 GLN 98 37.495 14.059 12.076 539 H THR 99 HN THR 99 34.527 12.869 8.101 540 HA THR 99 HA THR 99 32.409 13.693 6.322 541 HB THR 99 HB THR 99 34.740 11.858 5.731 542 HG1 THR 99 HG1 THR 99 35.623 13.719 6.458 543 HG21 THR 99 HG21 THR 99 34.400 12.772 3.432 544 HG22 THR 99 HG22 THR 99 32.966 13.618 4.017 545 HG23 THR 99 HG23 THR 99 33.011 11.855 4.017 546 H LYS 100 HN LYS 100 30.765 12.504 5.529 547 HA LYS 100 HA LYS 100 30.729 9.599 6.102 548 HB2 LYS 100 HB2 LYS 100 29.272 11.291 7.613 549 HB3 LYS 100 HB1 LYS 100 28.159 11.114 6.262 550 HG2 LYS 100 HG2 LYS 100 27.488 9.324 7.599 551 HG3 LYS 100 HG1 LYS 100 28.677 8.528 6.564 552 HD2 LYS 100 HD2 LYS 100 30.419 8.987 8.317 553 HD3 LYS 100 HD1 LYS 100 29.141 9.608 9.360 554 HE2 LYS 100 HE2 LYS 100 29.342 7.369 10.038 555 HE3 LYS 100 HE1 LYS 100 27.978 7.324 8.920 556 HZ1 LYS 100 HZ1 LYS 100 29.476 5.561 8.381 557 HZ2 LYS 100 HZ2 LYS 100 30.799 6.625 8.317 558 HZ3 LYS 100 HZ3 LYS 100 29.568 6.724 7.150 559 H GLY 101 HN GLY 101 29.830 8.326 4.546 560 HA2 GLY 101 HA2 GLY 101 29.754 9.263 1.896 561 HA3 GLY 101 HA1 GLY 101 29.104 7.720 2.444 562 H ILE 102 HN ILE 102 27.931 9.242 0.437 563 HA ILE 102 HA ILE 102 25.741 10.797 1.439 564 HB ILE 102 HB ILE 102 26.723 11.068 -0.847 565 HG12 ILE 102 HG12 ILE 102 23.774 10.358 -0.891 566 HG13 ILE 102 HG11 ILE 102 24.402 11.841 -0.163 567 HG21 ILE 102 HG21 ILE 102 26.221 9.486 -2.570 568 HG22 ILE 102 HG22 ILE 102 25.124 8.588 -1.520 569 HG23 ILE 102 HG23 ILE 102 26.862 8.550 -1.220 570 HD11 ILE 102 HD11 ILE 102 24.834 11.002 -3.046 571 HD12 ILE 102 HD12 ILE 102 25.389 12.503 -2.308 572 HD13 ILE 102 HD13 ILE 102 23.662 12.204 -2.507 573 H ASN 103 HN ASN 103 26.221 7.437 0.555 574 HA ASN 103 HA ASN 103 23.553 6.607 0.360 575 HB2 ASN 103 HB2 ASN 103 26.096 5.202 1.169 576 HB3 ASN 103 HB1 ASN 103 24.552 4.353 1.160 577 HD21 ASN 103 HD21 ASN 103 23.356 5.543 -1.134 578 HD22 ASN 103 HD22 ASN 103 24.265 5.096 -2.508 579 H GLU 104 HN GLU 104 25.673 6.909 3.185 580 HA GLU 104 HA GLU 104 23.661 5.913 5.006 581 HB2 GLU 104 HB2 GLU 104 26.343 7.232 5.442 582 HB3 GLU 104 HB1 GLU 104 25.302 6.667 6.751 583 HG2 GLU 104 HG2 GLU 104 25.359 4.391 5.857 584 HG3 GLU 104 HG1 GLU 104 26.326 4.932 4.485 585 H PHE 105 HN PHE 105 23.358 8.456 3.264 586 HA PHE 105 HA PHE 105 22.405 10.206 5.467 587 HB2 PHE 105 HB2 PHE 105 24.257 10.782 3.296 588 HB3 PHE 105 HB1 PHE 105 22.837 11.823 3.166 589 HD1 PHE 105 HD2 PHE 105 25.569 10.725 5.445 590 HD2 PHE 105 HD1 PHE 105 22.444 13.574 4.717 591 HE1 PHE 105 HE2 PHE 105 26.407 12.129 7.305 592 HE2 PHE 105 HE1 PHE 105 23.282 14.967 6.586 593 HZ PHE 105 HZ PHE 105 25.269 14.248 7.872 594 H SER 106 HN SER 106 20.435 11.154 5.245 595 HA SER 106 HA SER 106 18.654 9.919 3.289 596 HB2 SER 106 HB2 SER 106 18.050 10.141 5.717 597 HB3 SER 106 HB1 SER 106 17.988 11.890 5.484 598 HG SER 106 HG SER 106 16.226 11.678 4.289 599 H LYS 107 HN LYS 107 17.017 11.332 2.215 600 HA LYS 107 HA LYS 107 18.312 13.313 0.637 601 HB2 LYS 107 HB2 LYS 107 15.402 12.575 0.957 602 HB3 LYS 107 HB1 LYS 107 15.990 13.739 -0.231 603 HG2 LYS 107 HG2 LYS 107 17.537 11.949 -1.105 604 HG3 LYS 107 HG1 LYS 107 16.728 10.805 -0.029 605 HD2 LYS 107 HD2 LYS 107 15.276 12.480 -2.096 606 HD3 LYS 107 HD1 LYS 107 15.823 10.830 -2.391 607 HE2 LYS 107 HE2 LYS 107 14.496 10.209 -0.260 608 HE3 LYS 107 HE1 LYS 107 13.734 11.789 -0.431 609 HZ1 LYS 107 HZ1 LYS 107 12.754 11.211 -2.405 610 HZ2 LYS 107 HZ2 LYS 107 12.673 9.745 -1.550 611 HZ3 LYS 107 HZ3 LYS 107 13.868 9.975 -2.737 612 H ALA 108 HN ALA 108 15.903 13.503 3.245 613 HA ALA 108 HA ALA 108 15.600 16.316 3.195 614 HB1 ALA 108 HB1 ALA 108 14.100 14.606 4.350 615 HB2 ALA 108 HB2 ALA 108 14.449 16.076 5.259 616 HB3 ALA 108 HB3 ALA 108 15.298 14.578 5.644 617 H GLN 109 HN GLN 109 17.816 14.177 4.921 618 HA GLN 109 HA GLN 109 18.931 16.060 6.678 619 HB2 GLN 109 HB2 GLN 109 19.830 13.447 5.516 620 HB3 GLN 109 HB1 GLN 109 21.024 14.439 6.354 621 HG2 GLN 109 HG2 GLN 109 19.904 12.814 7.871 622 HG3 GLN 109 HG1 GLN 109 19.644 14.492 8.357 623 HE21 GLN 109 HE21 GLN 109 18.010 11.623 8.012 624 HE22 GLN 109 HE22 GLN 109 16.450 12.224 7.716 625 H ARG 110 HN ARG 110 19.400 15.547 3.276 626 HA ARG 110 HA ARG 110 21.831 17.116 3.139 627 HB2 ARG 110 HB2 ARG 110 21.396 15.243 1.571 628 HB3 ARG 110 HB1 ARG 110 20.024 16.139 0.917 629 HG2 ARG 110 HG2 ARG 110 21.523 17.981 0.258 630 HG3 ARG 110 HG1 ARG 110 22.901 17.104 0.934 631 HD2 ARG 110 HD2 ARG 110 22.402 15.225 -0.647 632 HD3 ARG 110 HD1 ARG 110 21.152 16.229 -1.380 633 HE ARG 110 HE ARG 110 23.587 17.668 -1.343 634 HH11 ARG 110 HH21 ARG 110 22.063 14.932 -2.814 635 HH12 ARG 110 HH22 ARG 110 22.971 15.042 -4.285 636 HH21 ARG 110 HH11 ARG 110 24.781 17.820 -3.269 637 HH22 ARG 110 HH12 ARG 110 24.510 16.677 -4.542 638 H HIS 111 HN HIS 111 18.383 17.593 2.749 639 HA HIS 111 HA HIS 111 18.483 20.064 1.360 640 HB2 HIS 111 HB2 HIS 111 16.388 18.828 3.153 641 HB3 HIS 111 HB1 HIS 111 16.148 20.350 2.287 642 HD2 HIS 111 HD2 HIS 111 14.414 17.631 1.384 643 HE1 HIS 111 HE1 HIS 111 16.938 17.687 -1.999 644 HE2 HIS 111 HE2 HIS 111 14.764 16.774 -1.058 645 H VAL 112 HN VAL 112 18.300 19.267 4.817 646 HA VAL 112 HA VAL 112 18.046 21.868 5.820 647 HB VAL 112 HB VAL 112 19.115 20.915 7.899 648 HG11 VAL 112 HG11 VAL 112 16.647 20.702 7.263 649 HG12 VAL 112 HG12 VAL 112 17.249 19.489 8.392 650 HG13 VAL 112 HG13 VAL 112 17.031 19.076 6.691 651 HG21 VAL 112 HG21 VAL 112 20.578 19.326 6.503 652 HG22 VAL 112 HG22 VAL 112 19.132 18.336 6.327 653 HG23 VAL 112 HG23 VAL 112 19.808 18.629 7.929 654 H LEU 113 HN LEU 113 19.674 23.181 6.911 655 HA LEU 113 HA LEU 113 22.007 23.523 5.225 656 HB2 LEU 113 HB2 LEU 113 20.794 25.054 7.520 657 HB3 LEU 113 HB1 LEU 113 22.414 25.446 6.933 658 HG LEU 113 HG LEU 113 21.542 25.814 4.680 659 HD11 LEU 113 HD11 LEU 113 19.751 24.261 4.504 660 HD12 LEU 113 HD12 LEU 113 18.976 25.843 4.463 661 HD13 LEU 113 HD13 LEU 113 18.956 24.891 5.947 662 HD21 LEU 113 HD21 LEU 113 21.449 27.622 6.483 663 HD22 LEU 113 HD22 LEU 113 19.732 27.251 6.635 664 HD23 LEU 113 HD23 LEU 113 20.371 27.857 5.107 665 H ASP 114 HN ASP 114 21.312 21.677 7.933 666 HA ASP 114 HA ASP 114 24.190 21.493 8.634 667 HB2 ASP 114 HB2 ASP 114 21.834 21.365 10.527 668 HB3 ASP 114 HB1 ASP 114 23.514 21.057 10.962 669 HA PRO 115 HA PRO 115 22.522 17.440 7.080 670 HB2 PRO 115 HB2 PRO 115 25.446 17.181 6.495 671 HB3 PRO 115 HB1 PRO 115 24.051 16.810 5.461 672 HG2 PRO 115 HG2 PRO 115 25.545 18.979 5.051 673 HG3 PRO 115 HG1 PRO 115 23.788 18.999 4.797 674 HD2 PRO 115 HD2 PRO 115 25.379 20.145 7.065 675 HD3 PRO 115 HD1 PRO 115 23.890 20.755 6.306 676 H ARG 116 HN ARG 116 22.389 15.662 8.307 677 HA ARG 116 HA ARG 116 24.537 15.098 10.278 678 HB2 ARG 116 HB2 ARG 116 21.647 14.634 10.977 679 HB3 ARG 116 HB1 ARG 116 23.035 14.857 12.047 680 HG2 ARG 116 HG2 ARG 116 23.184 17.234 11.251 681 HG3 ARG 116 HG1 ARG 116 21.695 16.973 10.346 682 HD2 ARG 116 HD2 ARG 116 20.536 16.363 12.446 683 HD3 ARG 116 HD1 ARG 116 22.019 16.686 13.346 684 HE ARG 116 HE ARG 116 20.219 18.664 12.186 685 HH11 ARG 116 HH21 ARG 116 23.336 17.922 13.492 686 HH12 ARG 116 HH22 ARG 116 23.699 19.559 13.924 687 HH21 ARG 116 HH11 ARG 116 20.687 20.814 12.750 688 HH22 ARG 116 HH12 ARG 116 22.199 21.197 13.504 689 H CYS 117 HN CYS 117 25.107 13.014 10.463 690 HA CYS 117 HA CYS 117 24.226 11.120 8.525 691 HB2 CYS 117 HB2 CYS 117 25.636 10.191 10.999 692 HB3 CYS 117 HB1 CYS 117 25.939 9.776 9.308 693 H GLN 118 HN GLN 118 23.109 9.178 8.833 694 HA GLN 118 HA GLN 118 20.758 9.296 10.314 695 HB2 GLN 118 HB2 GLN 118 22.248 6.886 9.272 696 HB3 GLN 118 HB1 GLN 118 20.609 6.831 9.933 697 HG2 GLN 118 HG2 GLN 118 19.832 8.405 8.238 698 HG3 GLN 118 HG1 GLN 118 21.470 8.579 7.611 699 HE21 GLN 118 HE21 GLN 118 19.244 7.617 6.017 700 HE22 GLN 118 HE22 GLN 118 19.585 6.011 5.600 701 H ILE 119 HN ILE 119 23.877 8.873 11.464 702 HA ILE 119 HA ILE 119 23.168 7.187 13.742 703 HB ILE 119 HB ILE 119 25.732 8.541 12.889 704 HG12 ILE 119 HG12 ILE 119 26.454 6.174 12.589 705 HG13 ILE 119 HG11 ILE 119 24.828 5.648 13.028 706 HG21 ILE 119 HG21 ILE 119 25.047 6.953 15.369 707 HG22 ILE 119 HG22 ILE 119 25.863 8.513 15.262 708 HG23 ILE 119 HG23 ILE 119 26.697 7.045 14.756 709 HD11 ILE 119 HD11 ILE 119 23.893 6.414 11.045 710 HD12 ILE 119 HD12 ILE 119 25.498 5.958 10.482 711 HD13 ILE 119 HD13 ILE 119 25.132 7.651 10.808 712 H CYS 120 HN CYS 120 24.312 10.524 13.210 713 HA CYS 120 HA CYS 120 24.207 11.291 15.932 714 HB2 CYS 120 HB2 CYS 120 23.930 13.681 14.683 715 HB3 CYS 120 HB1 CYS 120 25.472 12.822 14.757 716 H VAL 121 HN VAL 121 21.774 11.109 13.447 717 HA VAL 121 HA VAL 121 19.853 12.723 14.892 718 HB VAL 121 HB VAL 121 18.343 12.222 13.098 719 HG11 VAL 121 HG11 VAL 121 19.759 12.802 11.116 720 HG12 VAL 121 HG12 VAL 121 21.192 12.504 12.097 721 HG13 VAL 121 HG13 VAL 121 20.093 13.814 12.522 722 HG21 VAL 121 HG21 VAL 121 19.114 10.561 11.311 723 HG22 VAL 121 HG22 VAL 121 18.590 9.859 12.842 724 HG23 VAL 121 HG23 VAL 121 20.308 10.013 12.486 725 H HIS 122 HN HIS 122 20.669 9.340 14.565 726 HA HIS 122 HA HIS 122 18.256 8.318 15.709 727 HB2 HIS 122 HB2 HIS 122 19.611 6.874 14.312 728 HB3 HIS 122 HB1 HIS 122 21.006 7.092 15.373 729 HD2 HIS 122 HD2 HIS 122 21.109 5.291 17.487 730 HE1 HIS 122 HE1 HIS 122 17.183 3.776 17.135 731 HE2 HIS 122 HE2 HIS 122 19.393 3.527 18.360 732 H SER 123 HN SER 123 20.691 10.133 17.027 733 HA SER 123 HA SER 123 20.856 8.789 19.599 734 HB2 SER 123 HB2 SER 123 22.769 10.067 18.611 735 HB3 SER 123 HB1 SER 123 21.835 11.544 18.824 736 HG SER 123 HG SER 123 22.153 9.785 20.986 737 H GLN 124 HN GLN 124 19.927 12.114 18.701 738 HA GLN 124 HA GLN 124 17.600 11.934 20.502 739 HB2 GLN 124 HB2 GLN 124 19.798 14.002 20.660 740 HB3 GLN 124 HB1 GLN 124 18.207 14.215 21.393 741 HG2 GLN 124 HG2 GLN 124 18.522 12.187 22.729 742 HG3 GLN 124 HG1 GLN 124 20.086 11.906 21.964 743 HE21 GLN 124 HE21 GLN 124 20.241 15.099 22.076 744 HE22 GLN 124 HE22 GLN 124 20.838 15.357 23.643 745 H ARG 125 HN ARG 125 17.685 11.879 17.670 746 HA ARG 125 HA ARG 125 17.010 13.043 15.768 747 HB2 ARG 125 HB2 ARG 125 14.719 13.916 16.045 748 HB3 ARG 125 HB1 ARG 125 14.917 12.371 16.873 749 HG2 ARG 125 HG2 ARG 125 15.115 13.458 19.019 750 HG3 ARG 125 HG1 ARG 125 15.187 15.054 18.275 751 HD2 ARG 125 HD2 ARG 125 12.837 13.164 18.088 752 HD3 ARG 125 HD1 ARG 125 12.959 14.504 19.228 753 HE ARG 125 HE ARG 125 13.407 15.522 16.649 754 HH11 ARG 125 HH21 ARG 125 10.931 14.042 18.553 755 HH12 ARG 125 HH22 ARG 125 9.631 14.833 17.727 756 HH21 ARG 125 HH11 ARG 125 11.711 16.563 15.558 757 HH22 ARG 125 HH12 ARG 125 10.072 16.262 16.030 758 H ASN 126 HN ASN 126 15.465 15.484 15.711 759 HA ASN 126 HA ASN 126 17.555 17.387 15.524 760 HB2 ASN 126 HB2 ASN 126 14.545 17.683 15.544 761 HB3 ASN 126 HB1 ASN 126 15.657 19.015 15.231 762 HD21 ASN 126 HD21 ASN 126 13.730 17.886 13.296 763 HD22 ASN 126 HD22 ASN 126 14.649 17.289 12.000 Start of MODEL 7 1 H MET 31 HT1 MET 31 -6.208 15.667 -9.394 2 HA MET 31 HA MET 31 -5.959 17.886 -9.082 3 HB2 MET 31 HB2 MET 31 -4.601 16.651 -6.663 4 HB3 MET 31 HB1 MET 31 -5.263 18.287 -6.727 5 HG2 MET 31 HG2 MET 31 -6.877 15.772 -7.247 6 HG3 MET 31 HG1 MET 31 -6.839 16.621 -5.703 7 HE1 MET 31 HE1 MET 31 -8.201 20.005 -6.285 8 HE2 MET 31 HE2 MET 31 -7.063 18.953 -5.449 9 HE3 MET 31 HE3 MET 31 -8.792 18.696 -5.256 10 H GLY 32 HN GLY 32 -4.457 18.345 -10.828 11 HA2 GLY 32 HA2 GLY 32 -1.620 18.437 -10.284 12 HA3 GLY 32 HA1 GLY 32 -2.427 19.017 -11.738 13 H LYS 33 HN LYS 33 -0.548 20.061 -9.354 14 HA LYS 33 HA LYS 33 -1.955 22.500 -8.626 15 HB2 LYS 33 HB2 LYS 33 0.828 21.481 -8.041 16 HB3 LYS 33 HB1 LYS 33 0.221 23.038 -7.479 17 HG2 LYS 33 HG2 LYS 33 -1.650 21.882 -6.338 18 HG3 LYS 33 HG1 LYS 33 -1.002 20.330 -6.869 19 HD2 LYS 33 HD2 LYS 33 1.097 20.790 -5.645 20 HD3 LYS 33 HD1 LYS 33 0.435 22.332 -5.101 21 HE2 LYS 33 HE2 LYS 33 -1.420 21.125 -3.980 22 HE3 LYS 33 HE1 LYS 33 -0.710 19.593 -4.486 23 HZ1 LYS 33 HZ1 LYS 33 0.836 21.578 -2.936 24 HZ2 LYS 33 HZ2 LYS 33 1.145 19.919 -3.140 25 HZ3 LYS 33 HZ3 LYS 33 -0.152 20.432 -2.169 26 H ASN 34 HN ASN 34 1.381 22.192 -9.797 27 HA ASN 34 HA ASN 34 0.799 24.218 -11.885 28 HB2 ASN 34 HB2 ASN 34 3.255 24.171 -10.114 29 HB3 ASN 34 HB1 ASN 34 2.870 25.358 -11.365 30 HD21 ASN 34 HD21 ASN 34 3.147 25.580 -8.287 31 HD22 ASN 34 HD22 ASN 34 1.724 26.379 -7.819 32 H ASP 35 HN ASP 35 3.836 24.141 -12.264 33 HA ASP 35 HA ASP 35 3.807 21.950 -14.194 34 HB2 ASP 35 HB2 ASP 35 5.802 24.155 -13.632 35 HB3 ASP 35 HB1 ASP 35 6.005 22.928 -14.886 36 H ASN 36 HN ASN 36 4.355 22.039 -11.017 37 HA ASN 36 HA ASN 36 6.901 20.862 -10.666 38 HB2 ASN 36 HB2 ASN 36 4.446 20.479 -8.941 39 HB3 ASN 36 HB1 ASN 36 6.128 20.252 -8.454 40 HD21 ASN 36 HD21 ASN 36 6.962 22.691 -10.068 41 HD22 ASN 36 HD22 ASN 36 6.463 24.016 -9.132 42 H ASP 37 HN ASP 37 4.051 19.653 -12.050 43 HA ASP 37 HA ASP 37 4.462 16.882 -11.365 44 HB2 ASP 37 HB2 ASP 37 2.662 16.479 -13.040 45 HB3 ASP 37 HB1 ASP 37 2.203 17.652 -11.806 46 H ALA 38 HN ALA 38 6.143 18.907 -13.259 47 HA ALA 38 HA ALA 38 6.518 17.398 -15.648 48 HB1 ALA 38 HB1 ALA 38 8.549 18.807 -15.939 49 HB2 ALA 38 HB2 ALA 38 8.271 19.475 -14.329 50 HB3 ALA 38 HB3 ALA 38 7.093 19.750 -15.612 51 H LEU 39 HN LEU 39 7.977 15.830 -16.165 52 HA LEU 39 HA LEU 39 9.680 14.809 -13.962 53 HB2 LEU 39 HB2 LEU 39 8.528 13.214 -16.251 54 HB3 LEU 39 HB1 LEU 39 9.381 12.604 -14.835 55 HG LEU 39 HG LEU 39 7.371 14.029 -13.606 56 HD11 LEU 39 HD11 LEU 39 6.108 12.765 -16.048 57 HD12 LEU 39 HD12 LEU 39 6.400 14.498 -15.888 58 HD13 LEU 39 HD13 LEU 39 5.296 13.684 -14.778 59 HD21 LEU 39 HD21 LEU 39 6.182 11.771 -13.466 60 HD22 LEU 39 HD22 LEU 39 7.873 11.785 -12.962 61 HD23 LEU 39 HD23 LEU 39 7.432 11.153 -14.548 62 H ILE 40 HN ILE 40 11.762 14.879 -14.266 63 HA ILE 40 HA ILE 40 12.793 15.438 -16.990 64 HB ILE 40 HB ILE 40 14.315 15.520 -14.379 65 HG12 ILE 40 HG12 ILE 40 12.441 17.050 -14.205 66 HG13 ILE 40 HG11 ILE 40 13.906 17.988 -14.508 67 HG21 ILE 40 HG21 ILE 40 15.730 15.437 -16.360 68 HG22 ILE 40 HG22 ILE 40 15.749 17.086 -15.731 69 HG23 ILE 40 HG23 ILE 40 14.768 16.693 -17.140 70 HD11 ILE 40 HD11 ILE 40 13.215 17.781 -17.029 71 HD12 ILE 40 HD12 ILE 40 12.350 18.927 -16.010 72 HD13 ILE 40 HD13 ILE 40 11.630 17.366 -16.382 73 H MET 41 HN MET 41 13.871 14.002 -18.124 74 HA MET 41 HA MET 41 14.286 11.333 -17.019 75 HB2 MET 41 HB2 MET 41 13.326 11.437 -19.221 76 HB3 MET 41 HB1 MET 41 14.640 12.461 -19.802 77 HG2 MET 41 HG2 MET 41 15.447 9.845 -18.581 78 HG3 MET 41 HG1 MET 41 14.639 9.767 -20.149 79 HE1 MET 41 HE1 MET 41 15.994 10.062 -22.409 80 HE2 MET 41 HE2 MET 41 16.708 11.664 -22.569 81 HE3 MET 41 HE3 MET 41 15.080 11.494 -21.914 82 H CYS 42 HN CYS 42 16.248 10.313 -16.810 83 HA CYS 42 HA CYS 42 18.536 12.034 -16.350 84 HB2 CYS 42 HB2 CYS 42 18.146 10.211 -14.817 85 HB3 CYS 42 HB1 CYS 42 18.177 9.038 -16.130 86 H MET 43 HN MET 43 19.995 12.557 -17.854 87 HA MET 43 HA MET 43 19.992 11.495 -20.485 88 HB2 MET 43 HB2 MET 43 22.247 12.676 -20.632 89 HB3 MET 43 HB1 MET 43 20.878 13.692 -20.182 90 HG2 MET 43 HG2 MET 43 21.479 13.520 -17.816 91 HG3 MET 43 HG1 MET 43 22.800 12.417 -18.207 92 HE1 MET 43 HE1 MET 43 25.525 14.383 -19.695 93 HE2 MET 43 HE2 MET 43 24.330 13.671 -20.771 94 HE3 MET 43 HE3 MET 43 24.781 12.834 -19.289 95 H ARG 44 HN ARG 44 20.866 9.961 -17.739 96 HA ARG 44 HA ARG 44 22.929 8.330 -19.125 97 HB2 ARG 44 HB2 ARG 44 23.463 9.697 -16.902 98 HB3 ARG 44 HB1 ARG 44 22.683 8.319 -16.125 99 HG2 ARG 44 HG2 ARG 44 24.218 6.803 -17.394 100 HG3 ARG 44 HG1 ARG 44 25.045 8.226 -18.025 101 HD2 ARG 44 HD2 ARG 44 26.316 7.533 -16.132 102 HD3 ARG 44 HD1 ARG 44 25.392 8.933 -15.607 103 HE ARG 44 HE ARG 44 23.843 6.683 -15.028 104 HH11 ARG 44 HH21 ARG 44 26.905 8.057 -14.194 105 HH12 ARG 44 HH22 ARG 44 26.929 7.384 -12.598 106 HH21 ARG 44 HH11 ARG 44 23.867 5.795 -12.939 107 HH22 ARG 44 HH12 ARG 44 25.208 6.102 -11.887 108 H CYS 45 HN CYS 45 20.875 7.870 -16.255 109 HA CYS 45 HA CYS 45 20.401 5.136 -16.785 110 HB2 CYS 45 HB2 CYS 45 18.644 6.940 -15.113 111 HB3 CYS 45 HB1 CYS 45 18.877 5.201 -14.948 112 H ARG 46 HN ARG 46 19.002 8.008 -18.037 113 HA ARG 46 HA ARG 46 17.244 8.399 -19.471 114 HB2 ARG 46 HB2 ARG 46 17.767 5.486 -20.047 115 HB3 ARG 46 HB1 ARG 46 16.608 6.464 -20.952 116 HG2 ARG 46 HG2 ARG 46 18.370 8.022 -21.599 117 HG3 ARG 46 HG1 ARG 46 19.542 7.151 -20.609 118 HD2 ARG 46 HD2 ARG 46 19.789 6.475 -22.927 119 HD3 ARG 46 HD1 ARG 46 19.156 5.123 -21.989 120 HE ARG 46 HE ARG 46 17.088 6.728 -23.211 121 HH11 ARG 46 HH21 ARG 46 19.357 4.148 -23.630 122 HH12 ARG 46 HH22 ARG 46 18.457 3.378 -24.894 123 HH21 ARG 46 HH11 ARG 46 15.904 5.723 -24.868 124 HH22 ARG 46 HH12 ARG 46 16.502 4.270 -25.595 125 H LYS 47 HN LYS 47 16.653 7.757 -16.719 126 HA LYS 47 HA LYS 47 14.061 6.344 -16.966 127 HB2 LYS 47 HB2 LYS 47 15.744 7.034 -14.545 128 HB3 LYS 47 HB1 LYS 47 14.146 6.289 -14.471 129 HG2 LYS 47 HG2 LYS 47 14.957 4.392 -15.818 130 HG3 LYS 47 HG1 LYS 47 16.554 5.135 -15.906 131 HD2 LYS 47 HD2 LYS 47 16.690 5.065 -13.418 132 HD3 LYS 47 HD1 LYS 47 15.143 4.217 -13.388 133 HE2 LYS 47 HE2 LYS 47 17.593 3.227 -14.870 134 HE3 LYS 47 HE1 LYS 47 17.118 2.678 -13.262 135 HZ1 LYS 47 HZ1 LYS 47 15.931 1.163 -14.369 136 HZ2 LYS 47 HZ2 LYS 47 16.009 2.014 -15.838 137 HZ3 LYS 47 HZ3 LYS 47 14.836 2.420 -14.677 138 H VAL 48 HN VAL 48 12.201 7.415 -16.766 139 HA VAL 48 HA VAL 48 12.313 10.319 -16.376 140 HB VAL 48 HB VAL 48 9.803 8.768 -16.959 141 HG11 VAL 48 HG11 VAL 48 9.582 11.142 -16.569 142 HG12 VAL 48 HG12 VAL 48 9.321 10.826 -18.279 143 HG13 VAL 48 HG13 VAL 48 10.860 11.497 -17.729 144 HG21 VAL 48 HG21 VAL 48 10.370 8.965 -19.382 145 HG22 VAL 48 HG22 VAL 48 11.439 7.861 -18.519 146 HG23 VAL 48 HG23 VAL 48 11.992 9.487 -18.924 147 H LYS 49 HN LYS 49 11.883 11.238 -14.482 148 HA LYS 49 HA LYS 49 9.984 9.981 -12.625 149 HB2 LYS 49 HB2 LYS 49 12.815 10.737 -11.885 150 HB3 LYS 49 HB1 LYS 49 11.551 10.255 -10.750 151 HG2 LYS 49 HG2 LYS 49 11.357 8.077 -11.913 152 HG3 LYS 49 HG1 LYS 49 12.661 8.551 -12.999 153 HD2 LYS 49 HD2 LYS 49 14.138 8.849 -10.994 154 HD3 LYS 49 HD1 LYS 49 12.842 8.169 -10.012 155 HE2 LYS 49 HE2 LYS 49 12.880 6.162 -11.585 156 HE3 LYS 49 HE1 LYS 49 14.398 6.810 -12.207 157 HZ1 LYS 49 HZ1 LYS 49 13.787 5.774 -9.521 158 HZ2 LYS 49 HZ2 LYS 49 15.032 6.912 -9.723 159 HZ3 LYS 49 HZ3 LYS 49 15.102 5.421 -10.534 160 H GLY 50 HN GLY 50 9.432 11.446 -10.820 161 HA2 GLY 50 HA2 GLY 50 9.094 14.155 -11.860 162 HA3 GLY 50 HA1 GLY 50 8.300 13.461 -10.463 163 H ILE 51 HN ILE 51 9.068 15.880 -9.979 164 HA ILE 51 HA ILE 51 11.716 16.432 -9.307 165 HB ILE 51 HB ILE 51 9.828 18.073 -9.300 166 HG12 ILE 51 HG12 ILE 51 11.234 18.035 -6.619 167 HG13 ILE 51 HG11 ILE 51 12.088 18.406 -8.117 168 HG21 ILE 51 HG21 ILE 51 9.224 16.960 -6.551 169 HG22 ILE 51 HG22 ILE 51 8.306 16.507 -7.987 170 HG23 ILE 51 HG23 ILE 51 8.320 18.185 -7.443 171 HD11 ILE 51 HD11 ILE 51 11.335 20.467 -7.041 172 HD12 ILE 51 HD12 ILE 51 9.677 19.865 -7.016 173 HD13 ILE 51 HD13 ILE 51 10.463 20.226 -8.554 174 H ASP 52 HN ASP 52 9.865 13.957 -8.059 175 HA ASP 52 HA ASP 52 10.691 14.040 -5.322 176 HB2 ASP 52 HB2 ASP 52 9.812 11.704 -5.289 177 HB3 ASP 52 HB1 ASP 52 8.656 12.876 -5.918 178 H SER 53 HN SER 53 11.660 12.202 -8.192 179 HA SER 53 HA SER 53 13.942 11.040 -6.748 180 HB2 SER 53 HB2 SER 53 13.523 10.694 -9.689 181 HB3 SER 53 HB1 SER 53 14.173 9.558 -8.513 182 HG SER 53 HG SER 53 12.155 9.167 -7.767 183 H TYR 54 HN TYR 54 13.416 13.968 -7.961 184 HA TYR 54 HA TYR 54 16.213 14.302 -8.903 185 HB2 TYR 54 HB2 TYR 54 13.642 15.196 -10.102 186 HB3 TYR 54 HB1 TYR 54 14.930 16.403 -10.093 187 HD1 TYR 54 HD1 TYR 54 14.493 12.727 -10.799 188 HD2 TYR 54 HD2 TYR 54 16.381 16.417 -11.911 189 HE1 TYR 54 HE1 TYR 54 15.577 11.593 -12.710 190 HE2 TYR 54 HE2 TYR 54 17.460 15.290 -13.817 191 HH TYR 54 HH TYR 54 18.016 13.197 -14.645 192 H SER 55 HN SER 55 17.385 15.838 -7.967 193 HA SER 55 HA SER 55 16.483 17.033 -5.557 194 HB2 SER 55 HB2 SER 55 18.648 18.109 -5.500 195 HB3 SER 55 HB1 SER 55 18.863 16.454 -6.074 196 HG SER 55 HG SER 55 19.450 18.766 -7.296 197 H LYS 56 HN LYS 56 16.321 19.311 -5.097 198 HA LYS 56 HA LYS 56 14.639 20.704 -6.881 199 HB2 LYS 56 HB2 LYS 56 16.220 21.640 -4.482 200 HB3 LYS 56 HB1 LYS 56 15.057 22.642 -5.347 201 HG2 LYS 56 HG2 LYS 56 13.273 21.027 -4.882 202 HG3 LYS 56 HG1 LYS 56 14.427 19.957 -4.089 203 HD2 LYS 56 HD2 LYS 56 13.407 21.115 -2.295 204 HD3 LYS 56 HD1 LYS 56 14.939 21.958 -2.534 205 HE2 LYS 56 HE2 LYS 56 13.862 23.744 -3.737 206 HE3 LYS 56 HE1 LYS 56 12.343 22.853 -3.821 207 HZ1 LYS 56 HZ1 LYS 56 12.383 24.572 -2.088 208 HZ2 LYS 56 HZ2 LYS 56 13.640 23.737 -1.307 209 HZ3 LYS 56 HZ3 LYS 56 12.108 23.017 -1.467 210 H THR 57 HN THR 57 18.101 20.994 -6.177 211 HA THR 57 HA THR 57 18.597 23.282 -7.753 212 HB THR 57 HB THR 57 20.441 20.986 -7.051 213 HG1 THR 57 HG1 THR 57 20.172 21.866 -5.168 214 HG21 THR 57 HG21 THR 57 20.908 23.716 -8.251 215 HG22 THR 57 HG22 THR 57 21.471 22.151 -8.839 216 HG23 THR 57 HG23 THR 57 22.179 22.853 -7.383 217 H GLN 58 HN GLN 58 18.893 19.813 -8.515 218 HA GLN 58 HA GLN 58 19.717 20.189 -11.205 219 HB2 GLN 58 HB2 GLN 58 18.388 17.845 -9.830 220 HB3 GLN 58 HB1 GLN 58 19.031 17.795 -11.471 221 HG2 GLN 58 HG2 GLN 58 20.672 18.566 -9.045 222 HG3 GLN 58 HG1 GLN 58 20.632 16.939 -9.721 223 HE21 GLN 58 HE21 GLN 58 22.544 19.603 -9.721 224 HE22 GLN 58 HE22 GLN 58 23.202 19.498 -11.287 225 H TRP 59 HN TRP 59 16.541 19.671 -9.704 226 HA TRP 59 HA TRP 59 15.091 19.547 -12.141 227 HB2 TRP 59 HB2 TRP 59 14.161 18.655 -10.070 228 HB3 TRP 59 HB1 TRP 59 14.184 20.264 -9.340 229 HD1 TRP 59 HD1 TRP 59 12.516 18.336 -12.229 230 HE1 TRP 59 HE1 TRP 59 10.254 19.466 -12.765 231 HE3 TRP 59 HE3 TRP 59 12.782 22.359 -9.094 232 HZ2 TRP 59 HZ2 TRP 59 8.768 21.775 -11.966 233 HZ3 TRP 59 HZ3 TRP 59 10.932 24.006 -9.002 234 HH2 TRP 59 HH2 TRP 59 8.927 23.719 -10.431 235 H SER 60 HN SER 60 16.043 22.166 -9.991 236 HA SER 60 HA SER 60 14.398 24.194 -11.061 237 HB2 SER 60 HB2 SER 60 17.051 24.279 -9.628 238 HB3 SER 60 HB1 SER 60 16.190 25.733 -10.124 239 HG SER 60 HG SER 60 14.567 25.251 -8.758 240 H LYS 61 HN LYS 61 17.449 22.837 -12.101 241 HA LYS 61 HA LYS 61 18.236 24.885 -13.882 242 HB2 LYS 61 HB2 LYS 61 18.838 21.934 -13.750 243 HB3 LYS 61 HB1 LYS 61 19.525 22.981 -14.990 244 HG2 LYS 61 HG2 LYS 61 20.563 24.390 -13.307 245 HG3 LYS 61 HG1 LYS 61 19.767 23.498 -12.014 246 HD2 LYS 61 HD2 LYS 61 21.961 22.591 -12.091 247 HD3 LYS 61 HD1 LYS 61 20.963 21.411 -12.938 248 HE2 LYS 61 HE2 LYS 61 21.689 22.215 -15.085 249 HE3 LYS 61 HE1 LYS 61 22.468 23.623 -14.364 250 HZ1 LYS 61 HZ1 LYS 61 24.285 22.371 -14.390 251 HZ2 LYS 61 HZ2 LYS 61 23.417 20.928 -14.628 252 HZ3 LYS 61 HZ3 LYS 61 23.612 21.557 -13.061 253 H THR 62 HN THR 62 15.511 23.025 -13.957 254 HA THR 62 HA THR 62 15.367 22.423 -16.752 255 HB THR 62 HB THR 62 12.974 21.972 -16.270 256 HG1 THR 62 HG1 THR 62 13.751 23.140 -13.833 257 HG21 THR 62 HG21 THR 62 13.485 20.268 -14.379 258 HG22 THR 62 HG22 THR 62 15.148 20.839 -14.516 259 HG23 THR 62 HG23 THR 62 14.352 20.105 -15.906 260 H PHE 63 HN PHE 63 14.909 25.240 -14.883 261 HA PHE 63 HA PHE 63 13.967 26.708 -17.237 262 HB2 PHE 63 HB2 PHE 63 12.331 27.941 -15.785 263 HB3 PHE 63 HB1 PHE 63 11.899 26.259 -16.097 264 HD1 PHE 63 HD1 PHE 63 13.459 28.543 -13.600 265 HD2 PHE 63 HD2 PHE 63 11.732 24.679 -14.328 266 HE1 PHE 63 HE1 PHE 63 13.440 28.091 -11.161 267 HE2 PHE 63 HE2 PHE 63 11.718 24.223 -11.892 268 HZ PHE 63 HZ PHE 63 12.570 25.931 -10.306 269 H THR 64 HN THR 64 14.387 28.950 -17.153 270 HA THR 64 HA THR 64 16.286 29.805 -15.041 271 HB THR 64 HB THR 64 17.550 30.999 -16.812 272 HG1 THR 64 HG1 THR 64 15.870 29.511 -18.531 273 HG21 THR 64 HG21 THR 64 18.379 28.810 -17.959 274 HG22 THR 64 HG22 THR 64 17.252 28.010 -16.863 275 HG23 THR 64 HG23 THR 64 18.571 28.984 -16.214 276 H PHE 65 HN PHE 65 16.597 32.231 -15.121 277 HA PHE 65 HA PHE 65 13.940 33.492 -15.452 278 HB2 PHE 65 HB2 PHE 65 15.688 33.417 -13.260 279 HB3 PHE 65 HB1 PHE 65 15.931 35.028 -13.925 280 HD1 PHE 65 HD2 PHE 65 13.044 32.681 -13.391 281 HD2 PHE 65 HD1 PHE 65 14.560 36.683 -13.006 282 HE1 PHE 65 HE2 PHE 65 10.888 33.403 -12.407 283 HE2 PHE 65 HE1 PHE 65 12.404 37.400 -12.020 284 HZ PHE 65 HZ PHE 65 10.572 35.768 -11.728 285 H VAL 66 HN VAL 66 13.674 34.833 -17.064 286 HA VAL 66 HA VAL 66 15.996 36.383 -18.059 287 HB VAL 66 HB VAL 66 13.914 34.897 -19.669 288 HG11 VAL 66 HG11 VAL 66 15.849 37.090 -20.442 289 HG12 VAL 66 HG12 VAL 66 14.113 37.017 -20.745 290 HG13 VAL 66 HG13 VAL 66 15.205 35.948 -21.623 291 HG21 VAL 66 HG21 VAL 66 16.949 34.847 -19.721 292 HG22 VAL 66 HG22 VAL 66 15.865 33.803 -20.638 293 HG23 VAL 66 HG23 VAL 66 15.951 33.660 -18.881 294 H ARG 67 HN ARG 67 15.643 38.495 -18.330 295 HA ARG 67 HA ARG 67 14.578 40.523 -18.060 296 HB2 ARG 67 HB2 ARG 67 12.655 38.986 -19.818 297 HB3 ARG 67 HB1 ARG 67 12.485 40.713 -19.475 298 HG2 ARG 67 HG2 ARG 67 14.725 41.131 -20.399 299 HG3 ARG 67 HG1 ARG 67 14.931 39.408 -20.710 300 HD2 ARG 67 HD2 ARG 67 13.015 39.434 -22.247 301 HD3 ARG 67 HD1 ARG 67 12.757 41.147 -21.911 302 HE ARG 67 HE ARG 67 14.610 41.659 -23.254 303 HH11 ARG 67 HH21 ARG 67 14.310 38.260 -22.687 304 HH12 ARG 67 HH22 ARG 67 15.474 37.816 -23.889 305 HH21 ARG 67 HH11 ARG 67 16.139 41.086 -24.832 306 HH22 ARG 67 HH12 ARG 67 16.512 39.417 -25.103 307 H GLY 68 HN GLY 68 14.026 38.431 -16.019 308 HA2 GLY 68 HA2 GLY 68 12.824 38.427 -14.053 309 HA3 GLY 68 HA1 GLY 68 11.923 39.823 -14.644 310 H ARG 69 HN ARG 69 12.170 36.917 -16.549 311 HA ARG 69 HA ARG 69 9.411 36.134 -15.805 312 HB2 ARG 69 HB2 ARG 69 9.363 37.467 -17.891 313 HB3 ARG 69 HB1 ARG 69 10.487 36.326 -18.628 314 HG2 ARG 69 HG2 ARG 69 8.877 34.500 -18.308 315 HG3 ARG 69 HG1 ARG 69 7.755 35.613 -17.523 316 HD2 ARG 69 HD2 ARG 69 7.719 36.972 -19.619 317 HD3 ARG 69 HD1 ARG 69 8.726 35.749 -20.389 318 HE ARG 69 HE ARG 69 5.898 35.522 -19.756 319 HH11 ARG 69 HH21 ARG 69 8.877 33.921 -20.482 320 HH12 ARG 69 HH22 ARG 69 8.122 32.480 -21.074 321 HH21 ARG 69 HH11 ARG 69 4.896 33.633 -20.533 322 HH22 ARG 69 HH12 ARG 69 5.867 32.318 -21.103 323 H THR 70 HN THR 70 9.123 34.019 -15.515 324 HA THR 70 HA THR 70 11.345 32.247 -15.475 325 HB THR 70 HB THR 70 8.421 31.477 -15.451 326 HG1 THR 70 HG1 THR 70 8.862 31.642 -13.101 327 HG21 THR 70 HG21 THR 70 10.161 29.676 -15.656 328 HG22 THR 70 HG22 THR 70 9.205 29.570 -14.178 329 HG23 THR 70 HG23 THR 70 10.841 30.227 -14.125 330 H VAL 71 HN VAL 71 12.188 31.033 -17.047 331 HA VAL 71 HA VAL 71 10.546 30.402 -19.432 332 HB VAL 71 HB VAL 71 12.723 30.736 -20.748 333 HG11 VAL 71 HG11 VAL 71 11.270 33.073 -19.476 334 HG12 VAL 71 HG12 VAL 71 10.866 32.273 -20.994 335 HG13 VAL 71 HG13 VAL 71 12.349 33.219 -20.864 336 HG21 VAL 71 HG21 VAL 71 13.404 32.447 -18.332 337 HG22 VAL 71 HG22 VAL 71 14.383 32.192 -19.777 338 HG23 VAL 71 HG23 VAL 71 14.131 30.870 -18.644 339 H SER 72 HN SER 72 10.667 28.355 -20.094 340 HA SER 72 HA SER 72 12.127 26.447 -18.527 341 HB2 SER 72 HB2 SER 72 10.692 25.961 -21.134 342 HB3 SER 72 HB1 SER 72 11.083 24.778 -19.882 343 HG SER 72 HG SER 72 9.586 27.057 -19.218 344 H VAL 73 HN VAL 73 14.083 25.505 -18.948 345 HA VAL 73 HA VAL 73 15.813 26.623 -20.860 346 HB VAL 73 HB VAL 73 15.983 24.040 -19.303 347 HG11 VAL 73 HG11 VAL 73 18.467 24.320 -19.797 348 HG12 VAL 73 HG12 VAL 73 17.999 25.503 -21.018 349 HG13 VAL 73 HG13 VAL 73 17.475 23.824 -21.168 350 HG21 VAL 73 HG21 VAL 73 16.014 25.819 -17.754 351 HG22 VAL 73 HG22 VAL 73 16.913 26.874 -18.838 352 HG23 VAL 73 HG23 VAL 73 17.721 25.519 -18.051 353 H SER 74 HN SER 74 16.368 26.024 -22.893 354 HA SER 74 HA SER 74 14.574 24.432 -24.410 355 HB2 SER 74 HB2 SER 74 15.858 26.284 -25.394 356 HB3 SER 74 HB1 SER 74 17.354 25.397 -25.115 357 HG SER 74 HG SER 74 16.111 25.254 -27.258 358 H ASP 75 HN ASP 75 17.819 23.839 -23.113 359 HA ASP 75 HA ASP 75 17.386 20.945 -23.496 360 HB2 ASP 75 HB2 ASP 75 18.759 21.892 -25.377 361 HB3 ASP 75 HB1 ASP 75 19.992 22.294 -24.177 362 HA PRO 76 HA PRO 76 19.097 21.869 -19.319 363 HB2 PRO 76 HB2 PRO 76 17.233 20.481 -17.875 364 HB3 PRO 76 HB1 PRO 76 16.979 22.146 -18.419 365 HG2 PRO 76 HG2 PRO 76 15.848 19.621 -19.489 366 HG3 PRO 76 HG1 PRO 76 15.146 21.247 -19.460 367 HD2 PRO 76 HD2 PRO 76 16.368 20.014 -21.683 368 HD3 PRO 76 HD1 PRO 76 15.986 21.743 -21.538 369 H LYS 77 HN LYS 77 20.864 20.638 -18.947 370 HA LYS 77 HA LYS 77 20.664 17.699 -19.242 371 HB2 LYS 77 HB2 LYS 77 23.063 19.536 -19.177 372 HB3 LYS 77 HB1 LYS 77 23.135 17.780 -19.333 373 HG2 LYS 77 HG2 LYS 77 21.675 17.981 -21.381 374 HG3 LYS 77 HG1 LYS 77 21.860 19.731 -21.270 375 HD2 LYS 77 HD2 LYS 77 24.203 17.816 -21.426 376 HD3 LYS 77 HD1 LYS 77 23.495 18.596 -22.840 377 HE2 LYS 77 HE2 LYS 77 23.881 20.819 -21.593 378 HE3 LYS 77 HE1 LYS 77 24.915 19.891 -20.508 379 HZ1 LYS 77 HZ1 LYS 77 25.284 19.679 -23.414 380 HZ2 LYS 77 HZ2 LYS 77 26.408 19.438 -22.163 381 HZ3 LYS 77 HZ3 LYS 77 25.923 21.012 -22.581 382 H VAL 78 HN VAL 78 20.296 16.671 -17.400 383 HA VAL 78 HA VAL 78 21.942 17.255 -15.059 384 HB VAL 78 HB VAL 78 19.856 17.198 -13.597 385 HG11 VAL 78 HG11 VAL 78 19.504 19.584 -13.816 386 HG12 VAL 78 HG12 VAL 78 20.090 19.565 -15.478 387 HG13 VAL 78 HG13 VAL 78 21.207 19.259 -14.147 388 HG21 VAL 78 HG21 VAL 78 18.463 18.073 -16.138 389 HG22 VAL 78 HG22 VAL 78 17.740 17.652 -14.583 390 HG23 VAL 78 HG23 VAL 78 18.441 16.394 -15.603 391 H ILE 79 HN ILE 79 21.852 15.564 -13.461 392 HA ILE 79 HA ILE 79 20.961 12.972 -14.605 393 HB ILE 79 HB ILE 79 23.038 12.814 -12.506 394 HG12 ILE 79 HG12 ILE 79 23.660 14.275 -15.097 395 HG13 ILE 79 HG11 ILE 79 23.749 14.953 -13.472 396 HG21 ILE 79 HG21 ILE 79 24.006 11.258 -14.073 397 HG22 ILE 79 HG22 ILE 79 23.062 11.922 -15.402 398 HG23 ILE 79 HG23 ILE 79 22.261 11.027 -14.117 399 HD11 ILE 79 HD11 ILE 79 25.982 14.311 -14.116 400 HD12 ILE 79 HD12 ILE 79 25.438 12.702 -14.597 401 HD13 ILE 79 HD13 ILE 79 25.421 13.169 -12.894 402 H CYS 80 HN CYS 80 19.834 11.583 -13.354 403 HA CYS 80 HA CYS 80 18.217 12.542 -11.307 404 HB2 CYS 80 HB2 CYS 80 17.627 10.226 -10.873 405 HB3 CYS 80 HB1 CYS 80 17.775 10.477 -12.608 406 H ARG 81 HN ARG 81 18.138 11.606 -9.059 407 HA ARG 81 HA ARG 81 20.459 12.381 -7.628 408 HB2 ARG 81 HB2 ARG 81 17.981 10.881 -6.767 409 HB3 ARG 81 HB1 ARG 81 19.249 11.388 -5.650 410 HG2 ARG 81 HG2 ARG 81 18.927 13.726 -6.287 411 HG3 ARG 81 HG1 ARG 81 17.726 13.253 -7.487 412 HD2 ARG 81 HD2 ARG 81 16.592 14.019 -5.466 413 HD3 ARG 81 HD1 ARG 81 16.325 12.291 -5.674 414 HE ARG 81 HE ARG 81 18.615 12.721 -4.052 415 HH11 ARG 81 HH21 ARG 81 15.164 12.971 -4.067 416 HH12 ARG 81 HH22 ARG 81 15.000 12.719 -2.361 417 HH21 ARG 81 HH11 ARG 81 18.408 12.389 -1.815 418 HH22 ARG 81 HH12 ARG 81 16.837 12.390 -1.085 419 H THR 82 HN THR 82 19.194 9.249 -8.642 420 HA THR 82 HA THR 82 20.867 7.601 -7.099 421 HB THR 82 HB THR 82 20.192 5.839 -8.522 422 HG1 THR 82 HG1 THR 82 19.140 6.756 -10.626 423 HG21 THR 82 HG21 THR 82 18.002 7.884 -8.919 424 HG22 THR 82 HG22 THR 82 18.331 7.141 -7.354 425 HG23 THR 82 HG23 THR 82 17.833 6.139 -8.719 426 H CYS 83 HN CYS 83 21.502 9.548 -9.879 427 HA CYS 83 HA CYS 83 23.907 8.132 -10.660 428 HB2 CYS 83 HB2 CYS 83 22.375 10.485 -11.622 429 HB3 CYS 83 HB1 CYS 83 24.111 10.518 -11.934 430 H GLN 84 HN GLN 84 23.176 10.034 -8.081 431 HA GLN 84 HA GLN 84 24.991 12.002 -7.725 432 HB2 GLN 84 HB2 GLN 84 23.759 9.994 -5.947 433 HB3 GLN 84 HB1 GLN 84 25.278 10.628 -5.312 434 HG2 GLN 84 HG2 GLN 84 24.472 12.879 -5.439 435 HG3 GLN 84 HG1 GLN 84 23.029 12.372 -6.326 436 HE21 GLN 84 HE21 GLN 84 22.559 13.770 -4.011 437 HE22 GLN 84 HE22 GLN 84 22.015 12.734 -2.782 438 HA PRO 85 HA PRO 85 28.615 9.001 -6.626 439 HB2 PRO 85 HB2 PRO 85 28.239 6.350 -7.384 440 HB3 PRO 85 HB1 PRO 85 27.903 6.978 -5.756 441 HG2 PRO 85 HG2 PRO 85 26.012 6.508 -8.025 442 HG3 PRO 85 HG1 PRO 85 25.814 6.141 -6.301 443 HD2 PRO 85 HD2 PRO 85 24.659 8.283 -7.385 444 HD3 PRO 85 HD1 PRO 85 25.339 8.346 -5.746 445 H LYS 86 HN LYS 86 29.580 10.139 -8.318 446 HA LYS 86 HA LYS 86 29.887 8.621 -10.826 447 HB2 LYS 86 HB2 LYS 86 28.166 10.501 -11.046 448 HB3 LYS 86 HB1 LYS 86 29.510 11.615 -10.802 449 HG2 LYS 86 HG2 LYS 86 29.499 11.443 -13.134 450 HG3 LYS 86 HG1 LYS 86 30.668 10.194 -12.711 451 HD2 LYS 86 HD2 LYS 86 28.961 8.463 -12.906 452 HD3 LYS 86 HD1 LYS 86 27.712 9.677 -13.167 453 HE2 LYS 86 HE2 LYS 86 28.368 8.740 -15.305 454 HE3 LYS 86 HE1 LYS 86 28.916 10.414 -15.217 455 HZ1 LYS 86 HZ1 LYS 86 30.865 8.666 -14.137 456 HZ2 LYS 86 HZ2 LYS 86 31.006 9.760 -15.428 457 HZ3 LYS 86 HZ3 LYS 86 30.457 8.177 -15.709 458 H GLN 87 HN GLN 87 31.972 8.148 -10.911 459 HA GLN 87 HA GLN 87 34.253 8.298 -10.492 460 HB2 GLN 87 HB2 GLN 87 33.583 10.893 -11.895 461 HB3 GLN 87 HB1 GLN 87 35.233 10.312 -11.644 462 HG2 GLN 87 HG2 GLN 87 34.700 8.242 -12.867 463 HG3 GLN 87 HG1 GLN 87 33.046 8.804 -13.106 464 HE21 GLN 87 HE21 GLN 87 32.663 10.383 -14.759 465 HE22 GLN 87 HE22 GLN 87 33.885 10.933 -15.800 466 H HIS 88 HN HIS 88 34.001 8.397 -8.146 467 HA HIS 88 HA HIS 88 34.195 11.056 -6.916 468 HB2 HIS 88 HB2 HIS 88 33.770 8.253 -5.889 469 HB3 HIS 88 HB1 HIS 88 34.285 9.532 -4.783 470 HD2 HIS 88 HD2 HIS 88 31.598 9.364 -3.644 471 HE1 HIS 88 HE1 HIS 88 29.782 11.301 -6.925 472 HE2 HIS 88 HE2 HIS 88 29.434 10.526 -4.531 473 H ASP 89 HN ASP 89 35.796 11.009 -4.938 474 HA ASP 89 HA ASP 89 37.977 11.084 -4.233 475 HB2 ASP 89 HB2 ASP 89 37.698 8.552 -4.591 476 HB3 ASP 89 HB1 ASP 89 38.565 8.793 -6.106 477 H SER 90 HN SER 90 36.976 11.716 -7.293 478 HA SER 90 HA SER 90 39.593 12.901 -8.042 479 HB2 SER 90 HB2 SER 90 39.354 11.037 -9.508 480 HB3 SER 90 HB1 SER 90 37.644 11.385 -9.782 481 HG SER 90 HG SER 90 38.496 12.370 -11.463 482 H ILE 91 HN ILE 91 39.528 14.925 -8.948 483 HA ILE 91 HA ILE 91 36.861 16.243 -9.036 484 HB ILE 91 HB ILE 91 39.538 17.448 -8.285 485 HG12 ILE 91 HG12 ILE 91 37.109 17.001 -6.528 486 HG13 ILE 91 HG11 ILE 91 38.425 15.827 -6.639 487 HG21 ILE 91 HG21 ILE 91 37.981 19.348 -7.574 488 HG22 ILE 91 HG22 ILE 91 36.715 18.528 -8.488 489 HG23 ILE 91 HG23 ILE 91 38.155 19.119 -9.316 490 HD11 ILE 91 HD11 ILE 91 38.702 17.428 -4.735 491 HD12 ILE 91 HD12 ILE 91 38.802 18.738 -5.909 492 HD13 ILE 91 HD13 ILE 91 40.033 17.483 -5.888 493 H TRP 92 HN TRP 92 36.330 17.267 -10.855 494 HA TRP 92 HA TRP 92 38.108 17.070 -13.135 495 HB2 TRP 92 HB2 TRP 92 35.822 16.595 -13.611 496 HB3 TRP 92 HB1 TRP 92 35.270 18.052 -12.778 497 HD1 TRP 92 HD1 TRP 92 38.217 18.053 -15.212 498 HE1 TRP 92 HE1 TRP 92 37.639 19.539 -17.228 499 HE3 TRP 92 HE3 TRP 92 33.321 19.032 -14.172 500 HZ2 TRP 92 HZ2 TRP 92 35.372 20.947 -18.274 501 HZ3 TRP 92 HZ3 TRP 92 31.974 20.447 -15.695 502 HH2 TRP 92 HH2 TRP 92 32.992 21.405 -17.743 503 H CYS 93 HN CYS 93 39.644 18.558 -13.448 504 HA CYS 93 HA CYS 93 39.325 21.273 -12.390 505 HB2 CYS 93 HB2 CYS 93 41.467 20.218 -12.017 506 HB3 CYS 93 HB1 CYS 93 41.639 19.866 -13.738 507 H THR 94 HN THR 94 38.876 23.018 -13.608 508 HA THR 94 HA THR 94 38.331 22.615 -16.461 509 HB THR 94 HB THR 94 37.016 24.531 -16.351 510 HG1 THR 94 HG1 THR 94 37.447 25.862 -14.258 511 HG21 THR 94 HG21 THR 94 35.647 24.312 -14.400 512 HG22 THR 94 HG22 THR 94 36.992 23.680 -13.450 513 HG23 THR 94 HG23 THR 94 36.287 22.703 -14.740 514 H ALA 95 HN ALA 95 40.768 23.903 -14.418 515 HA ALA 95 HA ALA 95 41.839 25.790 -16.321 516 HB1 ALA 95 HB1 ALA 95 43.052 24.611 -13.811 517 HB2 ALA 95 HB2 ALA 95 42.168 26.134 -13.920 518 HB3 ALA 95 HB3 ALA 95 43.720 25.955 -14.737 519 H CYS 96 HN CYS 96 42.555 22.476 -15.306 520 HA CYS 96 HA CYS 96 44.758 22.295 -17.238 521 HB2 CYS 96 HB2 CYS 96 43.735 20.294 -15.204 522 HB3 CYS 96 HB1 CYS 96 45.174 20.103 -16.211 523 H GLN 97 HN GLN 97 41.457 21.293 -16.750 524 HA GLN 97 HA GLN 97 39.959 20.309 -18.171 525 HB2 GLN 97 HB2 GLN 97 41.577 21.672 -19.871 526 HB3 GLN 97 HB1 GLN 97 41.893 20.034 -20.435 527 HG2 GLN 97 HG2 GLN 97 39.168 21.342 -20.165 528 HG3 GLN 97 HG1 GLN 97 40.009 20.988 -21.674 529 HE21 GLN 97 HE21 GLN 97 39.859 18.846 -22.499 530 HE22 GLN 97 HE22 GLN 97 39.006 17.604 -21.719 531 H GLN 98 HN GLN 98 41.807 18.799 -16.486 532 HA GLN 98 HA GLN 98 41.503 16.193 -17.817 533 HB2 GLN 98 HB2 GLN 98 44.062 17.250 -16.596 534 HB3 GLN 98 HB1 GLN 98 43.776 15.542 -16.930 535 HG2 GLN 98 HG2 GLN 98 43.412 16.051 -19.308 536 HG3 GLN 98 HG1 GLN 98 43.660 17.766 -18.987 537 HE21 GLN 98 HE21 GLN 98 45.260 14.959 -19.976 538 HE22 GLN 98 HE22 GLN 98 46.852 15.455 -19.659 539 H THR 99 HN THR 99 41.627 14.390 -16.310 540 HA THR 99 HA THR 99 40.188 14.979 -13.889 541 HB THR 99 HB THR 99 41.381 12.327 -14.715 542 HG1 THR 99 HG1 THR 99 39.926 12.261 -16.206 543 HG21 THR 99 HG21 THR 99 39.010 13.109 -13.001 544 HG22 THR 99 HG22 THR 99 40.544 12.465 -12.414 545 HG23 THR 99 HG23 THR 99 39.480 11.453 -13.393 546 H LYS 100 HN LYS 100 40.941 15.127 -11.848 547 HA LYS 100 HA LYS 100 43.718 14.282 -11.298 548 HB2 LYS 100 HB2 LYS 100 43.250 16.875 -11.759 549 HB3 LYS 100 HB1 LYS 100 42.710 16.828 -10.088 550 HG2 LYS 100 HG2 LYS 100 44.979 17.276 -9.768 551 HG3 LYS 100 HG1 LYS 100 44.997 15.512 -9.709 552 HD2 LYS 100 HD2 LYS 100 45.559 15.437 -12.119 553 HD3 LYS 100 HD1 LYS 100 45.550 17.200 -12.171 554 HE2 LYS 100 HE2 LYS 100 47.359 17.243 -10.484 555 HE3 LYS 100 HE1 LYS 100 47.384 15.481 -10.485 556 HZ1 LYS 100 HZ1 LYS 100 48.994 15.918 -12.010 557 HZ2 LYS 100 HZ2 LYS 100 48.262 17.351 -12.556 558 HZ3 LYS 100 HZ3 LYS 100 47.648 15.842 -13.040 559 H GLY 101 HN GLY 101 44.072 13.477 -9.277 560 HA2 GLY 101 HA2 GLY 101 41.868 12.469 -7.823 561 HA3 GLY 101 HA1 GLY 101 43.546 12.452 -7.284 562 H ILE 102 HN ILE 102 41.626 12.842 -5.427 563 HA ILE 102 HA ILE 102 41.143 15.652 -4.967 564 HB ILE 102 HB ILE 102 40.219 14.846 -2.789 565 HG12 ILE 102 HG12 ILE 102 40.704 12.091 -3.944 566 HG13 ILE 102 HG11 ILE 102 41.780 12.820 -2.747 567 HG21 ILE 102 HG21 ILE 102 38.598 15.061 -4.464 568 HG22 ILE 102 HG22 ILE 102 38.411 13.374 -3.998 569 HG23 ILE 102 HG23 ILE 102 39.304 13.790 -5.461 570 HD11 ILE 102 HD11 ILE 102 40.121 11.419 -1.617 571 HD12 ILE 102 HD12 ILE 102 38.812 12.300 -2.405 572 HD13 ILE 102 HD13 ILE 102 39.835 13.114 -1.223 573 H ASN 103 HN ASN 103 43.561 13.330 -4.134 574 HA ASN 103 HA ASN 103 44.571 14.388 -1.758 575 HB2 ASN 103 HB2 ASN 103 46.769 13.387 -2.560 576 HB3 ASN 103 HB1 ASN 103 45.398 12.281 -2.499 577 HD21 ASN 103 HD21 ASN 103 47.130 11.263 -4.178 578 HD22 ASN 103 HD22 ASN 103 46.811 11.640 -5.813 579 H GLU 104 HN GLU 104 45.291 15.259 -5.119 580 HA GLU 104 HA GLU 104 47.165 17.330 -4.289 581 HB2 GLU 104 HB2 GLU 104 46.136 16.479 -6.997 582 HB3 GLU 104 HB1 GLU 104 47.311 17.770 -6.745 583 HG2 GLU 104 HG2 GLU 104 48.815 16.173 -5.603 584 HG3 GLU 104 HG1 GLU 104 47.646 14.881 -5.883 585 H PHE 105 HN PHE 105 44.325 17.499 -3.484 586 HA PHE 105 HA PHE 105 43.761 20.176 -4.620 587 HB2 PHE 105 HB2 PHE 105 42.030 17.765 -4.554 588 HB3 PHE 105 HB1 PHE 105 41.239 19.250 -4.024 589 HD1 PHE 105 HD1 PHE 105 43.533 18.041 -6.765 590 HD2 PHE 105 HD2 PHE 105 40.274 20.609 -5.648 591 HE1 PHE 105 HE1 PHE 105 43.299 18.770 -9.101 592 HE2 PHE 105 HE2 PHE 105 40.058 21.335 -8.000 593 HZ PHE 105 HZ PHE 105 41.561 20.414 -9.724 594 H SER 106 HN SER 106 43.007 21.680 -3.242 595 HA SER 106 HA SER 106 43.466 21.186 -0.418 596 HB2 SER 106 HB2 SER 106 42.795 23.623 -2.045 597 HB3 SER 106 HB1 SER 106 42.737 23.664 -0.282 598 HG SER 106 HG SER 106 44.928 22.737 -0.427 599 H LYS 107 HN LYS 107 41.799 22.269 1.118 600 HA LYS 107 HA LYS 107 39.433 20.742 1.043 601 HB2 LYS 107 HB2 LYS 107 40.163 23.187 2.663 602 HB3 LYS 107 HB1 LYS 107 38.708 22.226 2.929 603 HG2 LYS 107 HG2 LYS 107 40.093 20.220 3.316 604 HG3 LYS 107 HG1 LYS 107 41.553 21.179 3.045 605 HD2 LYS 107 HD2 LYS 107 40.966 22.621 4.959 606 HD3 LYS 107 HD1 LYS 107 39.507 21.668 5.231 607 HE2 LYS 107 HE2 LYS 107 40.875 19.663 5.632 608 HE3 LYS 107 HE1 LYS 107 42.341 20.594 5.333 609 HZ1 LYS 107 HZ1 LYS 107 41.917 21.938 7.223 610 HZ2 LYS 107 HZ2 LYS 107 41.745 20.322 7.720 611 HZ3 LYS 107 HZ3 LYS 107 40.370 21.279 7.439 612 H ALA 108 HN ALA 108 40.142 24.052 0.060 613 HA ALA 108 HA ALA 108 37.351 24.643 -0.515 614 HB1 ALA 108 HB1 ALA 108 38.207 26.806 -1.278 615 HB2 ALA 108 HB2 ALA 108 39.864 26.213 -1.135 616 HB3 ALA 108 HB3 ALA 108 38.865 26.403 0.307 617 H GLN 109 HN GLN 109 40.330 24.164 -2.367 618 HA GLN 109 HA GLN 109 39.445 24.551 -4.932 619 HB2 GLN 109 HB2 GLN 109 41.416 22.528 -3.865 620 HB3 GLN 109 HB1 GLN 109 41.134 22.780 -5.593 621 HG2 GLN 109 HG2 GLN 109 41.807 25.087 -5.445 622 HG3 GLN 109 HG1 GLN 109 41.887 25.007 -3.684 623 HE21 GLN 109 HE21 GLN 109 43.219 22.982 -6.378 624 HE22 GLN 109 HE22 GLN 109 44.796 22.944 -5.750 625 H ARG 110 HN ARG 110 38.765 21.882 -2.796 626 HA ARG 110 HA ARG 110 37.473 20.341 -4.932 627 HB2 ARG 110 HB2 ARG 110 37.255 18.578 -3.287 628 HB3 ARG 110 HB1 ARG 110 38.904 19.199 -3.224 629 HG2 ARG 110 HG2 ARG 110 38.263 20.646 -1.324 630 HG3 ARG 110 HG1 ARG 110 36.647 19.944 -1.334 631 HD2 ARG 110 HD2 ARG 110 37.652 17.704 -0.976 632 HD3 ARG 110 HD1 ARG 110 39.245 18.458 -0.876 633 HE ARG 110 HE ARG 110 37.343 19.600 0.970 634 HH11 ARG 110 HH21 ARG 110 39.568 17.020 0.363 635 HH12 ARG 110 HH22 ARG 110 39.865 16.697 2.039 636 HH21 ARG 110 HH11 ARG 110 37.729 19.182 3.170 637 HH22 ARG 110 HH12 ARG 110 38.823 17.920 3.629 638 H HIS 111 HN HIS 111 36.692 22.744 -2.698 639 HA HIS 111 HA HIS 111 33.803 22.067 -2.889 640 HB2 HIS 111 HB2 HIS 111 34.734 21.778 -0.576 641 HB3 HIS 111 HB1 HIS 111 35.150 23.496 -0.582 642 HD2 HIS 111 HD2 HIS 111 33.014 25.191 0.005 643 HE1 HIS 111 HE1 HIS 111 29.949 22.293 -0.153 644 HE2 HIS 111 HE2 HIS 111 30.479 24.713 0.403 645 H VAL 112 HN VAL 112 35.819 23.862 -4.409 646 HA VAL 112 HA VAL 112 34.563 26.484 -3.974 647 HB VAL 112 HB VAL 112 37.032 26.348 -4.127 648 HG11 VAL 112 HG11 VAL 112 36.490 25.458 -6.973 649 HG12 VAL 112 HG12 VAL 112 37.127 24.441 -5.690 650 HG13 VAL 112 HG13 VAL 112 38.068 25.807 -6.280 651 HG21 VAL 112 HG21 VAL 112 35.978 27.702 -6.596 652 HG22 VAL 112 HG22 VAL 112 37.276 28.221 -5.521 653 HG23 VAL 112 HG23 VAL 112 35.600 28.311 -4.984 654 H LEU 113 HN LEU 113 33.908 27.716 -5.890 655 HA LEU 113 HA LEU 113 32.026 26.309 -7.444 656 HB2 LEU 113 HB2 LEU 113 33.200 29.077 -7.579 657 HB3 LEU 113 HB1 LEU 113 32.072 28.523 -8.819 658 HG LEU 113 HG LEU 113 31.348 28.177 -5.907 659 HD11 LEU 113 HD11 LEU 113 31.884 30.484 -5.894 660 HD12 LEU 113 HD12 LEU 113 30.144 30.433 -6.171 661 HD13 LEU 113 HD13 LEU 113 31.243 30.729 -7.518 662 HD21 LEU 113 HD21 LEU 113 29.911 27.133 -7.608 663 HD22 LEU 113 HD22 LEU 113 29.773 28.667 -8.463 664 HD23 LEU 113 HD23 LEU 113 29.058 28.482 -6.864 665 H ASP 114 HN ASP 114 35.287 27.408 -8.141 666 HA ASP 114 HA ASP 114 35.224 25.856 -10.669 667 HB2 ASP 114 HB2 ASP 114 36.894 28.314 -10.169 668 HB3 ASP 114 HB1 ASP 114 36.669 27.446 -11.685 669 HA PRO 115 HA PRO 115 38.277 23.914 -7.715 670 HB2 PRO 115 HB2 PRO 115 37.692 21.714 -9.663 671 HB3 PRO 115 HB1 PRO 115 37.793 21.650 -7.894 672 HG2 PRO 115 HG2 PRO 115 35.447 21.576 -9.154 673 HG3 PRO 115 HG1 PRO 115 35.644 22.420 -7.604 674 HD2 PRO 115 HD2 PRO 115 35.369 23.574 -10.345 675 HD3 PRO 115 HD1 PRO 115 34.838 24.227 -8.789 676 H ARG 116 HN ARG 116 40.403 24.097 -8.042 677 HA ARG 116 HA ARG 116 41.534 23.522 -10.697 678 HB2 ARG 116 HB2 ARG 116 42.640 25.976 -9.412 679 HB3 ARG 116 HB1 ARG 116 42.357 25.624 -11.121 680 HG2 ARG 116 HG2 ARG 116 39.921 25.944 -10.744 681 HG3 ARG 116 HG1 ARG 116 40.275 26.360 -9.065 682 HD2 ARG 116 HD2 ARG 116 40.026 28.388 -10.372 683 HD3 ARG 116 HD1 ARG 116 41.701 28.219 -9.845 684 HE ARG 116 HE ARG 116 41.403 27.026 -12.391 685 HH11 ARG 116 HH21 ARG 116 41.353 30.099 -10.805 686 HH12 ARG 116 HH22 ARG 116 41.912 30.978 -12.189 687 HH21 ARG 116 HH11 ARG 116 42.138 28.169 -14.210 688 HH22 ARG 116 HH12 ARG 116 42.357 29.884 -14.118 689 H CYS 117 HN CYS 117 43.097 22.093 -10.372 690 HA CYS 117 HA CYS 117 44.165 21.214 -8.031 691 HB2 CYS 117 HB2 CYS 117 46.091 21.476 -10.312 692 HB3 CYS 117 HB1 CYS 117 45.722 20.069 -9.308 693 H GLN 118 HN GLN 118 46.164 21.559 -6.922 694 HA GLN 118 HA GLN 118 46.654 24.259 -6.287 695 HB2 GLN 118 HB2 GLN 118 48.221 21.745 -5.722 696 HB3 GLN 118 HB1 GLN 118 48.681 23.330 -5.090 697 HG2 GLN 118 HG2 GLN 118 46.508 23.551 -3.986 698 HG3 GLN 118 HG1 GLN 118 45.985 22.007 -4.660 699 HE21 GLN 118 HE21 GLN 118 45.797 21.839 -2.048 700 HE22 GLN 118 HE22 GLN 118 47.138 21.108 -1.309 701 H ILE 119 HN ILE 119 47.622 22.472 -8.954 702 HA ILE 119 HA ILE 119 50.169 23.840 -9.358 703 HB ILE 119 HB ILE 119 48.636 21.887 -11.088 704 HG12 ILE 119 HG12 ILE 119 51.184 21.503 -9.489 705 HG13 ILE 119 HG11 ILE 119 49.585 21.069 -8.879 706 HG21 ILE 119 HG21 ILE 119 51.361 23.177 -11.374 707 HG22 ILE 119 HG22 ILE 119 50.023 23.233 -12.522 708 HG23 ILE 119 HG23 ILE 119 50.892 21.723 -12.251 709 HD11 ILE 119 HD11 ILE 119 50.966 19.950 -11.334 710 HD12 ILE 119 HD12 ILE 119 49.279 19.635 -10.931 711 HD13 ILE 119 HD13 ILE 119 50.561 19.083 -9.853 712 H CYS 120 HN CYS 120 46.849 24.082 -10.375 713 HA CYS 120 HA CYS 120 47.434 25.867 -12.594 714 HB2 CYS 120 HB2 CYS 120 44.650 25.988 -11.982 715 HB3 CYS 120 HB1 CYS 120 45.418 25.051 -13.267 716 H VAL 121 HN VAL 121 46.618 26.099 -9.229 717 HA VAL 121 HA VAL 121 45.777 28.862 -9.354 718 HB VAL 121 HB VAL 121 45.631 28.732 -6.950 719 HG11 VAL 121 HG11 VAL 121 44.764 26.175 -8.330 720 HG12 VAL 121 HG12 VAL 121 43.812 27.642 -8.124 721 HG13 VAL 121 HG13 VAL 121 44.224 26.653 -6.722 722 HG21 VAL 121 HG21 VAL 121 47.285 26.235 -7.337 723 HG22 VAL 121 HG22 VAL 121 46.371 26.527 -5.857 724 HG23 VAL 121 HG23 VAL 121 47.656 27.638 -6.337 725 H HIS 122 HN HIS 122 48.745 27.111 -8.919 726 HA HIS 122 HA HIS 122 50.190 29.421 -7.880 727 HB2 HIS 122 HB2 HIS 122 51.062 26.632 -8.663 728 HB3 HIS 122 HB1 HIS 122 52.167 27.875 -8.064 729 HD2 HIS 122 HD2 HIS 122 51.207 25.073 -6.291 730 HE1 HIS 122 HE1 HIS 122 49.565 28.001 -3.731 731 HE2 HIS 122 HE2 HIS 122 50.274 25.568 -3.903 732 H SER 123 HN SER 123 49.013 28.696 -10.820 733 HA SER 123 HA SER 123 51.399 29.487 -12.358 734 HB2 SER 123 HB2 SER 123 48.698 28.392 -13.126 735 HB3 SER 123 HB1 SER 123 49.806 29.069 -14.317 736 HG SER 123 HG SER 123 49.932 26.711 -12.890 737 H GLN 124 HN GLN 124 48.124 30.570 -11.556 738 HA GLN 124 HA GLN 124 48.888 33.299 -12.359 739 HB2 GLN 124 HB2 GLN 124 47.593 32.034 -14.219 740 HB3 GLN 124 HB1 GLN 124 46.195 32.196 -13.156 741 HG2 GLN 124 HG2 GLN 124 46.566 34.658 -13.084 742 HG3 GLN 124 HG1 GLN 124 47.915 34.466 -14.200 743 HE21 GLN 124 HE21 GLN 124 47.332 34.869 -16.322 744 HE22 GLN 124 HE22 GLN 124 45.792 34.589 -16.980 745 H ARG 125 HN ARG 125 48.689 32.167 -9.774 746 HA ARG 125 HA ARG 125 47.715 32.526 -7.720 747 HB2 ARG 125 HB2 ARG 125 46.879 35.017 -9.218 748 HB3 ARG 125 HB1 ARG 125 46.588 34.784 -7.490 749 HG2 ARG 125 HG2 ARG 125 48.991 34.491 -7.101 750 HG3 ARG 125 HG1 ARG 125 49.306 34.655 -8.829 751 HD2 ARG 125 HD2 ARG 125 48.408 36.938 -8.796 752 HD3 ARG 125 HD1 ARG 125 48.030 36.780 -7.084 753 HE ARG 125 HE ARG 125 50.306 37.035 -6.589 754 HH11 ARG 125 HH21 ARG 125 49.745 36.650 -9.980 755 HH12 ARG 125 HH22 ARG 125 51.353 37.108 -10.439 756 HH21 ARG 125 HH11 ARG 125 52.415 37.634 -7.180 757 HH22 ARG 125 HH12 ARG 125 52.865 37.664 -8.852 758 H ASN 126 HN ASN 126 45.121 34.289 -9.257 759 HA ASN 126 HA ASN 126 43.305 31.991 -9.165 760 HB2 ASN 126 HB2 ASN 126 42.990 34.455 -7.440 761 HB3 ASN 126 HB1 ASN 126 41.673 33.336 -7.786 762 HD21 ASN 126 HD21 ASN 126 43.277 30.896 -7.729 763 HD22 ASN 126 HD22 ASN 126 43.752 30.649 -6.119 Start of MODEL 8 1 H MET 31 HT1 MET 31 -2.111 19.166 -20.541 2 HA MET 31 HA MET 31 -0.895 18.598 -18.657 3 HB2 MET 31 HB2 MET 31 0.706 17.928 -21.143 4 HB3 MET 31 HB1 MET 31 0.946 17.156 -19.570 5 HG2 MET 31 HG2 MET 31 -1.418 16.414 -19.583 6 HG3 MET 31 HG1 MET 31 -1.632 17.153 -21.170 7 HE1 MET 31 HE1 MET 31 0.318 16.685 -23.063 8 HE2 MET 31 HE2 MET 31 -1.298 16.026 -23.289 9 HE3 MET 31 HE3 MET 31 0.110 15.032 -23.654 10 H GLY 32 HN GLY 32 1.373 18.460 -17.679 11 HA2 GLY 32 HA2 GLY 32 3.307 19.468 -16.924 12 HA3 GLY 32 HA1 GLY 32 3.326 20.420 -18.406 13 H LYS 33 HN LYS 33 3.112 22.539 -18.126 14 HA LYS 33 HA LYS 33 2.406 24.563 -17.315 15 HB2 LYS 33 HB2 LYS 33 0.166 23.205 -17.136 16 HB3 LYS 33 HB1 LYS 33 0.509 23.197 -15.406 17 HG2 LYS 33 HG2 LYS 33 0.623 25.630 -15.369 18 HG3 LYS 33 HG1 LYS 33 0.395 25.698 -17.117 19 HD2 LYS 33 HD2 LYS 33 -1.813 24.599 -16.857 20 HD3 LYS 33 HD1 LYS 33 -1.593 24.613 -15.107 21 HE2 LYS 33 HE2 LYS 33 -1.433 27.071 -15.134 22 HE3 LYS 33 HE1 LYS 33 -1.640 27.066 -16.885 23 HZ1 LYS 33 HZ1 LYS 33 -3.600 26.647 -14.789 24 HZ2 LYS 33 HZ2 LYS 33 -3.737 25.616 -16.133 25 HZ3 LYS 33 HZ3 LYS 33 -3.791 27.302 -16.341 26 H ASN 34 HN ASN 34 2.711 22.015 -14.863 27 HA ASN 34 HA ASN 34 3.832 23.951 -12.953 28 HB2 ASN 34 HB2 ASN 34 2.084 22.197 -12.315 29 HB3 ASN 34 HB1 ASN 34 3.376 21.006 -12.492 30 HD21 ASN 34 HD21 ASN 34 4.913 23.789 -11.526 31 HD22 ASN 34 HD22 ASN 34 4.902 23.547 -9.847 32 H ASP 35 HN ASP 35 5.916 24.375 -13.410 33 HA ASP 35 HA ASP 35 7.725 22.520 -14.579 34 HB2 ASP 35 HB2 ASP 35 7.987 25.195 -13.220 35 HB3 ASP 35 HB1 ASP 35 9.444 24.260 -13.586 36 H ASN 36 HN ASN 36 6.954 23.377 -11.259 37 HA ASN 36 HA ASN 36 9.140 22.103 -10.010 38 HB2 ASN 36 HB2 ASN 36 6.334 22.710 -9.062 39 HB3 ASN 36 HB1 ASN 36 7.573 22.008 -8.015 40 HD21 ASN 36 HD21 ASN 36 6.445 24.612 -7.513 41 HD22 ASN 36 HD22 ASN 36 7.673 25.763 -7.734 42 H ASP 37 HN ASP 37 5.930 20.922 -10.941 43 HA ASP 37 HA ASP 37 6.662 18.202 -10.063 44 HB2 ASP 37 HB2 ASP 37 4.047 19.445 -10.918 45 HB3 ASP 37 HB1 ASP 37 4.249 17.722 -10.624 46 H ALA 38 HN ALA 38 7.957 19.389 -12.366 47 HA ALA 38 HA ALA 38 6.750 18.235 -14.715 48 HB1 ALA 38 HB1 ALA 38 9.292 19.724 -14.166 49 HB2 ALA 38 HB2 ALA 38 7.948 20.180 -15.207 50 HB3 ALA 38 HB3 ALA 38 9.054 18.904 -15.709 51 H LEU 39 HN LEU 39 8.473 16.967 -16.158 52 HA LEU 39 HA LEU 39 9.828 14.929 -14.520 53 HB2 LEU 39 HB2 LEU 39 7.805 14.422 -16.690 54 HB3 LEU 39 HB1 LEU 39 8.927 13.197 -16.131 55 HG LEU 39 HG LEU 39 7.137 14.715 -14.215 56 HD11 LEU 39 HD11 LEU 39 6.577 12.182 -15.767 57 HD12 LEU 39 HD12 LEU 39 5.601 13.650 -15.719 58 HD13 LEU 39 HD13 LEU 39 5.710 12.614 -14.295 59 HD21 LEU 39 HD21 LEU 39 7.527 12.411 -13.009 60 HD22 LEU 39 HD22 LEU 39 8.784 13.628 -12.972 61 HD23 LEU 39 HD23 LEU 39 8.904 12.276 -14.091 62 H ILE 40 HN ILE 40 11.842 15.637 -15.094 63 HA ILE 40 HA ILE 40 12.521 16.005 -17.908 64 HB ILE 40 HB ILE 40 14.283 16.132 -15.446 65 HG12 ILE 40 HG12 ILE 40 12.490 17.813 -15.368 66 HG13 ILE 40 HG11 ILE 40 14.033 18.594 -15.718 67 HG21 ILE 40 HG21 ILE 40 14.667 17.000 -18.324 68 HG22 ILE 40 HG22 ILE 40 15.590 15.772 -17.458 69 HG23 ILE 40 HG23 ILE 40 15.742 17.470 -17.007 70 HD11 ILE 40 HD11 ILE 40 11.688 18.125 -17.526 71 HD12 ILE 40 HD12 ILE 40 13.291 18.217 -18.242 72 HD13 ILE 40 HD13 ILE 40 12.664 19.571 -17.327 73 H MET 41 HN MET 41 13.700 14.665 -19.149 74 HA MET 41 HA MET 41 13.884 11.910 -18.319 75 HB2 MET 41 HB2 MET 41 13.324 12.675 -20.657 76 HB3 MET 41 HB1 MET 41 15.010 13.163 -20.827 77 HG2 MET 41 HG2 MET 41 15.772 10.893 -20.441 78 HG3 MET 41 HG1 MET 41 14.128 10.364 -20.072 79 HE1 MET 41 HE1 MET 41 14.316 8.362 -22.108 80 HE2 MET 41 HE2 MET 41 15.941 8.980 -21.835 81 HE3 MET 41 HE3 MET 41 15.348 8.791 -23.480 82 H CYS 42 HN CYS 42 15.681 10.728 -17.818 83 HA CYS 42 HA CYS 42 18.026 12.237 -16.967 84 HB2 CYS 42 HB2 CYS 42 16.921 10.277 -15.714 85 HB3 CYS 42 HB1 CYS 42 17.727 9.237 -16.895 86 H MET 43 HN MET 43 20.031 12.220 -17.888 87 HA MET 43 HA MET 43 20.188 11.323 -20.652 88 HB2 MET 43 HB2 MET 43 22.631 12.182 -20.330 89 HB3 MET 43 HB1 MET 43 21.312 13.350 -20.284 90 HG2 MET 43 HG2 MET 43 21.328 13.409 -17.882 91 HG3 MET 43 HG1 MET 43 22.421 12.021 -17.800 92 HE1 MET 43 HE1 MET 43 24.637 13.257 -16.431 93 HE2 MET 43 HE2 MET 43 23.024 13.890 -16.106 94 HE3 MET 43 HE3 MET 43 24.359 15.003 -16.390 95 H ARG 44 HN ARG 44 20.537 9.743 -17.777 96 HA ARG 44 HA ARG 44 22.540 7.858 -18.886 97 HB2 ARG 44 HB2 ARG 44 21.873 8.594 -16.040 98 HB3 ARG 44 HB1 ARG 44 22.824 7.169 -16.462 99 HG2 ARG 44 HG2 ARG 44 24.289 8.851 -17.828 100 HG3 ARG 44 HG1 ARG 44 23.494 10.090 -16.852 101 HD2 ARG 44 HD2 ARG 44 25.526 9.489 -15.730 102 HD3 ARG 44 HD1 ARG 44 24.193 8.779 -14.820 103 HE ARG 44 HE ARG 44 25.110 6.894 -16.703 104 HH11 ARG 44 HH21 ARG 44 26.073 8.529 -13.810 105 HH12 ARG 44 HH22 ARG 44 27.096 7.244 -13.260 106 HH21 ARG 44 HH11 ARG 44 26.450 5.205 -15.988 107 HH22 ARG 44 HH12 ARG 44 27.309 5.363 -14.493 108 H CYS 45 HN CYS 45 20.442 7.296 -16.149 109 HA CYS 45 HA CYS 45 19.661 4.746 -17.116 110 HB2 CYS 45 HB2 CYS 45 18.293 4.597 -15.155 111 HB3 CYS 45 HB1 CYS 45 19.774 5.432 -14.701 112 H ARG 46 HN ARG 46 18.838 7.560 -18.402 113 HA ARG 46 HA ARG 46 16.930 8.436 -19.416 114 HB2 ARG 46 HB2 ARG 46 16.982 5.550 -20.281 115 HB3 ARG 46 HB1 ARG 46 15.991 6.794 -21.051 116 HG2 ARG 46 HG2 ARG 46 18.067 8.111 -21.498 117 HG3 ARG 46 HG1 ARG 46 19.015 6.794 -20.820 118 HD2 ARG 46 HD2 ARG 46 17.119 6.483 -23.157 119 HD3 ARG 46 HD1 ARG 46 18.857 6.727 -23.319 120 HE ARG 46 HE ARG 46 17.538 4.276 -22.616 121 HH11 ARG 46 HH21 ARG 46 20.366 6.212 -22.139 122 HH12 ARG 46 HH22 ARG 46 21.392 4.867 -21.768 123 HH21 ARG 46 HH11 ARG 46 18.878 2.507 -22.133 124 HH22 ARG 46 HH12 ARG 46 20.550 2.770 -21.764 125 H LYS 47 HN LYS 47 16.273 8.014 -16.803 126 HA LYS 47 HA LYS 47 13.583 6.767 -16.954 127 HB2 LYS 47 HB2 LYS 47 15.320 5.784 -15.349 128 HB3 LYS 47 HB1 LYS 47 15.143 7.273 -14.425 129 HG2 LYS 47 HG2 LYS 47 12.779 6.887 -14.110 130 HG3 LYS 47 HG1 LYS 47 12.806 5.504 -15.202 131 HD2 LYS 47 HD2 LYS 47 14.664 5.471 -12.838 132 HD3 LYS 47 HD1 LYS 47 12.951 5.162 -12.559 133 HE2 LYS 47 HE2 LYS 47 12.970 3.336 -14.169 134 HE3 LYS 47 HE1 LYS 47 14.640 3.690 -14.603 135 HZ1 LYS 47 HZ1 LYS 47 15.425 2.903 -12.620 136 HZ2 LYS 47 HZ2 LYS 47 14.113 1.854 -12.878 137 HZ3 LYS 47 HZ3 LYS 47 13.963 3.158 -11.797 138 H VAL 48 HN VAL 48 11.940 8.111 -16.864 139 HA VAL 48 HA VAL 48 12.254 10.916 -16.486 140 HB VAL 48 HB VAL 48 9.571 10.589 -16.221 141 HG11 VAL 48 HG11 VAL 48 10.522 11.811 -18.043 142 HG12 VAL 48 HG12 VAL 48 9.524 10.546 -18.761 143 HG13 VAL 48 HG13 VAL 48 11.278 10.363 -18.707 144 HG21 VAL 48 HG21 VAL 48 8.801 8.590 -17.245 145 HG22 VAL 48 HG22 VAL 48 10.033 8.054 -16.103 146 HG23 VAL 48 HG23 VAL 48 10.413 8.168 -17.825 147 H LYS 49 HN LYS 49 12.136 12.140 -14.719 148 HA LYS 49 HA LYS 49 10.906 11.090 -12.267 149 HB2 LYS 49 HB2 LYS 49 13.809 11.760 -12.613 150 HB3 LYS 49 HB1 LYS 49 13.044 11.963 -11.060 151 HG2 LYS 49 HG2 LYS 49 12.412 9.633 -10.981 152 HG3 LYS 49 HG1 LYS 49 12.954 9.386 -12.638 153 HD2 LYS 49 HD2 LYS 49 15.239 9.689 -12.052 154 HD3 LYS 49 HD1 LYS 49 14.820 10.315 -10.464 155 HE2 LYS 49 HE2 LYS 49 15.599 7.854 -10.608 156 HE3 LYS 49 HE1 LYS 49 14.142 8.190 -9.674 157 HZ1 LYS 49 HZ1 LYS 49 12.783 7.432 -11.392 158 HZ2 LYS 49 HZ2 LYS 49 14.046 6.297 -11.333 159 HZ3 LYS 49 HZ3 LYS 49 14.028 7.489 -12.544 160 H GLY 50 HN GLY 50 10.427 12.706 -10.720 161 HA2 GLY 50 HA2 GLY 50 10.320 15.433 -11.869 162 HA3 GLY 50 HA1 GLY 50 9.163 14.774 -10.722 163 H ILE 51 HN ILE 51 9.937 17.058 -9.870 164 HA ILE 51 HA ILE 51 12.409 17.436 -8.673 165 HB ILE 51 HB ILE 51 10.640 19.159 -8.843 166 HG12 ILE 51 HG12 ILE 51 11.361 18.771 -5.931 167 HG13 ILE 51 HG11 ILE 51 12.580 19.196 -7.131 168 HG21 ILE 51 HG21 ILE 51 8.780 17.617 -8.148 169 HG22 ILE 51 HG22 ILE 51 8.777 19.160 -7.293 170 HG23 ILE 51 HG23 ILE 51 9.383 17.710 -6.494 171 HD11 ILE 51 HD11 ILE 51 11.678 21.210 -6.044 172 HD12 ILE 51 HD12 ILE 51 10.049 20.753 -6.541 173 HD13 ILE 51 HD13 ILE 51 11.252 21.182 -7.752 174 H ASP 52 HN ASP 52 10.259 14.973 -7.985 175 HA ASP 52 HA ASP 52 10.596 14.769 -5.160 176 HB2 ASP 52 HB2 ASP 52 8.684 13.743 -6.290 177 HB3 ASP 52 HB1 ASP 52 9.769 12.701 -7.209 178 H SER 53 HN SER 53 11.884 12.881 -7.870 179 HA SER 53 HA SER 53 13.999 11.780 -6.134 180 HB2 SER 53 HB2 SER 53 13.210 11.187 -8.970 181 HB3 SER 53 HB1 SER 53 14.601 10.465 -8.180 182 HG SER 53 HG SER 53 11.964 10.403 -7.145 183 H TYR 54 HN TYR 54 13.759 14.648 -7.277 184 HA TYR 54 HA TYR 54 16.563 14.796 -8.211 185 HB2 TYR 54 HB2 TYR 54 14.088 15.782 -9.514 186 HB3 TYR 54 HB1 TYR 54 15.385 16.975 -9.413 187 HD1 TYR 54 HD2 TYR 54 14.809 13.378 -10.328 188 HD2 TYR 54 HD1 TYR 54 17.077 16.957 -11.031 189 HE1 TYR 54 HE2 TYR 54 15.982 12.276 -12.201 190 HE2 TYR 54 HE1 TYR 54 18.250 15.844 -12.883 191 HH TYR 54 HH TYR 54 18.409 14.016 -14.140 192 H SER 55 HN SER 55 17.797 16.366 -7.336 193 HA SER 55 HA SER 55 16.948 17.610 -4.936 194 HB2 SER 55 HB2 SER 55 19.134 18.876 -5.194 195 HB3 SER 55 HB1 SER 55 19.271 17.114 -5.183 196 HG SER 55 HG SER 55 19.063 18.709 -7.528 197 H LYS 56 HN LYS 56 16.774 19.886 -4.509 198 HA LYS 56 HA LYS 56 15.102 21.261 -6.320 199 HB2 LYS 56 HB2 LYS 56 15.116 21.625 -3.857 200 HB3 LYS 56 HB1 LYS 56 16.685 22.417 -4.014 201 HG2 LYS 56 HG2 LYS 56 15.714 24.115 -5.489 202 HG3 LYS 56 HG1 LYS 56 14.149 23.305 -5.419 203 HD2 LYS 56 HD2 LYS 56 14.068 23.678 -2.975 204 HD3 LYS 56 HD1 LYS 56 15.625 24.510 -3.059 205 HE2 LYS 56 HE2 LYS 56 14.665 26.209 -4.545 206 HE3 LYS 56 HE1 LYS 56 13.115 25.367 -4.530 207 HZ1 LYS 56 HZ1 LYS 56 13.492 25.623 -1.939 208 HZ2 LYS 56 HZ2 LYS 56 12.737 26.828 -2.866 209 HZ3 LYS 56 HZ3 LYS 56 14.377 26.977 -2.451 210 H THR 57 HN THR 57 18.559 21.502 -5.625 211 HA THR 57 HA THR 57 19.076 23.822 -7.147 212 HB THR 57 HB THR 57 21.018 21.546 -6.729 213 HG1 THR 57 HG1 THR 57 20.757 21.898 -4.692 214 HG21 THR 57 HG21 THR 57 22.677 23.285 -6.805 215 HG22 THR 57 HG22 THR 57 21.442 24.544 -6.755 216 HG23 THR 57 HG23 THR 57 21.611 23.532 -8.187 217 H GLN 58 HN GLN 58 19.312 20.369 -7.986 218 HA GLN 58 HA GLN 58 20.185 20.777 -10.645 219 HB2 GLN 58 HB2 GLN 58 18.748 18.447 -9.356 220 HB3 GLN 58 HB1 GLN 58 19.433 18.413 -10.981 221 HG2 GLN 58 HG2 GLN 58 21.027 19.065 -8.488 222 HG3 GLN 58 HG1 GLN 58 20.960 17.464 -9.221 223 HE21 GLN 58 HE21 GLN 58 22.990 20.006 -9.061 224 HE22 GLN 58 HE22 GLN 58 23.673 19.958 -10.623 225 H TRP 59 HN TRP 59 16.973 20.435 -9.204 226 HA TRP 59 HA TRP 59 15.527 20.250 -11.596 227 HB2 TRP 59 HB2 TRP 59 14.822 19.999 -9.021 228 HB3 TRP 59 HB1 TRP 59 14.333 21.681 -9.229 229 HD1 TRP 59 HD1 TRP 59 11.892 21.849 -9.893 230 HE1 TRP 59 HE1 TRP 59 10.248 20.471 -11.325 231 HE3 TRP 59 HE3 TRP 59 14.968 18.045 -11.354 232 HZ2 TRP 59 HZ2 TRP 59 10.253 18.082 -12.858 233 HZ3 TRP 59 HZ3 TRP 59 14.119 16.231 -12.799 234 HH2 TRP 59 HH2 TRP 59 11.760 16.261 -13.554 235 H SER 60 HN SER 60 16.609 23.031 -9.704 236 HA SER 60 HA SER 60 15.188 25.037 -11.055 237 HB2 SER 60 HB2 SER 60 17.837 25.068 -9.610 238 HB3 SER 60 HB1 SER 60 17.111 26.522 -10.290 239 HG SER 60 HG SER 60 15.305 26.165 -8.983 240 H LYS 61 HN LYS 61 18.079 23.275 -11.908 241 HA LYS 61 HA LYS 61 18.988 25.061 -13.943 242 HB2 LYS 61 HB2 LYS 61 19.510 22.101 -13.552 243 HB3 LYS 61 HB1 LYS 61 20.399 23.159 -14.648 244 HG2 LYS 61 HG2 LYS 61 21.119 24.550 -12.758 245 HG3 LYS 61 HG1 LYS 61 20.196 23.538 -11.650 246 HD2 LYS 61 HD2 LYS 61 21.596 21.571 -12.565 247 HD3 LYS 61 HD1 LYS 61 22.656 22.808 -13.244 248 HE2 LYS 61 HE2 LYS 61 21.884 22.626 -10.322 249 HE3 LYS 61 HE1 LYS 61 23.399 22.026 -10.991 250 HZ1 LYS 61 HZ1 LYS 61 23.263 24.548 -11.953 251 HZ2 LYS 61 HZ2 LYS 61 24.158 24.067 -10.591 252 HZ3 LYS 61 HZ3 LYS 61 22.601 24.721 -10.401 253 H THR 62 HN THR 62 16.357 22.954 -13.753 254 HA THR 62 HA THR 62 16.246 22.150 -16.507 255 HB THR 62 HB THR 62 14.063 21.270 -15.979 256 HG1 THR 62 HG1 THR 62 13.086 21.795 -14.018 257 HG21 THR 62 HG21 THR 62 16.083 20.982 -13.741 258 HG22 THR 62 HG22 THR 62 15.854 19.918 -15.125 259 HG23 THR 62 HG23 THR 62 14.630 19.997 -13.857 260 H PHE 63 HN PHE 63 15.416 24.997 -14.783 261 HA PHE 63 HA PHE 63 14.351 26.196 -17.217 262 HB2 PHE 63 HB2 PHE 63 12.377 27.072 -16.116 263 HB3 PHE 63 HB1 PHE 63 12.379 25.319 -15.965 264 HD1 PHE 63 HD2 PHE 63 13.162 28.490 -14.183 265 HD2 PHE 63 HD1 PHE 63 12.484 24.266 -13.829 266 HE1 PHE 63 HE2 PHE 63 13.086 28.709 -11.714 267 HE2 PHE 63 HE1 PHE 63 12.413 24.482 -11.361 268 HZ PHE 63 HZ PHE 63 12.712 26.704 -10.302 269 H THR 64 HN THR 64 14.347 28.514 -17.144 270 HA THR 64 HA THR 64 15.976 29.690 -14.961 271 HB THR 64 HB THR 64 17.032 31.119 -16.758 272 HG1 THR 64 HG1 THR 64 16.694 29.293 -18.695 273 HG21 THR 64 HG21 THR 64 17.470 28.175 -16.386 274 HG22 THR 64 HG22 THR 64 18.521 29.526 -15.968 275 HG23 THR 64 HG23 THR 64 18.380 29.003 -17.648 276 H PHE 65 HN PHE 65 15.871 32.122 -15.020 277 HA PHE 65 HA PHE 65 13.067 32.915 -15.505 278 HB2 PHE 65 HB2 PHE 65 14.709 33.199 -13.258 279 HB3 PHE 65 HB1 PHE 65 14.728 34.804 -13.974 280 HD1 PHE 65 HD1 PHE 65 12.219 32.049 -13.448 281 HD2 PHE 65 HD2 PHE 65 13.073 36.252 -13.205 282 HE1 PHE 65 HE1 PHE 65 9.938 32.464 -12.573 283 HE2 PHE 65 HE2 PHE 65 10.795 36.661 -12.322 284 HZ PHE 65 HZ PHE 65 9.229 34.774 -12.017 285 H VAL 66 HN VAL 66 12.608 34.221 -17.121 286 HA VAL 66 HA VAL 66 14.675 36.113 -18.079 287 HB VAL 66 HB VAL 66 13.037 34.197 -19.744 288 HG11 VAL 66 HG11 VAL 66 14.478 36.749 -20.476 289 HG12 VAL 66 HG12 VAL 66 12.851 36.239 -20.924 290 HG13 VAL 66 HG13 VAL 66 14.251 35.457 -21.656 291 HG21 VAL 66 HG21 VAL 66 15.240 33.532 -20.587 292 HG22 VAL 66 HG22 VAL 66 15.216 33.398 -18.829 293 HG23 VAL 66 HG23 VAL 66 16.015 34.768 -19.597 294 H ARG 67 HN ARG 67 13.936 38.102 -18.545 295 HA ARG 67 HA ARG 67 12.497 39.898 -18.509 296 HB2 ARG 67 HB2 ARG 67 10.842 37.846 -19.997 297 HB3 ARG 67 HB1 ARG 67 10.396 39.553 -19.855 298 HG2 ARG 67 HG2 ARG 67 12.448 40.235 -20.962 299 HG3 ARG 67 HG1 ARG 67 13.032 38.572 -20.990 300 HD2 ARG 67 HD2 ARG 67 12.105 39.157 -23.177 301 HD3 ARG 67 HD1 ARG 67 11.091 37.934 -22.403 302 HE ARG 67 HE ARG 67 10.125 40.533 -21.779 303 HH11 ARG 67 HH21 ARG 67 10.404 38.238 -24.355 304 HH12 ARG 67 HH22 ARG 67 8.983 38.785 -25.180 305 HH21 ARG 67 HH11 ARG 67 8.262 41.256 -22.857 306 HH22 ARG 67 HH12 ARG 67 7.771 40.493 -24.332 307 H GLY 68 HN GLY 68 12.356 37.823 -16.302 308 HA2 GLY 68 HA2 GLY 68 11.236 37.791 -14.286 309 HA3 GLY 68 HA1 GLY 68 10.115 38.993 -14.922 310 H ARG 69 HN ARG 69 10.722 36.065 -16.698 311 HA ARG 69 HA ARG 69 8.183 34.885 -15.732 312 HB2 ARG 69 HB2 ARG 69 8.967 35.244 -18.637 313 HB3 ARG 69 HB1 ARG 69 7.541 34.389 -18.049 314 HG2 ARG 69 HG2 ARG 69 6.765 36.481 -16.954 315 HG3 ARG 69 HG1 ARG 69 8.161 37.325 -17.627 316 HD2 ARG 69 HD2 ARG 69 7.397 36.714 -19.911 317 HD3 ARG 69 HD1 ARG 69 5.978 35.942 -19.211 318 HE ARG 69 HE ARG 69 6.294 38.702 -18.413 319 HH11 ARG 69 HH21 ARG 69 5.108 36.503 -20.808 320 HH12 ARG 69 HH22 ARG 69 3.907 37.594 -21.413 321 HH21 ARG 69 HH11 ARG 69 4.722 40.138 -19.203 322 HH22 ARG 69 HH12 ARG 69 3.688 39.652 -20.505 323 H THR 70 HN THR 70 8.277 32.748 -15.421 324 HA THR 70 HA THR 70 10.723 31.356 -15.473 325 HB THR 70 HB THR 70 7.974 30.095 -15.530 326 HG1 THR 70 HG1 THR 70 9.380 30.814 -13.206 327 HG21 THR 70 HG21 THR 70 10.653 29.270 -14.378 328 HG22 THR 70 HG22 THR 70 9.808 28.511 -15.728 329 HG23 THR 70 HG23 THR 70 9.140 28.405 -14.098 330 H VAL 71 HN VAL 71 11.776 30.320 -17.048 331 HA VAL 71 HA VAL 71 10.295 29.456 -19.458 332 HB VAL 71 HB VAL 71 12.249 30.278 -20.823 333 HG11 VAL 71 HG11 VAL 71 10.554 32.267 -19.283 334 HG12 VAL 71 HG12 VAL 71 10.176 31.530 -20.840 335 HG13 VAL 71 HG13 VAL 71 11.501 32.686 -20.711 336 HG21 VAL 71 HG21 VAL 71 12.851 31.952 -18.370 337 HG22 VAL 71 HG22 VAL 71 13.773 31.862 -19.870 338 HG23 VAL 71 HG23 VAL 71 13.748 30.486 -18.770 339 H SER 72 HN SER 72 11.283 27.751 -20.613 340 HA SER 72 HA SER 72 12.869 25.994 -18.923 341 HB2 SER 72 HB2 SER 72 10.867 25.259 -20.319 342 HB3 SER 72 HB1 SER 72 11.930 25.426 -21.717 343 HG SER 72 HG SER 72 12.356 23.413 -21.142 344 H VAL 73 HN VAL 73 14.968 25.437 -19.241 345 HA VAL 73 HA VAL 73 16.669 27.122 -20.686 346 HB VAL 73 HB VAL 73 17.274 24.308 -19.822 347 HG11 VAL 73 HG11 VAL 73 19.574 25.337 -19.538 348 HG12 VAL 73 HG12 VAL 73 18.958 26.753 -20.388 349 HG13 VAL 73 HG13 VAL 73 19.023 25.191 -21.205 350 HG21 VAL 73 HG21 VAL 73 18.161 25.554 -17.751 351 HG22 VAL 73 HG22 VAL 73 16.415 25.394 -17.887 352 HG23 VAL 73 HG23 VAL 73 17.190 26.915 -18.306 353 H SER 74 HN SER 74 17.968 26.674 -22.563 354 HA SER 74 HA SER 74 16.547 25.621 -24.754 355 HB2 SER 74 HB2 SER 74 19.483 26.245 -24.405 356 HB3 SER 74 HB1 SER 74 18.757 25.791 -25.944 357 HG SER 74 HG SER 74 17.804 27.917 -24.325 358 H ASP 75 HN ASP 75 19.125 24.249 -22.745 359 HA ASP 75 HA ASP 75 18.327 21.566 -23.577 360 HB2 ASP 75 HB2 ASP 75 20.034 22.234 -25.213 361 HB3 ASP 75 HB1 ASP 75 21.169 22.507 -23.883 362 HA PRO 76 HA PRO 76 19.573 21.925 -19.141 363 HB2 PRO 76 HB2 PRO 76 17.326 20.766 -18.087 364 HB3 PRO 76 HB1 PRO 76 17.433 22.482 -18.481 365 HG2 PRO 76 HG2 PRO 76 16.109 20.277 -19.968 366 HG3 PRO 76 HG1 PRO 76 15.624 21.973 -19.810 367 HD2 PRO 76 HD2 PRO 76 16.894 20.875 -22.028 368 HD3 PRO 76 HD1 PRO 76 16.859 22.611 -21.647 369 H LYS 77 HN LYS 77 21.047 20.407 -18.640 370 HA LYS 77 HA LYS 77 20.281 17.543 -18.879 371 HB2 LYS 77 HB2 LYS 77 22.932 18.858 -19.484 372 HB3 LYS 77 HB1 LYS 77 22.707 17.119 -19.308 373 HG2 LYS 77 HG2 LYS 77 21.107 17.091 -21.146 374 HG3 LYS 77 HG1 LYS 77 21.177 18.844 -21.277 375 HD2 LYS 77 HD2 LYS 77 22.640 18.092 -22.980 376 HD3 LYS 77 HD1 LYS 77 23.718 18.538 -21.658 377 HE2 LYS 77 HE2 LYS 77 23.988 16.243 -20.996 378 HE3 LYS 77 HE1 LYS 77 22.697 15.714 -22.068 379 HZ1 LYS 77 HZ1 LYS 77 25.036 15.378 -22.876 380 HZ2 LYS 77 HZ2 LYS 77 25.131 17.065 -23.062 381 HZ3 LYS 77 HZ3 LYS 77 23.987 16.173 -23.945 382 H VAL 78 HN VAL 78 20.328 16.488 -17.019 383 HA VAL 78 HA VAL 78 22.307 17.142 -14.976 384 HB VAL 78 HB VAL 78 20.378 17.188 -13.244 385 HG11 VAL 78 HG11 VAL 78 20.180 19.594 -13.451 386 HG12 VAL 78 HG12 VAL 78 20.615 19.531 -15.158 387 HG13 VAL 78 HG13 VAL 78 21.815 19.140 -13.923 388 HG21 VAL 78 HG21 VAL 78 18.824 18.142 -15.660 389 HG22 VAL 78 HG22 VAL 78 18.219 17.853 -14.027 390 HG23 VAL 78 HG23 VAL 78 18.698 16.491 -15.058 391 H ILE 79 HN ILE 79 22.667 15.476 -13.522 392 HA ILE 79 HA ILE 79 21.654 12.867 -14.397 393 HB ILE 79 HB ILE 79 24.081 13.137 -14.160 394 HG12 ILE 79 HG12 ILE 79 22.837 11.366 -12.030 395 HG13 ILE 79 HG11 ILE 79 23.103 10.930 -13.713 396 HG21 ILE 79 HG21 ILE 79 23.620 13.499 -11.204 397 HG22 ILE 79 HG22 ILE 79 23.813 14.869 -12.293 398 HG23 ILE 79 HG23 ILE 79 25.117 13.698 -12.108 399 HD11 ILE 79 HD11 ILE 79 24.898 10.021 -12.342 400 HD12 ILE 79 HD12 ILE 79 25.221 11.600 -11.654 401 HD13 ILE 79 HD13 ILE 79 25.546 11.309 -13.359 402 H CYS 80 HN CYS 80 20.149 11.788 -13.313 403 HA CYS 80 HA CYS 80 18.856 12.843 -11.032 404 HB2 CYS 80 HB2 CYS 80 17.489 10.917 -11.101 405 HB3 CYS 80 HB1 CYS 80 17.940 11.200 -12.788 406 H ARG 81 HN ARG 81 18.636 11.755 -8.933 407 HA ARG 81 HA ARG 81 21.174 11.326 -7.712 408 HB2 ARG 81 HB2 ARG 81 18.382 10.794 -6.673 409 HB3 ARG 81 HB1 ARG 81 19.849 10.776 -5.694 410 HG2 ARG 81 HG2 ARG 81 20.286 13.125 -6.261 411 HG3 ARG 81 HG1 ARG 81 18.851 13.155 -7.293 412 HD2 ARG 81 HD2 ARG 81 18.283 14.129 -5.143 413 HD3 ARG 81 HD1 ARG 81 17.460 12.580 -5.304 414 HE ARG 81 HE ARG 81 19.966 12.222 -4.010 415 HH11 ARG 81 HH21 ARG 81 16.778 13.493 -3.562 416 HH12 ARG 81 HH22 ARG 81 16.763 13.228 -1.851 417 HH21 ARG 81 HH11 ARG 81 19.954 11.873 -1.765 418 HH22 ARG 81 HH12 ARG 81 18.562 12.311 -0.833 419 H THR 82 HN THR 82 18.576 9.197 -8.735 420 HA THR 82 HA THR 82 19.418 6.772 -7.640 421 HB THR 82 HB THR 82 18.261 7.047 -10.415 422 HG1 THR 82 HG1 THR 82 16.265 6.777 -9.061 423 HG21 THR 82 HG21 THR 82 17.854 4.927 -8.294 424 HG22 THR 82 HG22 THR 82 19.051 4.796 -9.583 425 HG23 THR 82 HG23 THR 82 17.333 4.869 -9.978 426 H CYS 83 HN CYS 83 20.493 8.395 -10.595 427 HA CYS 83 HA CYS 83 22.210 6.286 -11.464 428 HB2 CYS 83 HB2 CYS 83 21.765 9.147 -12.209 429 HB3 CYS 83 HB1 CYS 83 23.266 8.379 -12.737 430 H GLN 84 HN GLN 84 22.442 7.549 -8.641 431 HA GLN 84 HA GLN 84 25.382 7.610 -8.644 432 HB2 GLN 84 HB2 GLN 84 23.763 9.644 -7.114 433 HB3 GLN 84 HB1 GLN 84 25.509 9.601 -7.360 434 HG2 GLN 84 HG2 GLN 84 25.131 9.894 -9.812 435 HG3 GLN 84 HG1 GLN 84 23.400 10.064 -9.491 436 HE21 GLN 84 HE21 GLN 84 22.650 12.081 -8.654 437 HE22 GLN 84 HE22 GLN 84 23.673 13.411 -8.396 438 HA PRO 85 HA PRO 85 23.369 5.187 -5.181 439 HB2 PRO 85 HB2 PRO 85 24.331 2.711 -5.872 440 HB3 PRO 85 HB1 PRO 85 22.799 3.366 -6.485 441 HG2 PRO 85 HG2 PRO 85 25.452 3.187 -7.829 442 HG3 PRO 85 HG1 PRO 85 23.829 2.998 -8.506 443 HD2 PRO 85 HD2 PRO 85 25.362 5.298 -8.750 444 HD3 PRO 85 HD1 PRO 85 23.588 5.264 -8.880 445 H LYS 86 HN LYS 86 26.302 3.561 -6.319 446 HA LYS 86 HA LYS 86 27.867 4.735 -4.121 447 HB2 LYS 86 HB2 LYS 86 27.428 1.781 -4.583 448 HB3 LYS 86 HB1 LYS 86 28.713 2.437 -3.571 449 HG2 LYS 86 HG2 LYS 86 27.039 3.573 -2.163 450 HG3 LYS 86 HG1 LYS 86 25.747 2.953 -3.187 451 HD2 LYS 86 HD2 LYS 86 25.741 1.349 -1.499 452 HD3 LYS 86 HD1 LYS 86 26.853 0.601 -2.642 453 HE2 LYS 86 HE2 LYS 86 27.824 0.533 -0.400 454 HE3 LYS 86 HE1 LYS 86 28.762 1.630 -1.405 455 HZ1 LYS 86 HZ1 LYS 86 26.586 2.487 0.420 456 HZ2 LYS 86 HZ2 LYS 86 27.633 3.497 -0.460 457 HZ3 LYS 86 HZ3 LYS 86 28.237 2.540 0.807 458 H GLN 87 HN GLN 87 29.588 5.586 -5.072 459 HA GLN 87 HA GLN 87 30.557 4.634 -7.621 460 HB2 GLN 87 HB2 GLN 87 30.566 7.043 -6.991 461 HB3 GLN 87 HB1 GLN 87 31.775 6.681 -5.751 462 HG2 GLN 87 HG2 GLN 87 33.360 5.942 -7.415 463 HG3 GLN 87 HG1 GLN 87 32.147 6.041 -8.688 464 HE21 GLN 87 HE21 GLN 87 34.594 7.502 -8.874 465 HE22 GLN 87 HE22 GLN 87 34.242 9.158 -8.745 466 H HIS 88 HN HIS 88 31.136 3.867 -4.354 467 HA HIS 88 HA HIS 88 33.886 3.155 -4.484 468 HB2 HIS 88 HB2 HIS 88 31.673 2.139 -2.680 469 HB3 HIS 88 HB1 HIS 88 33.399 1.845 -2.434 470 HD2 HIS 88 HD2 HIS 88 30.802 4.716 -1.943 471 HE1 HIS 88 HE1 HIS 88 34.574 6.195 -0.758 472 HE2 HIS 88 HE2 HIS 88 32.083 6.682 -0.797 473 H ASP 89 HN ASP 89 34.856 1.428 -5.341 474 HA ASP 89 HA ASP 89 33.243 -0.976 -5.963 475 HB2 ASP 89 HB2 ASP 89 35.075 0.531 -7.833 476 HB3 ASP 89 HB1 ASP 89 34.554 -1.129 -8.119 477 H SER 90 HN SER 90 34.174 -2.788 -5.308 478 HA SER 90 HA SER 90 37.108 -2.897 -4.995 479 HB2 SER 90 HB2 SER 90 36.912 -3.895 -2.797 480 HB3 SER 90 HB1 SER 90 36.082 -2.335 -2.790 481 HG SER 90 HG SER 90 34.129 -3.462 -3.085 482 H ILE 91 HN ILE 91 37.912 -5.116 -4.748 483 HA ILE 91 HA ILE 91 36.156 -7.072 -6.121 484 HB ILE 91 HB ILE 91 39.172 -6.832 -6.281 485 HG12 ILE 91 HG12 ILE 91 37.600 -5.060 -7.440 486 HG13 ILE 91 HG11 ILE 91 38.917 -5.781 -8.364 487 HG21 ILE 91 HG21 ILE 91 38.694 -8.442 -8.257 488 HG22 ILE 91 HG22 ILE 91 37.125 -8.707 -7.485 489 HG23 ILE 91 HG23 ILE 91 38.607 -9.104 -6.620 490 HD11 ILE 91 HD11 ILE 91 36.166 -7.027 -8.364 491 HD12 ILE 91 HD12 ILE 91 37.465 -7.230 -9.528 492 HD13 ILE 91 HD13 ILE 91 36.564 -5.716 -9.464 493 H TRP 92 HN TRP 92 35.816 -8.959 -5.164 494 HA TRP 92 HA TRP 92 36.912 -9.394 -2.530 495 HB2 TRP 92 HB2 TRP 92 34.611 -9.973 -2.813 496 HB3 TRP 92 HB1 TRP 92 34.965 -10.947 -4.247 497 HD1 TRP 92 HD1 TRP 92 37.206 -11.187 -1.186 498 HE1 TRP 92 HE1 TRP 92 36.970 -13.515 -0.138 499 HE3 TRP 92 HE3 TRP 92 33.293 -12.966 -3.934 500 HZ2 TRP 92 HZ2 TRP 92 35.319 -15.841 -0.421 501 HZ3 TRP 92 HZ3 TRP 92 32.408 -15.243 -3.522 502 HH2 TRP 92 HH2 TRP 92 33.414 -16.682 -1.772 503 H CYS 93 HN CYS 93 38.907 -10.191 -2.332 504 HA CYS 93 HA CYS 93 40.041 -11.953 -4.367 505 HB2 CYS 93 HB2 CYS 93 41.424 -10.166 -3.402 506 HB3 CYS 93 HB1 CYS 93 41.235 -10.885 -1.801 507 H THR 94 HN THR 94 40.195 -14.101 -4.221 508 HA THR 94 HA THR 94 39.211 -15.421 -1.786 509 HB THR 94 HB THR 94 38.806 -17.291 -3.103 510 HG1 THR 94 HG1 THR 94 40.652 -17.791 -4.061 511 HG21 THR 94 HG21 THR 94 37.518 -15.269 -3.870 512 HG22 THR 94 HG22 THR 94 37.706 -16.513 -5.106 513 HG23 THR 94 HG23 THR 94 38.712 -15.066 -5.153 514 H ALA 95 HN ALA 95 42.131 -14.454 -3.130 515 HA ALA 95 HA ALA 95 43.710 -16.695 -2.103 516 HB1 ALA 95 HB1 ALA 95 45.635 -15.428 -2.971 517 HB2 ALA 95 HB2 ALA 95 44.560 -14.097 -3.398 518 HB3 ALA 95 HB3 ALA 95 44.397 -15.655 -4.205 519 H CYS 96 HN CYS 96 42.978 -13.330 -1.325 520 HA CYS 96 HA CYS 96 44.693 -13.474 1.070 521 HB2 CYS 96 HB2 CYS 96 43.196 -11.130 -0.130 522 HB3 CYS 96 HB1 CYS 96 44.316 -11.065 1.239 523 H GLN 97 HN GLN 97 41.373 -13.415 0.037 524 HA GLN 97 HA GLN 97 39.430 -13.845 1.199 525 HB2 GLN 97 HB2 GLN 97 41.069 -15.362 2.544 526 HB3 GLN 97 HB1 GLN 97 41.003 -14.090 3.762 527 HG2 GLN 97 HG2 GLN 97 38.554 -14.267 3.846 528 HG3 GLN 97 HG1 GLN 97 38.598 -15.522 2.614 529 HE21 GLN 97 HE21 GLN 97 37.507 -16.017 5.214 530 HE22 GLN 97 HE22 GLN 97 38.517 -17.128 6.008 531 H GLN 98 HN GLN 98 40.498 -11.195 0.828 532 HA GLN 98 HA GLN 98 38.969 -9.826 2.917 533 HB2 GLN 98 HB2 GLN 98 41.315 -9.803 3.711 534 HB3 GLN 98 HB1 GLN 98 41.803 -9.038 2.198 535 HG2 GLN 98 HG2 GLN 98 40.523 -7.072 2.671 536 HG3 GLN 98 HG1 GLN 98 39.704 -7.853 4.024 537 HE21 GLN 98 HE21 GLN 98 41.110 -5.406 4.403 538 HE22 GLN 98 HE22 GLN 98 42.483 -5.711 5.354 539 H THR 99 HN THR 99 38.498 -7.577 2.344 540 HA THR 99 HA THR 99 37.839 -7.371 -0.466 541 HB THR 99 HB THR 99 37.415 -5.389 1.780 542 HG1 THR 99 HG1 THR 99 35.267 -6.283 1.645 543 HG21 THR 99 HG21 THR 99 37.231 -4.230 -0.289 544 HG22 THR 99 HG22 THR 99 35.575 -4.633 0.164 545 HG23 THR 99 HG23 THR 99 36.412 -5.587 -1.062 546 H LYS 100 HN LYS 100 38.738 -6.044 -1.973 547 HA LYS 100 HA LYS 100 40.802 -4.137 -1.141 548 HB2 LYS 100 HB2 LYS 100 41.818 -6.418 -1.732 549 HB3 LYS 100 HB1 LYS 100 41.308 -6.089 -3.380 550 HG2 LYS 100 HG2 LYS 100 43.555 -5.297 -3.256 551 HG3 LYS 100 HG1 LYS 100 42.538 -3.857 -3.184 552 HD2 LYS 100 HD2 LYS 100 42.934 -3.518 -0.899 553 HD3 LYS 100 HD1 LYS 100 43.358 -5.203 -0.609 554 HE2 LYS 100 HE2 LYS 100 45.481 -4.953 -1.619 555 HE3 LYS 100 HE1 LYS 100 45.044 -3.413 -2.354 556 HZ1 LYS 100 HZ1 LYS 100 45.720 -2.370 -0.544 557 HZ2 LYS 100 HZ2 LYS 100 46.219 -3.849 0.127 558 HZ3 LYS 100 HZ3 LYS 100 44.652 -3.261 0.425 559 H GLY 101 HN GLY 101 41.115 -2.427 -2.563 560 HA2 GLY 101 HA2 GLY 101 38.888 -1.680 -4.145 561 HA3 GLY 101 HA1 GLY 101 40.435 -0.842 -4.094 562 H ILE 102 HN ILE 102 39.072 -1.025 -6.461 563 HA ILE 102 HA ILE 102 40.027 -3.251 -8.022 564 HB ILE 102 HB ILE 102 39.036 -1.998 -9.931 565 HG12 ILE 102 HG12 ILE 102 38.156 -0.066 -7.763 566 HG13 ILE 102 HG11 ILE 102 39.463 0.267 -8.904 567 HG21 ILE 102 HG21 ILE 102 37.502 -3.484 -9.025 568 HG22 ILE 102 HG22 ILE 102 36.640 -1.982 -8.754 569 HG23 ILE 102 HG23 ILE 102 37.529 -2.726 -7.431 570 HD11 ILE 102 HD11 ILE 102 37.508 1.261 -9.856 571 HD12 ILE 102 HD12 ILE 102 36.535 -0.172 -9.514 572 HD13 ILE 102 HD13 ILE 102 37.777 -0.230 -10.766 573 H ASN 103 HN ASN 103 41.246 -0.224 -7.046 574 HA ASN 103 HA ASN 103 42.837 0.477 -9.267 575 HB2 ASN 103 HB2 ASN 103 43.166 1.030 -6.313 576 HB3 ASN 103 HB1 ASN 103 44.190 1.743 -7.558 577 HD21 ASN 103 HD21 ASN 103 41.944 2.856 -5.671 578 HD22 ASN 103 HD22 ASN 103 40.967 3.762 -6.747 579 H GLU 104 HN GLU 104 43.493 -1.553 -6.435 580 HA GLU 104 HA GLU 104 46.196 -2.141 -7.340 581 HB2 GLU 104 HB2 GLU 104 44.551 -3.161 -5.012 582 HB3 GLU 104 HB1 GLU 104 46.218 -3.642 -5.333 583 HG2 GLU 104 HG2 GLU 104 45.311 -0.775 -4.941 584 HG3 GLU 104 HG1 GLU 104 46.042 -1.769 -3.680 585 H PHE 105 HN PHE 105 43.713 -2.915 -8.891 586 HA PHE 105 HA PHE 105 44.392 -5.793 -9.178 587 HB2 PHE 105 HB2 PHE 105 41.760 -4.451 -8.872 588 HB3 PHE 105 HB1 PHE 105 41.833 -5.712 -10.093 589 HD1 PHE 105 HD2 PHE 105 43.070 -5.127 -6.584 590 HD2 PHE 105 HD1 PHE 105 41.341 -7.871 -9.397 591 HE1 PHE 105 HE2 PHE 105 42.951 -6.850 -4.833 592 HE2 PHE 105 HE1 PHE 105 41.235 -9.604 -7.634 593 HZ PHE 105 HZ PHE 105 42.040 -9.091 -5.349 594 H SER 106 HN SER 106 44.805 -6.502 -11.173 595 HA SER 106 HA SER 106 45.165 -4.571 -13.269 596 HB2 SER 106 HB2 SER 106 46.301 -6.251 -14.404 597 HB3 SER 106 HB1 SER 106 46.497 -6.783 -12.731 598 HG SER 106 HG SER 106 44.777 -7.740 -14.744 599 H LYS 107 HN LYS 107 44.321 -5.041 -15.508 600 HA LYS 107 HA LYS 107 41.499 -4.948 -15.508 601 HB2 LYS 107 HB2 LYS 107 42.972 -3.926 -17.251 602 HB3 LYS 107 HB1 LYS 107 43.312 -5.551 -17.849 603 HG2 LYS 107 HG2 LYS 107 40.982 -5.918 -18.379 604 HG3 LYS 107 HG1 LYS 107 40.517 -4.407 -17.594 605 HD2 LYS 107 HD2 LYS 107 40.578 -3.978 -19.966 606 HD3 LYS 107 HD1 LYS 107 41.991 -3.195 -19.257 607 HE2 LYS 107 HE2 LYS 107 43.462 -4.865 -20.052 608 HE3 LYS 107 HE1 LYS 107 42.151 -6.002 -20.364 609 HZ1 LYS 107 HZ1 LYS 107 41.874 -3.521 -21.777 610 HZ2 LYS 107 HZ2 LYS 107 41.763 -5.119 -22.345 611 HZ3 LYS 107 HZ3 LYS 107 43.281 -4.369 -22.195 612 H ALA 108 HN ALA 108 43.792 -7.540 -16.251 613 HA ALA 108 HA ALA 108 41.853 -9.407 -17.156 614 HB1 ALA 108 HB1 ALA 108 44.226 -9.656 -17.694 615 HB2 ALA 108 HB2 ALA 108 43.645 -11.079 -16.832 616 HB3 ALA 108 HB3 ALA 108 44.606 -9.868 -15.984 617 H GLN 109 HN GLN 109 43.340 -8.793 -14.005 618 HA GLN 109 HA GLN 109 42.318 -10.975 -12.600 619 HB2 GLN 109 HB2 GLN 109 43.004 -8.177 -11.708 620 HB3 GLN 109 HB1 GLN 109 42.513 -9.453 -10.586 621 HG2 GLN 109 HG2 GLN 109 44.367 -10.857 -11.289 622 HG3 GLN 109 HG1 GLN 109 44.828 -9.688 -12.524 623 HE21 GLN 109 HE21 GLN 109 46.910 -10.055 -10.968 624 HE22 GLN 109 HE22 GLN 109 47.070 -8.887 -9.748 625 H ARG 110 HN ARG 110 40.849 -7.875 -13.386 626 HA ARG 110 HA ARG 110 38.475 -8.385 -11.820 627 HB2 ARG 110 HB2 ARG 110 39.055 -6.248 -13.890 628 HB3 ARG 110 HB1 ARG 110 37.656 -6.281 -12.816 629 HG2 ARG 110 HG2 ARG 110 39.142 -6.194 -10.855 630 HG3 ARG 110 HG1 ARG 110 40.545 -6.172 -11.930 631 HD2 ARG 110 HD2 ARG 110 38.345 -4.099 -12.025 632 HD3 ARG 110 HD1 ARG 110 39.830 -3.894 -11.092 633 HE ARG 110 HE ARG 110 40.561 -4.558 -13.718 634 HH11 ARG 110 HH21 ARG 110 38.942 -2.053 -11.961 635 HH12 ARG 110 HH22 ARG 110 39.408 -0.794 -13.057 636 HH21 ARG 110 HH11 ARG 110 41.174 -2.912 -15.160 637 HH22 ARG 110 HH12 ARG 110 40.672 -1.281 -14.867 638 H HIS 111 HN HIS 111 39.625 -9.374 -14.833 639 HA HIS 111 HA HIS 111 36.943 -9.641 -16.020 640 HB2 HIS 111 HB2 HIS 111 38.739 -8.794 -17.462 641 HB3 HIS 111 HB1 HIS 111 39.683 -10.257 -17.154 642 HD2 HIS 111 HD2 HIS 111 39.174 -12.248 -18.994 643 HE1 HIS 111 HE1 HIS 111 35.413 -10.879 -20.338 644 HE2 HIS 111 HE2 HIS 111 37.207 -12.646 -20.665 645 H VAL 112 HN VAL 112 39.742 -11.644 -15.102 646 HA VAL 112 HA VAL 112 38.791 -14.137 -15.829 647 HB VAL 112 HB VAL 112 40.223 -15.023 -13.987 648 HG11 VAL 112 HG11 VAL 112 41.246 -12.853 -15.825 649 HG12 VAL 112 HG12 VAL 112 41.355 -14.599 -16.030 650 HG13 VAL 112 HG13 VAL 112 42.338 -13.791 -14.808 651 HG21 VAL 112 HG21 VAL 112 41.535 -13.290 -12.706 652 HG22 VAL 112 HG22 VAL 112 39.822 -13.341 -12.288 653 HG23 VAL 112 HG23 VAL 112 40.433 -12.079 -13.349 654 H LEU 113 HN LEU 113 38.194 -15.892 -14.138 655 HA LEU 113 HA LEU 113 35.717 -14.995 -12.865 656 HB2 LEU 113 HB2 LEU 113 36.920 -17.684 -13.520 657 HB3 LEU 113 HB1 LEU 113 35.533 -17.548 -12.429 658 HG LEU 113 HG LEU 113 34.303 -16.294 -14.192 659 HD11 LEU 113 HD11 LEU 113 36.017 -15.292 -15.491 660 HD12 LEU 113 HD12 LEU 113 35.341 -16.530 -16.545 661 HD13 LEU 113 HD13 LEU 113 36.864 -16.823 -15.707 662 HD21 LEU 113 HD21 LEU 113 34.149 -18.791 -13.953 663 HD22 LEU 113 HD22 LEU 113 35.395 -18.939 -15.194 664 HD23 LEU 113 HD23 LEU 113 33.835 -18.219 -15.592 665 H ASP 114 HN ASP 114 38.944 -15.504 -11.983 666 HA ASP 114 HA ASP 114 38.177 -15.556 -9.121 667 HB2 ASP 114 HB2 ASP 114 40.275 -16.943 -8.773 668 HB3 ASP 114 HB1 ASP 114 38.905 -17.773 -9.507 669 HA PRO 115 HA PRO 115 40.905 -11.941 -10.174 670 HB2 PRO 115 HB2 PRO 115 39.255 -10.809 -7.965 671 HB3 PRO 115 HB1 PRO 115 39.652 -10.104 -9.545 672 HG2 PRO 115 HG2 PRO 115 37.213 -11.046 -9.020 673 HG3 PRO 115 HG1 PRO 115 37.960 -11.258 -10.620 674 HD2 PRO 115 HD2 PRO 115 37.653 -13.266 -8.401 675 HD3 PRO 115 HD1 PRO 115 37.496 -13.491 -10.163 676 H ARG 116 HN ARG 116 42.679 -11.208 -9.012 677 HA ARG 116 HA ARG 116 42.953 -11.804 -6.172 678 HB2 ARG 116 HB2 ARG 116 45.175 -13.012 -6.681 679 HB3 ARG 116 HB1 ARG 116 43.676 -13.921 -6.913 680 HG2 ARG 116 HG2 ARG 116 43.731 -13.341 -9.332 681 HG3 ARG 116 HG1 ARG 116 45.260 -12.501 -9.076 682 HD2 ARG 116 HD2 ARG 116 46.273 -14.610 -8.279 683 HD3 ARG 116 HD1 ARG 116 44.739 -15.443 -8.548 684 HE ARG 116 HE ARG 116 45.730 -14.100 -10.904 685 HH11 ARG 116 HH21 ARG 116 45.864 -16.939 -8.933 686 HH12 ARG 116 HH22 ARG 116 46.375 -17.979 -10.221 687 HH21 ARG 116 HH11 ARG 116 46.398 -15.454 -12.600 688 HH22 ARG 116 HH12 ARG 116 46.678 -17.138 -12.298 689 H CYS 117 HN CYS 117 44.020 -10.184 -5.244 690 HA CYS 117 HA CYS 117 44.936 -7.931 -6.513 691 HB2 CYS 117 HB2 CYS 117 46.458 -8.773 -4.079 692 HB3 CYS 117 HB1 CYS 117 45.659 -7.237 -4.435 693 H GLN 118 HN GLN 118 46.914 -7.149 -7.181 694 HA GLN 118 HA GLN 118 48.607 -8.880 -8.580 695 HB2 GLN 118 HB2 GLN 118 49.108 -6.084 -7.551 696 HB3 GLN 118 HB1 GLN 118 50.195 -6.937 -8.656 697 HG2 GLN 118 HG2 GLN 118 48.382 -7.166 -10.294 698 HG3 GLN 118 HG1 GLN 118 47.264 -6.370 -9.187 699 HE21 GLN 118 HE21 GLN 118 47.303 -4.976 -11.413 700 HE22 GLN 118 HE22 GLN 118 48.355 -3.645 -11.366 701 H ILE 119 HN ILE 119 48.348 -8.473 -5.272 702 HA ILE 119 HA ILE 119 51.162 -9.013 -4.664 703 HB ILE 119 HB ILE 119 48.836 -8.944 -2.729 704 HG12 ILE 119 HG12 ILE 119 48.747 -6.858 -3.961 705 HG13 ILE 119 HG11 ILE 119 49.507 -6.528 -2.402 706 HG21 ILE 119 HG21 ILE 119 51.043 -9.844 -1.964 707 HG22 ILE 119 HG22 ILE 119 50.583 -8.364 -1.124 708 HG23 ILE 119 HG23 ILE 119 51.786 -8.310 -2.411 709 HD11 ILE 119 HD11 ILE 119 51.751 -6.949 -3.647 710 HD12 ILE 119 HD12 ILE 119 50.914 -5.433 -3.952 711 HD13 ILE 119 HD13 ILE 119 50.802 -6.748 -5.116 712 H CYS 120 HN CYS 120 48.134 -10.696 -4.936 713 HA CYS 120 HA CYS 120 49.075 -13.058 -3.544 714 HB2 CYS 120 HB2 CYS 120 46.741 -13.640 -5.114 715 HB3 CYS 120 HB1 CYS 120 46.849 -13.421 -3.370 716 H VAL 121 HN VAL 121 48.773 -11.939 -6.850 717 HA VAL 121 HA VAL 121 49.120 -14.423 -8.153 718 HB VAL 121 HB VAL 121 49.730 -13.082 -10.115 719 HG11 VAL 121 HG11 VAL 121 47.390 -13.188 -9.751 720 HG12 VAL 121 HG12 VAL 121 47.716 -11.476 -10.006 721 HG13 VAL 121 HG13 VAL 121 47.467 -12.092 -8.373 722 HG21 VAL 121 HG21 VAL 121 51.177 -11.414 -9.221 723 HG22 VAL 121 HG22 VAL 121 49.975 -10.917 -8.040 724 HG23 VAL 121 HG23 VAL 121 49.740 -10.538 -9.743 725 H HIS 122 HN HIS 122 51.395 -12.042 -6.893 726 HA HIS 122 HA HIS 122 53.693 -13.542 -7.906 727 HB2 HIS 122 HB2 HIS 122 53.374 -10.958 -6.377 728 HB3 HIS 122 HB1 HIS 122 54.953 -11.708 -6.619 729 HD2 HIS 122 HD2 HIS 122 52.688 -9.305 -8.475 730 HE1 HIS 122 HE1 HIS 122 55.154 -11.020 -11.438 731 HE2 HIS 122 HE2 HIS 122 53.502 -9.155 -10.949 732 H SER 123 HN SER 123 51.657 -14.236 -5.574 733 HA SER 123 HA SER 123 53.776 -15.195 -3.722 734 HB2 SER 123 HB2 SER 123 52.460 -14.703 -1.855 735 HB3 SER 123 HB1 SER 123 52.233 -13.291 -2.884 736 HG SER 123 HG SER 123 50.287 -14.342 -1.967 737 H GLN 124 HN GLN 124 51.295 -15.980 -5.849 738 HA GLN 124 HA GLN 124 51.302 -18.756 -4.874 739 HB2 GLN 124 HB2 GLN 124 49.223 -17.347 -4.099 740 HB3 GLN 124 HB1 GLN 124 48.696 -17.536 -5.770 741 HG2 GLN 124 HG2 GLN 124 47.755 -19.403 -4.672 742 HG3 GLN 124 HG1 GLN 124 49.197 -20.058 -5.438 743 HE21 GLN 124 HE21 GLN 124 48.075 -18.714 -2.295 744 HE22 GLN 124 HE22 GLN 124 49.151 -19.631 -1.356 745 H ARG 125 HN ARG 125 52.301 -17.009 -7.208 746 HA ARG 125 HA ARG 125 52.419 -17.107 -9.520 747 HB2 ARG 125 HB2 ARG 125 52.260 -20.028 -8.736 748 HB3 ARG 125 HB1 ARG 125 52.735 -19.450 -10.340 749 HG2 ARG 125 HG2 ARG 125 54.626 -18.245 -9.401 750 HG3 ARG 125 HG1 ARG 125 54.119 -18.656 -7.762 751 HD2 ARG 125 HD2 ARG 125 55.909 -20.163 -8.462 752 HD3 ARG 125 HD1 ARG 125 54.404 -21.065 -8.305 753 HE ARG 125 HE ARG 125 54.703 -20.150 -10.976 754 HH11 ARG 125 HH21 ARG 125 55.966 -22.409 -8.679 755 HH12 ARG 125 HH22 ARG 125 56.451 -23.564 -9.874 756 HH21 ARG 125 HH11 ARG 125 55.338 -21.661 -12.549 757 HH22 ARG 125 HH12 ARG 125 56.095 -23.141 -12.066 758 H ASN 126 HN ASN 126 50.566 -20.066 -9.445 759 HA ASN 126 HA ASN 126 48.098 -18.739 -10.271 760 HB2 ASN 126 HB2 ASN 126 49.683 -20.542 -12.111 761 HB3 ASN 126 HB1 ASN 126 47.990 -20.124 -12.364 762 HD21 ASN 126 HD21 ASN 126 50.653 -19.349 -13.818 763 HD22 ASN 126 HD22 ASN 126 50.524 -17.664 -13.970 Start of MODEL 9 1 H MET 31 HT1 MET 31 -4.390 16.925 -12.891 2 HA MET 31 HA MET 31 -1.825 16.017 -13.058 3 HB2 MET 31 HB2 MET 31 -3.365 15.486 -15.623 4 HB3 MET 31 HB1 MET 31 -1.602 15.513 -15.493 5 HG2 MET 31 HG2 MET 31 -3.416 13.667 -13.911 6 HG3 MET 31 HG1 MET 31 -2.544 13.198 -15.366 7 HE1 MET 31 HE1 MET 31 0.997 13.058 -14.651 8 HE2 MET 31 HE2 MET 31 0.522 14.745 -14.820 9 HE3 MET 31 HE3 MET 31 -0.285 13.511 -15.780 10 H GLY 32 HN GLY 32 -0.641 17.793 -13.522 11 HA2 GLY 32 HA2 GLY 32 -0.106 19.824 -14.588 12 HA3 GLY 32 HA1 GLY 32 -1.756 19.927 -15.196 13 H LYS 33 HN LYS 33 -2.301 19.106 -12.153 14 HA LYS 33 HA LYS 33 -3.165 21.663 -11.330 15 HB2 LYS 33 HB2 LYS 33 -2.748 19.053 -9.870 16 HB3 LYS 33 HB1 LYS 33 -3.315 20.492 -9.029 17 HG2 LYS 33 HG2 LYS 33 -5.293 19.337 -9.668 18 HG3 LYS 33 HG1 LYS 33 -5.142 20.648 -10.831 19 HD2 LYS 33 HD2 LYS 33 -4.264 19.178 -12.511 20 HD3 LYS 33 HD1 LYS 33 -4.065 17.864 -11.352 21 HE2 LYS 33 HE2 LYS 33 -6.713 19.097 -12.148 22 HE3 LYS 33 HE1 LYS 33 -6.077 17.576 -12.771 23 HZ1 LYS 33 HZ1 LYS 33 -5.853 17.073 -10.219 24 HZ2 LYS 33 HZ2 LYS 33 -7.313 16.806 -11.047 25 HZ3 LYS 33 HZ3 LYS 33 -7.109 18.207 -10.109 26 H ASN 34 HN ASN 34 -0.262 19.797 -10.575 27 HA ASN 34 HA ASN 34 0.825 22.163 -9.137 28 HB2 ASN 34 HB2 ASN 34 1.473 19.216 -8.932 29 HB3 ASN 34 HB1 ASN 34 2.453 20.490 -8.192 30 HD21 ASN 34 HD21 ASN 34 1.019 18.475 -6.658 31 HD22 ASN 34 HD22 ASN 34 -0.164 19.281 -5.747 32 H ASP 35 HN ASP 35 2.490 23.214 -9.993 33 HA ASP 35 HA ASP 35 3.527 22.417 -12.565 34 HB2 ASP 35 HB2 ASP 35 4.916 24.490 -12.319 35 HB3 ASP 35 HB1 ASP 35 3.178 24.771 -12.153 36 H ASN 36 HN ASN 36 4.269 21.588 -9.411 37 HA ASN 36 HA ASN 36 7.156 21.319 -9.826 38 HB2 ASN 36 HB2 ASN 36 5.371 20.613 -7.485 39 HB3 ASN 36 HB1 ASN 36 7.127 20.414 -7.511 40 HD21 ASN 36 HD21 ASN 36 7.894 22.799 -8.846 41 HD22 ASN 36 HD22 ASN 36 7.470 24.127 -7.879 42 H ASP 37 HN ASP 37 4.473 19.615 -10.718 43 HA ASP 37 HA ASP 37 5.577 16.948 -10.229 44 HB2 ASP 37 HB2 ASP 37 3.128 17.409 -9.989 45 HB3 ASP 37 HB1 ASP 37 3.066 17.728 -11.721 46 H ALA 38 HN ALA 38 6.509 19.193 -12.216 47 HA ALA 38 HA ALA 38 6.254 18.377 -14.842 48 HB1 ALA 38 HB1 ALA 38 8.856 19.360 -13.686 49 HB2 ALA 38 HB2 ALA 38 7.477 20.424 -13.960 50 HB3 ALA 38 HB3 ALA 38 8.237 19.596 -15.320 51 H LEU 39 HN LEU 39 8.256 17.504 -16.123 52 HA LEU 39 HA LEU 39 9.395 15.137 -14.786 53 HB2 LEU 39 HB2 LEU 39 8.053 15.088 -17.480 54 HB3 LEU 39 HB1 LEU 39 8.900 13.742 -16.718 55 HG LEU 39 HG LEU 39 7.159 14.413 -14.689 56 HD11 LEU 39 HD11 LEU 39 4.965 14.873 -15.670 57 HD12 LEU 39 HD12 LEU 39 5.677 14.921 -17.283 58 HD13 LEU 39 HD13 LEU 39 6.097 16.158 -16.097 59 HD21 LEU 39 HD21 LEU 39 7.449 12.166 -15.515 60 HD22 LEU 39 HD22 LEU 39 6.677 12.576 -17.050 61 HD23 LEU 39 HD23 LEU 39 5.727 12.548 -15.563 62 H ILE 40 HN ILE 40 11.508 15.253 -14.934 63 HA ILE 40 HA ILE 40 12.715 16.667 -17.246 64 HB ILE 40 HB ILE 40 13.872 15.856 -14.570 65 HG12 ILE 40 HG12 ILE 40 13.441 18.644 -15.684 66 HG13 ILE 40 HG11 ILE 40 12.180 17.813 -14.762 67 HG21 ILE 40 HG21 ILE 40 15.816 17.245 -15.330 68 HG22 ILE 40 HG22 ILE 40 15.082 17.334 -16.930 69 HG23 ILE 40 HG23 ILE 40 15.612 15.784 -16.285 70 HD11 ILE 40 HD11 ILE 40 13.467 19.179 -13.241 71 HD12 ILE 40 HD12 ILE 40 14.978 18.472 -13.815 72 HD13 ILE 40 HD13 ILE 40 13.830 17.489 -12.913 73 H MET 41 HN MET 41 14.160 15.695 -18.596 74 HA MET 41 HA MET 41 14.209 12.746 -18.552 75 HB2 MET 41 HB2 MET 41 13.626 14.068 -20.635 76 HB3 MET 41 HB1 MET 41 15.304 14.616 -20.667 77 HG2 MET 41 HG2 MET 41 16.078 12.284 -20.756 78 HG3 MET 41 HG1 MET 41 14.405 11.721 -20.692 79 HE1 MET 41 HE1 MET 41 15.043 10.325 -22.450 80 HE2 MET 41 HE2 MET 41 16.419 10.902 -23.387 81 HE3 MET 41 HE3 MET 41 14.851 10.710 -24.165 82 H CYS 42 HN CYS 42 15.918 11.604 -17.978 83 HA CYS 42 HA CYS 42 18.314 12.971 -17.047 84 HB2 CYS 42 HB2 CYS 42 17.191 10.999 -15.871 85 HB3 CYS 42 HB1 CYS 42 17.859 9.992 -17.155 86 H MET 43 HN MET 43 20.456 12.402 -17.743 87 HA MET 43 HA MET 43 20.554 11.636 -20.615 88 HB2 MET 43 HB2 MET 43 22.685 12.835 -20.667 89 HB3 MET 43 HB1 MET 43 21.397 13.886 -20.077 90 HG2 MET 43 HG2 MET 43 23.061 14.303 -18.503 91 HG3 MET 43 HG1 MET 43 22.178 13.001 -17.701 92 HE1 MET 43 HE1 MET 43 25.363 14.161 -19.469 93 HE2 MET 43 HE2 MET 43 26.490 13.154 -18.563 94 HE3 MET 43 HE3 MET 43 25.348 14.183 -17.701 95 H ARG 44 HN ARG 44 21.198 10.481 -17.511 96 HA ARG 44 HA ARG 44 23.414 8.745 -18.421 97 HB2 ARG 44 HB2 ARG 44 23.689 9.997 -16.288 98 HB3 ARG 44 HB1 ARG 44 22.292 9.138 -15.637 99 HG2 ARG 44 HG2 ARG 44 23.420 6.997 -15.919 100 HG3 ARG 44 HG1 ARG 44 24.791 7.790 -16.696 101 HD2 ARG 44 HD2 ARG 44 25.139 9.112 -14.592 102 HD3 ARG 44 HD1 ARG 44 23.875 8.148 -13.837 103 HE ARG 44 HE ARG 44 25.332 6.316 -13.771 104 HH11 ARG 44 HH21 ARG 44 26.621 8.965 -15.589 105 HH12 ARG 44 HH22 ARG 44 28.221 8.310 -15.671 106 HH21 ARG 44 HH11 ARG 44 27.430 5.452 -13.875 107 HH22 ARG 44 HH12 ARG 44 28.680 6.320 -14.702 108 H CYS 45 HN CYS 45 20.417 8.442 -16.485 109 HA CYS 45 HA CYS 45 20.203 5.629 -17.377 110 HB2 CYS 45 HB2 CYS 45 18.833 5.247 -15.473 111 HB3 CYS 45 HB1 CYS 45 20.207 6.204 -14.914 112 H ARG 46 HN ARG 46 19.078 8.629 -18.206 113 HA ARG 46 HA ARG 46 17.300 9.372 -19.451 114 HB2 ARG 46 HB2 ARG 46 17.251 6.446 -20.197 115 HB3 ARG 46 HB1 ARG 46 16.320 7.700 -21.022 116 HG2 ARG 46 HG2 ARG 46 18.364 8.874 -21.638 117 HG3 ARG 46 HG1 ARG 46 19.339 7.733 -20.710 118 HD2 ARG 46 HD2 ARG 46 19.417 7.121 -23.071 119 HD3 ARG 46 HD1 ARG 46 18.526 5.893 -22.176 120 HE ARG 46 HE ARG 46 16.568 6.552 -23.280 121 HH11 ARG 46 HH21 ARG 46 19.188 8.736 -23.857 122 HH12 ARG 46 HH22 ARG 46 18.381 9.587 -25.132 123 HH21 ARG 46 HH11 ARG 46 15.503 7.662 -24.951 124 HH22 ARG 46 HH12 ARG 46 16.294 8.979 -25.751 125 H LYS 47 HN LYS 47 16.795 8.585 -16.705 126 HA LYS 47 HA LYS 47 14.126 7.410 -16.721 127 HB2 LYS 47 HB2 LYS 47 15.653 6.829 -14.910 128 HB3 LYS 47 HB1 LYS 47 15.779 8.528 -14.446 129 HG2 LYS 47 HG2 LYS 47 13.366 8.578 -13.962 130 HG3 LYS 47 HG1 LYS 47 13.223 6.895 -14.472 131 HD2 LYS 47 HD2 LYS 47 15.239 7.584 -12.338 132 HD3 LYS 47 HD1 LYS 47 13.533 7.535 -11.898 133 HE2 LYS 47 HE2 LYS 47 14.978 5.280 -13.317 134 HE3 LYS 47 HE1 LYS 47 14.696 5.340 -11.578 135 HZ1 LYS 47 HZ1 LYS 47 12.896 4.148 -12.337 136 HZ2 LYS 47 HZ2 LYS 47 12.750 5.052 -13.768 137 HZ3 LYS 47 HZ3 LYS 47 12.258 5.718 -12.285 138 H VAL 48 HN VAL 48 12.263 8.519 -16.622 139 HA VAL 48 HA VAL 48 12.422 11.477 -16.456 140 HB VAL 48 HB VAL 48 10.015 11.199 -17.480 141 HG11 VAL 48 HG11 VAL 48 11.024 11.114 -19.751 142 HG12 VAL 48 HG12 VAL 48 12.554 10.599 -19.037 143 HG13 VAL 48 HG13 VAL 48 11.902 12.198 -18.672 144 HG21 VAL 48 HG21 VAL 48 9.640 9.169 -18.682 145 HG22 VAL 48 HG22 VAL 48 10.159 8.662 -17.073 146 HG23 VAL 48 HG23 VAL 48 11.297 8.618 -18.422 147 H LYS 49 HN LYS 49 11.584 12.482 -14.774 148 HA LYS 49 HA LYS 49 9.245 11.608 -13.442 149 HB2 LYS 49 HB2 LYS 49 11.430 10.211 -12.580 150 HB3 LYS 49 HB1 LYS 49 11.465 11.579 -11.480 151 HG2 LYS 49 HG2 LYS 49 10.061 10.110 -10.320 152 HG3 LYS 49 HG1 LYS 49 8.888 11.086 -11.195 153 HD2 LYS 49 HD2 LYS 49 8.828 9.379 -12.999 154 HD3 LYS 49 HD1 LYS 49 9.970 8.397 -12.083 155 HE2 LYS 49 HE2 LYS 49 7.266 9.283 -11.054 156 HE3 LYS 49 HE1 LYS 49 7.601 7.696 -11.745 157 HZ1 LYS 49 HZ1 LYS 49 9.569 8.151 -9.863 158 HZ2 LYS 49 HZ2 LYS 49 8.266 7.067 -9.744 159 HZ3 LYS 49 HZ3 LYS 49 8.121 8.645 -9.129 160 H GLY 50 HN GLY 50 9.084 12.886 -11.223 161 HA2 GLY 50 HA2 GLY 50 9.652 15.682 -11.952 162 HA3 GLY 50 HA1 GLY 50 8.480 15.130 -10.763 163 H ILE 51 HN ILE 51 9.590 16.926 -9.536 164 HA ILE 51 HA ILE 51 12.223 16.891 -8.693 165 HB ILE 51 HB ILE 51 10.429 18.615 -8.158 166 HG12 ILE 51 HG12 ILE 51 12.044 17.689 -5.765 167 HG13 ILE 51 HG11 ILE 51 12.751 18.531 -7.143 168 HG21 ILE 51 HG21 ILE 51 8.889 16.789 -7.190 169 HG22 ILE 51 HG22 ILE 51 9.010 18.293 -6.278 170 HG23 ILE 51 HG23 ILE 51 9.900 16.866 -5.747 171 HD11 ILE 51 HD11 ILE 51 12.099 19.997 -5.175 172 HD12 ILE 51 HD12 ILE 51 10.420 19.628 -5.570 173 HD13 ILE 51 HD13 ILE 51 11.434 20.476 -6.735 174 H ASP 52 HN ASP 52 10.061 14.381 -8.286 175 HA ASP 52 HA ASP 52 10.728 13.487 -5.678 176 HB2 ASP 52 HB2 ASP 52 8.667 12.795 -6.857 177 HB3 ASP 52 HB1 ASP 52 9.648 11.942 -8.048 178 H SER 53 HN SER 53 11.688 12.401 -8.930 179 HA SER 53 HA SER 53 13.895 10.844 -7.784 180 HB2 SER 53 HB2 SER 53 12.309 10.210 -9.805 181 HB3 SER 53 HB1 SER 53 13.533 11.073 -10.732 182 HG SER 53 HG SER 53 15.088 9.719 -9.711 183 H TYR 54 HN TYR 54 13.525 13.971 -8.338 184 HA TYR 54 HA TYR 54 16.341 14.346 -9.201 185 HB2 TYR 54 HB2 TYR 54 13.833 15.567 -10.286 186 HB3 TYR 54 HB1 TYR 54 15.227 16.640 -10.120 187 HD1 TYR 54 HD1 TYR 54 14.339 13.225 -11.419 188 HD2 TYR 54 HD2 TYR 54 16.820 16.697 -11.829 189 HE1 TYR 54 HE1 TYR 54 15.328 12.264 -13.461 190 HE2 TYR 54 HE2 TYR 54 17.812 15.740 -13.862 191 HH TYR 54 HH TYR 54 18.133 13.308 -14.802 192 H SER 55 HN SER 55 17.509 15.800 -8.092 193 HA SER 55 HA SER 55 16.610 16.574 -5.510 194 HB2 SER 55 HB2 SER 55 18.775 17.376 -5.174 195 HB3 SER 55 HB1 SER 55 19.033 16.154 -6.425 196 HG SER 55 HG SER 55 18.800 17.910 -7.957 197 H LYS 56 HN LYS 56 16.531 18.785 -4.697 198 HA LYS 56 HA LYS 56 14.733 20.403 -6.120 199 HB2 LYS 56 HB2 LYS 56 15.041 20.461 -3.654 200 HB3 LYS 56 HB1 LYS 56 16.600 21.252 -3.892 201 HG2 LYS 56 HG2 LYS 56 15.502 23.129 -5.026 202 HG3 LYS 56 HG1 LYS 56 13.938 22.331 -4.867 203 HD2 LYS 56 HD2 LYS 56 14.156 22.402 -2.405 204 HD3 LYS 56 HD1 LYS 56 15.714 23.219 -2.574 205 HE2 LYS 56 HE2 LYS 56 14.624 25.096 -3.723 206 HE3 LYS 56 HE1 LYS 56 13.066 24.279 -3.609 207 HZ1 LYS 56 HZ1 LYS 56 12.859 24.781 -1.446 208 HZ2 LYS 56 HZ2 LYS 56 13.966 26.020 -1.803 209 HZ3 LYS 56 HZ3 LYS 56 14.508 24.565 -1.112 210 H THR 57 HN THR 57 18.253 20.581 -5.778 211 HA THR 57 HA THR 57 18.571 23.047 -7.134 212 HB THR 57 HB THR 57 20.653 20.859 -7.157 213 HG1 THR 57 HG1 THR 57 21.171 21.803 -5.028 214 HG21 THR 57 HG21 THR 57 20.871 23.258 -8.191 215 HG22 THR 57 HG22 THR 57 22.185 22.635 -7.193 216 HG23 THR 57 HG23 THR 57 21.023 23.775 -6.513 217 H GLN 58 HN GLN 58 19.441 19.784 -8.320 218 HA GLN 58 HA GLN 58 19.855 20.392 -10.961 219 HB2 GLN 58 HB2 GLN 58 18.636 17.906 -9.763 220 HB3 GLN 58 HB1 GLN 58 19.162 18.029 -11.440 221 HG2 GLN 58 HG2 GLN 58 21.446 18.541 -10.718 222 HG3 GLN 58 HG1 GLN 58 20.939 18.512 -9.030 223 HE21 GLN 58 HE21 GLN 58 22.895 16.712 -10.509 224 HE22 GLN 58 HE22 GLN 58 22.315 15.134 -10.233 225 H TRP 59 HN TRP 59 16.785 19.658 -9.395 226 HA TRP 59 HA TRP 59 15.164 19.695 -11.692 227 HB2 TRP 59 HB2 TRP 59 14.365 18.858 -9.520 228 HB3 TRP 59 HB1 TRP 59 14.453 20.491 -8.849 229 HD1 TRP 59 HD1 TRP 59 12.440 18.334 -11.257 230 HE1 TRP 59 HE1 TRP 59 10.229 19.532 -11.812 231 HE3 TRP 59 HE3 TRP 59 13.299 22.831 -9.012 232 HZ2 TRP 59 HZ2 TRP 59 8.990 22.074 -11.367 233 HZ3 TRP 59 HZ3 TRP 59 11.590 24.628 -9.092 234 HH2 TRP 59 HH2 TRP 59 9.437 24.252 -10.265 235 H SER 60 HN SER 60 16.271 22.281 -9.550 236 HA SER 60 HA SER 60 14.707 24.321 -10.847 237 HB2 SER 60 HB2 SER 60 17.061 24.703 -8.998 238 HB3 SER 60 HB1 SER 60 15.778 25.855 -9.354 239 HG SER 60 HG SER 60 15.839 23.982 -7.480 240 H LYS 61 HN LYS 61 17.568 22.721 -11.589 241 HA LYS 61 HA LYS 61 18.922 24.922 -12.881 242 HB2 LYS 61 HB2 LYS 61 19.389 21.952 -12.838 243 HB3 LYS 61 HB1 LYS 61 20.347 23.019 -13.845 244 HG2 LYS 61 HG2 LYS 61 20.874 24.346 -11.762 245 HG3 LYS 61 HG1 LYS 61 20.079 23.088 -10.832 246 HD2 LYS 61 HD2 LYS 61 21.658 21.424 -11.902 247 HD3 LYS 61 HD1 LYS 61 22.515 22.798 -12.587 248 HE2 LYS 61 HE2 LYS 61 22.641 23.695 -10.179 249 HE3 LYS 61 HE1 LYS 61 22.188 22.066 -9.689 250 HZ1 LYS 61 HZ1 LYS 61 24.296 22.156 -11.646 251 HZ2 LYS 61 HZ2 LYS 61 24.191 21.268 -10.201 252 HZ3 LYS 61 HZ3 LYS 61 24.710 22.886 -10.172 253 H THR 62 HN THR 62 16.587 22.528 -13.753 254 HA THR 62 HA THR 62 16.966 22.746 -16.592 255 HB THR 62 HB THR 62 14.918 21.438 -16.769 256 HG1 THR 62 HG1 THR 62 14.708 21.726 -13.962 257 HG21 THR 62 HG21 THR 62 15.752 19.494 -15.796 258 HG22 THR 62 HG22 THR 62 16.283 20.327 -14.337 259 HG23 THR 62 HG23 THR 62 17.203 20.494 -15.828 260 H PHE 63 HN PHE 63 16.166 25.100 -14.637 261 HA PHE 63 HA PHE 63 14.193 26.285 -16.503 262 HB2 PHE 63 HB2 PHE 63 14.288 26.581 -13.486 263 HB3 PHE 63 HB1 PHE 63 13.207 27.458 -14.570 264 HD1 PHE 63 HD2 PHE 63 11.400 26.323 -15.749 265 HD2 PHE 63 HD1 PHE 63 13.978 24.215 -13.055 266 HE1 PHE 63 HE2 PHE 63 9.798 24.410 -15.709 267 HE2 PHE 63 HE1 PHE 63 12.392 22.304 -13.002 268 HZ PHE 63 HZ PHE 63 10.299 22.403 -14.340 269 H THR 64 HN THR 64 14.396 28.491 -16.864 270 HA THR 64 HA THR 64 16.802 29.827 -15.760 271 HB THR 64 HB THR 64 17.027 30.810 -18.168 272 HG1 THR 64 HG1 THR 64 15.164 28.808 -18.442 273 HG21 THR 64 HG21 THR 64 18.399 28.801 -18.848 274 HG22 THR 64 HG22 THR 64 17.765 27.975 -17.423 275 HG23 THR 64 HG23 THR 64 18.749 29.424 -17.236 276 H PHE 65 HN PHE 65 16.738 32.126 -15.928 277 HA PHE 65 HA PHE 65 13.977 33.168 -15.824 278 HB2 PHE 65 HB2 PHE 65 16.172 33.484 -14.096 279 HB3 PHE 65 HB1 PHE 65 16.075 35.024 -14.938 280 HD1 PHE 65 HD2 PHE 65 13.665 32.500 -13.541 281 HD2 PHE 65 HD1 PHE 65 14.761 36.639 -13.880 282 HE1 PHE 65 HE2 PHE 65 11.714 33.130 -12.149 283 HE2 PHE 65 HE1 PHE 65 12.814 37.264 -12.485 284 HZ PHE 65 HZ PHE 65 11.291 35.519 -11.632 285 H VAL 66 HN VAL 66 13.238 34.325 -17.433 286 HA VAL 66 HA VAL 66 15.136 35.909 -19.073 287 HB VAL 66 HB VAL 66 12.909 34.100 -20.021 288 HG11 VAL 66 HG11 VAL 66 14.371 36.360 -21.402 289 HG12 VAL 66 HG12 VAL 66 12.633 36.080 -21.309 290 HG13 VAL 66 HG13 VAL 66 13.642 35.037 -22.311 291 HG21 VAL 66 HG21 VAL 66 15.851 34.289 -20.745 292 HG22 VAL 66 HG22 VAL 66 14.709 33.088 -21.339 293 HG23 VAL 66 HG23 VAL 66 15.167 33.101 -19.635 294 H ARG 67 HN ARG 67 14.562 37.954 -19.360 295 HA ARG 67 HA ARG 67 13.410 39.916 -19.023 296 HB2 ARG 67 HB2 ARG 67 12.335 38.744 -21.087 297 HB3 ARG 67 HB1 ARG 67 10.976 38.422 -20.004 298 HG2 ARG 67 HG2 ARG 67 10.766 40.834 -19.530 299 HG3 ARG 67 HG1 ARG 67 12.147 41.164 -20.569 300 HD2 ARG 67 HD2 ARG 67 10.887 40.102 -22.463 301 HD3 ARG 67 HD1 ARG 67 9.483 39.996 -21.398 302 HE ARG 67 HE ARG 67 10.376 42.655 -21.367 303 HH11 ARG 67 HH21 ARG 67 9.062 40.315 -23.550 304 HH12 ARG 67 HH22 ARG 67 8.267 41.488 -24.546 305 HH21 ARG 67 HH11 ARG 67 9.337 44.199 -22.668 306 HH22 ARG 67 HH12 ARG 67 8.422 43.686 -24.046 307 H GLY 68 HN GLY 68 13.473 38.083 -16.748 308 HA2 GLY 68 HA2 GLY 68 12.644 38.142 -14.607 309 HA3 GLY 68 HA1 GLY 68 11.496 39.377 -15.127 310 H ARG 69 HN ARG 69 11.710 36.341 -16.814 311 HA ARG 69 HA ARG 69 9.228 35.386 -15.490 312 HB2 ARG 69 HB2 ARG 69 8.693 36.466 -17.661 313 HB3 ARG 69 HB1 ARG 69 9.780 35.333 -18.466 314 HG2 ARG 69 HG2 ARG 69 8.437 33.441 -17.668 315 HG3 ARG 69 HG1 ARG 69 7.368 34.546 -16.803 316 HD2 ARG 69 HD2 ARG 69 6.828 35.645 -18.983 317 HD3 ARG 69 HD1 ARG 69 7.795 34.421 -19.801 318 HE ARG 69 HE ARG 69 5.167 34.044 -18.586 319 HH11 ARG 69 HH21 ARG 69 8.068 32.641 -19.849 320 HH12 ARG 69 HH22 ARG 69 7.347 31.101 -20.177 321 HH21 ARG 69 HH11 ARG 69 4.213 32.025 -19.014 322 HH22 ARG 69 HH12 ARG 69 5.164 30.752 -19.704 323 H THR 70 HN THR 70 9.131 33.251 -15.084 324 HA THR 70 HA THR 70 11.553 31.721 -15.256 325 HB THR 70 HB THR 70 8.774 30.782 -14.511 326 HG1 THR 70 HG1 THR 70 9.117 32.179 -12.970 327 HG21 THR 70 HG21 THR 70 10.035 29.068 -13.242 328 HG22 THR 70 HG22 THR 70 11.543 29.717 -13.890 329 HG23 THR 70 HG23 THR 70 10.365 28.972 -14.971 330 H VAL 71 HN VAL 71 12.204 30.449 -16.864 331 HA VAL 71 HA VAL 71 10.198 29.363 -18.761 332 HB VAL 71 HB VAL 71 11.981 29.750 -20.549 333 HG11 VAL 71 HG11 VAL 71 9.976 31.083 -20.549 334 HG12 VAL 71 HG12 VAL 71 11.334 32.189 -20.768 335 HG13 VAL 71 HG13 VAL 71 10.554 32.052 -19.193 336 HG21 VAL 71 HG21 VAL 71 12.975 31.825 -18.567 337 HG22 VAL 71 HG22 VAL 71 13.673 31.383 -20.128 338 HG23 VAL 71 HG23 VAL 71 13.755 30.262 -18.784 339 H SER 72 HN SER 72 10.451 27.285 -19.261 340 HA SER 72 HA SER 72 12.329 25.689 -17.813 341 HB2 SER 72 HB2 SER 72 10.343 25.094 -20.003 342 HB3 SER 72 HB1 SER 72 11.425 23.850 -19.367 343 HG SER 72 HG SER 72 9.172 24.434 -18.371 344 H VAL 73 HN VAL 73 14.078 24.469 -18.603 345 HA VAL 73 HA VAL 73 15.532 25.744 -20.755 346 HB VAL 73 HB VAL 73 16.239 23.403 -18.978 347 HG11 VAL 73 HG11 VAL 73 17.860 25.003 -20.977 348 HG12 VAL 73 HG12 VAL 73 17.506 23.281 -21.044 349 HG13 VAL 73 HG13 VAL 73 18.566 23.911 -19.789 350 HG21 VAL 73 HG21 VAL 73 15.913 25.798 -18.008 351 HG22 VAL 73 HG22 VAL 73 17.382 26.200 -18.894 352 HG23 VAL 73 HG23 VAL 73 17.417 24.956 -17.643 353 H SER 74 HN SER 74 15.615 25.061 -22.814 354 HA SER 74 HA SER 74 14.017 22.915 -23.735 355 HB2 SER 74 HB2 SER 74 15.081 23.366 -25.921 356 HB3 SER 74 HB1 SER 74 14.524 24.845 -25.145 357 HG SER 74 HG SER 74 16.769 24.739 -26.053 358 H ASP 75 HN ASP 75 17.418 23.206 -22.921 359 HA ASP 75 HA ASP 75 17.748 20.296 -23.437 360 HB2 ASP 75 HB2 ASP 75 18.944 21.784 -25.077 361 HB3 ASP 75 HB1 ASP 75 19.921 22.364 -23.723 362 HA PRO 76 HA PRO 76 18.826 21.238 -19.042 363 HB2 PRO 76 HB2 PRO 76 17.125 19.442 -17.873 364 HB3 PRO 76 HB1 PRO 76 16.625 21.083 -18.333 365 HG2 PRO 76 HG2 PRO 76 16.077 18.484 -19.675 366 HG3 PRO 76 HG1 PRO 76 15.069 19.937 -19.573 367 HD2 PRO 76 HD2 PRO 76 16.619 19.189 -21.786 368 HD3 PRO 76 HD1 PRO 76 15.964 20.813 -21.494 369 H LYS 77 HN LYS 77 20.801 20.324 -18.821 370 HA LYS 77 HA LYS 77 21.102 17.405 -19.194 371 HB2 LYS 77 HB2 LYS 77 23.174 19.589 -18.979 372 HB3 LYS 77 HB1 LYS 77 23.511 17.877 -19.252 373 HG2 LYS 77 HG2 LYS 77 22.072 17.999 -21.315 374 HG3 LYS 77 HG1 LYS 77 21.965 19.740 -21.077 375 HD2 LYS 77 HD2 LYS 77 24.587 18.243 -21.330 376 HD3 LYS 77 HD1 LYS 77 23.779 19.024 -22.687 377 HE2 LYS 77 HE2 LYS 77 23.793 21.158 -21.224 378 HE3 LYS 77 HE1 LYS 77 24.971 20.307 -20.229 379 HZ1 LYS 77 HZ1 LYS 77 25.433 21.685 -22.577 380 HZ2 LYS 77 HZ2 LYS 77 25.647 20.040 -22.948 381 HZ3 LYS 77 HZ3 LYS 77 26.539 20.754 -21.690 382 H VAL 78 HN VAL 78 20.174 16.791 -17.201 383 HA VAL 78 HA VAL 78 22.027 17.094 -14.921 384 HB VAL 78 HB VAL 78 19.823 17.140 -13.488 385 HG11 VAL 78 HG11 VAL 78 20.938 19.491 -15.042 386 HG12 VAL 78 HG12 VAL 78 21.395 18.962 -13.422 387 HG13 VAL 78 HG13 VAL 78 19.804 19.668 -13.704 388 HG21 VAL 78 HG21 VAL 78 17.893 17.992 -14.520 389 HG22 VAL 78 HG22 VAL 78 18.499 16.877 -15.752 390 HG23 VAL 78 HG23 VAL 78 18.782 18.609 -15.913 391 H ILE 79 HN ILE 79 21.725 15.443 -13.282 392 HA ILE 79 HA ILE 79 20.647 12.920 -14.417 393 HB ILE 79 HB ILE 79 22.393 11.775 -13.124 394 HG12 ILE 79 HG12 ILE 79 23.405 14.576 -12.567 395 HG13 ILE 79 HG11 ILE 79 22.652 13.523 -11.370 396 HG21 ILE 79 HG21 ILE 79 22.775 12.431 -15.490 397 HG22 ILE 79 HG22 ILE 79 24.271 12.414 -14.556 398 HG23 ILE 79 HG23 ILE 79 23.485 13.947 -14.932 399 HD11 ILE 79 HD11 ILE 79 25.068 13.342 -11.165 400 HD12 ILE 79 HD12 ILE 79 25.217 12.976 -12.884 401 HD13 ILE 79 HD13 ILE 79 24.432 11.825 -11.802 402 H CYS 80 HN CYS 80 20.138 11.277 -12.713 403 HA CYS 80 HA CYS 80 18.311 12.470 -10.818 404 HB2 CYS 80 HB2 CYS 80 19.028 9.543 -10.900 405 HB3 CYS 80 HB1 CYS 80 17.486 10.301 -10.485 406 H ARG 81 HN ARG 81 18.275 11.682 -8.531 407 HA ARG 81 HA ARG 81 20.683 12.380 -7.210 408 HB2 ARG 81 HB2 ARG 81 18.147 11.064 -6.218 409 HB3 ARG 81 HB1 ARG 81 19.472 11.547 -5.158 410 HG2 ARG 81 HG2 ARG 81 19.260 13.865 -5.869 411 HG3 ARG 81 HG1 ARG 81 18.022 13.422 -7.044 412 HD2 ARG 81 HD2 ARG 81 16.936 14.312 -5.061 413 HD3 ARG 81 HD1 ARG 81 16.600 12.590 -5.172 414 HE ARG 81 HE ARG 81 18.914 12.982 -3.595 415 HH11 ARG 81 HH21 ARG 81 15.490 13.491 -3.590 416 HH12 ARG 81 HH22 ARG 81 15.335 13.371 -1.869 417 HH21 ARG 81 HH11 ARG 81 18.717 12.824 -1.338 418 HH22 ARG 81 HH12 ARG 81 17.162 12.993 -0.593 419 H THR 82 HN THR 82 19.179 9.284 -8.008 420 HA THR 82 HA THR 82 21.088 7.719 -6.531 421 HB THR 82 HB THR 82 20.028 5.801 -7.655 422 HG1 THR 82 HG1 THR 82 18.193 7.477 -8.890 423 HG21 THR 82 HG21 THR 82 18.177 7.942 -6.584 424 HG22 THR 82 HG22 THR 82 18.920 6.621 -5.682 425 HG23 THR 82 HG23 THR 82 17.671 6.279 -6.878 426 H CYS 83 HN CYS 83 20.864 9.029 -9.742 427 HA CYS 83 HA CYS 83 22.668 7.340 -11.082 428 HB2 CYS 83 HB2 CYS 83 21.560 10.064 -11.501 429 HB3 CYS 83 HB1 CYS 83 23.077 9.724 -12.342 430 H GLN 84 HN GLN 84 23.165 9.897 -8.779 431 HA GLN 84 HA GLN 84 26.037 9.909 -9.338 432 HB2 GLN 84 HB2 GLN 84 26.057 11.838 -7.715 433 HB3 GLN 84 HB1 GLN 84 25.115 12.104 -9.180 434 HG2 GLN 84 HG2 GLN 84 23.057 11.667 -8.023 435 HG3 GLN 84 HG1 GLN 84 23.926 11.103 -6.592 436 HE21 GLN 84 HE21 GLN 84 25.455 12.855 -5.596 437 HE22 GLN 84 HE22 GLN 84 24.866 14.447 -5.584 438 HA PRO 85 HA PRO 85 26.860 7.311 -5.849 439 HB2 PRO 85 HB2 PRO 85 29.367 8.233 -5.133 440 HB3 PRO 85 HB1 PRO 85 29.064 7.196 -6.545 441 HG2 PRO 85 HG2 PRO 85 29.429 10.162 -6.420 442 HG3 PRO 85 HG1 PRO 85 30.061 8.997 -7.599 443 HD2 PRO 85 HD2 PRO 85 27.914 10.552 -8.118 444 HD3 PRO 85 HD1 PRO 85 28.075 8.911 -8.786 445 H LYS 86 HN LYS 86 26.615 7.301 -3.644 446 HA LYS 86 HA LYS 86 26.887 9.795 -2.130 447 HB2 LYS 86 HB2 LYS 86 24.301 8.281 -2.466 448 HB3 LYS 86 HB1 LYS 86 24.598 9.347 -1.094 449 HG2 LYS 86 HG2 LYS 86 25.085 11.205 -2.677 450 HG3 LYS 86 HG1 LYS 86 24.695 10.132 -4.022 451 HD2 LYS 86 HD2 LYS 86 22.416 9.855 -3.195 452 HD3 LYS 86 HD1 LYS 86 22.789 10.826 -1.769 453 HE2 LYS 86 HE2 LYS 86 23.265 12.769 -3.216 454 HE3 LYS 86 HE1 LYS 86 22.881 11.802 -4.638 455 HZ1 LYS 86 HZ1 LYS 86 20.813 12.525 -4.338 456 HZ2 LYS 86 HZ2 LYS 86 21.124 13.067 -2.757 457 HZ3 LYS 86 HZ3 LYS 86 20.729 11.438 -3.039 458 H GLN 87 HN GLN 87 26.835 9.465 0.179 459 HA GLN 87 HA GLN 87 28.237 7.101 0.961 460 HB2 GLN 87 HB2 GLN 87 26.993 9.327 2.599 461 HB3 GLN 87 HB1 GLN 87 28.027 8.051 3.259 462 HG2 GLN 87 HG2 GLN 87 29.863 8.749 1.795 463 HG3 GLN 87 HG1 GLN 87 28.838 9.984 1.068 464 HE21 GLN 87 HE21 GLN 87 30.929 11.211 2.054 465 HE22 GLN 87 HE22 GLN 87 30.684 11.856 3.605 466 H HIS 88 HN HIS 88 25.220 7.197 0.026 467 HA HIS 88 HA HIS 88 23.304 6.004 0.451 468 HB2 HIS 88 HB2 HIS 88 25.217 4.246 2.012 469 HB3 HIS 88 HB1 HIS 88 23.612 3.784 1.430 470 HD2 HIS 88 HD2 HIS 88 27.192 3.603 0.203 471 HE1 HIS 88 HE1 HIS 88 24.817 3.480 -3.285 472 HE2 HIS 88 HE2 HIS 88 27.158 3.132 -2.366 473 H ASP 89 HN ASP 89 22.593 7.857 1.760 474 HA ASP 89 HA ASP 89 22.718 7.487 4.674 475 HB2 ASP 89 HB2 ASP 89 21.654 9.727 2.944 476 HB3 ASP 89 HB1 ASP 89 21.546 9.702 4.703 477 H SER 90 HN SER 90 20.883 6.310 2.233 478 HA SER 90 HA SER 90 18.512 6.041 3.992 479 HB2 SER 90 HB2 SER 90 18.502 6.695 1.035 480 HB3 SER 90 HB1 SER 90 17.077 6.219 1.965 481 HG SER 90 HG SER 90 18.745 8.488 2.344 482 H ILE 91 HN ILE 91 17.396 4.105 3.808 483 HA ILE 91 HA ILE 91 18.699 2.000 2.148 484 HB ILE 91 HB ILE 91 17.633 1.767 4.968 485 HG12 ILE 91 HG12 ILE 91 20.426 1.276 3.889 486 HG13 ILE 91 HG11 ILE 91 19.928 2.818 4.598 487 HG21 ILE 91 HG21 ILE 91 18.618 -0.600 4.684 488 HG22 ILE 91 HG22 ILE 91 18.590 -0.268 2.947 489 HG23 ILE 91 HG23 ILE 91 17.086 -0.268 3.867 490 HD11 ILE 91 HD11 ILE 91 19.994 0.108 5.950 491 HD12 ILE 91 HD12 ILE 91 19.221 1.525 6.645 492 HD13 ILE 91 HD13 ILE 91 20.951 1.530 6.357 493 H TRP 92 HN TRP 92 17.384 0.819 0.919 494 HA TRP 92 HA TRP 92 14.596 1.538 0.762 495 HB2 TRP 92 HB2 TRP 92 15.644 1.096 -1.323 496 HB3 TRP 92 HB1 TRP 92 16.342 -0.419 -0.738 497 HD1 TRP 92 HD1 TRP 92 12.696 0.735 -0.361 498 HE1 TRP 92 HE1 TRP 92 11.158 -1.026 -1.454 499 HE3 TRP 92 HE3 TRP 92 16.220 -2.366 -2.344 500 HZ2 TRP 92 HZ2 TRP 92 11.408 -3.427 -2.990 501 HZ3 TRP 92 HZ3 TRP 92 15.551 -4.382 -3.619 502 HH2 TRP 92 HH2 TRP 92 13.151 -4.916 -3.944 503 H CYS 93 HN CYS 93 13.139 0.749 2.123 504 HA CYS 93 HA CYS 93 13.547 -1.845 3.430 505 HB2 CYS 93 HB2 CYS 93 12.775 -0.067 4.861 506 HB3 CYS 93 HB1 CYS 93 11.459 0.316 3.752 507 H THR 94 HN THR 94 12.472 -3.669 2.900 508 HA THR 94 HA THR 94 10.623 -3.564 0.613 509 HB THR 94 HB THR 94 11.089 -5.818 0.280 510 HG1 THR 94 HG1 THR 94 11.017 -5.862 2.957 511 HG21 THR 94 HG21 THR 94 13.571 -4.862 1.728 512 HG22 THR 94 HG22 THR 94 13.131 -4.364 0.094 513 HG23 THR 94 HG23 THR 94 13.489 -6.057 0.434 514 H ALA 95 HN ALA 95 10.506 -3.590 3.997 515 HA ALA 95 HA ALA 95 8.015 -5.112 4.189 516 HB1 ALA 95 HB1 ALA 95 9.653 -3.615 6.242 517 HB2 ALA 95 HB2 ALA 95 9.596 -5.358 6.000 518 HB3 ALA 95 HB3 ALA 95 8.177 -4.502 6.603 519 H CYS 96 HN CYS 96 9.104 -1.807 3.954 520 HA CYS 96 HA CYS 96 6.408 -0.794 4.599 521 HB2 CYS 96 HB2 CYS 96 9.077 0.588 4.273 522 HB3 CYS 96 HB1 CYS 96 7.546 1.440 4.502 523 H GLN 97 HN GLN 97 8.839 -0.896 2.035 524 HA GLN 97 HA GLN 97 8.511 -0.848 -0.261 525 HB2 GLN 97 HB2 GLN 97 6.050 -1.524 0.409 526 HB3 GLN 97 HB1 GLN 97 5.687 0.167 0.065 527 HG2 GLN 97 HG2 GLN 97 6.686 -0.066 -2.169 528 HG3 GLN 97 HG1 GLN 97 7.009 -1.768 -1.841 529 HE21 GLN 97 HE21 GLN 97 5.424 -3.129 -2.650 530 HE22 GLN 97 HE22 GLN 97 3.790 -2.715 -2.849 531 H GLN 98 HN GLN 98 9.366 1.322 1.506 532 HA GLN 98 HA GLN 98 9.139 3.504 -0.413 533 HB2 GLN 98 HB2 GLN 98 8.682 5.054 1.694 534 HB3 GLN 98 HB1 GLN 98 7.345 4.280 0.846 535 HG2 GLN 98 HG2 GLN 98 7.275 2.481 2.449 536 HG3 GLN 98 HG1 GLN 98 8.736 3.065 3.244 537 HE21 GLN 98 HE21 GLN 98 7.252 3.149 5.226 538 HE22 GLN 98 HE22 GLN 98 6.293 4.532 5.439 539 H THR 99 HN THR 99 10.566 5.355 0.252 540 HA THR 99 HA THR 99 13.157 4.307 0.961 541 HB THR 99 HB THR 99 12.408 7.214 0.602 542 HG1 THR 99 HG1 THR 99 11.731 6.296 -1.240 543 HG21 THR 99 HG21 THR 99 14.636 6.894 1.463 544 HG22 THR 99 HG22 THR 99 14.785 7.268 -0.253 545 HG23 THR 99 HG23 THR 99 14.959 5.604 0.305 546 H LYS 100 HN LYS 100 14.267 4.525 2.829 547 HA LYS 100 HA LYS 100 13.106 6.177 4.980 548 HB2 LYS 100 HB2 LYS 100 12.497 3.675 5.135 549 HB3 LYS 100 HB1 LYS 100 14.197 3.417 5.496 550 HG2 LYS 100 HG2 LYS 100 13.286 3.688 7.649 551 HG3 LYS 100 HG1 LYS 100 13.875 5.307 7.283 552 HD2 LYS 100 HD2 LYS 100 11.681 6.094 6.749 553 HD3 LYS 100 HD1 LYS 100 11.028 4.460 6.683 554 HE2 LYS 100 HE2 LYS 100 11.231 4.181 9.035 555 HE3 LYS 100 HE1 LYS 100 12.206 5.640 9.196 556 HZ1 LYS 100 HZ1 LYS 100 9.335 5.438 8.504 557 HZ2 LYS 100 HZ2 LYS 100 10.233 6.863 8.275 558 HZ3 LYS 100 HZ3 LYS 100 10.035 6.222 9.836 559 H GLY 101 HN GLY 101 14.561 7.175 6.287 560 HA2 GLY 101 HA2 GLY 101 17.194 7.562 5.350 561 HA3 GLY 101 HA1 GLY 101 16.589 8.071 6.922 562 H ILE 102 HN ILE 102 19.164 7.186 6.655 563 HA ILE 102 HA ILE 102 19.383 4.395 7.333 564 HB ILE 102 HB ILE 102 21.164 5.636 6.115 565 HG12 ILE 102 HG12 ILE 102 22.146 4.599 8.788 566 HG13 ILE 102 HG11 ILE 102 21.538 3.527 7.518 567 HG21 ILE 102 HG21 ILE 102 22.515 7.245 7.225 568 HG22 ILE 102 HG22 ILE 102 21.836 6.846 8.804 569 HG23 ILE 102 HG23 ILE 102 20.857 7.704 7.613 570 HD11 ILE 102 HD11 ILE 102 23.719 5.552 6.985 571 HD12 ILE 102 HD12 ILE 102 23.273 4.146 6.018 572 HD13 ILE 102 HD13 ILE 102 24.078 3.929 7.572 573 H ASN 103 HN ASN 103 18.955 7.367 9.049 574 HA ASN 103 HA ASN 103 20.044 6.677 11.547 575 HB2 ASN 103 HB2 ASN 103 17.832 8.547 10.706 576 HB3 ASN 103 HB1 ASN 103 18.281 8.358 12.400 577 HD21 ASN 103 HD21 ASN 103 18.785 10.454 9.976 578 HD22 ASN 103 HD22 ASN 103 20.404 10.911 10.286 579 H GLU 104 HN GLU 104 16.813 6.155 10.184 580 HA GLU 104 HA GLU 104 15.850 4.840 12.589 581 HB2 GLU 104 HB2 GLU 104 14.652 5.188 9.834 582 HB3 GLU 104 HB1 GLU 104 13.830 4.407 11.184 583 HG2 GLU 104 HG2 GLU 104 14.919 7.234 11.271 584 HG3 GLU 104 HG1 GLU 104 13.237 6.835 10.921 585 H PHE 105 HN PHE 105 18.191 3.795 10.979 586 HA PHE 105 HA PHE 105 17.191 1.016 10.757 587 HB2 PHE 105 HB2 PHE 105 18.515 2.687 8.719 588 HB3 PHE 105 HB1 PHE 105 19.292 1.115 8.939 589 HD1 PHE 105 HD1 PHE 105 15.976 2.742 8.313 590 HD2 PHE 105 HD2 PHE 105 18.324 -0.826 8.085 591 HE1 PHE 105 HE1 PHE 105 14.191 1.647 7.011 592 HE2 PHE 105 HE2 PHE 105 16.518 -1.940 6.807 593 HZ PHE 105 HZ PHE 105 14.454 -0.703 6.268 594 H SER 106 HN SER 106 18.487 -0.566 11.516 595 HA SER 106 HA SER 106 20.749 0.323 13.174 596 HB2 SER 106 HB2 SER 106 19.567 -1.100 14.529 597 HB3 SER 106 HB1 SER 106 18.877 -1.981 13.168 598 HG SER 106 HG SER 106 21.219 -2.395 14.580 599 H LYS 107 HN LYS 107 22.487 -1.553 13.307 600 HA LYS 107 HA LYS 107 23.794 -1.553 10.750 601 HB2 LYS 107 HB2 LYS 107 24.521 -2.808 13.401 602 HB3 LYS 107 HB1 LYS 107 25.553 -2.858 11.973 603 HG2 LYS 107 HG2 LYS 107 25.591 -0.397 11.896 604 HG3 LYS 107 HG1 LYS 107 24.538 -0.333 13.315 605 HD2 LYS 107 HD2 LYS 107 26.243 -1.481 14.657 606 HD3 LYS 107 HD1 LYS 107 27.292 -1.609 13.244 607 HE2 LYS 107 HE2 LYS 107 27.980 0.300 14.615 608 HE3 LYS 107 HE1 LYS 107 27.331 0.872 13.079 609 HZ1 LYS 107 HZ1 LYS 107 25.826 2.031 14.185 610 HZ2 LYS 107 HZ2 LYS 107 26.451 1.478 15.665 611 HZ3 LYS 107 HZ3 LYS 107 25.213 0.613 14.886 612 H ALA 108 HN ALA 108 22.191 -3.971 12.765 613 HA ALA 108 HA ALA 108 22.916 -6.264 11.337 614 HB1 ALA 108 HB1 ALA 108 20.237 -5.842 12.667 615 HB2 ALA 108 HB2 ALA 108 21.720 -6.146 13.573 616 HB3 ALA 108 HB3 ALA 108 21.109 -7.359 12.448 617 H GLN 109 HN GLN 109 20.234 -4.018 10.847 618 HA GLN 109 HA GLN 109 18.874 -5.432 8.845 619 HB2 GLN 109 HB2 GLN 109 19.075 -2.507 9.521 620 HB3 GLN 109 HB1 GLN 109 18.119 -3.079 8.144 621 HG2 GLN 109 HG2 GLN 109 16.848 -2.815 10.333 622 HG3 GLN 109 HG1 GLN 109 16.700 -4.388 9.539 623 HE21 GLN 109 HE21 GLN 109 16.587 -5.867 11.256 624 HE22 GLN 109 HE22 GLN 109 17.702 -5.936 12.534 625 H ARG 110 HN ARG 110 21.601 -3.225 8.677 626 HA ARG 110 HA ARG 110 21.710 -3.088 5.831 627 HB2 ARG 110 HB2 ARG 110 23.724 -2.443 7.992 628 HB3 ARG 110 HB1 ARG 110 24.050 -2.219 6.271 629 HG2 ARG 110 HG2 ARG 110 22.203 -0.676 6.050 630 HG3 ARG 110 HG1 ARG 110 21.676 -0.999 7.708 631 HD2 ARG 110 HD2 ARG 110 22.929 1.111 7.610 632 HD3 ARG 110 HD1 ARG 110 23.814 -0.089 8.555 633 HE ARG 110 HE ARG 110 25.447 -0.156 6.880 634 HH11 ARG 110 HH21 ARG 110 22.655 1.626 5.896 635 HH12 ARG 110 HH22 ARG 110 23.399 2.286 4.481 636 HH21 ARG 110 HH11 ARG 110 26.436 0.706 5.028 637 HH22 ARG 110 HH12 ARG 110 25.543 1.766 3.990 638 H HIS 111 HN HIS 111 23.262 -5.093 8.294 639 HA HIS 111 HA HIS 111 25.155 -6.379 6.682 640 HB2 HIS 111 HB2 HIS 111 25.112 -6.553 9.143 641 HB3 HIS 111 HB1 HIS 111 23.633 -7.517 9.043 642 HD2 HIS 111 HD2 HIS 111 24.118 -10.225 8.762 643 HE1 HIS 111 HE1 HIS 111 28.146 -9.981 7.520 644 HE2 HIS 111 HE2 HIS 111 26.268 -11.574 8.143 645 H VAL 112 HN VAL 112 21.774 -7.222 7.366 646 HA VAL 112 HA VAL 112 21.814 -9.608 5.781 647 HB VAL 112 HB VAL 112 19.346 -9.531 6.053 648 HG11 VAL 112 HG11 VAL 112 19.375 -9.956 8.396 649 HG12 VAL 112 HG12 VAL 112 20.694 -8.813 8.669 650 HG13 VAL 112 HG13 VAL 112 21.006 -10.348 7.849 651 HG21 VAL 112 HG21 VAL 112 19.930 -6.964 7.524 652 HG22 VAL 112 HG22 VAL 112 18.347 -7.713 7.350 653 HG23 VAL 112 HG23 VAL 112 19.163 -7.033 5.941 654 H LEU 113 HN LEU 113 20.835 -9.963 3.765 655 HA LEU 113 HA LEU 113 21.248 -7.884 1.878 656 HB2 LEU 113 HB2 LEU 113 21.368 -10.477 1.570 657 HB3 LEU 113 HB1 LEU 113 19.626 -10.356 1.298 658 HG LEU 113 HG LEU 113 20.325 -8.406 -0.375 659 HD11 LEU 113 HD11 LEU 113 22.714 -8.409 0.210 660 HD12 LEU 113 HD12 LEU 113 22.504 -8.908 -1.463 661 HD13 LEU 113 HD13 LEU 113 22.831 -10.113 -0.222 662 HD21 LEU 113 HD21 LEU 113 19.194 -10.432 -1.088 663 HD22 LEU 113 HD22 LEU 113 20.686 -11.360 -0.947 664 HD23 LEU 113 HD23 LEU 113 20.535 -10.116 -2.188 665 H ASP 114 HN ASP 114 18.660 -8.607 3.909 666 HA ASP 114 HA ASP 114 16.834 -6.925 2.271 667 HB2 ASP 114 HB2 ASP 114 15.880 -9.085 4.129 668 HB3 ASP 114 HB1 ASP 114 15.001 -8.249 2.848 669 HA PRO 115 HA PRO 115 17.613 -4.868 6.351 670 HB2 PRO 115 HB2 PRO 115 17.108 -2.479 4.621 671 HB3 PRO 115 HB1 PRO 115 18.441 -2.786 5.760 672 HG2 PRO 115 HG2 PRO 115 18.811 -2.865 3.115 673 HG3 PRO 115 HG1 PRO 115 19.654 -3.991 4.204 674 HD2 PRO 115 HD2 PRO 115 17.261 -4.495 2.455 675 HD3 PRO 115 HD1 PRO 115 18.662 -5.538 2.793 676 H ARG 116 HN ARG 116 16.063 -4.070 7.750 677 HA ARG 116 HA ARG 116 13.453 -3.222 6.703 678 HB2 ARG 116 HB2 ARG 116 13.544 -5.343 8.838 679 HB3 ARG 116 HB1 ARG 116 12.189 -4.848 7.819 680 HG2 ARG 116 HG2 ARG 116 13.381 -5.748 5.834 681 HG3 ARG 116 HG1 ARG 116 14.671 -6.304 6.897 682 HD2 ARG 116 HD2 ARG 116 13.193 -8.164 6.490 683 HD3 ARG 116 HD1 ARG 116 12.998 -7.645 8.166 684 HE ARG 116 HE ARG 116 11.109 -6.294 6.551 685 HH11 ARG 116 HH21 ARG 116 11.901 -9.434 7.769 686 HH12 ARG 116 HH22 ARG 116 10.261 -9.991 7.789 687 HH21 ARG 116 HH11 ARG 116 8.957 -7.017 6.573 688 HH22 ARG 116 HH12 ARG 116 8.594 -8.623 7.112 689 H CYS 117 HN CYS 117 12.796 -1.480 7.773 690 HA CYS 117 HA CYS 117 14.112 -0.135 9.727 691 HB2 CYS 117 HB2 CYS 117 11.101 -0.247 9.831 692 HB3 CYS 117 HB1 CYS 117 12.173 1.140 10.064 693 H GLN 118 HN GLN 118 14.140 -0.039 11.969 694 HA GLN 118 HA GLN 118 14.150 -2.387 13.416 695 HB2 GLN 118 HB2 GLN 118 13.727 0.485 14.242 696 HB3 GLN 118 HB1 GLN 118 13.742 -0.811 15.445 697 HG2 GLN 118 HG2 GLN 118 15.986 0.048 15.293 698 HG3 GLN 118 HG1 GLN 118 15.983 -1.527 14.510 699 HE21 GLN 118 HE21 GLN 118 16.766 1.773 14.057 700 HE22 GLN 118 HE22 GLN 118 17.004 1.722 12.381 701 H ILE 119 HN ILE 119 11.431 -0.374 12.597 702 HA ILE 119 HA ILE 119 9.630 -1.656 14.468 703 HB ILE 119 HB ILE 119 9.194 0.276 12.184 704 HG12 ILE 119 HG12 ILE 119 8.611 1.801 14.074 705 HG13 ILE 119 HG11 ILE 119 9.031 0.515 15.209 706 HG21 ILE 119 HG21 ILE 119 6.866 0.456 13.265 707 HG22 ILE 119 HG22 ILE 119 7.230 -1.092 14.025 708 HG23 ILE 119 HG23 ILE 119 7.176 -0.965 12.268 709 HD11 ILE 119 HD11 ILE 119 11.301 0.674 14.767 710 HD12 ILE 119 HD12 ILE 119 10.820 2.351 14.538 711 HD13 ILE 119 HD13 ILE 119 11.062 1.311 13.138 712 H CYS 120 HN CYS 120 10.744 -2.210 11.261 713 HA CYS 120 HA CYS 120 8.492 -3.846 10.456 714 HB2 CYS 120 HB2 CYS 120 11.184 -3.299 9.198 715 HB3 CYS 120 HB1 CYS 120 9.984 -4.389 8.494 716 H VAL 121 HN VAL 121 11.818 -4.379 11.530 717 HA VAL 121 HA VAL 121 11.619 -7.244 11.325 718 HB VAL 121 HB VAL 121 13.798 -6.332 11.052 719 HG11 VAL 121 HG11 VAL 121 13.159 -4.844 13.605 720 HG12 VAL 121 HG12 VAL 121 13.643 -4.192 12.041 721 HG13 VAL 121 HG13 VAL 121 14.818 -5.036 13.043 722 HG21 VAL 121 HG21 VAL 121 13.473 -8.409 12.578 723 HG22 VAL 121 HG22 VAL 121 13.840 -7.317 13.914 724 HG23 VAL 121 HG23 VAL 121 15.034 -7.592 12.645 725 H HIS 122 HN HIS 122 11.197 -4.834 13.828 726 HA HIS 122 HA HIS 122 10.982 -6.796 15.954 727 HB2 HIS 122 HB2 HIS 122 10.369 -3.831 15.936 728 HB3 HIS 122 HB1 HIS 122 10.425 -4.859 17.371 729 HD2 HIS 122 HD2 HIS 122 12.707 -2.421 16.914 730 HE1 HIS 122 HE1 HIS 122 15.348 -5.658 16.307 731 HE2 HIS 122 HE2 HIS 122 15.205 -3.177 16.829 732 H SER 123 HN SER 123 9.084 -6.472 13.488 733 HA SER 123 HA SER 123 6.516 -6.212 14.923 734 HB2 SER 123 HB2 SER 123 6.731 -4.948 12.847 735 HB3 SER 123 HB1 SER 123 7.132 -6.418 11.967 736 HG SER 123 HG SER 123 4.762 -6.166 13.488 737 H GLN 124 HN GLN 124 8.047 -8.412 12.556 738 HA GLN 124 HA GLN 124 6.675 -10.681 13.888 739 HB2 GLN 124 HB2 GLN 124 6.889 -10.188 10.905 740 HB3 GLN 124 HB1 GLN 124 6.297 -11.674 11.648 741 HG2 GLN 124 HG2 GLN 124 5.094 -8.936 12.135 742 HG3 GLN 124 HG1 GLN 124 4.460 -10.103 10.977 743 HE21 GLN 124 HE21 GLN 124 3.621 -8.981 13.860 744 HE22 GLN 124 HE22 GLN 124 3.099 -10.398 14.636 745 H ARG 125 HN ARG 125 9.399 -9.661 14.133 746 HA ARG 125 HA ARG 125 11.561 -10.443 14.166 747 HB2 ARG 125 HB2 ARG 125 10.113 -13.085 13.825 748 HB3 ARG 125 HB1 ARG 125 11.812 -12.909 14.285 749 HG2 ARG 125 HG2 ARG 125 11.183 -11.694 16.301 750 HG3 ARG 125 HG1 ARG 125 9.484 -11.726 15.830 751 HD2 ARG 125 HD2 ARG 125 9.845 -13.495 17.442 752 HD3 ARG 125 HD1 ARG 125 9.584 -14.231 15.865 753 HE ARG 125 HE ARG 125 11.814 -14.937 15.856 754 HH11 ARG 125 HH21 ARG 125 11.150 -12.735 18.442 755 HH12 ARG 125 HH22 ARG 125 12.650 -13.023 19.259 756 HH21 ARG 125 HH11 ARG 125 13.786 -15.320 16.923 757 HH22 ARG 125 HH12 ARG 125 14.143 -14.487 18.398 758 H ASN 126 HN ASN 126 13.139 -11.967 12.875 759 HA ASN 126 HA ASN 126 12.887 -11.177 10.089 760 HB2 ASN 126 HB2 ASN 126 15.038 -11.015 11.381 761 HB3 ASN 126 HB1 ASN 126 15.091 -12.778 11.404 762 HD21 ASN 126 HD21 ASN 126 17.225 -11.809 10.128 763 HD22 ASN 126 HD22 ASN 126 17.057 -11.857 8.440 Start of MODEL 10 1 H MET 31 HT1 MET 31 2.904 25.664 -20.027 2 HA MET 31 HA MET 31 0.813 24.992 -20.270 3 HB2 MET 31 HB2 MET 31 1.789 22.889 -21.313 4 HB3 MET 31 HB1 MET 31 1.670 22.139 -19.717 5 HG2 MET 31 HG2 MET 31 -0.749 22.539 -19.682 6 HG3 MET 31 HG1 MET 31 -0.653 23.367 -21.234 7 HE1 MET 31 HE1 MET 31 -1.295 21.986 -23.457 8 HE2 MET 31 HE2 MET 31 0.013 20.869 -23.840 9 HE3 MET 31 HE3 MET 31 0.389 22.471 -23.209 10 H GLY 32 HN GLY 32 1.234 26.170 -18.041 11 HA2 GLY 32 HA2 GLY 32 -0.616 25.656 -16.208 12 HA3 GLY 32 HA1 GLY 32 0.605 24.479 -15.730 13 H LYS 33 HN LYS 33 -0.413 26.849 -14.299 14 HA LYS 33 HA LYS 33 1.506 28.933 -14.326 15 HB2 LYS 33 HB2 LYS 33 0.527 29.574 -12.161 16 HB3 LYS 33 HB1 LYS 33 -0.730 29.200 -13.340 17 HG2 LYS 33 HG2 LYS 33 -0.858 26.884 -12.396 18 HG3 LYS 33 HG1 LYS 33 0.289 27.372 -11.148 19 HD2 LYS 33 HD2 LYS 33 -1.236 29.030 -10.287 20 HD3 LYS 33 HD1 LYS 33 -2.341 28.788 -11.643 21 HE2 LYS 33 HE2 LYS 33 -3.180 27.596 -9.676 22 HE3 LYS 33 HE1 LYS 33 -2.686 26.436 -10.910 23 HZ1 LYS 33 HZ1 LYS 33 -0.626 27.244 -9.030 24 HZ2 LYS 33 HZ2 LYS 33 -0.974 25.710 -9.674 25 HZ3 LYS 33 HZ3 LYS 33 -1.889 26.318 -8.378 26 H ASN 34 HN ASN 34 1.272 25.891 -12.563 27 HA ASN 34 HA ASN 34 3.749 26.471 -11.085 28 HB2 ASN 34 HB2 ASN 34 1.654 25.437 -10.015 29 HB3 ASN 34 HB1 ASN 34 2.088 23.960 -10.881 30 HD21 ASN 34 HD21 ASN 34 2.122 24.197 -7.975 31 HD22 ASN 34 HD22 ASN 34 3.732 24.005 -7.475 32 H ASP 35 HN ASP 35 5.644 25.818 -11.831 33 HA ASP 35 HA ASP 35 5.800 24.022 -14.112 34 HB2 ASP 35 HB2 ASP 35 8.238 24.516 -13.981 35 HB3 ASP 35 HB1 ASP 35 7.242 25.970 -14.096 36 H ASN 36 HN ASN 36 5.275 23.395 -11.021 37 HA ASN 36 HA ASN 36 7.308 21.607 -10.222 38 HB2 ASN 36 HB2 ASN 36 5.634 22.487 -8.655 39 HB3 ASN 36 HB1 ASN 36 4.364 21.606 -9.508 40 HD21 ASN 36 HD21 ASN 36 5.040 21.170 -6.705 41 HD22 ASN 36 HD22 ASN 36 5.617 19.580 -6.570 42 H ASP 37 HN ASP 37 4.335 21.148 -12.092 43 HA ASP 37 HA ASP 37 4.558 18.304 -12.259 44 HB2 ASP 37 HB2 ASP 37 2.434 19.565 -12.609 45 HB3 ASP 37 HB1 ASP 37 3.095 20.193 -14.117 46 H ALA 38 HN ALA 38 7.046 19.546 -12.882 47 HA ALA 38 HA ALA 38 7.355 19.049 -15.786 48 HB1 ALA 38 HB1 ALA 38 8.141 21.237 -15.085 49 HB2 ALA 38 HB2 ALA 38 9.522 20.227 -15.517 50 HB3 ALA 38 HB3 ALA 38 9.133 20.508 -13.821 51 H LEU 39 HN LEU 39 8.311 17.232 -16.423 52 HA LEU 39 HA LEU 39 9.915 15.690 -14.455 53 HB2 LEU 39 HB2 LEU 39 7.990 14.848 -16.601 54 HB3 LEU 39 HB1 LEU 39 9.305 13.761 -16.154 55 HG LEU 39 HG LEU 39 8.583 13.831 -13.807 56 HD11 LEU 39 HD11 LEU 39 7.582 15.869 -13.366 57 HD12 LEU 39 HD12 LEU 39 6.145 14.870 -13.544 58 HD13 LEU 39 HD13 LEU 39 6.678 15.893 -14.880 59 HD21 LEU 39 HD21 LEU 39 6.456 12.600 -14.094 60 HD22 LEU 39 HD22 LEU 39 7.643 12.117 -15.305 61 HD23 LEU 39 HD23 LEU 39 6.331 13.211 -15.744 62 H ILE 40 HN ILE 40 11.916 15.078 -14.962 63 HA ILE 40 HA ILE 40 12.935 15.753 -17.680 64 HB ILE 40 HB ILE 40 14.407 16.001 -15.050 65 HG12 ILE 40 HG12 ILE 40 14.340 18.522 -16.110 66 HG13 ILE 40 HG11 ILE 40 12.796 17.918 -16.714 67 HG21 ILE 40 HG21 ILE 40 16.061 17.195 -16.593 68 HG22 ILE 40 HG22 ILE 40 15.159 16.493 -17.937 69 HG23 ILE 40 HG23 ILE 40 15.961 15.442 -16.771 70 HD11 ILE 40 HD11 ILE 40 12.164 17.277 -14.401 71 HD12 ILE 40 HD12 ILE 40 12.510 19.002 -14.525 72 HD13 ILE 40 HD13 ILE 40 13.701 17.912 -13.817 73 H MET 41 HN MET 41 13.998 14.209 -18.719 74 HA MET 41 HA MET 41 14.196 11.582 -17.498 75 HB2 MET 41 HB2 MET 41 13.377 11.732 -19.780 76 HB3 MET 41 HB1 MET 41 14.856 12.552 -20.281 77 HG2 MET 41 HG2 MET 41 16.178 10.627 -19.977 78 HG3 MET 41 HG1 MET 41 14.964 9.841 -18.965 79 HE1 MET 41 HE1 MET 41 14.647 10.663 -23.457 80 HE2 MET 41 HE2 MET 41 15.638 11.491 -22.260 81 HE3 MET 41 HE3 MET 41 13.899 11.779 -22.307 82 H CYS 42 HN CYS 42 15.967 10.566 -16.862 83 HA CYS 42 HA CYS 42 18.345 12.071 -16.336 84 HB2 CYS 42 HB2 CYS 42 17.522 10.178 -14.929 85 HB3 CYS 42 HB1 CYS 42 17.981 9.079 -16.235 86 H MET 43 HN MET 43 20.372 11.980 -17.281 87 HA MET 43 HA MET 43 20.416 11.194 -20.078 88 HB2 MET 43 HB2 MET 43 22.874 11.995 -19.817 89 HB3 MET 43 HB1 MET 43 21.580 13.184 -19.666 90 HG2 MET 43 HG2 MET 43 21.923 13.478 -17.404 91 HG3 MET 43 HG1 MET 43 22.371 11.793 -17.143 92 HE1 MET 43 HE1 MET 43 23.922 15.482 -17.705 93 HE2 MET 43 HE2 MET 43 23.163 14.788 -19.134 94 HE3 MET 43 HE3 MET 43 24.909 15.025 -19.101 95 H ARG 44 HN ARG 44 20.913 9.556 -17.210 96 HA ARG 44 HA ARG 44 22.744 7.594 -18.498 97 HB2 ARG 44 HB2 ARG 44 22.474 8.372 -15.588 98 HB3 ARG 44 HB1 ARG 44 23.386 6.972 -16.150 99 HG2 ARG 44 HG2 ARG 44 24.800 8.444 -17.534 100 HG3 ARG 44 HG1 ARG 44 23.886 9.846 -16.979 101 HD2 ARG 44 HD2 ARG 44 25.915 9.670 -15.654 102 HD3 ARG 44 HD1 ARG 44 24.532 9.278 -14.631 103 HE ARG 44 HE ARG 44 25.555 6.902 -15.789 104 HH11 ARG 44 HH21 ARG 44 26.297 9.359 -13.466 105 HH12 ARG 44 HH22 ARG 44 27.253 8.317 -12.466 106 HH21 ARG 44 HH11 ARG 44 26.806 5.531 -14.482 107 HH22 ARG 44 HH12 ARG 44 27.542 6.150 -13.042 108 H CYS 45 HN CYS 45 20.104 7.942 -16.120 109 HA CYS 45 HA CYS 45 19.489 5.103 -16.292 110 HB2 CYS 45 HB2 CYS 45 17.894 7.246 -14.877 111 HB3 CYS 45 HB1 CYS 45 17.882 5.510 -14.587 112 H ARG 46 HN ARG 46 18.520 8.023 -17.833 113 HA ARG 46 HA ARG 46 16.939 8.487 -19.435 114 HB2 ARG 46 HB2 ARG 46 16.916 5.486 -19.794 115 HB3 ARG 46 HB1 ARG 46 16.342 6.684 -20.957 116 HG2 ARG 46 HG2 ARG 46 19.186 6.703 -19.929 117 HG3 ARG 46 HG1 ARG 46 18.713 5.737 -21.324 118 HD2 ARG 46 HD2 ARG 46 17.793 7.848 -22.366 119 HD3 ARG 46 HD1 ARG 46 18.506 8.748 -21.036 120 HE ARG 46 HE ARG 46 20.597 8.428 -21.984 121 HH11 ARG 46 HH21 ARG 46 18.225 6.350 -23.399 122 HH12 ARG 46 HH22 ARG 46 19.255 5.817 -24.685 123 HH21 ARG 46 HH11 ARG 46 21.957 7.741 -23.667 124 HH22 ARG 46 HH12 ARG 46 21.371 6.607 -24.836 125 H LYS 47 HN LYS 47 16.142 7.817 -16.636 126 HA LYS 47 HA LYS 47 13.347 6.960 -17.121 127 HB2 LYS 47 HB2 LYS 47 14.937 7.142 -14.554 128 HB3 LYS 47 HB1 LYS 47 13.242 6.666 -14.660 129 HG2 LYS 47 HG2 LYS 47 14.100 4.879 -16.371 130 HG3 LYS 47 HG1 LYS 47 15.684 5.206 -15.666 131 HD2 LYS 47 HD2 LYS 47 13.215 4.349 -14.131 132 HD3 LYS 47 HD1 LYS 47 14.588 3.315 -14.525 133 HE2 LYS 47 HE2 LYS 47 16.050 4.975 -13.281 134 HE3 LYS 47 HE1 LYS 47 14.568 5.742 -12.718 135 HZ1 LYS 47 HZ1 LYS 47 14.299 4.170 -11.209 136 HZ2 LYS 47 HZ2 LYS 47 15.834 3.563 -11.612 137 HZ3 LYS 47 HZ3 LYS 47 14.444 2.937 -12.363 138 H VAL 48 HN VAL 48 11.702 8.270 -16.787 139 HA VAL 48 HA VAL 48 12.173 11.095 -16.509 140 HB VAL 48 HB VAL 48 9.382 10.650 -16.264 141 HG11 VAL 48 HG11 VAL 48 9.329 11.361 -18.637 142 HG12 VAL 48 HG12 VAL 48 11.073 11.120 -18.737 143 HG13 VAL 48 HG13 VAL 48 10.415 12.362 -17.672 144 HG21 VAL 48 HG21 VAL 48 9.884 8.240 -16.736 145 HG22 VAL 48 HG22 VAL 48 10.606 8.732 -18.270 146 HG23 VAL 48 HG23 VAL 48 8.885 8.997 -17.979 147 H LYS 49 HN LYS 49 12.025 12.335 -14.779 148 HA LYS 49 HA LYS 49 10.784 11.295 -12.309 149 HB2 LYS 49 HB2 LYS 49 13.624 12.240 -12.648 150 HB3 LYS 49 HB1 LYS 49 12.826 12.211 -11.089 151 HG2 LYS 49 HG2 LYS 49 12.491 9.833 -11.203 152 HG3 LYS 49 HG1 LYS 49 13.010 9.783 -12.881 153 HD2 LYS 49 HD2 LYS 49 15.262 10.406 -12.274 154 HD3 LYS 49 HD1 LYS 49 14.793 10.644 -10.590 155 HE2 LYS 49 HE2 LYS 49 14.437 8.001 -12.021 156 HE3 LYS 49 HE1 LYS 49 15.913 8.409 -11.148 157 HZ1 LYS 49 HZ1 LYS 49 14.569 8.793 -9.162 158 HZ2 LYS 49 HZ2 LYS 49 14.398 7.201 -9.729 159 HZ3 LYS 49 HZ3 LYS 49 13.171 8.343 -10.010 160 H GLY 50 HN GLY 50 9.949 12.853 -10.974 161 HA2 GLY 50 HA2 GLY 50 9.718 15.547 -12.144 162 HA3 GLY 50 HA1 GLY 50 8.677 14.847 -10.910 163 H ILE 51 HN ILE 51 9.514 17.334 -10.438 164 HA ILE 51 HA ILE 51 11.917 17.916 -9.291 165 HB ILE 51 HB ILE 51 9.976 19.474 -9.485 166 HG12 ILE 51 HG12 ILE 51 11.116 19.343 -6.680 167 HG13 ILE 51 HG11 ILE 51 12.026 19.924 -8.074 168 HG21 ILE 51 HG21 ILE 51 9.076 18.229 -6.873 169 HG22 ILE 51 HG22 ILE 51 8.350 17.834 -8.431 170 HG23 ILE 51 HG23 ILE 51 8.258 19.481 -7.806 171 HD11 ILE 51 HD11 ILE 51 10.424 21.704 -8.452 172 HD12 ILE 51 HD12 ILE 51 10.923 21.761 -6.761 173 HD13 ILE 51 HD13 ILE 51 9.361 21.069 -7.197 174 H ASP 52 HN ASP 52 9.552 15.676 -8.056 175 HA ASP 52 HA ASP 52 10.517 15.631 -5.360 176 HB2 ASP 52 HB2 ASP 52 9.132 13.576 -5.191 177 HB3 ASP 52 HB1 ASP 52 8.242 14.939 -5.868 178 H SER 53 HN SER 53 10.998 13.634 -8.223 179 HA SER 53 HA SER 53 13.021 12.017 -6.830 180 HB2 SER 53 HB2 SER 53 11.462 11.700 -9.349 181 HB3 SER 53 HB1 SER 53 13.008 10.873 -9.201 182 HG SER 53 HG SER 53 10.973 10.775 -7.242 183 H TYR 54 HN TYR 54 13.091 14.937 -8.081 184 HA TYR 54 HA TYR 54 15.796 14.598 -9.257 185 HB2 TYR 54 HB2 TYR 54 13.424 15.791 -10.426 186 HB3 TYR 54 HB1 TYR 54 14.648 17.045 -10.229 187 HD1 TYR 54 HD1 TYR 54 14.814 13.389 -11.029 188 HD2 TYR 54 HD2 TYR 54 15.776 17.384 -12.252 189 HE1 TYR 54 HE1 TYR 54 15.999 12.495 -13.006 190 HE2 TYR 54 HE2 TYR 54 16.974 16.486 -14.220 191 HH TYR 54 HH TYR 54 16.593 13.610 -15.464 192 H SER 55 HN SER 55 17.375 15.716 -8.355 193 HA SER 55 HA SER 55 17.084 17.024 -5.913 194 HB2 SER 55 HB2 SER 55 19.228 16.143 -6.644 195 HB3 SER 55 HB1 SER 55 19.257 17.259 -8.009 196 HG SER 55 HG SER 55 20.240 18.521 -6.644 197 H LYS 56 HN LYS 56 16.969 19.163 -5.321 198 HA LYS 56 HA LYS 56 15.510 20.912 -6.975 199 HB2 LYS 56 HB2 LYS 56 17.120 21.418 -4.466 200 HB3 LYS 56 HB1 LYS 56 16.085 22.627 -5.227 201 HG2 LYS 56 HG2 LYS 56 14.143 21.131 -4.981 202 HG3 LYS 56 HG1 LYS 56 15.172 19.909 -4.234 203 HD2 LYS 56 HD2 LYS 56 15.709 21.461 -2.402 204 HD3 LYS 56 HD1 LYS 56 14.703 22.704 -3.151 205 HE2 LYS 56 HE2 LYS 56 12.731 21.228 -2.938 206 HE3 LYS 56 HE1 LYS 56 13.737 19.999 -2.171 207 HZ1 LYS 56 HZ1 LYS 56 12.396 21.873 -0.830 208 HZ2 LYS 56 HZ2 LYS 56 13.898 22.646 -1.005 209 HZ3 LYS 56 HZ3 LYS 56 13.805 21.128 -0.250 210 H THR 57 HN THR 57 18.966 20.707 -6.227 211 HA THR 57 HA THR 57 19.801 23.089 -7.445 212 HB THR 57 HB THR 57 22.002 21.874 -7.715 213 HG1 THR 57 HG1 THR 57 22.098 19.786 -6.996 214 HG21 THR 57 HG21 THR 57 22.351 21.626 -5.284 215 HG22 THR 57 HG22 THR 57 20.604 21.650 -5.035 216 HG23 THR 57 HG23 THR 57 21.428 23.084 -5.650 217 H GLN 58 HN GLN 58 19.640 19.796 -8.820 218 HA GLN 58 HA GLN 58 20.403 20.597 -11.444 219 HB2 GLN 58 HB2 GLN 58 19.169 18.134 -10.235 220 HB3 GLN 58 HB1 GLN 58 19.209 18.300 -11.990 221 HG2 GLN 58 HG2 GLN 58 21.203 17.100 -11.182 222 HG3 GLN 58 HG1 GLN 58 21.651 18.645 -11.904 223 HE21 GLN 58 HE21 GLN 58 23.362 19.454 -10.678 224 HE22 GLN 58 HE22 GLN 58 23.390 19.511 -8.976 225 H TRP 59 HN TRP 59 17.275 20.108 -9.861 226 HA TRP 59 HA TRP 59 15.619 20.398 -12.097 227 HB2 TRP 59 HB2 TRP 59 14.849 19.648 -9.855 228 HB3 TRP 59 HB1 TRP 59 15.039 21.304 -9.269 229 HD1 TRP 59 HD1 TRP 59 13.239 19.525 -12.204 230 HE1 TRP 59 HE1 TRP 59 10.964 20.683 -12.575 231 HE3 TRP 59 HE3 TRP 59 13.539 23.183 -8.658 232 HZ2 TRP 59 HZ2 TRP 59 9.472 22.875 -11.499 233 HZ3 TRP 59 HZ3 TRP 59 11.678 24.791 -8.350 234 HH2 TRP 59 HH2 TRP 59 9.647 24.642 -9.765 235 H SER 60 HN SER 60 17.114 22.812 -9.999 236 HA SER 60 HA SER 60 15.731 25.066 -10.984 237 HB2 SER 60 HB2 SER 60 17.067 25.095 -8.909 238 HB3 SER 60 HB1 SER 60 18.537 24.903 -9.860 239 HG SER 60 HG SER 60 16.974 26.918 -10.790 240 H LYS 61 HN LYS 61 18.269 23.141 -12.326 241 HA LYS 61 HA LYS 61 19.167 25.177 -14.201 242 HB2 LYS 61 HB2 LYS 61 19.789 22.221 -14.016 243 HB3 LYS 61 HB1 LYS 61 20.583 23.367 -15.095 244 HG2 LYS 61 HG2 LYS 61 21.368 24.671 -13.172 245 HG3 LYS 61 HG1 LYS 61 20.539 23.569 -12.072 246 HD2 LYS 61 HD2 LYS 61 21.924 21.694 -13.028 247 HD3 LYS 61 HD1 LYS 61 22.842 22.906 -13.922 248 HE2 LYS 61 HE2 LYS 61 22.487 22.957 -10.919 249 HE3 LYS 61 HE1 LYS 61 23.880 22.232 -11.721 250 HZ1 LYS 61 HZ1 LYS 61 24.483 24.428 -11.176 251 HZ2 LYS 61 HZ2 LYS 61 23.026 25.069 -11.770 252 HZ3 LYS 61 HZ3 LYS 61 24.181 24.439 -12.844 253 H THR 62 HN THR 62 16.776 22.704 -14.048 254 HA THR 62 HA THR 62 16.499 22.162 -16.823 255 HB THR 62 HB THR 62 14.350 21.186 -16.242 256 HG1 THR 62 HG1 THR 62 13.287 21.792 -14.525 257 HG21 THR 62 HG21 THR 62 16.224 19.815 -15.659 258 HG22 THR 62 HG22 THR 62 15.112 19.749 -14.291 259 HG23 THR 62 HG23 THR 62 16.548 20.765 -14.213 260 H PHE 63 HN PHE 63 16.081 25.017 -15.241 261 HA PHE 63 HA PHE 63 14.657 26.192 -17.441 262 HB2 PHE 63 HB2 PHE 63 12.805 27.099 -16.138 263 HB3 PHE 63 HB1 PHE 63 12.783 25.338 -16.055 264 HD1 PHE 63 HD1 PHE 63 13.733 28.426 -14.226 265 HD2 PHE 63 HD2 PHE 63 13.115 24.184 -13.987 266 HE1 PHE 63 HE1 PHE 63 13.874 28.547 -11.755 267 HE2 PHE 63 HE2 PHE 63 13.258 24.303 -11.517 268 HZ PHE 63 HZ PHE 63 13.636 26.485 -10.399 269 H THR 64 HN THR 64 14.439 28.594 -17.101 270 HA THR 64 HA THR 64 16.438 29.665 -15.197 271 HB THR 64 HB THR 64 17.635 30.787 -16.826 272 HG1 THR 64 HG1 THR 64 15.759 30.571 -18.850 273 HG21 THR 64 HG21 THR 64 16.490 28.652 -18.619 274 HG22 THR 64 HG22 THR 64 17.581 28.264 -17.288 275 HG23 THR 64 HG23 THR 64 18.131 29.300 -18.606 276 H PHE 65 HN PHE 65 16.242 32.108 -15.089 277 HA PHE 65 HA PHE 65 13.368 32.839 -15.122 278 HB2 PHE 65 HB2 PHE 65 15.220 32.843 -13.012 279 HB3 PHE 65 HB1 PHE 65 15.116 34.537 -13.476 280 HD1 PHE 65 HD1 PHE 65 12.771 31.628 -13.128 281 HD2 PHE 65 HD2 PHE 65 13.503 35.781 -12.313 282 HE1 PHE 65 HE1 PHE 65 10.581 31.787 -11.984 283 HE2 PHE 65 HE2 PHE 65 11.313 35.938 -11.160 284 HZ PHE 65 HZ PHE 65 9.850 33.944 -11.003 285 H VAL 66 HN VAL 66 12.711 34.485 -16.317 286 HA VAL 66 HA VAL 66 14.647 36.500 -17.234 287 HB VAL 66 HB VAL 66 14.381 34.633 -18.954 288 HG11 VAL 66 HG11 VAL 66 12.359 34.497 -20.192 289 HG12 VAL 66 HG12 VAL 66 11.721 35.972 -19.474 290 HG13 VAL 66 HG13 VAL 66 11.856 34.507 -18.503 291 HG21 VAL 66 HG21 VAL 66 15.268 36.804 -19.575 292 HG22 VAL 66 HG22 VAL 66 13.648 37.497 -19.619 293 HG23 VAL 66 HG23 VAL 66 14.126 36.298 -20.820 294 H ARG 67 HN ARG 67 13.810 38.524 -17.365 295 HA ARG 67 HA ARG 67 12.331 40.204 -16.784 296 HB2 ARG 67 HB2 ARG 67 10.803 38.491 -18.744 297 HB3 ARG 67 HB1 ARG 67 10.155 40.016 -18.131 298 HG2 ARG 67 HG2 ARG 67 12.148 41.204 -18.953 299 HG3 ARG 67 HG1 ARG 67 12.819 39.685 -19.546 300 HD2 ARG 67 HD2 ARG 67 10.927 39.410 -21.073 301 HD3 ARG 67 HD1 ARG 67 10.185 40.885 -20.448 302 HE ARG 67 HE ARG 67 12.449 40.713 -22.277 303 HH11 ARG 67 HH21 ARG 67 10.595 42.600 -20.047 304 HH12 ARG 67 HH22 ARG 67 11.099 44.124 -20.699 305 HH21 ARG 67 HH11 ARG 67 13.118 42.712 -23.139 306 HH22 ARG 67 HH12 ARG 67 12.527 44.186 -22.448 307 H GLY 68 HN GLY 68 12.268 37.648 -15.133 308 HA2 GLY 68 HA2 GLY 68 11.193 37.198 -13.121 309 HA3 GLY 68 HA1 GLY 68 9.974 38.406 -13.526 310 H ARG 69 HN ARG 69 10.868 35.816 -15.711 311 HA ARG 69 HA ARG 69 8.371 34.358 -15.084 312 HB2 ARG 69 HB2 ARG 69 9.299 35.272 -17.815 313 HB3 ARG 69 HB1 ARG 69 8.024 34.079 -17.550 314 HG2 ARG 69 HG2 ARG 69 6.758 35.738 -16.221 315 HG3 ARG 69 HG1 ARG 69 8.022 36.932 -16.521 316 HD2 ARG 69 HD2 ARG 69 6.498 35.520 -18.719 317 HD3 ARG 69 HD1 ARG 69 6.039 37.094 -18.077 318 HE ARG 69 HE ARG 69 8.720 37.296 -18.790 319 HH11 ARG 69 HH21 ARG 69 5.682 36.578 -20.287 320 HH12 ARG 69 HH22 ARG 69 6.134 37.223 -21.830 321 HH21 ARG 69 HH11 ARG 69 9.317 38.145 -20.813 322 HH22 ARG 69 HH12 ARG 69 8.191 38.108 -22.127 323 H THR 70 HN THR 70 8.606 32.224 -15.001 324 HA THR 70 HA THR 70 11.187 31.033 -15.202 325 HB THR 70 HB THR 70 8.523 29.600 -15.131 326 HG1 THR 70 HG1 THR 70 8.428 30.052 -13.063 327 HG21 THR 70 HG21 THR 70 11.271 28.838 -14.103 328 HG22 THR 70 HG22 THR 70 10.561 28.248 -15.606 329 HG23 THR 70 HG23 THR 70 9.821 27.833 -14.061 330 H VAL 71 HN VAL 71 12.166 30.026 -16.859 331 HA VAL 71 HA VAL 71 10.580 29.357 -19.273 332 HB VAL 71 HB VAL 71 12.625 30.145 -20.589 333 HG11 VAL 71 HG11 VAL 71 11.238 32.364 -19.080 334 HG12 VAL 71 HG12 VAL 71 10.395 31.394 -20.287 335 HG13 VAL 71 HG13 VAL 71 11.789 32.359 -20.753 336 HG21 VAL 71 HG21 VAL 71 14.208 31.560 -19.553 337 HG22 VAL 71 HG22 VAL 71 13.981 30.277 -18.372 338 HG23 VAL 71 HG23 VAL 71 13.187 31.832 -18.139 339 H SER 72 HN SER 72 11.004 27.432 -20.132 340 HA SER 72 HA SER 72 12.811 25.654 -18.757 341 HB2 SER 72 HB2 SER 72 11.351 25.095 -21.337 342 HB3 SER 72 HB1 SER 72 11.918 23.935 -20.132 343 HG SER 72 HG SER 72 10.263 25.904 -19.153 344 H VAL 73 HN VAL 73 14.742 24.825 -19.468 345 HA VAL 73 HA VAL 73 16.252 26.391 -21.308 346 HB VAL 73 HB VAL 73 16.942 23.678 -20.185 347 HG11 VAL 73 HG11 VAL 73 19.280 24.611 -20.484 348 HG12 VAL 73 HG12 VAL 73 18.556 25.938 -21.392 349 HG13 VAL 73 HG13 VAL 73 18.419 24.284 -21.988 350 HG21 VAL 73 HG21 VAL 73 18.250 25.173 -18.532 351 HG22 VAL 73 HG22 VAL 73 16.508 25.059 -18.303 352 HG23 VAL 73 HG23 VAL 73 17.198 26.479 -19.078 353 H SER 74 HN SER 74 17.263 25.623 -23.287 354 HA SER 74 HA SER 74 15.426 24.329 -25.037 355 HB2 SER 74 HB2 SER 74 16.856 25.911 -26.045 356 HB3 SER 74 HB1 SER 74 18.294 25.213 -25.304 357 HG SER 74 HG SER 74 17.778 23.291 -26.574 358 H ASP 75 HN ASP 75 18.459 23.302 -23.507 359 HA ASP 75 HA ASP 75 17.661 20.499 -23.816 360 HB2 ASP 75 HB2 ASP 75 19.938 19.920 -24.684 361 HB3 ASP 75 HB1 ASP 75 18.925 20.812 -25.823 362 HA PRO 76 HA PRO 76 19.768 21.456 -19.811 363 HB2 PRO 76 HB2 PRO 76 17.876 20.380 -18.154 364 HB3 PRO 76 HB1 PRO 76 17.769 22.031 -18.789 365 HG2 PRO 76 HG2 PRO 76 16.322 19.580 -19.648 366 HG3 PRO 76 HG1 PRO 76 15.765 21.261 -19.607 367 HD2 PRO 76 HD2 PRO 76 16.626 19.914 -21.898 368 HD3 PRO 76 HD1 PRO 76 16.533 21.681 -21.740 369 H LYS 77 HN LYS 77 21.407 20.077 -19.478 370 HA LYS 77 HA LYS 77 20.890 17.155 -19.514 371 HB2 LYS 77 HB2 LYS 77 23.423 18.756 -19.928 372 HB3 LYS 77 HB1 LYS 77 23.367 17.000 -19.797 373 HG2 LYS 77 HG2 LYS 77 21.908 16.847 -21.740 374 HG3 LYS 77 HG1 LYS 77 21.795 18.603 -21.831 375 HD2 LYS 77 HD2 LYS 77 23.423 18.036 -23.458 376 HD3 LYS 77 HD1 LYS 77 24.358 18.593 -22.073 377 HE2 LYS 77 HE2 LYS 77 24.872 16.334 -21.412 378 HE3 LYS 77 HE1 LYS 77 23.726 15.671 -22.577 379 HZ1 LYS 77 HZ1 LYS 77 26.074 17.308 -23.341 380 HZ2 LYS 77 HZ2 LYS 77 25.063 16.406 -24.365 381 HZ3 LYS 77 HZ3 LYS 77 26.098 15.613 -23.279 382 H VAL 78 HN VAL 78 20.464 16.494 -17.501 383 HA VAL 78 HA VAL 78 22.458 17.026 -15.412 384 HB VAL 78 HB VAL 78 20.450 17.328 -13.794 385 HG11 VAL 78 HG11 VAL 78 20.395 19.781 -14.279 386 HG12 VAL 78 HG12 VAL 78 21.221 19.467 -15.807 387 HG13 VAL 78 HG13 VAL 78 22.032 19.126 -14.279 388 HG21 VAL 78 HG21 VAL 78 18.433 18.210 -14.762 389 HG22 VAL 78 HG22 VAL 78 18.798 16.716 -15.629 390 HG23 VAL 78 HG23 VAL 78 19.160 18.275 -16.367 391 H ILE 79 HN ILE 79 22.323 15.519 -13.642 392 HA ILE 79 HA ILE 79 21.256 12.898 -14.505 393 HB ILE 79 HB ILE 79 22.863 11.975 -12.888 394 HG12 ILE 79 HG12 ILE 79 23.693 14.861 -12.495 395 HG13 ILE 79 HG11 ILE 79 22.859 13.870 -11.296 396 HG21 ILE 79 HG21 ILE 79 24.179 13.996 -14.710 397 HG22 ILE 79 HG22 ILE 79 23.499 12.468 -15.260 398 HG23 ILE 79 HG23 ILE 79 24.860 12.472 -14.147 399 HD11 ILE 79 HD11 ILE 79 25.211 13.777 -10.782 400 HD12 ILE 79 HD12 ILE 79 25.608 13.399 -12.458 401 HD13 ILE 79 HD13 ILE 79 24.753 12.217 -11.469 402 H CYS 80 HN CYS 80 20.196 11.545 -12.988 403 HA CYS 80 HA CYS 80 18.474 13.021 -11.184 404 HB2 CYS 80 HB2 CYS 80 17.149 11.088 -11.089 405 HB3 CYS 80 HB1 CYS 80 17.787 11.088 -12.733 406 H ARG 81 HN ARG 81 17.965 11.480 -9.089 407 HA ARG 81 HA ARG 81 20.248 11.880 -7.402 408 HB2 ARG 81 HB2 ARG 81 17.589 10.550 -6.842 409 HB3 ARG 81 HB1 ARG 81 18.783 11.012 -5.629 410 HG2 ARG 81 HG2 ARG 81 18.614 13.379 -6.489 411 HG3 ARG 81 HG1 ARG 81 17.261 12.849 -7.490 412 HD2 ARG 81 HD2 ARG 81 17.382 12.499 -4.493 413 HD3 ARG 81 HD1 ARG 81 16.570 13.842 -5.289 414 HE ARG 81 HE ARG 81 15.539 11.510 -6.409 415 HH11 ARG 81 HH21 ARG 81 15.775 13.036 -3.309 416 HH12 ARG 81 HH22 ARG 81 14.301 12.353 -2.707 417 HH21 ARG 81 HH11 ARG 81 13.604 10.610 -5.618 418 HH22 ARG 81 HH12 ARG 81 13.074 10.981 -4.011 419 H THR 82 HN THR 82 18.708 9.094 -8.895 420 HA THR 82 HA THR 82 19.851 7.038 -7.401 421 HB THR 82 HB THR 82 19.277 5.584 -9.172 422 HG1 THR 82 HG1 THR 82 19.602 6.091 -11.182 423 HG21 THR 82 HG21 THR 82 17.477 7.999 -9.494 424 HG22 THR 82 HG22 THR 82 17.343 6.817 -8.197 425 HG23 THR 82 HG23 THR 82 17.061 6.330 -9.868 426 H CYS 83 HN CYS 83 21.096 8.573 -10.377 427 HA CYS 83 HA CYS 83 23.606 7.106 -10.148 428 HB2 CYS 83 HB2 CYS 83 24.185 8.643 -12.164 429 HB3 CYS 83 HB1 CYS 83 22.967 7.385 -12.390 430 H GLN 84 HN GLN 84 22.364 9.645 -8.532 431 HA GLN 84 HA GLN 84 25.024 10.895 -8.141 432 HB2 GLN 84 HB2 GLN 84 23.519 12.375 -9.463 433 HB3 GLN 84 HB1 GLN 84 22.374 12.353 -8.127 434 HG2 GLN 84 HG2 GLN 84 23.727 13.645 -6.740 435 HG3 GLN 84 HG1 GLN 84 25.213 13.111 -7.521 436 HE21 GLN 84 HE21 GLN 84 26.126 15.035 -8.283 437 HE22 GLN 84 HE22 GLN 84 25.310 16.153 -9.266 438 HA PRO 85 HA PRO 85 22.922 9.418 -4.183 439 HB2 PRO 85 HB2 PRO 85 24.849 7.586 -3.451 440 HB3 PRO 85 HB1 PRO 85 23.438 7.178 -4.451 441 HG2 PRO 85 HG2 PRO 85 26.248 7.748 -5.293 442 HG3 PRO 85 HG1 PRO 85 25.123 6.515 -5.888 443 HD2 PRO 85 HD2 PRO 85 25.598 8.840 -7.236 444 HD3 PRO 85 HD1 PRO 85 24.031 8.001 -7.301 445 H LYS 86 HN LYS 86 26.077 10.498 -5.153 446 HA LYS 86 HA LYS 86 27.233 10.951 -2.611 447 HB2 LYS 86 HB2 LYS 86 27.710 12.539 -5.142 448 HB3 LYS 86 HB1 LYS 86 28.810 12.359 -3.777 449 HG2 LYS 86 HG2 LYS 86 27.852 10.073 -5.525 450 HG3 LYS 86 HG1 LYS 86 29.409 10.883 -5.701 451 HD2 LYS 86 HD2 LYS 86 29.779 10.290 -3.204 452 HD3 LYS 86 HD1 LYS 86 28.434 9.169 -3.411 453 HE2 LYS 86 HE2 LYS 86 30.903 9.179 -5.167 454 HE3 LYS 86 HE1 LYS 86 30.671 8.107 -3.786 455 HZ1 LYS 86 HZ1 LYS 86 29.340 6.802 -4.962 456 HZ2 LYS 86 HZ2 LYS 86 29.827 7.658 -6.346 457 HZ3 LYS 86 HZ3 LYS 86 28.410 8.105 -5.523 458 H GLN 87 HN GLN 87 25.828 11.920 -1.193 459 HA GLN 87 HA GLN 87 24.451 14.374 -1.887 460 HB2 GLN 87 HB2 GLN 87 23.423 12.734 -0.358 461 HB3 GLN 87 HB1 GLN 87 24.749 12.979 0.785 462 HG2 GLN 87 HG2 GLN 87 24.145 15.302 1.085 463 HG3 GLN 87 HG1 GLN 87 22.944 15.203 -0.201 464 HE21 GLN 87 HE21 GLN 87 22.223 15.993 2.461 465 HE22 GLN 87 HE22 GLN 87 21.233 14.784 3.121 466 H HIS 88 HN HIS 88 25.160 16.387 -1.563 467 HA HIS 88 HA HIS 88 26.713 18.061 -1.192 468 HB2 HIS 88 HB2 HIS 88 25.507 17.955 0.954 469 HB3 HIS 88 HB1 HIS 88 26.658 16.748 1.537 470 HD2 HIS 88 HD2 HIS 88 26.847 20.540 0.319 471 HE1 HIS 88 HE1 HIS 88 30.016 19.784 3.003 472 HE2 HIS 88 HE2 HIS 88 28.868 21.570 1.609 473 H ASP 89 HN ASP 89 28.504 16.829 1.328 474 HA ASP 89 HA ASP 89 30.413 15.217 -0.020 475 HB2 ASP 89 HB2 ASP 89 30.826 17.439 -1.132 476 HB3 ASP 89 HB1 ASP 89 31.289 18.073 0.445 477 H SER 90 HN SER 90 32.564 15.242 1.323 478 HA SER 90 HA SER 90 31.969 14.484 3.943 479 HB2 SER 90 HB2 SER 90 34.495 14.708 4.260 480 HB3 SER 90 HB1 SER 90 33.964 13.638 2.963 481 HG SER 90 HG SER 90 35.646 15.482 2.657 482 H ILE 91 HN ILE 91 33.195 15.494 5.871 483 HA ILE 91 HA ILE 91 32.916 18.456 5.836 484 HB ILE 91 HB ILE 91 31.893 16.537 7.943 485 HG12 ILE 91 HG12 ILE 91 30.386 18.640 6.366 486 HG13 ILE 91 HG11 ILE 91 30.554 16.982 5.783 487 HG21 ILE 91 HG21 ILE 91 32.805 18.437 9.097 488 HG22 ILE 91 HG22 ILE 91 31.063 18.712 8.992 489 HG23 ILE 91 HG23 ILE 91 32.162 19.556 7.895 490 HD11 ILE 91 HD11 ILE 91 28.497 17.761 7.326 491 HD12 ILE 91 HD12 ILE 91 29.628 17.316 8.602 492 HD13 ILE 91 HD13 ILE 91 29.159 16.133 7.379 493 H TRP 92 HN TRP 92 34.530 19.538 6.762 494 HA TRP 92 HA TRP 92 36.806 18.020 7.769 495 HB2 TRP 92 HB2 TRP 92 37.513 19.685 6.280 496 HB3 TRP 92 HB1 TRP 92 36.350 20.865 6.889 497 HD1 TRP 92 HD1 TRP 92 39.336 18.889 8.318 498 HE1 TRP 92 HE1 TRP 92 40.659 20.440 9.909 499 HE3 TRP 92 HE3 TRP 92 36.487 23.087 7.974 500 HZ2 TRP 92 HZ2 TRP 92 40.511 23.124 10.889 501 HZ3 TRP 92 HZ3 TRP 92 37.091 25.131 9.237 502 HH2 TRP 92 HH2 TRP 92 39.098 25.155 10.694 503 H CYS 93 HN CYS 93 37.267 17.756 9.832 504 HA CYS 93 HA CYS 93 35.702 19.182 11.883 505 HB2 CYS 93 HB2 CYS 93 35.845 16.762 12.126 506 HB3 CYS 93 HB1 CYS 93 37.600 16.831 12.060 507 H THR 94 HN THR 94 36.598 20.718 13.170 508 HA THR 94 HA THR 94 39.369 21.497 12.608 509 HB THR 94 HB THR 94 38.822 23.590 13.466 510 HG1 THR 94 HG1 THR 94 37.713 22.237 15.357 511 HG21 THR 94 HG21 THR 94 36.017 22.769 12.762 512 HG22 THR 94 HG22 THR 94 37.271 22.710 11.522 513 HG23 THR 94 HG23 THR 94 36.888 24.236 12.320 514 H ALA 95 HN ALA 95 37.703 19.575 14.842 515 HA ALA 95 HA ALA 95 39.555 20.132 17.054 516 HB1 ALA 95 HB1 ALA 95 37.015 18.575 16.723 517 HB2 ALA 95 HB2 ALA 95 37.397 19.841 17.885 518 HB3 ALA 95 HB3 ALA 95 38.080 18.229 18.088 519 H CYS 96 HN CYS 96 39.253 18.035 14.357 520 HA CYS 96 HA CYS 96 41.211 16.128 15.533 521 HB2 CYS 96 HB2 CYS 96 39.156 15.715 13.350 522 HB3 CYS 96 HB1 CYS 96 40.419 14.555 13.754 523 H GLN 97 HN GLN 97 40.567 18.450 13.092 524 HA GLN 97 HA GLN 97 41.857 19.323 11.386 525 HB2 GLN 97 HB2 GLN 97 44.115 17.837 12.759 526 HB3 GLN 97 HB1 GLN 97 44.282 19.130 11.576 527 HG2 GLN 97 HG2 GLN 97 42.828 19.443 14.210 528 HG3 GLN 97 HG1 GLN 97 44.514 19.897 13.958 529 HE21 GLN 97 HE21 GLN 97 41.646 21.368 14.220 530 HE22 GLN 97 HE22 GLN 97 41.817 22.611 13.077 531 H GLN 98 HN GLN 98 40.547 16.679 11.151 532 HA GLN 98 HA GLN 98 42.106 15.679 8.843 533 HB2 GLN 98 HB2 GLN 98 40.871 14.039 11.063 534 HB3 GLN 98 HB1 GLN 98 41.337 13.358 9.503 535 HG2 GLN 98 HG2 GLN 98 43.242 14.921 11.260 536 HG3 GLN 98 HG1 GLN 98 43.097 13.166 11.323 537 HE21 GLN 98 HE21 GLN 98 43.526 11.992 9.200 538 HE22 GLN 98 HE22 GLN 98 44.634 12.681 8.114 539 H THR 99 HN THR 99 40.856 14.727 7.193 540 HA THR 99 HA THR 99 38.195 15.863 6.940 541 HB THR 99 HB THR 99 39.716 14.052 5.048 542 HG1 THR 99 HG1 THR 99 40.629 15.816 4.302 543 HG21 THR 99 HG21 THR 99 37.401 14.044 4.475 544 HG22 THR 99 HG22 THR 99 38.156 15.216 3.394 545 HG23 THR 99 HG23 THR 99 37.242 15.770 4.798 546 H LYS 100 HN LYS 100 36.320 14.849 7.253 547 HA LYS 100 HA LYS 100 36.311 11.895 7.541 548 HB2 LYS 100 HB2 LYS 100 34.821 13.945 9.170 549 HB3 LYS 100 HB1 LYS 100 34.578 12.208 9.297 550 HG2 LYS 100 HG2 LYS 100 37.339 13.375 9.636 551 HG3 LYS 100 HG1 LYS 100 36.195 13.405 10.978 552 HD2 LYS 100 HD2 LYS 100 36.057 11.039 11.069 553 HD3 LYS 100 HD1 LYS 100 36.778 10.841 9.478 554 HE2 LYS 100 HE2 LYS 100 38.412 10.293 11.206 555 HE3 LYS 100 HE1 LYS 100 38.911 11.746 10.342 556 HZ1 LYS 100 HZ1 LYS 100 39.016 11.796 12.866 557 HZ2 LYS 100 HZ2 LYS 100 37.320 11.887 12.829 558 HZ3 LYS 100 HZ3 LYS 100 38.256 13.105 12.103 559 H GLY 101 HN GLY 101 34.684 10.825 6.607 560 HA2 GLY 101 HA2 GLY 101 33.282 11.965 4.467 561 HA3 GLY 101 HA1 GLY 101 32.870 10.433 5.232 562 H ILE 102 HN ILE 102 30.903 12.034 4.236 563 HA ILE 102 HA ILE 102 29.771 13.822 6.126 564 HB ILE 102 HB ILE 102 29.194 13.782 3.699 565 HG12 ILE 102 HG12 ILE 102 26.724 13.297 5.382 566 HG13 ILE 102 HG11 ILE 102 27.711 14.749 5.579 567 HG21 ILE 102 HG21 ILE 102 29.074 11.258 3.594 568 HG22 ILE 102 HG22 ILE 102 27.719 12.088 2.831 569 HG23 ILE 102 HG23 ILE 102 27.521 11.362 4.425 570 HD11 ILE 102 HD11 ILE 102 26.390 13.835 3.007 571 HD12 ILE 102 HD12 ILE 102 27.425 15.254 3.170 572 HD13 ILE 102 HD13 ILE 102 25.877 15.189 4.014 573 H ASN 103 HN ASN 103 29.458 10.367 5.577 574 HA ASN 103 HA ASN 103 27.229 9.861 7.210 575 HB2 ASN 103 HB2 ASN 103 29.619 8.151 6.505 576 HB3 ASN 103 HB1 ASN 103 28.230 7.547 7.404 577 HD21 ASN 103 HD21 ASN 103 29.340 7.172 4.466 578 HD22 ASN 103 HD22 ASN 103 27.926 7.327 3.524 579 H GLU 104 HN GLU 104 30.674 10.121 7.976 580 HA GLU 104 HA GLU 104 30.365 9.370 10.734 581 HB2 GLU 104 HB2 GLU 104 32.608 10.706 9.217 582 HB3 GLU 104 HB1 GLU 104 32.705 10.284 10.926 583 HG2 GLU 104 HG2 GLU 104 32.308 7.930 10.401 584 HG3 GLU 104 HG1 GLU 104 32.105 8.323 8.693 585 H PHE 105 HN PHE 105 29.053 11.866 9.272 586 HA PHE 105 HA PHE 105 29.393 13.659 11.608 587 HB2 PHE 105 HB2 PHE 105 29.868 14.207 8.752 588 HB3 PHE 105 HB1 PHE 105 28.743 15.345 9.479 589 HD1 PHE 105 HD1 PHE 105 32.138 13.875 9.827 590 HD2 PHE 105 HD2 PHE 105 29.453 17.008 10.972 591 HE1 PHE 105 HE1 PHE 105 33.994 15.080 10.915 592 HE2 PHE 105 HE2 PHE 105 31.314 18.218 12.075 593 HZ PHE 105 HZ PHE 105 33.591 17.250 12.047 594 H SER 106 HN SER 106 27.604 14.807 12.256 595 HA SER 106 HA SER 106 25.051 13.578 11.547 596 HB2 SER 106 HB2 SER 106 25.378 13.829 13.884 597 HB3 SER 106 HB1 SER 106 25.926 15.495 13.703 598 HG SER 106 HG SER 106 23.915 16.138 13.565 599 H LYS 107 HN LYS 107 23.148 15.143 11.458 600 HA LYS 107 HA LYS 107 23.527 16.885 9.215 601 HB2 LYS 107 HB2 LYS 107 21.433 15.532 9.780 602 HB3 LYS 107 HB1 LYS 107 21.075 16.785 10.969 603 HG2 LYS 107 HG2 LYS 107 21.099 18.498 9.222 604 HG3 LYS 107 HG1 LYS 107 21.556 17.290 8.016 605 HD2 LYS 107 HD2 LYS 107 19.447 16.077 8.431 606 HD3 LYS 107 HD1 LYS 107 18.985 17.290 9.627 607 HE2 LYS 107 HE2 LYS 107 19.056 19.037 7.885 608 HE3 LYS 107 HE1 LYS 107 19.515 17.826 6.688 609 HZ1 LYS 107 HZ1 LYS 107 17.204 17.037 8.152 610 HZ2 LYS 107 HZ2 LYS 107 17.419 17.182 6.474 611 HZ3 LYS 107 HZ3 LYS 107 16.966 18.535 7.394 612 H ALA 108 HN ALA 108 22.806 17.404 12.658 613 HA ALA 108 HA ALA 108 22.562 20.211 12.539 614 HB1 ALA 108 HB1 ALA 108 22.663 20.171 14.912 615 HB2 ALA 108 HB2 ALA 108 23.588 18.669 14.923 616 HB3 ALA 108 HB3 ALA 108 21.889 18.656 14.446 617 H GLN 109 HN GLN 109 25.352 18.106 13.017 618 HA GLN 109 HA GLN 109 27.247 20.015 13.774 619 HB2 GLN 109 HB2 GLN 109 27.510 17.461 12.187 620 HB3 GLN 109 HB1 GLN 109 28.897 18.422 12.713 621 HG2 GLN 109 HG2 GLN 109 28.342 18.128 15.021 622 HG3 GLN 109 HG1 GLN 109 26.766 17.435 14.623 623 HE21 GLN 109 HE21 GLN 109 27.902 15.660 16.126 624 HE22 GLN 109 HE22 GLN 109 28.750 14.455 15.286 625 H ARG 110 HN ARG 110 25.785 19.381 10.689 626 HA ARG 110 HA ARG 110 27.748 20.955 9.215 627 HB2 ARG 110 HB2 ARG 110 26.686 18.951 8.199 628 HB3 ARG 110 HB1 ARG 110 25.125 19.764 8.288 629 HG2 ARG 110 HG2 ARG 110 25.889 21.528 6.812 630 HG3 ARG 110 HG1 ARG 110 27.534 20.881 6.827 631 HD2 ARG 110 HD2 ARG 110 26.672 18.782 5.807 632 HD3 ARG 110 HD1 ARG 110 25.070 19.513 5.708 633 HE ARG 110 HE ARG 110 27.396 20.172 4.062 634 HH11 ARG 110 HH21 ARG 110 24.221 20.993 5.171 635 HH12 ARG 110 HH22 ARG 110 23.868 22.027 3.829 636 HH21 ARG 110 HH11 ARG 110 26.941 21.537 2.300 637 HH22 ARG 110 HH12 ARG 110 25.406 22.336 2.205 638 H HIS 111 HN HIS 111 24.877 21.473 10.988 639 HA HIS 111 HA HIS 111 24.120 23.905 9.543 640 HB2 HIS 111 HB2 HIS 111 22.950 22.473 11.932 641 HB3 HIS 111 HB1 HIS 111 22.337 24.016 11.329 642 HD2 HIS 111 HD2 HIS 111 20.046 23.221 9.973 643 HE1 HIS 111 HE1 HIS 111 21.792 20.142 7.673 644 HE2 HIS 111 HE2 HIS 111 19.664 21.468 8.075 645 H VAL 112 HN VAL 112 26.679 23.483 11.243 646 HA VAL 112 HA VAL 112 26.388 25.969 12.838 647 HB VAL 112 HB VAL 112 28.151 24.962 14.348 648 HG11 VAL 112 HG11 VAL 112 25.783 25.058 15.001 649 HG12 VAL 112 HG12 VAL 112 26.502 23.548 15.559 650 HG13 VAL 112 HG13 VAL 112 25.467 23.557 14.131 651 HG21 VAL 112 HG21 VAL 112 28.678 22.671 14.218 652 HG22 VAL 112 HG22 VAL 112 28.653 23.149 12.520 653 HG23 VAL 112 HG23 VAL 112 27.267 22.309 13.224 654 H LEU 113 HN LEU 113 28.362 27.168 13.080 655 HA LEU 113 HA LEU 113 29.718 27.542 10.636 656 HB2 LEU 113 HB2 LEU 113 30.096 28.576 13.440 657 HB3 LEU 113 HB1 LEU 113 31.278 28.968 12.185 658 HG LEU 113 HG LEU 113 29.447 30.680 12.442 659 HD11 LEU 113 HD11 LEU 113 29.000 29.560 9.704 660 HD12 LEU 113 HD12 LEU 113 30.677 29.877 10.148 661 HD13 LEU 113 HD13 LEU 113 29.491 31.178 10.201 662 HD21 LEU 113 HD21 LEU 113 27.193 30.155 11.864 663 HD22 LEU 113 HD22 LEU 113 27.709 28.845 12.926 664 HD23 LEU 113 HD23 LEU 113 27.651 28.596 11.182 665 H ASP 114 HN ASP 114 30.621 25.865 13.608 666 HA ASP 114 HA ASP 114 33.048 24.842 12.227 667 HB2 ASP 114 HB2 ASP 114 33.589 26.329 14.099 668 HB3 ASP 114 HB1 ASP 114 32.635 25.317 15.182 669 HA PRO 115 HA PRO 115 30.202 21.239 12.895 670 HB2 PRO 115 HB2 PRO 115 32.025 20.208 10.746 671 HB3 PRO 115 HB1 PRO 115 30.252 20.132 10.847 672 HG2 PRO 115 HG2 PRO 115 31.467 21.826 9.188 673 HG3 PRO 115 HG1 PRO 115 29.987 22.290 10.055 674 HD2 PRO 115 HD2 PRO 115 32.831 23.080 10.614 675 HD3 PRO 115 HD1 PRO 115 31.341 24.039 10.764 676 H ARG 116 HN ARG 116 30.612 19.453 14.133 677 HA ARG 116 HA ARG 116 33.441 18.701 14.639 678 HB2 ARG 116 HB2 ARG 116 31.244 19.151 16.669 679 HB3 ARG 116 HB1 ARG 116 32.764 18.323 17.031 680 HG2 ARG 116 HG2 ARG 116 34.017 20.331 16.304 681 HG3 ARG 116 HG1 ARG 116 32.493 21.158 15.982 682 HD2 ARG 116 HD2 ARG 116 31.851 20.924 18.346 683 HD3 ARG 116 HD1 ARG 116 33.357 20.065 18.674 684 HE ARG 116 HE ARG 116 34.522 22.100 18.522 685 HH11 ARG 116 HH21 ARG 116 31.189 22.432 17.637 686 HH12 ARG 116 HH22 ARG 116 31.210 24.162 17.680 687 HH21 ARG 116 HH11 ARG 116 34.553 24.367 18.574 688 HH22 ARG 116 HH12 ARG 116 33.113 25.257 18.207 689 H CYS 117 HN CYS 117 33.753 16.666 14.113 690 HA CYS 117 HA CYS 117 31.905 14.823 13.283 691 HB2 CYS 117 HB2 CYS 117 33.580 13.101 13.697 692 HB3 CYS 117 HB1 CYS 117 34.365 14.553 13.076 693 H GLN 118 HN GLN 118 30.711 13.185 14.197 694 HA GLN 118 HA GLN 118 29.492 13.616 16.651 695 HB2 GLN 118 HB2 GLN 118 28.813 11.179 16.498 696 HB3 GLN 118 HB1 GLN 118 28.423 12.180 15.096 697 HG2 GLN 118 HG2 GLN 118 30.563 11.388 14.027 698 HG3 GLN 118 HG1 GLN 118 30.761 10.276 15.376 699 HE21 GLN 118 HE21 GLN 118 27.535 10.994 14.139 700 HE22 GLN 118 HE22 GLN 118 27.288 9.483 13.418 701 H ILE 119 HN ILE 119 32.629 12.537 16.100 702 HA ILE 119 HA ILE 119 32.853 11.007 18.583 703 HB ILE 119 HB ILE 119 35.021 11.842 16.646 704 HG12 ILE 119 HG12 ILE 119 33.335 10.540 15.454 705 HG13 ILE 119 HG11 ILE 119 34.754 9.531 15.732 706 HG21 ILE 119 HG21 ILE 119 35.907 11.168 18.793 707 HG22 ILE 119 HG22 ILE 119 36.170 9.847 17.655 708 HG23 ILE 119 HG23 ILE 119 34.858 9.751 18.830 709 HD11 ILE 119 HD11 ILE 119 32.986 8.112 16.346 710 HD12 ILE 119 HD12 ILE 119 32.063 9.416 17.083 711 HD13 ILE 119 HD13 ILE 119 33.482 8.774 17.902 712 H CYS 120 HN CYS 120 33.857 14.128 17.252 713 HA CYS 120 HA CYS 120 35.404 14.903 19.514 714 HB2 CYS 120 HB2 CYS 120 34.343 16.293 17.079 715 HB3 CYS 120 HB1 CYS 120 34.878 17.293 18.434 716 H VAL 121 HN VAL 121 32.021 15.198 18.663 717 HA VAL 121 HA VAL 121 31.387 17.054 20.768 718 HB VAL 121 HB VAL 121 29.093 16.702 20.143 719 HG11 VAL 121 HG11 VAL 121 29.213 17.176 17.751 720 HG12 VAL 121 HG12 VAL 121 30.831 16.479 17.667 721 HG13 VAL 121 HG13 VAL 121 30.560 17.969 18.569 722 HG21 VAL 121 HG21 VAL 121 30.188 14.233 18.792 723 HG22 VAL 121 HG22 VAL 121 28.607 14.897 18.389 724 HG23 VAL 121 HG23 VAL 121 28.933 14.319 20.024 725 H HIS 122 HN HIS 122 31.205 13.548 20.341 726 HA HIS 122 HA HIS 122 29.837 12.942 22.730 727 HB2 HIS 122 HB2 HIS 122 30.118 11.316 20.907 728 HB3 HIS 122 HB1 HIS 122 31.856 11.263 21.224 729 HD2 HIS 122 HD2 HIS 122 28.844 10.919 23.828 730 HE1 HIS 122 HE1 HIS 122 31.499 7.673 24.318 731 HE2 HIS 122 HE2 HIS 122 29.381 8.763 25.200 732 H SER 123 HN SER 123 32.672 14.526 22.469 733 HA SER 123 HA SER 123 33.681 13.486 25.063 734 HB2 SER 123 HB2 SER 123 35.226 14.357 22.620 735 HB3 SER 123 HB1 SER 123 35.954 14.244 24.219 736 HG SER 123 HG SER 123 34.875 12.223 22.580 737 H GLN 124 HN GLN 124 33.977 16.289 22.860 738 HA GLN 124 HA GLN 124 34.170 18.072 25.198 739 HB2 GLN 124 HB2 GLN 124 34.572 18.617 22.245 740 HB3 GLN 124 HB1 GLN 124 34.831 19.777 23.548 741 HG2 GLN 124 HG2 GLN 124 36.277 17.126 23.289 742 HG3 GLN 124 HG1 GLN 124 36.948 18.686 22.811 743 HE21 GLN 124 HE21 GLN 124 37.221 16.542 25.249 744 HE22 GLN 124 HE22 GLN 124 37.463 17.591 26.560 745 H ARG 125 HN ARG 125 31.641 16.771 24.399 746 HA ARG 125 HA ARG 125 29.468 17.303 23.702 747 HB2 ARG 125 HB2 ARG 125 28.683 19.270 25.263 748 HB3 ARG 125 HB1 ARG 125 29.222 17.747 25.977 749 HG2 ARG 125 HG2 ARG 125 31.441 18.658 26.386 750 HG3 ARG 125 HG1 ARG 125 31.019 20.154 25.552 751 HD2 ARG 125 HD2 ARG 125 30.845 20.483 27.961 752 HD3 ARG 125 HD1 ARG 125 29.245 20.569 27.230 753 HE ARG 125 HE ARG 125 29.793 17.910 28.067 754 HH11 ARG 125 HH21 ARG 125 29.073 21.084 29.235 755 HH12 ARG 125 HH22 ARG 125 28.288 20.528 30.675 756 HH21 ARG 125 HH11 ARG 125 28.762 17.170 29.949 757 HH22 ARG 125 HH12 ARG 125 28.112 18.310 31.080 758 H ASN 126 HN ASN 126 29.694 20.615 24.465 759 HA ASN 126 HA ASN 126 29.536 21.345 21.595 760 HB2 ASN 126 HB2 ASN 126 28.368 22.609 24.076 761 HB3 ASN 126 HB1 ASN 126 28.418 23.425 22.514 762 HD21 ASN 126 HD21 ASN 126 25.920 22.770 23.731 763 HD22 ASN 126 HD22 ASN 126 25.170 21.562 22.801 Start of MODEL 11 1 H MET 31 HT1 MET 31 -1.714 30.028 -16.166 2 HA MET 31 HA MET 31 0.278 29.042 -17.254 3 HB2 MET 31 HB2 MET 31 1.663 31.019 -15.406 4 HB3 MET 31 HB1 MET 31 2.467 29.748 -16.332 5 HG2 MET 31 HG2 MET 31 0.834 32.005 -17.536 6 HG3 MET 31 HG1 MET 31 2.592 31.962 -17.466 7 HE1 MET 31 HE1 MET 31 4.079 30.840 -18.842 8 HE2 MET 31 HE2 MET 31 3.773 29.531 -19.980 9 HE3 MET 31 HE3 MET 31 3.672 29.224 -18.250 10 H GLY 32 HN GLY 32 0.617 27.103 -16.294 11 HA2 GLY 32 HA2 GLY 32 -0.484 26.624 -13.687 12 HA3 GLY 32 HA1 GLY 32 0.309 25.437 -14.719 13 H LYS 33 HN LYS 33 0.609 27.407 -11.974 14 HA LYS 33 HA LYS 33 3.409 27.743 -11.820 15 HB2 LYS 33 HB2 LYS 33 1.299 27.548 -9.663 16 HB3 LYS 33 HB1 LYS 33 2.985 27.968 -9.352 17 HG2 LYS 33 HG2 LYS 33 2.801 29.885 -10.891 18 HG3 LYS 33 HG1 LYS 33 1.118 29.468 -11.212 19 HD2 LYS 33 HD2 LYS 33 0.578 29.792 -8.827 20 HD3 LYS 33 HD1 LYS 33 2.261 30.209 -8.502 21 HE2 LYS 33 HE2 LYS 33 2.091 32.127 -10.042 22 HE3 LYS 33 HE1 LYS 33 0.412 31.710 -10.379 23 HZ1 LYS 33 HZ1 LYS 33 1.327 33.319 -8.354 24 HZ2 LYS 33 HZ2 LYS 33 0.899 31.867 -7.583 25 HZ3 LYS 33 HZ3 LYS 33 -0.243 32.700 -8.524 26 H ASN 34 HN ASN 34 1.286 25.076 -10.999 27 HA ASN 34 HA ASN 34 3.177 23.559 -9.513 28 HB2 ASN 34 HB2 ASN 34 0.707 22.694 -11.032 29 HB3 ASN 34 HB1 ASN 34 1.607 21.678 -9.903 30 HD21 ASN 34 HD21 ASN 34 2.060 24.454 -8.391 31 HD22 ASN 34 HD22 ASN 34 0.642 24.580 -7.467 32 H ASP 35 HN ASP 35 4.439 24.519 -11.858 33 HA ASP 35 HA ASP 35 4.586 22.425 -13.827 34 HB2 ASP 35 HB2 ASP 35 6.244 24.895 -13.307 35 HB3 ASP 35 HB1 ASP 35 6.602 23.760 -14.612 36 H ASN 36 HN ASN 36 5.736 22.683 -10.715 37 HA ASN 36 HA ASN 36 8.358 21.623 -10.946 38 HB2 ASN 36 HB2 ASN 36 8.105 21.061 -8.557 39 HB3 ASN 36 HB1 ASN 36 7.572 22.710 -8.897 40 HD21 ASN 36 HD21 ASN 36 6.437 21.952 -6.652 41 HD22 ASN 36 HD22 ASN 36 4.857 21.362 -6.850 42 H ASP 37 HN ASP 37 5.204 20.206 -11.114 43 HA ASP 37 HA ASP 37 6.050 17.505 -10.576 44 HB2 ASP 37 HB2 ASP 37 3.705 18.392 -10.236 45 HB3 ASP 37 HB1 ASP 37 3.535 18.397 -11.990 46 H ALA 38 HN ALA 38 7.360 19.152 -12.739 47 HA ALA 38 HA ALA 38 6.629 17.996 -15.240 48 HB1 ALA 38 HB1 ALA 38 7.715 20.101 -15.331 49 HB2 ALA 38 HB2 ALA 38 8.885 18.939 -15.955 50 HB3 ALA 38 HB3 ALA 38 9.036 19.542 -14.305 51 H LEU 39 HN LEU 39 8.440 16.843 -16.571 52 HA LEU 39 HA LEU 39 9.976 14.954 -14.914 53 HB2 LEU 39 HB2 LEU 39 8.180 14.044 -17.177 54 HB3 LEU 39 HB1 LEU 39 9.269 13.032 -16.234 55 HG LEU 39 HG LEU 39 7.869 14.085 -14.181 56 HD11 LEU 39 HD11 LEU 39 6.505 15.424 -15.912 57 HD12 LEU 39 HD12 LEU 39 5.596 14.533 -14.696 58 HD13 LEU 39 HD13 LEU 39 5.753 13.888 -16.330 59 HD21 LEU 39 HD21 LEU 39 8.091 11.676 -14.669 60 HD22 LEU 39 HD22 LEU 39 6.880 11.815 -15.944 61 HD23 LEU 39 HD23 LEU 39 6.421 12.075 -14.261 62 H ILE 40 HN ILE 40 11.958 15.333 -15.493 63 HA ILE 40 HA ILE 40 12.624 15.948 -18.312 64 HB ILE 40 HB ILE 40 13.993 16.490 -15.676 65 HG12 ILE 40 HG12 ILE 40 14.093 18.752 -16.552 66 HG13 ILE 40 HG11 ILE 40 13.588 18.202 -18.152 67 HG21 ILE 40 HG21 ILE 40 15.971 17.281 -17.126 68 HG22 ILE 40 HG22 ILE 40 15.290 16.271 -18.401 69 HG23 ILE 40 HG23 ILE 40 15.818 15.540 -16.887 70 HD11 ILE 40 HD11 ILE 40 11.783 19.253 -16.624 71 HD12 ILE 40 HD12 ILE 40 11.855 17.736 -15.728 72 HD13 ILE 40 HD13 ILE 40 11.392 17.734 -17.428 73 H MET 41 HN MET 41 14.164 14.771 -19.448 74 HA MET 41 HA MET 41 14.396 11.994 -18.645 75 HB2 MET 41 HB2 MET 41 14.299 13.403 -21.089 76 HB3 MET 41 HB1 MET 41 15.929 12.741 -21.032 77 HG2 MET 41 HG2 MET 41 14.862 10.499 -20.452 78 HG3 MET 41 HG1 MET 41 13.310 11.238 -20.835 79 HE1 MET 41 HE1 MET 41 16.769 10.259 -21.925 80 HE2 MET 41 HE2 MET 41 16.548 9.739 -23.595 81 HE3 MET 41 HE3 MET 41 15.713 8.890 -22.297 82 H CYS 42 HN CYS 42 16.187 10.988 -17.884 83 HA CYS 42 HA CYS 42 18.367 12.626 -16.920 84 HB2 CYS 42 HB2 CYS 42 17.276 10.502 -15.836 85 HB3 CYS 42 HB1 CYS 42 18.397 9.621 -16.874 86 H MET 43 HN MET 43 20.434 12.742 -17.702 87 HA MET 43 HA MET 43 20.832 11.981 -20.458 88 HB2 MET 43 HB2 MET 43 23.176 12.945 -19.983 89 HB3 MET 43 HB1 MET 43 21.805 14.048 -19.861 90 HG2 MET 43 HG2 MET 43 21.780 13.907 -17.469 91 HG3 MET 43 HG1 MET 43 22.912 12.550 -17.474 92 HE1 MET 43 HE1 MET 43 25.244 12.686 -17.219 93 HE2 MET 43 HE2 MET 43 26.303 13.894 -17.940 94 HE3 MET 43 HE3 MET 43 25.286 12.897 -18.975 95 H ARG 44 HN ARG 44 21.137 10.294 -17.599 96 HA ARG 44 HA ARG 44 23.238 8.514 -18.723 97 HB2 ARG 44 HB2 ARG 44 23.918 9.649 -16.638 98 HB3 ARG 44 HB1 ARG 44 22.520 8.961 -15.818 99 HG2 ARG 44 HG2 ARG 44 23.344 6.704 -16.202 100 HG3 ARG 44 HG1 ARG 44 24.680 7.322 -17.173 101 HD2 ARG 44 HD2 ARG 44 24.230 7.987 -14.251 102 HD3 ARG 44 HD1 ARG 44 25.365 6.771 -14.836 103 HE ARG 44 HE ARG 44 25.695 9.655 -14.954 104 HH11 ARG 44 HH21 ARG 44 26.596 6.551 -16.187 105 HH12 ARG 44 HH22 ARG 44 28.126 7.083 -16.798 106 HH21 ARG 44 HH11 ARG 44 27.700 10.363 -15.755 107 HH22 ARG 44 HH12 ARG 44 28.752 9.242 -16.554 108 H CYS 45 HN CYS 45 21.090 7.878 -15.995 109 HA CYS 45 HA CYS 45 20.430 5.289 -16.946 110 HB2 CYS 45 HB2 CYS 45 19.057 5.087 -15.021 111 HB3 CYS 45 HB1 CYS 45 20.420 6.091 -14.532 112 H ARG 46 HN ARG 46 19.353 8.234 -18.027 113 HA ARG 46 HA ARG 46 17.509 8.961 -19.203 114 HB2 ARG 46 HB2 ARG 46 17.654 6.074 -20.071 115 HB3 ARG 46 HB1 ARG 46 16.663 7.304 -20.863 116 HG2 ARG 46 HG2 ARG 46 18.708 8.674 -21.238 117 HG3 ARG 46 HG1 ARG 46 19.676 7.387 -20.520 118 HD2 ARG 46 HD2 ARG 46 17.889 7.024 -22.935 119 HD3 ARG 46 HD1 ARG 46 19.625 7.316 -23.018 120 HE ARG 46 HE ARG 46 19.276 5.134 -21.328 121 HH11 ARG 46 HH21 ARG 46 18.590 6.024 -24.600 122 HH12 ARG 46 HH22 ARG 46 18.728 4.410 -25.214 123 HH21 ARG 46 HH11 ARG 46 19.455 3.016 -22.123 124 HH22 ARG 46 HH12 ARG 46 19.217 2.705 -23.809 125 H LYS 47 HN LYS 47 16.943 8.216 -16.523 126 HA LYS 47 HA LYS 47 14.335 6.877 -16.633 127 HB2 LYS 47 HB2 LYS 47 15.921 6.344 -14.803 128 HB3 LYS 47 HB1 LYS 47 15.835 8.020 -14.264 129 HG2 LYS 47 HG2 LYS 47 13.434 7.809 -13.866 130 HG3 LYS 47 HG1 LYS 47 13.448 6.160 -14.488 131 HD2 LYS 47 HD2 LYS 47 15.280 6.881 -12.203 132 HD3 LYS 47 HD1 LYS 47 13.572 6.591 -11.878 133 HE2 LYS 47 HE2 LYS 47 13.711 4.365 -12.851 134 HE3 LYS 47 HE1 LYS 47 15.378 4.642 -13.344 135 HZ1 LYS 47 HZ1 LYS 47 15.150 5.212 -10.613 136 HZ2 LYS 47 HZ2 LYS 47 16.051 3.981 -11.363 137 HZ3 LYS 47 HZ3 LYS 47 14.443 3.694 -10.892 138 H VAL 48 HN VAL 48 12.488 7.946 -16.757 139 HA VAL 48 HA VAL 48 12.490 10.875 -16.647 140 HB VAL 48 HB VAL 48 9.942 10.299 -17.294 141 HG11 VAL 48 HG11 VAL 48 10.658 10.246 -19.681 142 HG12 VAL 48 HG12 VAL 48 12.320 9.993 -19.151 143 HG13 VAL 48 HG13 VAL 48 11.491 11.500 -18.761 144 HG21 VAL 48 HG21 VAL 48 9.721 8.203 -18.433 145 HG22 VAL 48 HG22 VAL 48 10.457 7.828 -16.875 146 HG23 VAL 48 HG23 VAL 48 11.454 7.889 -18.331 147 H LYS 49 HN LYS 49 12.176 11.804 -14.768 148 HA LYS 49 HA LYS 49 10.009 10.959 -13.007 149 HB2 LYS 49 HB2 LYS 49 12.918 10.835 -12.276 150 HB3 LYS 49 HB1 LYS 49 11.760 11.313 -11.038 151 HG2 LYS 49 HG2 LYS 49 11.306 8.817 -12.667 152 HG3 LYS 49 HG1 LYS 49 12.378 8.789 -11.277 153 HD2 LYS 49 HD2 LYS 49 10.554 9.620 -9.838 154 HD3 LYS 49 HD1 LYS 49 9.469 9.663 -11.224 155 HE2 LYS 49 HE2 LYS 49 9.128 7.599 -9.937 156 HE3 LYS 49 HE1 LYS 49 9.769 7.232 -11.537 157 HZ1 LYS 49 HZ1 LYS 49 11.805 6.672 -10.698 158 HZ2 LYS 49 HZ2 LYS 49 10.810 6.168 -9.418 159 HZ3 LYS 49 HZ3 LYS 49 11.645 7.645 -9.318 160 H GLY 50 HN GLY 50 9.844 12.579 -11.148 161 HA2 GLY 50 HA2 GLY 50 10.328 15.295 -12.250 162 HA3 GLY 50 HA1 GLY 50 9.029 14.873 -11.141 163 H ILE 51 HN ILE 51 9.971 16.775 -9.972 164 HA ILE 51 HA ILE 51 12.477 16.964 -8.869 165 HB ILE 51 HB ILE 51 10.599 18.625 -8.704 166 HG12 ILE 51 HG12 ILE 51 11.862 18.023 -6.019 167 HG13 ILE 51 HG11 ILE 51 12.773 18.708 -7.367 168 HG21 ILE 51 HG21 ILE 51 8.961 18.425 -6.988 169 HG22 ILE 51 HG22 ILE 51 9.805 17.073 -6.234 170 HG23 ILE 51 HG23 ILE 51 8.991 16.852 -7.782 171 HD11 ILE 51 HD11 ILE 51 10.213 19.920 -6.319 172 HD12 ILE 51 HD12 ILE 51 11.367 20.645 -7.437 173 HD13 ILE 51 HD13 ILE 51 11.810 20.403 -5.747 174 H ASP 52 HN ASP 52 10.395 14.383 -8.330 175 HA ASP 52 HA ASP 52 10.982 13.839 -5.579 176 HB2 ASP 52 HB2 ASP 52 9.954 12.124 -7.848 177 HB3 ASP 52 HB1 ASP 52 10.178 11.515 -6.209 178 H SER 53 HN SER 53 12.173 12.585 -8.653 179 HA SER 53 HA SER 53 14.371 11.150 -7.345 180 HB2 SER 53 HB2 SER 53 13.971 11.438 -10.313 181 HB3 SER 53 HB1 SER 53 14.845 10.181 -9.447 182 HG SER 53 HG SER 53 12.916 9.405 -8.661 183 H TYR 54 HN TYR 54 13.916 14.280 -7.998 184 HA TYR 54 HA TYR 54 16.785 14.752 -8.595 185 HB2 TYR 54 HB2 TYR 54 14.354 15.941 -9.879 186 HB3 TYR 54 HB1 TYR 54 15.750 16.990 -9.621 187 HD1 TYR 54 HD1 TYR 54 14.843 13.627 -11.039 188 HD2 TYR 54 HD2 TYR 54 17.492 16.996 -11.182 189 HE1 TYR 54 HE1 TYR 54 15.932 12.680 -13.045 190 HE2 TYR 54 HE2 TYR 54 18.585 16.049 -13.160 191 HH TYR 54 HH TYR 54 18.172 12.859 -14.177 192 H SER 55 HN SER 55 17.788 16.316 -7.443 193 HA SER 55 HA SER 55 16.656 17.136 -4.956 194 HB2 SER 55 HB2 SER 55 19.091 16.752 -5.297 195 HB3 SER 55 HB1 SER 55 19.137 18.155 -6.369 196 HG SER 55 HG SER 55 19.313 18.098 -3.728 197 H LYS 56 HN LYS 56 16.433 19.409 -4.289 198 HA LYS 56 HA LYS 56 14.737 20.866 -6.004 199 HB2 LYS 56 HB2 LYS 56 16.255 21.696 -3.525 200 HB3 LYS 56 HB1 LYS 56 15.044 22.703 -4.321 201 HG2 LYS 56 HG2 LYS 56 13.360 20.925 -4.021 202 HG3 LYS 56 HG1 LYS 56 14.568 19.915 -3.223 203 HD2 LYS 56 HD2 LYS 56 14.838 21.588 -1.456 204 HD3 LYS 56 HD1 LYS 56 13.679 22.649 -2.264 205 HE2 LYS 56 HE2 LYS 56 12.555 21.427 -0.462 206 HE3 LYS 56 HE1 LYS 56 11.940 20.885 -2.024 207 HZ1 LYS 56 HZ1 LYS 56 12.839 19.245 -0.116 208 HZ2 LYS 56 HZ2 LYS 56 14.249 19.441 -1.045 209 HZ3 LYS 56 HZ3 LYS 56 12.826 18.859 -1.767 210 H THR 57 HN THR 57 18.180 21.238 -5.238 211 HA THR 57 HA THR 57 18.591 23.656 -6.622 212 HB THR 57 HB THR 57 20.642 21.465 -6.270 213 HG1 THR 57 HG1 THR 57 21.004 22.436 -4.247 214 HG21 THR 57 HG21 THR 57 20.774 24.486 -6.469 215 HG22 THR 57 HG22 THR 57 21.396 23.321 -7.638 216 HG23 THR 57 HG23 THR 57 22.147 23.463 -6.049 217 H GLN 58 HN GLN 58 18.986 20.270 -7.698 218 HA GLN 58 HA GLN 58 19.936 20.878 -10.287 219 HB2 GLN 58 HB2 GLN 58 18.466 18.453 -9.236 220 HB3 GLN 58 HB1 GLN 58 19.234 18.542 -10.820 221 HG2 GLN 58 HG2 GLN 58 21.404 19.031 -9.728 222 HG3 GLN 58 HG1 GLN 58 20.628 18.889 -8.151 223 HE21 GLN 58 HE21 GLN 58 20.122 16.759 -7.369 224 HE22 GLN 58 HE22 GLN 58 20.615 15.348 -8.185 225 H TRP 59 HN TRP 59 16.676 20.082 -9.130 226 HA TRP 59 HA TRP 59 15.361 20.163 -11.583 227 HB2 TRP 59 HB2 TRP 59 14.517 19.585 -9.114 228 HB3 TRP 59 HB1 TRP 59 13.944 21.251 -9.154 229 HD1 TRP 59 HD1 TRP 59 11.544 21.433 -10.017 230 HE1 TRP 59 HE1 TRP 59 10.055 20.070 -11.647 231 HE3 TRP 59 HE3 TRP 59 14.873 17.871 -11.498 232 HZ2 TRP 59 HZ2 TRP 59 10.281 17.788 -13.324 233 HZ3 TRP 59 HZ3 TRP 59 14.214 16.106 -13.098 234 HH2 TRP 59 HH2 TRP 59 11.916 16.063 -14.009 235 H SER 60 HN SER 60 16.359 22.759 -9.441 236 HA SER 60 HA SER 60 14.845 24.843 -10.644 237 HB2 SER 60 HB2 SER 60 16.185 26.343 -9.372 238 HB3 SER 60 HB1 SER 60 16.000 24.903 -8.377 239 HG SER 60 HG SER 60 18.235 26.027 -9.351 240 H LYS 61 HN LYS 61 17.697 23.155 -11.617 241 HA LYS 61 HA LYS 61 18.736 25.258 -13.304 242 HB2 LYS 61 HB2 LYS 61 19.341 22.290 -13.258 243 HB3 LYS 61 HB1 LYS 61 20.242 23.504 -14.162 244 HG2 LYS 61 HG2 LYS 61 20.804 24.667 -12.070 245 HG3 LYS 61 HG1 LYS 61 19.889 23.471 -11.156 246 HD2 LYS 61 HD2 LYS 61 21.389 21.689 -12.031 247 HD3 LYS 61 HD1 LYS 61 22.340 22.930 -12.853 248 HE2 LYS 61 HE2 LYS 61 22.808 24.014 -10.695 249 HE3 LYS 61 HE1 LYS 61 21.843 22.791 -9.870 250 HZ1 LYS 61 HZ1 LYS 61 23.391 21.164 -10.271 251 HZ2 LYS 61 HZ2 LYS 61 24.396 22.513 -10.040 252 HZ3 LYS 61 HZ3 LYS 61 24.060 21.960 -11.611 253 H THR 62 HN THR 62 16.325 22.829 -13.555 254 HA THR 62 HA THR 62 16.358 22.506 -16.396 255 HB THR 62 HB THR 62 14.193 21.418 -16.110 256 HG1 THR 62 HG1 THR 62 13.053 22.437 -14.646 257 HG21 THR 62 HG21 THR 62 14.855 19.715 -14.424 258 HG22 THR 62 HG22 THR 62 16.154 20.782 -13.888 259 HG23 THR 62 HG23 THR 62 16.175 20.117 -15.522 260 H PHE 63 HN PHE 63 15.516 25.112 -14.476 261 HA PHE 63 HA PHE 63 13.775 26.240 -16.585 262 HB2 PHE 63 HB2 PHE 63 13.700 26.962 -13.647 263 HB3 PHE 63 HB1 PHE 63 12.572 27.457 -14.907 264 HD1 PHE 63 HD2 PHE 63 11.025 25.815 -15.921 265 HD2 PHE 63 HD1 PHE 63 13.565 24.815 -12.619 266 HE1 PHE 63 HE2 PHE 63 9.656 23.782 -15.492 267 HE2 PHE 63 HE1 PHE 63 12.203 22.783 -12.177 268 HZ PHE 63 HZ PHE 63 10.249 22.267 -13.615 269 H THR 64 HN THR 64 14.150 28.337 -17.161 270 HA THR 64 HA THR 64 16.544 29.655 -15.994 271 HB THR 64 HB THR 64 16.693 30.656 -18.412 272 HG1 THR 64 HG1 THR 64 15.777 29.415 -19.963 273 HG21 THR 64 HG21 THR 64 18.536 29.364 -17.863 274 HG22 THR 64 HG22 THR 64 17.825 28.345 -19.115 275 HG23 THR 64 HG23 THR 64 17.561 27.962 -17.414 276 H PHE 65 HN PHE 65 16.527 31.925 -16.056 277 HA PHE 65 HA PHE 65 13.808 33.078 -15.948 278 HB2 PHE 65 HB2 PHE 65 15.935 33.153 -14.122 279 HB3 PHE 65 HB1 PHE 65 15.979 34.745 -14.869 280 HD1 PHE 65 HD1 PHE 65 13.354 32.315 -13.703 281 HD2 PHE 65 HD2 PHE 65 14.736 36.382 -13.765 282 HE1 PHE 65 HE1 PHE 65 11.407 33.001 -12.330 283 HE2 PHE 65 HE2 PHE 65 12.793 37.063 -12.387 284 HZ PHE 65 HZ PHE 65 11.129 35.379 -11.681 285 H VAL 66 HN VAL 66 13.193 34.372 -17.554 286 HA VAL 66 HA VAL 66 15.246 35.920 -19.031 287 HB VAL 66 HB VAL 66 12.943 34.312 -20.149 288 HG11 VAL 66 HG11 VAL 66 12.811 36.363 -21.349 289 HG12 VAL 66 HG12 VAL 66 13.792 35.310 -22.369 290 HG13 VAL 66 HG13 VAL 66 14.563 36.549 -21.377 291 HG21 VAL 66 HG21 VAL 66 14.706 33.248 -21.452 292 HG22 VAL 66 HG22 VAL 66 15.150 33.190 -19.745 293 HG23 VAL 66 HG23 VAL 66 15.903 34.374 -20.812 294 H ARG 67 HN ARG 67 14.815 38.028 -19.203 295 HA ARG 67 HA ARG 67 13.768 40.039 -18.826 296 HB2 ARG 67 HB2 ARG 67 11.487 38.442 -20.010 297 HB3 ARG 67 HB1 ARG 67 11.465 40.195 -19.782 298 HG2 ARG 67 HG2 ARG 67 13.421 40.440 -21.228 299 HG3 ARG 67 HG1 ARG 67 13.533 38.690 -21.409 300 HD2 ARG 67 HD2 ARG 67 12.409 39.623 -23.360 301 HD3 ARG 67 HD1 ARG 67 11.252 38.682 -22.415 302 HE ARG 67 HE ARG 67 11.192 41.398 -21.589 303 HH11 ARG 67 HH21 ARG 67 10.327 39.292 -24.195 304 HH12 ARG 67 HH22 ARG 67 8.998 40.268 -24.724 305 HH21 ARG 67 HH11 ARG 67 9.453 42.680 -22.273 306 HH22 ARG 67 HH12 ARG 67 8.503 42.188 -23.635 307 H GLY 68 HN GLY 68 13.688 37.971 -16.638 308 HA2 GLY 68 HA2 GLY 68 12.964 38.105 -14.443 309 HA3 GLY 68 HA1 GLY 68 11.877 39.414 -14.908 310 H ARG 69 HN ARG 69 11.689 36.647 -16.880 311 HA ARG 69 HA ARG 69 9.212 35.756 -15.502 312 HB2 ARG 69 HB2 ARG 69 9.891 35.824 -18.451 313 HB3 ARG 69 HB1 ARG 69 8.454 35.055 -17.776 314 HG2 ARG 69 HG2 ARG 69 7.746 37.205 -16.809 315 HG3 ARG 69 HG1 ARG 69 9.190 37.979 -17.464 316 HD2 ARG 69 HD2 ARG 69 8.465 37.387 -19.752 317 HD3 ARG 69 HD1 ARG 69 7.015 36.633 -19.093 318 HE ARG 69 HE ARG 69 7.097 39.261 -18.134 319 HH11 ARG 69 HH21 ARG 69 6.858 37.545 -21.129 320 HH12 ARG 69 HH22 ARG 69 5.933 38.778 -21.920 321 HH21 ARG 69 HH11 ARG 69 5.887 40.883 -19.163 322 HH22 ARG 69 HH12 ARG 69 5.384 40.668 -20.807 323 H THR 70 HN THR 70 8.874 33.570 -15.259 324 HA THR 70 HA THR 70 11.228 31.905 -15.316 325 HB THR 70 HB THR 70 8.370 31.106 -14.711 326 HG1 THR 70 HG1 THR 70 9.846 31.425 -12.545 327 HG21 THR 70 HG21 THR 70 9.610 29.424 -13.259 328 HG22 THR 70 HG22 THR 70 11.081 29.909 -14.101 329 HG23 THR 70 HG23 THR 70 9.753 29.174 -14.998 330 H VAL 71 HN VAL 71 11.879 30.698 -16.974 331 HA VAL 71 HA VAL 71 9.886 29.705 -18.925 332 HB VAL 71 HB VAL 71 11.649 30.117 -20.703 333 HG11 VAL 71 HG11 VAL 71 10.471 32.508 -19.254 334 HG12 VAL 71 HG12 VAL 71 9.655 31.536 -20.479 335 HG13 VAL 71 HG13 VAL 71 11.055 32.516 -20.919 336 HG21 VAL 71 HG21 VAL 71 12.772 31.978 -18.584 337 HG22 VAL 71 HG22 VAL 71 13.368 31.767 -20.228 338 HG23 VAL 71 HG23 VAL 71 13.526 30.457 -19.064 339 H SER 72 HN SER 72 10.129 27.610 -19.478 340 HA SER 72 HA SER 72 11.968 25.984 -18.021 341 HB2 SER 72 HB2 SER 72 11.001 24.126 -19.220 342 HB3 SER 72 HB1 SER 72 9.699 25.239 -18.793 343 HG SER 72 HG SER 72 10.251 26.164 -20.996 344 H VAL 73 HN VAL 73 13.745 24.823 -18.742 345 HA VAL 73 HA VAL 73 15.356 26.126 -20.689 346 HB VAL 73 HB VAL 73 15.721 23.493 -19.263 347 HG11 VAL 73 HG11 VAL 73 18.149 23.889 -19.920 348 HG12 VAL 73 HG12 VAL 73 17.562 25.130 -21.028 349 HG13 VAL 73 HG13 VAL 73 17.083 23.450 -21.253 350 HG21 VAL 73 HG21 VAL 73 17.085 24.726 -17.748 351 HG22 VAL 73 HG22 VAL 73 15.627 25.694 -17.942 352 HG23 VAL 73 HG23 VAL 73 17.103 26.141 -18.793 353 H SER 74 HN SER 74 15.905 25.488 -22.772 354 HA SER 74 HA SER 74 13.978 23.983 -24.228 355 HB2 SER 74 HB2 SER 74 15.570 24.243 -26.122 356 HB3 SER 74 HB1 SER 74 15.220 25.765 -25.309 357 HG SER 74 HG SER 74 17.181 25.679 -24.316 358 H ASP 75 HN ASP 75 17.252 23.251 -23.076 359 HA ASP 75 HA ASP 75 16.669 20.389 -23.246 360 HB2 ASP 75 HB2 ASP 75 18.870 21.749 -24.802 361 HB3 ASP 75 HB1 ASP 75 18.899 20.027 -24.413 362 HA PRO 76 HA PRO 76 19.327 21.637 -19.687 363 HB2 PRO 76 HB2 PRO 76 17.811 20.647 -17.671 364 HB3 PRO 76 HB1 PRO 76 17.467 22.213 -18.433 365 HG2 PRO 76 HG2 PRO 76 16.125 19.581 -18.835 366 HG3 PRO 76 HG1 PRO 76 15.423 21.208 -18.788 367 HD2 PRO 76 HD2 PRO 76 16.002 19.789 -21.130 368 HD3 PRO 76 HD1 PRO 76 15.779 21.549 -21.046 369 H LYS 77 HN LYS 77 20.903 20.404 -18.778 370 HA LYS 77 HA LYS 77 20.657 17.452 -18.988 371 HB2 LYS 77 HB2 LYS 77 23.087 19.210 -19.381 372 HB3 LYS 77 HB1 LYS 77 23.123 17.448 -19.333 373 HG2 LYS 77 HG2 LYS 77 21.489 17.413 -21.233 374 HG3 LYS 77 HG1 LYS 77 21.624 19.167 -21.333 375 HD2 LYS 77 HD2 LYS 77 24.002 17.302 -21.553 376 HD3 LYS 77 HD1 LYS 77 23.104 17.892 -22.949 377 HE2 LYS 77 HE2 LYS 77 23.555 20.254 -22.041 378 HE3 LYS 77 HE1 LYS 77 24.732 19.494 -20.969 379 HZ1 LYS 77 HZ1 LYS 77 25.360 18.396 -23.322 380 HZ2 LYS 77 HZ2 LYS 77 26.106 19.783 -22.686 381 HZ3 LYS 77 HZ3 LYS 77 24.851 19.936 -23.820 382 H VAL 78 HN VAL 78 20.362 16.697 -16.983 383 HA VAL 78 HA VAL 78 22.340 17.351 -14.939 384 HB VAL 78 HB VAL 78 20.384 17.594 -13.249 385 HG11 VAL 78 HG11 VAL 78 20.331 20.015 -13.596 386 HG12 VAL 78 HG12 VAL 78 20.897 19.813 -15.253 387 HG13 VAL 78 HG13 VAL 78 21.959 19.411 -13.905 388 HG21 VAL 78 HG21 VAL 78 18.268 18.205 -14.030 389 HG22 VAL 78 HG22 VAL 78 18.734 17.007 -15.244 390 HG23 VAL 78 HG23 VAL 78 18.879 18.725 -15.603 391 H ILE 79 HN ILE 79 22.557 15.742 -13.352 392 HA ILE 79 HA ILE 79 21.520 13.134 -14.170 393 HB ILE 79 HB ILE 79 23.542 13.923 -12.056 394 HG12 ILE 79 HG12 ILE 79 23.863 12.444 -14.688 395 HG13 ILE 79 HG11 ILE 79 24.217 14.158 -14.466 396 HG21 ILE 79 HG21 ILE 79 22.495 11.915 -11.283 397 HG22 ILE 79 HG22 ILE 79 23.979 11.395 -12.069 398 HG23 ILE 79 HG23 ILE 79 22.437 11.238 -12.908 399 HD11 ILE 79 HD11 ILE 79 26.269 12.797 -14.253 400 HD12 ILE 79 HD12 ILE 79 25.521 11.879 -12.944 401 HD13 ILE 79 HD13 ILE 79 25.879 13.593 -12.729 402 H CYS 80 HN CYS 80 20.460 11.699 -12.726 403 HA CYS 80 HA CYS 80 18.682 13.092 -10.848 404 HB2 CYS 80 HB2 CYS 80 17.247 11.223 -11.038 405 HB3 CYS 80 HB1 CYS 80 17.880 11.479 -12.666 406 H ARG 81 HN ARG 81 18.307 12.263 -8.730 407 HA ARG 81 HA ARG 81 20.648 11.689 -7.260 408 HB2 ARG 81 HB2 ARG 81 17.728 11.404 -6.527 409 HB3 ARG 81 HB1 ARG 81 19.052 11.206 -5.379 410 HG2 ARG 81 HG2 ARG 81 19.820 13.484 -5.811 411 HG3 ARG 81 HG1 ARG 81 18.580 13.694 -7.047 412 HD2 ARG 81 HD2 ARG 81 17.820 14.731 -4.983 413 HD3 ARG 81 HD1 ARG 81 16.834 13.308 -5.310 414 HE ARG 81 HE ARG 81 19.045 12.618 -3.654 415 HH11 ARG 81 HH21 ARG 81 15.999 14.255 -3.685 416 HH12 ARG 81 HH22 ARG 81 15.682 13.993 -2.003 417 HH21 ARG 81 HH11 ARG 81 18.642 12.270 -1.448 418 HH22 ARG 81 HH12 ARG 81 17.180 12.868 -0.734 419 H THR 82 HN THR 82 18.272 9.648 -8.767 420 HA THR 82 HA THR 82 18.837 7.233 -7.404 421 HB THR 82 HB THR 82 17.887 7.437 -10.259 422 HG1 THR 82 HG1 THR 82 15.922 7.238 -8.462 423 HG21 THR 82 HG21 THR 82 18.403 5.189 -9.409 424 HG22 THR 82 HG22 THR 82 16.665 5.387 -9.634 425 HG23 THR 82 HG23 THR 82 17.359 5.472 -8.016 426 H CYS 83 HN CYS 83 20.265 8.735 -10.287 427 HA CYS 83 HA CYS 83 21.717 6.580 -11.263 428 HB2 CYS 83 HB2 CYS 83 21.898 9.531 -11.433 429 HB3 CYS 83 HB1 CYS 83 23.402 8.678 -11.784 430 H GLN 84 HN GLN 84 23.256 9.224 -9.421 431 HA GLN 84 HA GLN 84 25.222 9.165 -8.201 432 HB2 GLN 84 HB2 GLN 84 23.385 7.155 -6.909 433 HB3 GLN 84 HB1 GLN 84 24.939 7.588 -6.194 434 HG2 GLN 84 HG2 GLN 84 24.311 9.874 -5.948 435 HG3 GLN 84 HG1 GLN 84 22.913 9.681 -7.006 436 HE21 GLN 84 HE21 GLN 84 21.944 10.714 -4.851 437 HE22 GLN 84 HE22 GLN 84 21.369 9.596 -3.710 438 HA PRO 85 HA PRO 85 26.903 5.372 -10.316 439 HB2 PRO 85 HB2 PRO 85 28.910 6.607 -11.715 440 HB3 PRO 85 HB1 PRO 85 27.246 6.462 -12.322 441 HG2 PRO 85 HG2 PRO 85 28.602 8.797 -11.055 442 HG3 PRO 85 HG1 PRO 85 27.453 8.756 -12.404 443 HD2 PRO 85 HD2 PRO 85 26.754 9.431 -9.826 444 HD3 PRO 85 HD1 PRO 85 25.607 8.743 -10.999 445 H LYS 86 HN LYS 86 28.471 8.008 -8.594 446 HA LYS 86 HA LYS 86 29.923 6.231 -6.910 447 HB2 LYS 86 HB2 LYS 86 31.279 6.060 -9.014 448 HB3 LYS 86 HB1 LYS 86 31.604 7.787 -8.884 449 HG2 LYS 86 HG2 LYS 86 32.701 7.473 -6.736 450 HG3 LYS 86 HG1 LYS 86 32.253 5.769 -6.718 451 HD2 LYS 86 HD2 LYS 86 34.533 5.840 -7.450 452 HD3 LYS 86 HD1 LYS 86 33.565 5.520 -8.888 453 HE2 LYS 86 HE2 LYS 86 33.779 7.759 -9.662 454 HE3 LYS 86 HE1 LYS 86 34.364 8.329 -8.097 455 HZ1 LYS 86 HZ1 LYS 86 35.890 6.224 -9.417 456 HZ2 LYS 86 HZ2 LYS 86 36.427 7.530 -8.470 457 HZ3 LYS 86 HZ3 LYS 86 35.979 7.778 -10.090 458 H GLN 87 HN GLN 87 31.024 9.343 -8.204 459 HA GLN 87 HA GLN 87 31.460 11.338 -7.148 460 HB2 GLN 87 HB2 GLN 87 28.889 11.201 -7.315 461 HB3 GLN 87 HB1 GLN 87 28.925 10.838 -5.589 462 HG2 GLN 87 HG2 GLN 87 30.184 12.945 -5.190 463 HG3 GLN 87 HG1 GLN 87 30.108 13.301 -6.914 464 HE21 GLN 87 HE21 GLN 87 28.929 15.306 -5.802 465 HE22 GLN 87 HE22 GLN 87 27.244 15.156 -5.650 466 H HIS 88 HN HIS 88 29.981 11.387 -4.268 467 HA HIS 88 HA HIS 88 30.886 11.482 -2.139 468 HB2 HIS 88 HB2 HIS 88 30.006 9.184 -2.278 469 HB3 HIS 88 HB1 HIS 88 31.566 8.631 -2.901 470 HD2 HIS 88 HD2 HIS 88 33.395 8.000 -0.909 471 HE1 HIS 88 HE1 HIS 88 31.401 9.852 2.319 472 HE2 HIS 88 HE2 HIS 88 33.387 8.409 1.670 473 H ASP 89 HN ASP 89 32.584 12.990 -2.702 474 HA ASP 89 HA ASP 89 35.201 11.944 -2.052 475 HB2 ASP 89 HB2 ASP 89 34.626 13.104 -4.781 476 HB3 ASP 89 HB1 ASP 89 36.248 13.013 -4.097 477 H SER 90 HN SER 90 36.770 13.668 -1.673 478 HA SER 90 HA SER 90 35.746 15.820 -0.235 479 HB2 SER 90 HB2 SER 90 38.454 15.427 -1.526 480 HB3 SER 90 HB1 SER 90 38.086 16.717 -0.383 481 HG SER 90 HG SER 90 38.911 14.394 0.253 482 H ILE 91 HN ILE 91 36.422 18.171 -0.749 483 HA ILE 91 HA ILE 91 35.947 18.811 -3.609 484 HB ILE 91 HB ILE 91 34.503 20.098 -1.280 485 HG12 ILE 91 HG12 ILE 91 33.464 18.352 -3.541 486 HG13 ILE 91 HG11 ILE 91 33.709 17.799 -1.881 487 HG21 ILE 91 HG21 ILE 91 34.982 21.681 -3.094 488 HG22 ILE 91 HG22 ILE 91 33.266 21.277 -3.098 489 HG23 ILE 91 HG23 ILE 91 34.350 20.543 -4.280 490 HD11 ILE 91 HD11 ILE 91 31.439 18.371 -1.877 491 HD12 ILE 91 HD12 ILE 91 31.688 19.757 -2.940 492 HD13 ILE 91 HD13 ILE 91 32.187 19.842 -1.257 493 H TRP 92 HN TRP 92 37.093 20.507 -4.386 494 HA TRP 92 HA TRP 92 39.158 21.634 -2.668 495 HB2 TRP 92 HB2 TRP 92 39.594 20.850 -5.026 496 HB3 TRP 92 HB1 TRP 92 38.631 22.218 -5.589 497 HD1 TRP 92 HD1 TRP 92 39.513 24.699 -4.561 498 HE1 TRP 92 HE1 TRP 92 41.930 25.542 -4.366 499 HE3 TRP 92 HE3 TRP 92 41.997 20.241 -4.755 500 HZ2 TRP 92 HZ2 TRP 92 44.585 24.459 -4.290 501 HZ3 TRP 92 HZ3 TRP 92 44.471 20.178 -4.618 502 HH2 TRP 92 HH2 TRP 92 45.767 22.279 -4.387 503 H CYS 93 HN CYS 93 39.290 23.694 -1.975 504 HA CYS 93 HA CYS 93 36.988 25.486 -2.534 505 HB2 CYS 93 HB2 CYS 93 37.085 24.967 -0.209 506 HB3 CYS 93 HB1 CYS 93 38.820 25.274 -0.140 507 H THR 94 HN THR 94 37.327 27.492 -3.307 508 HA THR 94 HA THR 94 40.076 28.190 -4.095 509 HB THR 94 HB THR 94 39.100 29.652 -5.683 510 HG1 THR 94 HG1 THR 94 37.537 30.622 -4.417 511 HG21 THR 94 HG21 THR 94 37.176 27.324 -5.529 512 HG22 THR 94 HG22 THR 94 38.842 27.161 -6.082 513 HG23 THR 94 HG23 THR 94 37.714 28.180 -6.974 514 H ALA 95 HN ALA 95 37.780 28.888 -1.679 515 HA ALA 95 HA ALA 95 38.596 31.634 -1.227 516 HB1 ALA 95 HB1 ALA 95 36.277 30.876 -0.770 517 HB2 ALA 95 HB2 ALA 95 37.055 31.553 0.658 518 HB3 ALA 95 HB3 ALA 95 36.897 29.806 0.486 519 H CYS 96 HN CYS 96 39.560 28.465 -0.235 520 HA CYS 96 HA CYS 96 41.372 29.634 1.810 521 HB2 CYS 96 HB2 CYS 96 40.263 26.815 1.759 522 HB3 CYS 96 HB1 CYS 96 41.246 27.554 3.026 523 H GLN 97 HN GLN 97 41.040 28.087 -1.146 524 HA GLN 97 HA GLN 97 42.518 27.094 -2.616 525 HB2 GLN 97 HB2 GLN 97 44.493 28.552 -0.843 526 HB3 GLN 97 HB1 GLN 97 44.922 27.755 -2.354 527 HG2 GLN 97 HG2 GLN 97 43.403 29.194 -3.598 528 HG3 GLN 97 HG1 GLN 97 42.834 29.935 -2.103 529 HE21 GLN 97 HE21 GLN 97 44.541 30.916 -4.582 530 HE22 GLN 97 HE22 GLN 97 45.812 31.757 -3.835 531 H GLN 98 HN GLN 98 41.613 25.555 -0.354 532 HA GLN 98 HA GLN 98 43.798 23.584 -0.261 533 HB2 GLN 98 HB2 GLN 98 43.949 24.901 1.828 534 HB3 GLN 98 HB1 GLN 98 42.267 24.518 2.182 535 HG2 GLN 98 HG2 GLN 98 42.773 22.151 2.327 536 HG3 GLN 98 HG1 GLN 98 44.428 22.431 1.785 537 HE21 GLN 98 HE21 GLN 98 45.683 21.991 3.634 538 HE22 GLN 98 HE22 GLN 98 45.417 22.697 5.155 539 H THR 99 HN THR 99 43.105 21.446 0.226 540 HA THR 99 HA THR 99 40.428 20.896 -0.793 541 HB THR 99 HB THR 99 42.667 19.019 0.007 542 HG1 THR 99 HG1 THR 99 41.747 19.678 -2.578 543 HG21 THR 99 HG21 THR 99 40.617 17.811 0.136 544 HG22 THR 99 HG22 THR 99 41.287 17.435 -1.451 545 HG23 THR 99 HG23 THR 99 39.975 18.604 -1.303 546 H LYS 100 HN LYS 100 38.790 19.982 0.327 547 HA LYS 100 HA LYS 100 39.189 19.318 3.180 548 HB2 LYS 100 HB2 LYS 100 37.015 21.087 2.069 549 HB3 LYS 100 HB1 LYS 100 37.050 20.461 3.709 550 HG2 LYS 100 HG2 LYS 100 39.220 22.197 2.497 551 HG3 LYS 100 HG1 LYS 100 37.920 22.801 3.524 552 HD2 LYS 100 HD2 LYS 100 38.750 20.962 5.212 553 HD3 LYS 100 HD1 LYS 100 40.231 21.004 4.256 554 HE2 LYS 100 HE2 LYS 100 38.933 23.406 5.549 555 HE3 LYS 100 HE1 LYS 100 40.333 22.542 6.178 556 HZ1 LYS 100 HZ1 LYS 100 41.591 23.813 4.894 557 HZ2 LYS 100 HZ2 LYS 100 40.231 24.531 4.173 558 HZ3 LYS 100 HZ3 LYS 100 40.883 23.102 3.525 559 H GLY 101 HN GLY 101 37.826 17.781 3.996 560 HA2 GLY 101 HA2 GLY 101 36.910 15.813 2.186 561 HA3 GLY 101 HA1 GLY 101 36.544 15.864 3.905 562 H ILE 102 HN ILE 102 34.687 14.962 2.134 563 HA ILE 102 HA ILE 102 32.874 16.965 1.240 564 HB ILE 102 HB ILE 102 33.030 14.612 0.358 565 HG12 ILE 102 HG12 ILE 102 30.258 15.316 1.359 566 HG13 ILE 102 HG11 ILE 102 31.049 16.187 0.040 567 HG21 ILE 102 HG21 ILE 102 32.027 12.812 1.568 568 HG22 ILE 102 HG22 ILE 102 31.362 13.904 2.782 569 HG23 ILE 102 HG23 ILE 102 33.101 13.617 2.713 570 HD11 ILE 102 HD11 ILE 102 30.410 13.225 0.120 571 HD12 ILE 102 HD12 ILE 102 31.345 14.009 -1.156 572 HD13 ILE 102 HD13 ILE 102 29.652 14.440 -0.910 573 H ASN 103 HN ASN 103 33.239 15.164 4.230 574 HA ASN 103 HA ASN 103 30.715 15.678 5.369 575 HB2 ASN 103 HB2 ASN 103 33.437 15.131 6.544 576 HB3 ASN 103 HB1 ASN 103 32.035 15.419 7.573 577 HD21 ASN 103 HD21 ASN 103 29.984 14.038 6.574 578 HD22 ASN 103 HD22 ASN 103 30.363 12.393 6.316 579 H GLU 104 HN GLU 104 33.730 17.541 5.411 580 HA GLU 104 HA GLU 104 32.619 19.628 7.085 581 HB2 GLU 104 HB2 GLU 104 35.190 19.497 5.487 582 HB3 GLU 104 HB1 GLU 104 34.773 20.766 6.639 583 HG2 GLU 104 HG2 GLU 104 34.986 17.817 7.316 584 HG3 GLU 104 HG1 GLU 104 36.235 19.018 7.646 585 H PHE 105 HN PHE 105 31.912 18.776 4.066 586 HA PHE 105 HA PHE 105 31.550 21.575 3.143 587 HB2 PHE 105 HB2 PHE 105 32.861 19.342 1.856 588 HB3 PHE 105 HB1 PHE 105 31.446 19.791 0.907 589 HD1 PHE 105 HD1 PHE 105 34.666 20.966 2.285 590 HD2 PHE 105 HD2 PHE 105 31.306 21.943 -0.201 591 HE1 PHE 105 HE1 PHE 105 35.882 22.927 1.399 592 HE2 PHE 105 HE2 PHE 105 32.536 23.904 -1.084 593 HZ PHE 105 HZ PHE 105 34.823 24.397 -0.287 594 H SER 106 HN SER 106 29.599 22.167 2.370 595 HA SER 106 HA SER 106 27.347 20.420 2.996 596 HB2 SER 106 HB2 SER 106 27.263 22.775 3.681 597 HB3 SER 106 HB1 SER 106 27.438 23.278 1.998 598 HG SER 106 HG SER 106 25.482 22.124 1.575 599 H LYS 107 HN LYS 107 25.540 20.271 1.442 600 HA LYS 107 HA LYS 107 26.465 19.310 -1.108 601 HB2 LYS 107 HB2 LYS 107 23.697 19.669 0.061 602 HB3 LYS 107 HB1 LYS 107 24.000 18.980 -1.536 603 HG2 LYS 107 HG2 LYS 107 25.434 17.244 -0.512 604 HG3 LYS 107 HG1 LYS 107 25.105 17.923 1.086 605 HD2 LYS 107 HD2 LYS 107 22.705 17.473 0.796 606 HD3 LYS 107 HD1 LYS 107 23.013 16.820 -0.813 607 HE2 LYS 107 HE2 LYS 107 24.460 15.074 0.178 608 HE3 LYS 107 HE1 LYS 107 24.127 15.720 1.785 609 HZ1 LYS 107 HZ1 LYS 107 21.815 15.110 0.130 610 HZ2 LYS 107 HZ2 LYS 107 22.052 14.879 1.796 611 HZ3 LYS 107 HZ3 LYS 107 22.708 13.777 0.681 612 H ALA 108 HN ALA 108 24.775 22.193 0.044 613 HA ALA 108 HA ALA 108 24.026 23.262 -2.446 614 HB1 ALA 108 HB1 ALA 108 24.710 24.594 0.178 615 HB2 ALA 108 HB2 ALA 108 23.107 24.215 -0.452 616 HB3 ALA 108 HB3 ALA 108 24.082 25.471 -1.216 617 H GLN 109 HN GLN 109 27.042 23.536 -0.606 618 HA GLN 109 HA GLN 109 28.225 25.392 -2.459 619 HB2 GLN 109 HB2 GLN 109 29.253 23.793 -0.122 620 HB3 GLN 109 HB1 GLN 109 30.357 24.690 -1.170 621 HG2 GLN 109 HG2 GLN 109 29.676 26.054 0.774 622 HG3 GLN 109 HG1 GLN 109 29.107 26.763 -0.741 623 HE21 GLN 109 HE21 GLN 109 28.094 25.609 2.347 624 HE22 GLN 109 HE22 GLN 109 26.422 25.670 2.062 625 H ARG 110 HN ARG 110 27.748 22.024 -2.397 626 HA ARG 110 HA ARG 110 30.015 21.306 -4.031 627 HB2 ARG 110 HB2 ARG 110 28.983 19.717 -2.437 628 HB3 ARG 110 HB1 ARG 110 27.500 19.752 -3.386 629 HG2 ARG 110 HG2 ARG 110 28.625 18.813 -5.307 630 HG3 ARG 110 HG1 ARG 110 30.193 18.924 -4.498 631 HD2 ARG 110 HD2 ARG 110 29.393 16.643 -4.299 632 HD3 ARG 110 HD1 ARG 110 29.324 17.402 -2.711 633 HE ARG 110 HE ARG 110 26.838 17.702 -4.072 634 HH11 ARG 110 HH21 ARG 110 28.867 15.430 -2.432 635 HH12 ARG 110 HH22 ARG 110 27.559 14.419 -1.916 636 HH21 ARG 110 HH11 ARG 110 25.111 16.380 -3.396 637 HH22 ARG 110 HH12 ARG 110 25.432 14.956 -2.463 638 H HIS 111 HN HIS 111 26.826 22.521 -4.552 639 HA HIS 111 HA HIS 111 26.619 21.561 -7.292 640 HB2 HIS 111 HB2 HIS 111 24.890 23.408 -5.634 641 HB3 HIS 111 HB1 HIS 111 24.535 22.965 -7.308 642 HD2 HIS 111 HD2 HIS 111 25.922 19.816 -5.913 643 HE1 HIS 111 HE1 HIS 111 21.840 19.658 -4.850 644 HE2 HIS 111 HE2 HIS 111 23.981 18.306 -5.042 645 H VAL 112 HN VAL 112 27.148 24.681 -5.651 646 HA VAL 112 HA VAL 112 27.131 26.353 -7.874 647 HB VAL 112 HB VAL 112 28.638 27.832 -6.537 648 HG11 VAL 112 HG11 VAL 112 26.250 27.944 -6.123 649 HG12 VAL 112 HG12 VAL 112 27.079 28.003 -4.567 650 HG13 VAL 112 HG13 VAL 112 26.318 26.505 -5.102 651 HG21 VAL 112 HG21 VAL 112 28.650 25.412 -4.736 652 HG22 VAL 112 HG22 VAL 112 29.194 27.006 -4.226 653 HG23 VAL 112 HG23 VAL 112 30.050 26.146 -5.510 654 H LEU 113 HN LEU 113 29.086 27.452 -8.828 655 HA LEU 113 HA LEU 113 30.814 25.421 -9.953 656 HB2 LEU 113 HB2 LEU 113 30.526 28.390 -10.417 657 HB3 LEU 113 HB1 LEU 113 31.740 27.404 -11.237 658 HG LEU 113 HG LEU 113 29.886 25.910 -12.046 659 HD11 LEU 113 HD11 LEU 113 28.247 27.992 -10.601 660 HD12 LEU 113 HD12 LEU 113 28.077 26.238 -10.583 661 HD13 LEU 113 HD13 LEU 113 27.578 27.153 -12.001 662 HD21 LEU 113 HD21 LEU 113 30.714 27.512 -13.605 663 HD22 LEU 113 HD22 LEU 113 29.926 28.848 -12.764 664 HD23 LEU 113 HD23 LEU 113 28.959 27.678 -13.661 665 H ASP 114 HN ASP 114 30.975 27.595 -7.303 666 HA ASP 114 HA ASP 114 33.892 27.101 -7.054 667 HB2 ASP 114 HB2 ASP 114 32.395 29.660 -6.441 668 HB3 ASP 114 HB1 ASP 114 34.083 29.354 -6.034 669 HA PRO 115 HA PRO 115 31.486 25.500 -3.402 670 HB2 PRO 115 HB2 PRO 115 33.826 23.651 -3.372 671 HB3 PRO 115 HB1 PRO 115 32.096 23.274 -3.264 672 HG2 PRO 115 HG2 PRO 115 33.492 22.774 -5.485 673 HG3 PRO 115 HG1 PRO 115 31.804 23.325 -5.553 674 HD2 PRO 115 HD2 PRO 115 34.321 24.885 -6.063 675 HD3 PRO 115 HD1 PRO 115 32.741 24.991 -6.880 676 H ARG 116 HN ARG 116 31.831 26.041 -1.297 677 HA ARG 116 HA ARG 116 34.542 26.974 -0.496 678 HB2 ARG 116 HB2 ARG 116 31.932 28.264 0.328 679 HB3 ARG 116 HB1 ARG 116 33.568 28.867 0.609 680 HG2 ARG 116 HG2 ARG 116 33.882 29.038 -1.866 681 HG3 ARG 116 HG1 ARG 116 32.205 28.551 -2.083 682 HD2 ARG 116 HD2 ARG 116 31.481 30.504 -0.736 683 HD3 ARG 116 HD1 ARG 116 33.167 31.007 -0.592 684 HE ARG 116 HE ARG 116 32.629 30.715 -3.320 685 HH11 ARG 116 HH21 ARG 116 31.589 32.601 -0.612 686 HH12 ARG 116 HH22 ARG 116 31.175 33.990 -1.563 687 HH21 ARG 116 HH11 ARG 116 32.089 32.529 -4.573 688 HH22 ARG 116 HH12 ARG 116 31.457 33.948 -3.808 689 H CYS 117 HN CYS 117 35.202 26.441 1.557 690 HA CYS 117 HA CYS 117 33.921 24.276 2.895 691 HB2 CYS 117 HB2 CYS 117 35.856 26.027 4.382 692 HB3 CYS 117 HB1 CYS 117 35.746 24.264 4.330 693 H GLN 118 HN GLN 118 32.740 24.215 4.786 694 HA GLN 118 HA GLN 118 30.878 26.200 5.292 695 HB2 GLN 118 HB2 GLN 118 31.980 24.061 7.116 696 HB3 GLN 118 HB1 GLN 118 30.624 25.102 7.565 697 HG2 GLN 118 HG2 GLN 118 29.403 24.365 5.538 698 HG3 GLN 118 HG1 GLN 118 30.745 23.299 5.129 699 HE21 GLN 118 HE21 GLN 118 28.522 21.874 5.392 700 HE22 GLN 118 HE22 GLN 118 28.387 21.128 6.907 701 H ILE 119 HN ILE 119 34.182 26.335 5.919 702 HA ILE 119 HA ILE 119 33.987 28.094 8.239 703 HB ILE 119 HB ILE 119 36.382 27.242 6.595 704 HG12 ILE 119 HG12 ILE 119 35.490 26.309 9.339 705 HG13 ILE 119 HG11 ILE 119 35.113 25.435 7.852 706 HG21 ILE 119 HG21 ILE 119 36.883 29.307 7.726 707 HG22 ILE 119 HG22 ILE 119 37.605 28.011 8.682 708 HG23 ILE 119 HG23 ILE 119 36.094 28.756 9.203 709 HD11 ILE 119 HD11 ILE 119 37.163 24.562 8.972 710 HD12 ILE 119 HD12 ILE 119 37.915 26.145 8.772 711 HD13 ILE 119 HD13 ILE 119 37.494 25.184 7.356 712 H CYS 120 HN CYS 120 35.119 28.363 4.852 713 HA CYS 120 HA CYS 120 35.693 31.126 4.999 714 HB2 CYS 120 HB2 CYS 120 35.222 30.799 2.339 715 HB3 CYS 120 HB1 CYS 120 36.711 30.263 3.124 716 H VAL 121 HN VAL 121 32.699 29.390 4.366 717 HA VAL 121 HA VAL 121 31.254 31.629 3.324 718 HB VAL 121 HB VAL 121 29.269 30.296 3.638 719 HG11 VAL 121 HG11 VAL 121 31.686 28.639 2.865 720 HG12 VAL 121 HG12 VAL 121 30.648 29.572 1.789 721 HG13 VAL 121 HG13 VAL 121 30.019 28.132 2.588 722 HG21 VAL 121 HG21 VAL 121 29.524 28.056 4.852 723 HG22 VAL 121 HG22 VAL 121 29.524 29.493 5.874 724 HG23 VAL 121 HG23 VAL 121 31.042 28.691 5.483 725 H HIS 122 HN HIS 122 31.647 30.240 6.547 726 HA HIS 122 HA HIS 122 29.791 31.641 8.010 727 HB2 HIS 122 HB2 HIS 122 31.307 29.968 8.999 728 HB3 HIS 122 HB1 HIS 122 32.655 31.100 8.844 729 HD2 HIS 122 HD2 HIS 122 29.164 31.046 10.775 730 HE1 HIS 122 HE1 HIS 122 31.886 33.490 12.883 731 HE2 HIS 122 HE2 HIS 122 29.548 32.499 12.911 732 H SER 123 HN SER 123 33.117 32.768 7.282 733 HA SER 123 HA SER 123 32.499 35.431 8.250 734 HB2 SER 123 HB2 SER 123 34.798 35.925 7.807 735 HB3 SER 123 HB1 SER 123 34.752 34.302 8.487 736 HG SER 123 HG SER 123 35.395 35.168 5.938 737 H GLN 124 HN GLN 124 33.372 33.973 5.107 738 HA GLN 124 HA GLN 124 32.802 36.431 3.685 739 HB2 GLN 124 HB2 GLN 124 34.547 34.615 3.071 740 HB3 GLN 124 HB1 GLN 124 33.179 33.729 2.402 741 HG2 GLN 124 HG2 GLN 124 32.626 35.691 0.977 742 HG3 GLN 124 HG1 GLN 124 34.029 36.533 1.621 743 HE21 GLN 124 HE21 GLN 124 35.477 36.549 -0.139 744 HE22 GLN 124 HE22 GLN 124 35.954 35.159 -0.989 745 H ARG 125 HN ARG 125 30.604 35.417 5.215 746 HA ARG 125 HA ARG 125 28.426 34.576 5.021 747 HB2 ARG 125 HB2 ARG 125 27.221 36.110 3.270 748 HB3 ARG 125 HB1 ARG 125 27.970 36.840 4.692 749 HG2 ARG 125 HG2 ARG 125 29.965 37.406 3.416 750 HG3 ARG 125 HG1 ARG 125 29.335 36.576 1.995 751 HD2 ARG 125 HD2 ARG 125 27.985 38.929 3.333 752 HD3 ARG 125 HD1 ARG 125 29.007 39.050 1.904 753 HE ARG 125 HE ARG 125 27.027 37.136 1.374 754 HH11 ARG 125 HH21 ARG 125 27.350 40.516 2.041 755 HH12 ARG 125 HH22 ARG 125 25.953 40.971 1.123 756 HH21 ARG 125 HH11 ARG 125 25.195 37.725 0.169 757 HH22 ARG 125 HH12 ARG 125 24.734 39.390 0.063 758 H ASN 126 HN ASN 126 28.043 35.417 1.741 759 HA ASN 126 HA ASN 126 28.690 32.837 0.625 760 HB2 ASN 126 HB2 ASN 126 25.792 33.650 0.957 761 HB3 ASN 126 HB1 ASN 126 26.354 32.329 -0.067 762 HD21 ASN 126 HD21 ASN 126 25.292 33.061 3.076 763 HD22 ASN 126 HD22 ASN 126 25.855 31.661 3.852 Start of MODEL 12 1 H MET 31 HT1 MET 31 -6.681 25.663 -14.458 2 HA MET 31 HA MET 31 -5.418 26.202 -16.420 3 HB2 MET 31 HB2 MET 31 -5.859 29.036 -15.442 4 HB3 MET 31 HB1 MET 31 -4.674 28.600 -16.678 5 HG2 MET 31 HG2 MET 31 -6.463 27.658 -18.080 6 HG3 MET 31 HG1 MET 31 -7.653 28.050 -16.837 7 HE1 MET 31 HE1 MET 31 -5.301 30.751 -19.615 8 HE2 MET 31 HE2 MET 31 -4.936 29.122 -19.055 9 HE3 MET 31 HE3 MET 31 -4.527 30.505 -18.043 10 H GLY 32 HN GLY 32 -3.472 25.435 -15.896 11 HA2 GLY 32 HA2 GLY 32 -1.417 25.217 -14.869 12 HA3 GLY 32 HA1 GLY 32 -1.702 26.773 -14.091 13 H LYS 33 HN LYS 33 -3.074 23.472 -13.961 14 HA LYS 33 HA LYS 33 -3.947 23.646 -11.286 15 HB2 LYS 33 HB2 LYS 33 -4.606 21.918 -13.052 16 HB3 LYS 33 HB1 LYS 33 -3.099 21.093 -12.654 17 HG2 LYS 33 HG2 LYS 33 -3.781 20.861 -10.330 18 HG3 LYS 33 HG1 LYS 33 -5.238 21.808 -10.628 19 HD2 LYS 33 HD2 LYS 33 -6.034 20.100 -12.214 20 HD3 LYS 33 HD1 LYS 33 -4.575 19.151 -11.930 21 HE2 LYS 33 HE2 LYS 33 -6.376 18.259 -10.551 22 HE3 LYS 33 HE1 LYS 33 -5.181 19.027 -9.507 23 HZ1 LYS 33 HZ1 LYS 33 -6.677 20.490 -8.813 24 HZ2 LYS 33 HZ2 LYS 33 -7.868 19.577 -9.607 25 HZ3 LYS 33 HZ3 LYS 33 -7.138 20.891 -10.396 26 H ASN 34 HN ASN 34 -0.957 22.343 -12.695 27 HA ASN 34 HA ASN 34 0.581 23.016 -10.389 28 HB2 ASN 34 HB2 ASN 34 -0.584 21.041 -9.477 29 HB3 ASN 34 HB1 ASN 34 0.018 20.074 -10.827 30 HD21 ASN 34 HD21 ASN 34 0.741 21.078 -7.651 31 HD22 ASN 34 HD22 ASN 34 2.384 20.652 -7.638 32 H ASP 35 HN ASP 35 2.339 23.711 -11.428 33 HA ASP 35 HA ASP 35 3.268 22.341 -13.854 34 HB2 ASP 35 HB2 ASP 35 4.826 24.272 -14.020 35 HB3 ASP 35 HB1 ASP 35 3.131 24.760 -13.965 36 H ASN 36 HN ASN 36 3.667 21.867 -10.659 37 HA ASN 36 HA ASN 36 6.570 21.480 -10.659 38 HB2 ASN 36 HB2 ASN 36 4.456 21.027 -8.539 39 HB3 ASN 36 HB1 ASN 36 6.185 20.754 -8.303 40 HD21 ASN 36 HD21 ASN 36 6.939 23.102 -10.016 41 HD22 ASN 36 HD22 ASN 36 6.586 24.474 -9.079 42 H ASP 37 HN ASP 37 4.031 19.796 -11.856 43 HA ASP 37 HA ASP 37 4.926 17.138 -10.989 44 HB2 ASP 37 HB2 ASP 37 2.476 17.758 -11.180 45 HB3 ASP 37 HB1 ASP 37 2.709 17.807 -12.927 46 H ALA 38 HN ALA 38 6.255 19.180 -12.945 47 HA ALA 38 HA ALA 38 6.341 17.842 -15.471 48 HB1 ALA 38 HB1 ALA 38 6.877 20.228 -15.266 49 HB2 ALA 38 HB2 ALA 38 8.236 19.338 -15.953 50 HB3 ALA 38 HB3 ALA 38 8.273 19.834 -14.261 51 H LEU 39 HN LEU 39 7.736 16.328 -16.239 52 HA LEU 39 HA LEU 39 9.585 15.097 -14.281 53 HB2 LEU 39 HB2 LEU 39 8.350 13.987 -16.807 54 HB3 LEU 39 HB1 LEU 39 9.455 13.122 -15.741 55 HG LEU 39 HG LEU 39 6.993 14.348 -14.514 56 HD11 LEU 39 HD11 LEU 39 5.778 12.190 -14.989 57 HD12 LEU 39 HD12 LEU 39 7.047 11.803 -16.152 58 HD13 LEU 39 HD13 LEU 39 6.019 13.214 -16.406 59 HD21 LEU 39 HD21 LEU 39 7.253 12.610 -12.918 60 HD22 LEU 39 HD22 LEU 39 8.893 13.136 -13.281 61 HD23 LEU 39 HD23 LEU 39 8.269 11.656 -13.999 62 H ILE 40 HN ILE 40 11.681 15.257 -14.575 63 HA ILE 40 HA ILE 40 12.702 16.493 -17.028 64 HB ILE 40 HB ILE 40 13.894 15.937 -14.310 65 HG12 ILE 40 HG12 ILE 40 14.118 18.361 -14.257 66 HG13 ILE 40 HG11 ILE 40 13.569 18.484 -15.928 67 HG21 ILE 40 HG21 ILE 40 15.265 16.695 -16.894 68 HG22 ILE 40 HG22 ILE 40 15.729 15.457 -15.729 69 HG23 ILE 40 HG23 ILE 40 15.932 17.162 -15.331 70 HD11 ILE 40 HD11 ILE 40 11.361 17.869 -15.371 71 HD12 ILE 40 HD12 ILE 40 11.839 18.936 -14.056 72 HD13 ILE 40 HD13 ILE 40 11.843 17.188 -13.817 73 H MET 41 HN MET 41 13.952 15.502 -18.487 74 HA MET 41 HA MET 41 14.138 12.588 -18.389 75 HB2 MET 41 HB2 MET 41 13.477 13.791 -20.474 76 HB3 MET 41 HB1 MET 41 15.083 14.517 -20.527 77 HG2 MET 41 HG2 MET 41 16.109 12.288 -20.649 78 HG3 MET 41 HG1 MET 41 14.513 11.540 -20.543 79 HE1 MET 41 HE1 MET 41 14.610 10.645 -24.100 80 HE2 MET 41 HE2 MET 41 13.563 10.555 -22.687 81 HE3 MET 41 HE3 MET 41 15.283 10.205 -22.523 82 H CYS 42 HN CYS 42 15.827 11.539 -17.640 83 HA CYS 42 HA CYS 42 18.303 12.969 -17.023 84 HB2 CYS 42 HB2 CYS 42 17.520 11.472 -15.334 85 HB3 CYS 42 HB1 CYS 42 17.363 10.145 -16.485 86 H MET 43 HN MET 43 20.339 12.444 -17.921 87 HA MET 43 HA MET 43 20.163 11.226 -20.611 88 HB2 MET 43 HB2 MET 43 22.595 12.222 -20.680 89 HB3 MET 43 HB1 MET 43 21.204 13.300 -20.801 90 HG2 MET 43 HG2 MET 43 21.335 13.841 -18.438 91 HG3 MET 43 HG1 MET 43 22.618 12.650 -18.200 92 HE1 MET 43 HE1 MET 43 24.583 12.511 -19.488 93 HE2 MET 43 HE2 MET 43 25.295 13.565 -18.268 94 HE3 MET 43 HE3 MET 43 25.608 13.868 -19.975 95 H ARG 44 HN ARG 44 21.034 10.350 -17.501 96 HA ARG 44 HA ARG 44 23.224 8.586 -18.267 97 HB2 ARG 44 HB2 ARG 44 21.836 9.134 -15.645 98 HB3 ARG 44 HB1 ARG 44 23.088 7.914 -15.827 99 HG2 ARG 44 HG2 ARG 44 23.621 10.718 -16.796 100 HG3 ARG 44 HG1 ARG 44 23.740 10.363 -15.073 101 HD2 ARG 44 HD2 ARG 44 25.369 8.601 -15.507 102 HD3 ARG 44 HD1 ARG 44 25.214 8.837 -17.245 103 HE ARG 44 HE ARG 44 25.946 11.273 -15.971 104 HH11 ARG 44 HH21 ARG 44 27.103 8.147 -16.902 105 HH12 ARG 44 HH22 ARG 44 28.750 8.657 -17.079 106 HH21 ARG 44 HH11 ARG 44 28.097 11.950 -16.204 107 HH22 ARG 44 HH12 ARG 44 29.310 10.811 -16.683 108 H CYS 45 HN CYS 45 20.067 8.130 -16.675 109 HA CYS 45 HA CYS 45 20.046 5.348 -17.679 110 HB2 CYS 45 HB2 CYS 45 18.317 4.967 -15.970 111 HB3 CYS 45 HB1 CYS 45 19.800 5.600 -15.258 112 H ARG 46 HN ARG 46 19.213 8.074 -18.981 113 HA ARG 46 HA ARG 46 17.456 8.886 -20.262 114 HB2 ARG 46 HB2 ARG 46 17.515 5.945 -20.921 115 HB3 ARG 46 HB1 ARG 46 16.589 7.139 -21.837 116 HG2 ARG 46 HG2 ARG 46 18.632 8.395 -22.326 117 HG3 ARG 46 HG1 ARG 46 19.581 7.273 -21.351 118 HD2 ARG 46 HD2 ARG 46 17.940 6.418 -23.742 119 HD3 ARG 46 HD1 ARG 46 19.647 6.836 -23.842 120 HE ARG 46 HE ARG 46 19.565 4.965 -21.854 121 HH11 ARG 46 HH21 ARG 46 18.379 5.141 -25.101 122 HH12 ARG 46 HH22 ARG 46 18.527 3.440 -25.393 123 HH21 ARG 46 HH11 ARG 46 19.763 2.734 -22.233 124 HH22 ARG 46 HH12 ARG 46 19.310 2.077 -23.770 125 H LYS 47 HN LYS 47 16.717 8.110 -17.529 126 HA LYS 47 HA LYS 47 13.921 7.242 -17.935 127 HB2 LYS 47 HB2 LYS 47 15.655 6.098 -16.257 128 HB3 LYS 47 HB1 LYS 47 15.160 7.426 -15.209 129 HG2 LYS 47 HG2 LYS 47 12.841 6.760 -15.337 130 HG3 LYS 47 HG1 LYS 47 13.193 5.563 -16.582 131 HD2 LYS 47 HD2 LYS 47 12.956 4.455 -14.424 132 HD3 LYS 47 HD1 LYS 47 14.628 4.346 -14.971 133 HE2 LYS 47 HE2 LYS 47 15.367 5.966 -13.437 134 HE3 LYS 47 HE1 LYS 47 13.738 6.592 -13.167 135 HZ1 LYS 47 HZ1 LYS 47 15.103 4.512 -11.828 136 HZ2 LYS 47 HZ2 LYS 47 13.671 3.910 -12.519 137 HZ3 LYS 47 HZ3 LYS 47 13.614 5.229 -11.449 138 H VAL 48 HN VAL 48 12.252 8.324 -16.785 139 HA VAL 48 HA VAL 48 12.814 11.204 -16.461 140 HB VAL 48 HB VAL 48 10.132 11.115 -16.520 141 HG11 VAL 48 HG11 VAL 48 12.030 10.896 -18.860 142 HG12 VAL 48 HG12 VAL 48 11.354 12.360 -18.147 143 HG13 VAL 48 HG13 VAL 48 10.313 11.259 -19.053 144 HG21 VAL 48 HG21 VAL 48 10.874 8.730 -18.216 145 HG22 VAL 48 HG22 VAL 48 9.260 9.311 -17.805 146 HG23 VAL 48 HG23 VAL 48 10.271 8.564 -16.567 147 H LYS 49 HN LYS 49 12.591 12.174 -14.578 148 HA LYS 49 HA LYS 49 11.204 10.785 -12.362 149 HB2 LYS 49 HB2 LYS 49 13.974 11.946 -12.404 150 HB3 LYS 49 HB1 LYS 49 13.100 11.728 -10.900 151 HG2 LYS 49 HG2 LYS 49 12.875 9.336 -11.331 152 HG3 LYS 49 HG1 LYS 49 13.647 9.522 -12.905 153 HD2 LYS 49 HD2 LYS 49 15.730 10.191 -11.878 154 HD3 LYS 49 HD1 LYS 49 14.991 10.234 -10.279 155 HE2 LYS 49 HE2 LYS 49 14.511 7.787 -10.493 156 HE3 LYS 49 HE1 LYS 49 15.369 7.793 -12.031 157 HZ1 LYS 49 HZ1 LYS 49 16.479 7.415 -9.570 158 HZ2 LYS 49 HZ2 LYS 49 16.885 9.019 -9.953 159 HZ3 LYS 49 HZ3 LYS 49 17.317 7.757 -11.004 160 H GLY 50 HN GLY 50 10.069 12.079 -11.012 161 HA2 GLY 50 HA2 GLY 50 9.648 14.840 -11.856 162 HA3 GLY 50 HA1 GLY 50 8.685 13.934 -10.694 163 H ILE 51 HN ILE 51 9.315 16.467 -10.043 164 HA ILE 51 HA ILE 51 11.664 17.106 -8.791 165 HB ILE 51 HB ILE 51 9.635 18.568 -8.967 166 HG12 ILE 51 HG12 ILE 51 10.682 18.364 -6.130 167 HG13 ILE 51 HG11 ILE 51 11.637 19.023 -7.459 168 HG21 ILE 51 HG21 ILE 51 7.851 18.363 -7.398 169 HG22 ILE 51 HG22 ILE 51 8.741 17.193 -6.425 170 HG23 ILE 51 HG23 ILE 51 8.119 16.732 -8.010 171 HD11 ILE 51 HD11 ILE 51 8.878 20.052 -6.761 172 HD12 ILE 51 HD12 ILE 51 10.072 20.798 -7.823 173 HD13 ILE 51 HD13 ILE 51 10.354 20.740 -6.083 174 H ASP 52 HN ASP 52 9.309 14.740 -7.749 175 HA ASP 52 HA ASP 52 10.208 14.543 -5.045 176 HB2 ASP 52 HB2 ASP 52 7.950 13.819 -5.957 177 HB3 ASP 52 HB1 ASP 52 8.774 12.421 -6.648 178 H SER 53 HN SER 53 10.922 12.837 -8.055 179 HA SER 53 HA SER 53 12.916 11.152 -6.686 180 HB2 SER 53 HB2 SER 53 13.033 10.164 -9.116 181 HB3 SER 53 HB1 SER 53 11.657 9.782 -8.086 182 HG SER 53 HG SER 53 10.406 11.003 -9.285 183 H TYR 54 HN TYR 54 12.956 14.160 -7.654 184 HA TYR 54 HA TYR 54 15.722 13.981 -8.698 185 HB2 TYR 54 HB2 TYR 54 13.440 14.933 -10.126 186 HB3 TYR 54 HB1 TYR 54 14.394 16.360 -9.721 187 HD1 TYR 54 HD2 TYR 54 15.154 12.820 -10.693 188 HD2 TYR 54 HD1 TYR 54 15.841 16.989 -11.448 189 HE1 TYR 54 HE2 TYR 54 16.740 12.233 -12.498 190 HE2 TYR 54 HE1 TYR 54 17.448 16.393 -13.220 191 HH TYR 54 HH TYR 54 18.627 14.729 -14.157 192 H SER 55 HN SER 55 17.156 15.418 -7.901 193 HA SER 55 HA SER 55 16.673 16.596 -5.399 194 HB2 SER 55 HB2 SER 55 18.922 16.009 -6.062 195 HB3 SER 55 HB1 SER 55 18.843 17.097 -7.448 196 HG SER 55 HG SER 55 19.917 18.000 -5.601 197 H LYS 56 HN LYS 56 16.433 18.755 -4.790 198 HA LYS 56 HA LYS 56 14.697 20.320 -6.357 199 HB2 LYS 56 HB2 LYS 56 14.909 20.448 -3.887 200 HB3 LYS 56 HB1 LYS 56 16.467 21.247 -4.086 201 HG2 LYS 56 HG2 LYS 56 15.344 23.045 -5.407 202 HG3 LYS 56 HG1 LYS 56 13.793 22.264 -5.104 203 HD2 LYS 56 HD2 LYS 56 15.647 23.125 -2.874 204 HD3 LYS 56 HD1 LYS 56 14.405 24.187 -3.534 205 HE2 LYS 56 HE2 LYS 56 12.734 22.304 -3.039 206 HE3 LYS 56 HE1 LYS 56 14.022 21.549 -2.100 207 HZ1 LYS 56 HZ1 LYS 56 14.187 23.866 -1.020 208 HZ2 LYS 56 HZ2 LYS 56 12.952 22.803 -0.538 209 HZ3 LYS 56 HZ3 LYS 56 12.611 24.075 -1.611 210 H THR 57 HN THR 57 18.195 20.560 -5.786 211 HA THR 57 HA THR 57 18.613 22.958 -7.211 212 HB THR 57 HB THR 57 20.497 20.631 -6.764 213 HG1 THR 57 HG1 THR 57 20.877 22.905 -5.345 214 HG21 THR 57 HG21 THR 57 21.424 21.956 -8.508 215 HG22 THR 57 HG22 THR 57 22.216 22.511 -7.033 216 HG23 THR 57 HG23 THR 57 20.909 23.459 -7.742 217 H GLN 58 HN GLN 58 18.937 19.558 -8.253 218 HA GLN 58 HA GLN 58 19.701 20.087 -10.904 219 HB2 GLN 58 HB2 GLN 58 18.160 17.744 -9.761 220 HB3 GLN 58 HB1 GLN 58 18.905 17.780 -11.358 221 HG2 GLN 58 HG2 GLN 58 20.420 18.220 -8.771 222 HG3 GLN 58 HG1 GLN 58 20.331 16.672 -9.611 223 HE21 GLN 58 HE21 GLN 58 22.347 19.271 -9.250 224 HE22 GLN 58 HE22 GLN 58 23.126 19.238 -10.760 225 H TRP 59 HN TRP 59 16.483 19.525 -9.506 226 HA TRP 59 HA TRP 59 15.016 19.718 -11.900 227 HB2 TRP 59 HB2 TRP 59 14.133 18.836 -9.732 228 HB3 TRP 59 HB1 TRP 59 14.084 20.497 -9.129 229 HD1 TRP 59 HD1 TRP 59 12.492 18.209 -11.750 230 HE1 TRP 59 HE1 TRP 59 10.265 19.257 -12.526 231 HE3 TRP 59 HE3 TRP 59 12.745 22.697 -9.330 232 HZ2 TRP 59 HZ2 TRP 59 8.790 21.681 -12.162 233 HZ3 TRP 59 HZ3 TRP 59 10.918 24.354 -9.560 234 HH2 TRP 59 HH2 TRP 59 8.941 23.853 -10.971 235 H SER 60 HN SER 60 16.101 22.150 -9.603 236 HA SER 60 HA SER 60 14.666 24.330 -10.795 237 HB2 SER 60 HB2 SER 60 16.086 25.744 -9.362 238 HB3 SER 60 HB1 SER 60 15.342 24.429 -8.459 239 HG SER 60 HG SER 60 18.003 24.836 -9.206 240 H LYS 61 HN LYS 61 17.727 22.792 -11.370 241 HA LYS 61 HA LYS 61 18.961 24.939 -12.787 242 HB2 LYS 61 HB2 LYS 61 19.466 21.990 -12.523 243 HB3 LYS 61 HB1 LYS 61 20.338 22.919 -13.742 244 HG2 LYS 61 HG2 LYS 61 21.200 24.430 -12.033 245 HG3 LYS 61 HG1 LYS 61 20.248 23.621 -10.794 246 HD2 LYS 61 HD2 LYS 61 22.391 22.650 -10.555 247 HD3 LYS 61 HD1 LYS 61 21.510 21.463 -11.520 248 HE2 LYS 61 HE2 LYS 61 22.535 22.255 -13.558 249 HE3 LYS 61 HE1 LYS 61 23.252 23.634 -12.726 250 HZ1 LYS 61 HZ1 LYS 61 24.938 22.401 -12.044 251 HZ2 LYS 61 HZ2 LYS 61 24.404 21.199 -13.120 252 HZ3 LYS 61 HZ3 LYS 61 23.924 21.158 -11.491 253 H THR 62 HN THR 62 16.408 22.859 -13.550 254 HA THR 62 HA THR 62 16.900 22.865 -16.414 255 HB THR 62 HB THR 62 14.874 21.551 -16.571 256 HG1 THR 62 HG1 THR 62 14.494 22.626 -14.036 257 HG21 THR 62 HG21 THR 62 15.647 19.637 -15.478 258 HG22 THR 62 HG22 THR 62 16.142 20.537 -14.047 259 HG23 THR 62 HG23 THR 62 17.111 20.622 -15.517 260 H PHE 63 HN PHE 63 15.978 25.211 -14.412 261 HA PHE 63 HA PHE 63 14.076 26.402 -16.346 262 HB2 PHE 63 HB2 PHE 63 14.151 26.695 -13.331 263 HB3 PHE 63 HB1 PHE 63 13.097 27.609 -14.410 264 HD1 PHE 63 HD2 PHE 63 13.818 24.315 -12.965 265 HD2 PHE 63 HD1 PHE 63 11.254 26.545 -15.572 266 HE1 PHE 63 HE2 PHE 63 12.201 22.437 -12.944 267 HE2 PHE 63 HE1 PHE 63 9.613 24.665 -15.567 268 HZ PHE 63 HZ PHE 63 10.088 22.609 -14.250 269 H THR 64 HN THR 64 14.338 28.569 -16.786 270 HA THR 64 HA THR 64 16.717 29.926 -15.660 271 HB THR 64 HB THR 64 16.981 30.864 -18.074 272 HG1 THR 64 HG1 THR 64 16.019 28.445 -18.968 273 HG21 THR 64 HG21 THR 64 18.729 29.516 -17.275 274 HG22 THR 64 HG22 THR 64 18.213 28.680 -18.739 275 HG23 THR 64 HG23 THR 64 17.703 28.087 -17.157 276 H PHE 65 HN PHE 65 16.664 32.232 -15.934 277 HA PHE 65 HA PHE 65 13.896 33.300 -15.964 278 HB2 PHE 65 HB2 PHE 65 15.665 33.425 -13.892 279 HB3 PHE 65 HB1 PHE 65 16.087 34.912 -14.737 280 HD1 PHE 65 HD1 PHE 65 12.999 33.000 -13.824 281 HD2 PHE 65 HD2 PHE 65 14.912 36.837 -14.075 282 HE1 PHE 65 HE1 PHE 65 10.968 34.067 -12.897 283 HE2 PHE 65 HE2 PHE 65 12.881 37.902 -13.128 284 HZ PHE 65 HZ PHE 65 10.908 36.520 -12.553 285 H VAL 66 HN VAL 66 13.404 34.384 -17.711 286 HA VAL 66 HA VAL 66 15.408 36.172 -18.923 287 HB VAL 66 HB VAL 66 15.206 33.956 -20.170 288 HG11 VAL 66 HG11 VAL 66 12.586 35.125 -21.124 289 HG12 VAL 66 HG12 VAL 66 12.661 33.941 -19.821 290 HG13 VAL 66 HG13 VAL 66 13.238 33.515 -21.434 291 HG21 VAL 66 HG21 VAL 66 14.410 36.456 -21.690 292 HG22 VAL 66 HG22 VAL 66 15.269 35.061 -22.340 293 HG23 VAL 66 HG23 VAL 66 16.054 36.108 -21.156 294 H ARG 67 HN ARG 67 14.588 38.017 -19.879 295 HA ARG 67 HA ARG 67 13.149 39.796 -20.032 296 HB2 ARG 67 HB2 ARG 67 11.378 37.452 -20.713 297 HB3 ARG 67 HB1 ARG 67 10.772 39.110 -20.758 298 HG2 ARG 67 HG2 ARG 67 13.344 38.470 -22.192 299 HG3 ARG 67 HG1 ARG 67 11.815 38.009 -22.938 300 HD2 ARG 67 HD2 ARG 67 11.022 40.336 -22.762 301 HD3 ARG 67 HD1 ARG 67 12.547 40.804 -22.011 302 HE ARG 67 HE ARG 67 13.577 40.677 -24.105 303 HH11 ARG 67 HH21 ARG 67 10.382 39.353 -24.146 304 HH12 ARG 67 HH22 ARG 67 10.300 39.245 -25.872 305 HH21 ARG 67 HH11 ARG 67 13.481 40.541 -26.362 306 HH22 ARG 67 HH12 ARG 67 12.057 39.920 -27.128 307 H GLY 68 HN GLY 68 13.399 38.184 -17.438 308 HA2 GLY 68 HA2 GLY 68 12.697 38.636 -15.289 309 HA3 GLY 68 HA1 GLY 68 11.563 39.817 -15.945 310 H ARG 69 HN ARG 69 11.560 36.584 -17.196 311 HA ARG 69 HA ARG 69 9.200 35.863 -15.562 312 HB2 ARG 69 HB2 ARG 69 8.354 36.774 -17.667 313 HB3 ARG 69 HB1 ARG 69 9.392 35.678 -18.580 314 HG2 ARG 69 HG2 ARG 69 8.220 33.744 -17.713 315 HG3 ARG 69 HG1 ARG 69 7.291 34.750 -16.602 316 HD2 ARG 69 HD2 ARG 69 7.195 35.046 -19.610 317 HD3 ARG 69 HD1 ARG 69 6.048 34.077 -18.691 318 HE ARG 69 HE ARG 69 6.027 36.570 -17.495 319 HH11 ARG 69 HH21 ARG 69 5.478 35.240 -20.641 320 HH12 ARG 69 HH22 ARG 69 4.320 36.443 -21.100 321 HH21 ARG 69 HH11 ARG 69 4.506 38.149 -18.087 322 HH22 ARG 69 HH12 ARG 69 3.769 38.089 -19.653 323 H THR 70 HN THR 70 9.001 33.727 -15.083 324 HA THR 70 HA THR 70 11.330 32.106 -15.211 325 HB THR 70 HB THR 70 8.501 31.190 -14.648 326 HG1 THR 70 HG1 THR 70 9.225 31.629 -12.439 327 HG21 THR 70 HG21 THR 70 9.622 29.485 -13.304 328 HG22 THR 70 HG22 THR 70 11.194 30.189 -13.682 329 HG23 THR 70 HG23 THR 70 10.238 29.433 -14.956 330 H VAL 71 HN VAL 71 12.022 30.772 -16.756 331 HA VAL 71 HA VAL 71 10.106 29.731 -18.756 332 HB VAL 71 HB VAL 71 11.900 30.119 -20.496 333 HG11 VAL 71 HG11 VAL 71 10.856 32.636 -19.160 334 HG12 VAL 71 HG12 VAL 71 9.866 31.578 -20.167 335 HG13 VAL 71 HG13 VAL 71 11.246 32.421 -20.867 336 HG21 VAL 71 HG21 VAL 71 13.723 30.474 -18.772 337 HG22 VAL 71 HG22 VAL 71 12.996 32.041 -18.420 338 HG23 VAL 71 HG23 VAL 71 13.651 31.710 -20.023 339 H SER 72 HN SER 72 10.409 27.652 -19.308 340 HA SER 72 HA SER 72 12.208 26.057 -17.744 341 HB2 SER 72 HB2 SER 72 10.306 25.461 -20.010 342 HB3 SER 72 HB1 SER 72 11.355 24.216 -19.329 343 HG SER 72 HG SER 72 9.060 25.239 -18.366 344 H VAL 73 HN VAL 73 14.027 24.924 -18.404 345 HA VAL 73 HA VAL 73 15.627 26.167 -20.414 346 HB VAL 73 HB VAL 73 16.018 23.661 -18.768 347 HG11 VAL 73 HG11 VAL 73 18.454 24.004 -19.525 348 HG12 VAL 73 HG12 VAL 73 17.788 25.013 -20.810 349 HG13 VAL 73 HG13 VAL 73 17.342 23.311 -20.704 350 HG21 VAL 73 HG21 VAL 73 17.393 25.013 -17.390 351 HG22 VAL 73 HG22 VAL 73 15.996 26.036 -17.727 352 HG23 VAL 73 HG23 VAL 73 17.505 26.285 -18.605 353 H SER 74 HN SER 74 16.500 25.162 -22.313 354 HA SER 74 HA SER 74 14.561 23.420 -23.659 355 HB2 SER 74 HB2 SER 74 15.586 24.091 -25.687 356 HB3 SER 74 HB1 SER 74 15.501 25.545 -24.697 357 HG SER 74 HG SER 74 17.749 23.818 -24.772 358 H ASP 75 HN ASP 75 17.905 23.443 -22.555 359 HA ASP 75 HA ASP 75 18.101 20.552 -23.198 360 HB2 ASP 75 HB2 ASP 75 20.495 20.882 -23.639 361 HB3 ASP 75 HB1 ASP 75 19.494 21.808 -24.759 362 HA PRO 76 HA PRO 76 18.910 21.436 -18.694 363 HB2 PRO 76 HB2 PRO 76 17.069 19.696 -17.661 364 HB3 PRO 76 HB1 PRO 76 16.664 21.357 -18.139 365 HG2 PRO 76 HG2 PRO 76 16.180 18.802 -19.594 366 HG3 PRO 76 HG1 PRO 76 15.147 20.235 -19.459 367 HD2 PRO 76 HD2 PRO 76 16.711 19.675 -21.662 368 HD3 PRO 76 HD1 PRO 76 16.197 21.315 -21.215 369 H LYS 77 HN LYS 77 20.958 20.421 -19.060 370 HA LYS 77 HA LYS 77 21.098 17.507 -19.101 371 HB2 LYS 77 HB2 LYS 77 23.297 19.580 -18.963 372 HB3 LYS 77 HB1 LYS 77 23.509 17.855 -19.271 373 HG2 LYS 77 HG2 LYS 77 21.722 19.537 -21.035 374 HG3 LYS 77 HG1 LYS 77 23.461 19.454 -21.322 375 HD2 LYS 77 HD2 LYS 77 23.276 16.958 -21.423 376 HD3 LYS 77 HD1 LYS 77 21.526 17.116 -21.283 377 HE2 LYS 77 HE2 LYS 77 22.030 16.922 -23.617 378 HE3 LYS 77 HE1 LYS 77 21.584 18.603 -23.317 379 HZ1 LYS 77 HZ1 LYS 77 23.641 19.316 -23.765 380 HZ2 LYS 77 HZ2 LYS 77 23.825 17.828 -24.563 381 HZ3 LYS 77 HZ3 LYS 77 24.390 18.016 -22.973 382 H VAL 78 HN VAL 78 20.274 16.902 -17.113 383 HA VAL 78 HA VAL 78 22.063 17.423 -14.810 384 HB VAL 78 HB VAL 78 19.856 17.233 -13.427 385 HG11 VAL 78 HG11 VAL 78 19.532 19.664 -13.581 386 HG12 VAL 78 HG12 VAL 78 20.412 19.696 -15.109 387 HG13 VAL 78 HG13 VAL 78 21.251 19.271 -13.617 388 HG21 VAL 78 HG21 VAL 78 18.400 16.595 -15.310 389 HG22 VAL 78 HG22 VAL 78 18.792 18.104 -16.137 390 HG23 VAL 78 HG23 VAL 78 17.891 18.139 -14.623 391 H ILE 79 HN ILE 79 21.862 15.772 -13.133 392 HA ILE 79 HA ILE 79 21.278 13.109 -14.294 393 HB ILE 79 HB ILE 79 23.327 13.893 -12.202 394 HG12 ILE 79 HG12 ILE 79 23.739 12.862 -15.025 395 HG13 ILE 79 HG11 ILE 79 23.786 14.576 -14.608 396 HG21 ILE 79 HG21 ILE 79 22.411 11.283 -13.388 397 HG22 ILE 79 HG22 ILE 79 22.682 11.690 -11.693 398 HG23 ILE 79 HG23 ILE 79 24.055 11.450 -12.774 399 HD11 ILE 79 HD11 ILE 79 25.508 12.501 -13.235 400 HD12 ILE 79 HD12 ILE 79 25.659 14.256 -13.141 401 HD13 ILE 79 HD13 ILE 79 26.047 13.416 -14.643 402 H CYS 80 HN CYS 80 20.616 11.453 -12.788 403 HA CYS 80 HA CYS 80 18.610 12.416 -10.951 404 HB2 CYS 80 HB2 CYS 80 19.429 9.526 -11.143 405 HB3 CYS 80 HB1 CYS 80 17.835 10.221 -10.850 406 H ARG 81 HN ARG 81 18.437 11.347 -8.760 407 HA ARG 81 HA ARG 81 20.739 12.044 -7.222 408 HB2 ARG 81 HB2 ARG 81 18.180 10.622 -6.443 409 HB3 ARG 81 HB1 ARG 81 19.408 11.175 -5.302 410 HG2 ARG 81 HG2 ARG 81 19.114 13.489 -6.105 411 HG3 ARG 81 HG1 ARG 81 17.888 12.935 -7.245 412 HD2 ARG 81 HD2 ARG 81 16.764 13.803 -5.286 413 HD3 ARG 81 HD1 ARG 81 16.564 12.054 -5.317 414 HE ARG 81 HE ARG 81 18.867 12.769 -3.800 415 HH11 ARG 81 HH21 ARG 81 15.409 12.745 -3.764 416 HH12 ARG 81 HH22 ARG 81 15.289 12.631 -2.040 417 HH21 ARG 81 HH11 ARG 81 18.721 12.622 -1.538 418 HH22 ARG 81 HH12 ARG 81 17.165 12.561 -0.779 419 H THR 82 HN THR 82 19.340 9.014 -8.375 420 HA THR 82 HA THR 82 21.184 7.379 -6.850 421 HB THR 82 HB THR 82 19.960 5.556 -7.627 422 HG1 THR 82 HG1 THR 82 19.620 5.358 -9.674 423 HG21 THR 82 HG21 THR 82 17.643 6.145 -7.509 424 HG22 THR 82 HG22 THR 82 17.959 7.769 -8.123 425 HG23 THR 82 HG23 THR 82 18.497 7.317 -6.504 426 H CYS 83 HN CYS 83 21.024 8.823 -10.016 427 HA CYS 83 HA CYS 83 22.986 7.115 -11.240 428 HB2 CYS 83 HB2 CYS 83 21.604 9.667 -11.972 429 HB3 CYS 83 HB1 CYS 83 23.053 9.198 -12.862 430 H GLN 84 HN GLN 84 23.079 9.831 -9.121 431 HA GLN 84 HA GLN 84 25.498 11.047 -9.799 432 HB2 GLN 84 HB2 GLN 84 23.765 10.885 -7.411 433 HB3 GLN 84 HB1 GLN 84 25.456 11.181 -7.019 434 HG2 GLN 84 HG2 GLN 84 25.485 13.095 -8.546 435 HG3 GLN 84 HG1 GLN 84 23.802 12.787 -8.979 436 HE21 GLN 84 HE21 GLN 84 22.740 12.177 -6.409 437 HE22 GLN 84 HE22 GLN 84 22.843 13.567 -5.439 438 HA PRO 85 HA PRO 85 27.826 8.036 -6.828 439 HB2 PRO 85 HB2 PRO 85 26.429 5.732 -6.118 440 HB3 PRO 85 HB1 PRO 85 26.506 7.201 -5.122 441 HG2 PRO 85 HG2 PRO 85 24.372 6.313 -7.018 442 HG3 PRO 85 HG1 PRO 85 24.214 7.023 -5.401 443 HD2 PRO 85 HD2 PRO 85 23.835 8.511 -7.583 444 HD3 PRO 85 HD1 PRO 85 24.654 9.184 -6.160 445 H LYS 86 HN LYS 86 29.047 6.127 -7.369 446 HA LYS 86 HA LYS 86 29.115 5.530 -10.117 447 HB2 LYS 86 HB2 LYS 86 30.310 4.069 -7.749 448 HB3 LYS 86 HB1 LYS 86 30.693 3.711 -9.433 449 HG2 LYS 86 HG2 LYS 86 31.482 6.019 -9.758 450 HG3 LYS 86 HG1 LYS 86 31.082 6.397 -8.083 451 HD2 LYS 86 HD2 LYS 86 32.684 4.688 -7.308 452 HD3 LYS 86 HD1 LYS 86 33.087 4.307 -8.982 453 HE2 LYS 86 HE2 LYS 86 33.879 6.612 -9.328 454 HE3 LYS 86 HE1 LYS 86 33.459 7.014 -7.664 455 HZ1 LYS 86 HZ1 LYS 86 35.421 6.251 -7.035 456 HZ2 LYS 86 HZ2 LYS 86 35.806 5.819 -8.632 457 HZ3 LYS 86 HZ3 LYS 86 35.022 4.707 -7.614 458 H GLN 87 HN GLN 87 28.207 3.959 -11.323 459 HA GLN 87 HA GLN 87 25.848 2.730 -10.739 460 HB2 GLN 87 HB2 GLN 87 26.494 0.994 -12.463 461 HB3 GLN 87 HB1 GLN 87 26.669 2.670 -12.988 462 HG2 GLN 87 HG2 GLN 87 28.975 1.151 -11.762 463 HG3 GLN 87 HG1 GLN 87 28.633 1.072 -13.489 464 HE21 GLN 87 HE21 GLN 87 30.825 2.490 -11.709 465 HE22 GLN 87 HE22 GLN 87 30.880 4.050 -12.377 466 H HIS 88 HN HIS 88 25.368 0.379 -10.436 467 HA HIS 88 HA HIS 88 26.485 -0.542 -7.996 468 HB2 HIS 88 HB2 HIS 88 24.701 -1.876 -10.040 469 HB3 HIS 88 HB1 HIS 88 25.159 -2.632 -8.512 470 HD2 HIS 88 HD2 HIS 88 23.988 -1.441 -6.195 471 HE1 HIS 88 HE1 HIS 88 21.449 1.186 -8.311 472 HE2 HIS 88 HE2 HIS 88 21.988 0.228 -6.021 473 H ASP 89 HN ASP 89 27.347 -2.823 -7.761 474 HA ASP 89 HA ASP 89 29.697 -3.075 -9.440 475 HB2 ASP 89 HB2 ASP 89 28.718 -4.705 -7.086 476 HB3 ASP 89 HB1 ASP 89 30.267 -4.937 -7.895 477 H SER 90 HN SER 90 26.670 -3.851 -10.080 478 HA SER 90 HA SER 90 26.572 -6.580 -10.656 479 HB2 SER 90 HB2 SER 90 24.770 -6.031 -12.186 480 HB3 SER 90 HB1 SER 90 24.631 -5.015 -10.752 481 HG SER 90 HG SER 90 25.999 -3.506 -12.097 482 H ILE 91 HN ILE 91 26.319 -7.304 -13.080 483 HA ILE 91 HA ILE 91 28.595 -6.283 -14.678 484 HB ILE 91 HB ILE 91 27.986 -9.181 -14.044 485 HG12 ILE 91 HG12 ILE 91 30.495 -7.546 -13.575 486 HG13 ILE 91 HG11 ILE 91 29.251 -7.782 -12.345 487 HG21 ILE 91 HG21 ILE 91 28.631 -9.117 -16.333 488 HG22 ILE 91 HG22 ILE 91 30.102 -9.523 -15.447 489 HG23 ILE 91 HG23 ILE 91 29.849 -7.877 -16.038 490 HD11 ILE 91 HD11 ILE 91 31.237 -9.401 -12.306 491 HD12 ILE 91 HD12 ILE 91 30.548 -10.111 -13.767 492 HD13 ILE 91 HD13 ILE 91 29.628 -10.122 -12.261 493 H TRP 92 HN TRP 92 28.215 -6.104 -16.805 494 HA TRP 92 HA TRP 92 25.502 -6.575 -17.741 495 HB2 TRP 92 HB2 TRP 92 26.854 -4.496 -18.271 496 HB3 TRP 92 HB1 TRP 92 27.845 -5.510 -19.325 497 HD1 TRP 92 HD1 TRP 92 26.384 -6.916 -21.244 498 HE1 TRP 92 HE1 TRP 92 24.407 -6.095 -22.660 499 HE3 TRP 92 HE3 TRP 92 24.886 -2.962 -18.397 500 HZ2 TRP 92 HZ2 TRP 92 22.426 -4.021 -22.585 501 HZ3 TRP 92 HZ3 TRP 92 22.949 -1.580 -19.088 502 HH2 TRP 92 HH2 TRP 92 21.718 -2.104 -21.177 503 H CYS 93 HN CYS 93 24.855 -8.152 -19.108 504 HA CYS 93 HA CYS 93 26.830 -10.197 -19.893 505 HB2 CYS 93 HB2 CYS 93 24.595 -10.673 -18.618 506 HB3 CYS 93 HB1 CYS 93 23.849 -10.487 -20.206 507 H THR 94 HN THR 94 27.500 -10.278 -21.949 508 HA THR 94 HA THR 94 26.107 -8.633 -23.953 509 HB THR 94 HB THR 94 28.103 -8.588 -25.145 510 HG1 THR 94 HG1 THR 94 29.223 -10.740 -23.749 511 HG21 THR 94 HG21 THR 94 29.132 -9.133 -22.353 512 HG22 THR 94 HG22 THR 94 28.322 -7.633 -22.804 513 HG23 THR 94 HG23 THR 94 29.843 -8.079 -23.576 514 H ALA 95 HN ALA 95 26.216 -11.851 -22.914 515 HA ALA 95 HA ALA 95 25.949 -13.140 -25.461 516 HB1 ALA 95 HB1 ALA 95 25.528 -13.970 -22.601 517 HB2 ALA 95 HB2 ALA 95 26.735 -14.541 -23.752 518 HB3 ALA 95 HB3 ALA 95 25.053 -15.031 -23.928 519 H CYS 96 HN CYS 96 23.684 -12.153 -22.906 520 HA CYS 96 HA CYS 96 21.434 -12.592 -24.790 521 HB2 CYS 96 HB2 CYS 96 20.001 -12.677 -22.776 522 HB3 CYS 96 HB1 CYS 96 21.249 -13.926 -22.754 523 H GLN 97 HN GLN 97 23.366 -10.228 -23.465 524 HA GLN 97 HA GLN 97 23.254 -7.936 -23.516 525 HB2 GLN 97 HB2 GLN 97 22.055 -8.500 -25.741 526 HB3 GLN 97 HB1 GLN 97 20.569 -8.125 -24.871 527 HG2 GLN 97 HG2 GLN 97 21.470 -5.894 -24.298 528 HG3 GLN 97 HG1 GLN 97 22.951 -6.271 -25.174 529 HE21 GLN 97 HE21 GLN 97 22.954 -5.437 -27.246 530 HE22 GLN 97 HE22 GLN 97 21.578 -5.202 -28.208 531 H GLN 98 HN GLN 98 22.305 -9.350 -21.246 532 HA GLN 98 HA GLN 98 20.278 -7.434 -20.237 533 HB2 GLN 98 HB2 GLN 98 20.466 -10.389 -19.597 534 HB3 GLN 98 HB1 GLN 98 19.337 -9.253 -18.865 535 HG2 GLN 98 HG2 GLN 98 19.489 -9.847 -21.836 536 HG3 GLN 98 HG1 GLN 98 18.314 -10.558 -20.731 537 HE21 GLN 98 HE21 GLN 98 18.414 -8.256 -23.021 538 HE22 GLN 98 HE22 GLN 98 17.352 -7.108 -22.361 539 H THR 99 HN THR 99 20.620 -6.609 -18.246 540 HA THR 99 HA THR 99 23.284 -6.889 -17.148 541 HB THR 99 HB THR 99 20.935 -5.273 -16.136 542 HG1 THR 99 HG1 THR 99 22.523 -3.644 -17.168 543 HG21 THR 99 HG21 THR 99 22.874 -3.939 -15.125 544 HG22 THR 99 HG22 THR 99 23.886 -5.335 -15.495 545 HG23 THR 99 HG23 THR 99 22.527 -5.500 -14.384 546 H LYS 100 HN LYS 100 23.882 -8.014 -15.402 547 HA LYS 100 HA LYS 100 21.805 -9.145 -13.629 548 HB2 LYS 100 HB2 LYS 100 23.979 -10.627 -15.093 549 HB3 LYS 100 HB1 LYS 100 23.256 -11.272 -13.621 550 HG2 LYS 100 HG2 LYS 100 21.458 -10.346 -15.855 551 HG3 LYS 100 HG1 LYS 100 22.251 -11.917 -15.979 552 HD2 LYS 100 HD2 LYS 100 21.248 -12.668 -13.913 553 HD3 LYS 100 HD1 LYS 100 20.595 -11.067 -13.581 554 HE2 LYS 100 HE2 LYS 100 19.181 -11.212 -15.573 555 HE3 LYS 100 HE1 LYS 100 19.855 -12.798 -15.951 556 HZ1 LYS 100 HZ1 LYS 100 18.742 -13.782 -14.250 557 HZ2 LYS 100 HZ2 LYS 100 17.642 -12.529 -14.581 558 HZ3 LYS 100 HZ3 LYS 100 18.731 -12.388 -13.284 559 H GLY 101 HN GLY 101 22.405 -9.462 -11.524 560 HA2 GLY 101 HA2 GLY 101 24.547 -7.806 -10.567 561 HA3 GLY 101 HA1 GLY 101 23.493 -8.817 -9.578 562 H ILE 102 HN ILE 102 26.129 -8.666 -8.947 563 HA ILE 102 HA ILE 102 27.705 -10.731 -10.156 564 HB ILE 102 HB ILE 102 29.223 -10.366 -8.240 565 HG12 ILE 102 HG12 ILE 102 27.062 -8.439 -7.327 566 HG13 ILE 102 HG11 ILE 102 27.476 -9.963 -6.532 567 HG21 ILE 102 HG21 ILE 102 28.149 -7.788 -9.422 568 HG22 ILE 102 HG22 ILE 102 29.247 -8.887 -10.254 569 HG23 ILE 102 HG23 ILE 102 29.773 -8.056 -8.794 570 HD11 ILE 102 HD11 ILE 102 28.702 -8.360 -5.314 571 HD12 ILE 102 HD12 ILE 102 29.126 -7.452 -6.765 572 HD13 ILE 102 HD13 ILE 102 29.895 -9.009 -6.442 573 H ASN 103 HN ASN 103 25.163 -10.718 -7.884 574 HA ASN 103 HA ASN 103 25.888 -12.982 -6.328 575 HB2 ASN 103 HB2 ASN 103 23.278 -11.594 -6.920 576 HB3 ASN 103 HB1 ASN 103 23.330 -13.067 -5.953 577 HD21 ASN 103 HD21 ASN 103 25.592 -12.750 -4.398 578 HD22 ASN 103 HD22 ASN 103 25.459 -11.351 -3.434 579 H GLU 104 HN GLU 104 23.998 -12.574 -9.296 580 HA GLU 104 HA GLU 104 23.648 -15.481 -9.553 581 HB2 GLU 104 HB2 GLU 104 22.632 -13.255 -11.331 582 HB3 GLU 104 HB1 GLU 104 22.165 -14.956 -11.389 583 HG2 GLU 104 HG2 GLU 104 20.425 -14.013 -10.129 584 HG3 GLU 104 HG1 GLU 104 21.510 -14.616 -8.875 585 H PHE 105 HN PHE 105 26.192 -13.728 -9.976 586 HA PHE 105 HA PHE 105 26.880 -14.893 -12.620 587 HB2 PHE 105 HB2 PHE 105 26.959 -12.179 -11.785 588 HB3 PHE 105 HB1 PHE 105 28.640 -12.696 -11.859 589 HD1 PHE 105 HD1 PHE 105 29.226 -14.178 -13.981 590 HD2 PHE 105 HD2 PHE 105 25.966 -11.404 -13.744 591 HE1 PHE 105 HE1 PHE 105 29.172 -14.033 -16.449 592 HE2 PHE 105 HE2 PHE 105 25.915 -11.255 -16.200 593 HZ PHE 105 HZ PHE 105 27.506 -12.565 -17.563 594 H SER 106 HN SER 106 28.518 -16.284 -12.683 595 HA SER 106 HA SER 106 29.690 -17.313 -10.361 596 HB2 SER 106 HB2 SER 106 31.375 -18.274 -12.066 597 HB3 SER 106 HB1 SER 106 29.679 -18.717 -12.256 598 HG SER 106 HG SER 106 30.522 -18.035 -14.232 599 H LYS 107 HN LYS 107 31.742 -17.086 -9.479 600 HA LYS 107 HA LYS 107 32.808 -14.457 -9.426 601 HB2 LYS 107 HB2 LYS 107 32.973 -16.071 -7.543 602 HB3 LYS 107 HB1 LYS 107 34.119 -17.018 -8.491 603 HG2 LYS 107 HG2 LYS 107 35.656 -15.115 -8.598 604 HG3 LYS 107 HG1 LYS 107 34.495 -14.107 -7.728 605 HD2 LYS 107 HD2 LYS 107 34.636 -15.631 -5.783 606 HD3 LYS 107 HD1 LYS 107 35.818 -16.614 -6.648 607 HE2 LYS 107 HE2 LYS 107 37.364 -14.725 -6.760 608 HE3 LYS 107 HE1 LYS 107 36.176 -13.677 -5.984 609 HZ1 LYS 107 HZ1 LYS 107 37.644 -14.396 -4.305 610 HZ2 LYS 107 HZ2 LYS 107 37.575 -16.014 -4.818 611 HZ3 LYS 107 HZ3 LYS 107 36.221 -15.293 -4.088 612 H ALA 108 HN ALA 108 33.852 -17.437 -11.028 613 HA ALA 108 HA ALA 108 36.320 -16.513 -12.002 614 HB1 ALA 108 HB1 ALA 108 34.456 -18.507 -13.309 615 HB2 ALA 108 HB2 ALA 108 35.597 -18.889 -12.020 616 HB3 ALA 108 HB3 ALA 108 36.189 -18.349 -13.590 617 H GLN 109 HN GLN 109 33.041 -16.130 -13.217 618 HA GLN 109 HA GLN 109 33.688 -15.203 -15.804 619 HB2 GLN 109 HB2 GLN 109 31.314 -15.210 -14.035 620 HB3 GLN 109 HB1 GLN 109 31.314 -13.938 -15.257 621 HG2 GLN 109 HG2 GLN 109 30.230 -16.094 -15.998 622 HG3 GLN 109 HG1 GLN 109 31.554 -15.558 -17.033 623 HE21 GLN 109 HE21 GLN 109 31.874 -17.841 -17.703 624 HE22 GLN 109 HE22 GLN 109 32.667 -18.925 -16.665 625 H ARG 110 HN ARG 110 33.131 -13.468 -12.772 626 HA ARG 110 HA ARG 110 33.320 -10.860 -13.725 627 HB2 ARG 110 HB2 ARG 110 34.462 -11.647 -11.051 628 HB3 ARG 110 HB1 ARG 110 33.577 -10.184 -11.488 629 HG2 ARG 110 HG2 ARG 110 31.552 -11.641 -11.893 630 HG3 ARG 110 HG1 ARG 110 32.482 -12.984 -11.230 631 HD2 ARG 110 HD2 ARG 110 31.027 -11.866 -9.539 632 HD3 ARG 110 HD1 ARG 110 32.740 -11.877 -9.116 633 HE ARG 110 HE ARG 110 31.846 -9.494 -10.522 634 HH11 ARG 110 HH21 ARG 110 32.351 -11.107 -7.505 635 HH12 ARG 110 HH22 ARG 110 32.474 -9.645 -6.585 636 HH21 ARG 110 HH11 ARG 110 32.014 -7.572 -9.326 637 HH22 ARG 110 HH12 ARG 110 32.281 -7.642 -7.616 638 H HIS 111 HN HIS 111 35.618 -13.215 -13.976 639 HA HIS 111 HA HIS 111 37.874 -11.293 -13.936 640 HB2 HIS 111 HB2 HIS 111 37.817 -14.282 -13.493 641 HB3 HIS 111 HB1 HIS 111 39.300 -13.346 -13.704 642 HD2 HIS 111 HD2 HIS 111 40.154 -12.022 -11.408 643 HE1 HIS 111 HE1 HIS 111 36.705 -12.679 -9.065 644 HE2 HIS 111 HE2 HIS 111 39.074 -11.766 -9.045 645 H VAL 112 HN VAL 112 35.863 -12.030 -16.156 646 HA VAL 112 HA VAL 112 37.903 -12.697 -18.202 647 HB VAL 112 HB VAL 112 36.398 -14.104 -19.322 648 HG11 VAL 112 HG11 VAL 112 37.200 -15.118 -17.230 649 HG12 VAL 112 HG12 VAL 112 35.587 -15.702 -17.641 650 HG13 VAL 112 HG13 VAL 112 35.790 -14.486 -16.382 651 HG21 VAL 112 HG21 VAL 112 33.906 -14.200 -18.390 652 HG22 VAL 112 HG22 VAL 112 34.395 -12.954 -19.535 653 HG23 VAL 112 HG23 VAL 112 34.286 -12.568 -17.827 654 H LEU 113 HN LEU 113 37.441 -11.796 -20.300 655 HA LEU 113 HA LEU 113 36.708 -9.067 -20.195 656 HB2 LEU 113 HB2 LEU 113 37.305 -11.006 -22.419 657 HB3 LEU 113 HB1 LEU 113 36.720 -9.381 -22.791 658 HG LEU 113 HG LEU 113 38.567 -8.408 -21.494 659 HD11 LEU 113 HD11 LEU 113 38.976 -10.040 -19.811 660 HD12 LEU 113 HD12 LEU 113 40.421 -10.050 -20.818 661 HD13 LEU 113 HD13 LEU 113 39.212 -11.321 -21.000 662 HD21 LEU 113 HD21 LEU 113 40.341 -8.934 -23.047 663 HD22 LEU 113 HD22 LEU 113 38.822 -9.018 -23.938 664 HD23 LEU 113 HD23 LEU 113 39.623 -10.501 -23.418 665 H ASP 114 HN ASP 114 34.970 -11.961 -21.330 666 HA ASP 114 HA ASP 114 32.546 -10.283 -21.632 667 HB2 ASP 114 HB2 ASP 114 33.472 -11.304 -23.728 668 HB3 ASP 114 HB1 ASP 114 33.086 -12.888 -23.051 669 HA PRO 115 HA PRO 115 31.610 -13.246 -18.256 670 HB2 PRO 115 HB2 PRO 115 29.960 -11.585 -16.834 671 HB3 PRO 115 HB1 PRO 115 31.730 -11.509 -16.725 672 HG2 PRO 115 HG2 PRO 115 29.842 -9.737 -18.191 673 HG3 PRO 115 HG1 PRO 115 31.369 -9.337 -17.379 674 HD2 PRO 115 HD2 PRO 115 31.048 -9.673 -20.125 675 HD3 PRO 115 HD1 PRO 115 32.603 -9.754 -19.269 676 H ARG 116 HN ARG 116 30.055 -14.751 -18.410 677 HA ARG 116 HA ARG 116 27.537 -14.071 -19.829 678 HB2 ARG 116 HB2 ARG 116 28.996 -16.696 -19.489 679 HB3 ARG 116 HB1 ARG 116 27.391 -16.545 -20.211 680 HG2 ARG 116 HG2 ARG 116 28.296 -15.034 -21.926 681 HG3 ARG 116 HG1 ARG 116 29.898 -15.154 -21.202 682 HD2 ARG 116 HD2 ARG 116 29.917 -17.576 -21.632 683 HD3 ARG 116 HD1 ARG 116 28.303 -17.467 -22.336 684 HE ARG 116 HE ARG 116 29.239 -16.489 -24.252 685 HH11 ARG 116 HH21 ARG 116 31.542 -16.802 -21.691 686 HH12 ARG 116 HH22 ARG 116 32.911 -16.448 -22.693 687 HH21 ARG 116 HH11 ARG 116 31.027 -16.023 -25.573 688 HH22 ARG 116 HH12 ARG 116 32.620 -16.006 -24.891 689 H CYS 117 HN CYS 117 25.686 -14.116 -18.730 690 HA CYS 117 HA CYS 117 25.573 -14.489 -15.948 691 HB2 CYS 117 HB2 CYS 117 23.132 -14.386 -16.225 692 HB3 CYS 117 HB1 CYS 117 23.927 -13.149 -17.201 693 H GLN 118 HN GLN 118 24.641 -16.144 -14.674 694 HA GLN 118 HA GLN 118 25.401 -18.738 -15.234 695 HB2 GLN 118 HB2 GLN 118 23.220 -17.663 -13.450 696 HB3 GLN 118 HB1 GLN 118 23.621 -19.383 -13.514 697 HG2 GLN 118 HG2 GLN 118 25.669 -17.217 -12.979 698 HG3 GLN 118 HG1 GLN 118 24.818 -18.078 -11.697 699 HE21 GLN 118 HE21 GLN 118 27.728 -18.086 -13.133 700 HE22 GLN 118 HE22 GLN 118 28.087 -19.745 -13.115 701 H ILE 119 HN ILE 119 22.827 -17.005 -16.619 702 HA ILE 119 HA ILE 119 21.258 -19.369 -17.318 703 HB ILE 119 HB ILE 119 20.921 -16.477 -18.125 704 HG12 ILE 119 HG12 ILE 119 19.391 -18.093 -16.071 705 HG13 ILE 119 HG11 ILE 119 20.732 -17.024 -15.654 706 HG21 ILE 119 HG21 ILE 119 18.580 -17.297 -18.624 707 HG22 ILE 119 HG22 ILE 119 19.198 -18.939 -18.445 708 HG23 ILE 119 HG23 ILE 119 19.826 -17.892 -19.720 709 HD11 ILE 119 HD11 ILE 119 19.559 -15.104 -16.567 710 HD12 ILE 119 HD12 ILE 119 18.484 -15.927 -15.437 711 HD13 ILE 119 HD13 ILE 119 18.265 -16.136 -17.174 712 H CYS 120 HN CYS 120 23.349 -16.987 -18.903 713 HA CYS 120 HA CYS 120 22.981 -17.980 -21.543 714 HB2 CYS 120 HB2 CYS 120 24.908 -16.101 -20.220 715 HB3 CYS 120 HB1 CYS 120 25.328 -16.733 -21.815 716 H VAL 121 HN VAL 121 25.247 -18.746 -18.973 717 HA VAL 121 HA VAL 121 26.997 -20.336 -20.562 718 HB VAL 121 HB VAL 121 27.909 -21.107 -18.448 719 HG11 VAL 121 HG11 VAL 121 28.660 -18.927 -19.020 720 HG12 VAL 121 HG12 VAL 121 28.200 -18.819 -17.323 721 HG13 VAL 121 HG13 VAL 121 27.124 -18.189 -18.570 722 HG21 VAL 121 HG21 VAL 121 26.763 -20.265 -16.328 723 HG22 VAL 121 HG22 VAL 121 25.950 -21.582 -17.172 724 HG23 VAL 121 HG23 VAL 121 25.360 -19.930 -17.341 725 H HIS 122 HN HIS 122 24.091 -21.004 -18.684 726 HA HIS 122 HA HIS 122 24.297 -23.868 -19.042 727 HB2 HIS 122 HB2 HIS 122 23.239 -23.003 -17.027 728 HB3 HIS 122 HB1 HIS 122 22.052 -22.126 -17.996 729 HD2 HIS 122 HD2 HIS 122 19.824 -23.639 -18.693 730 HE1 HIS 122 HE1 HIS 122 21.338 -27.420 -17.583 731 HE2 HIS 122 HE2 HIS 122 19.284 -26.179 -18.412 732 H SER 123 HN SER 123 23.517 -21.392 -21.084 733 HA SER 123 HA SER 123 21.606 -23.056 -22.640 734 HB2 SER 123 HB2 SER 123 20.688 -21.033 -23.545 735 HB3 SER 123 HB1 SER 123 20.737 -20.850 -21.795 736 HG SER 123 HG SER 123 23.055 -20.023 -22.646 737 H GLN 124 HN GLN 124 24.734 -21.773 -22.513 738 HA GLN 124 HA GLN 124 25.164 -22.471 -25.350 739 HB2 GLN 124 HB2 GLN 124 26.087 -19.927 -23.996 740 HB3 GLN 124 HB1 GLN 124 26.690 -20.497 -25.552 741 HG2 GLN 124 HG2 GLN 124 23.767 -19.968 -24.952 742 HG3 GLN 124 HG1 GLN 124 24.835 -18.820 -25.756 743 HE21 GLN 124 HE21 GLN 124 25.465 -19.264 -27.958 744 HE22 GLN 124 HE22 GLN 124 24.760 -20.516 -28.862 745 H ARG 125 HN ARG 125 25.706 -24.012 -23.029 746 HA ARG 125 HA ARG 125 27.457 -24.915 -21.752 747 HB2 ARG 125 HB2 ARG 125 29.187 -25.859 -23.503 748 HB3 ARG 125 HB1 ARG 125 27.511 -26.421 -23.537 749 HG2 ARG 125 HG2 ARG 125 26.966 -24.843 -25.314 750 HG3 ARG 125 HG1 ARG 125 28.587 -24.151 -25.242 751 HD2 ARG 125 HD2 ARG 125 28.465 -25.724 -27.092 752 HD3 ARG 125 HD1 ARG 125 29.525 -26.373 -25.842 753 HE ARG 125 HE ARG 125 26.855 -27.280 -25.450 754 HH11 ARG 125 HH21 ARG 125 29.653 -27.648 -27.448 755 HH12 ARG 125 HH22 ARG 125 29.310 -29.294 -27.865 756 HH21 ARG 125 HH11 ARG 125 26.394 -29.437 -25.991 757 HH22 ARG 125 HH12 ARG 125 27.465 -30.307 -27.040 758 H ASN 126 HN ASN 126 29.882 -24.224 -24.035 759 HA ASN 126 HA ASN 126 30.802 -21.744 -22.947 760 HB2 ASN 126 HB2 ASN 126 31.367 -23.325 -21.106 761 HB3 ASN 126 HB1 ASN 126 32.379 -24.220 -22.237 762 HD21 ASN 126 HD21 ASN 126 33.818 -23.275 -20.180 763 HD22 ASN 126 HD22 ASN 126 34.677 -21.870 -20.586 Start of MODEL 13 1 H MET 31 HT1 MET 31 1.831 22.875 -18.635 2 HA MET 31 HA MET 31 2.240 21.531 -16.029 3 HB2 MET 31 HB2 MET 31 4.276 22.587 -18.008 4 HB3 MET 31 HB1 MET 31 4.641 22.279 -16.306 5 HG2 MET 31 HG2 MET 31 3.920 19.921 -16.601 6 HG3 MET 31 HG1 MET 31 3.636 20.235 -18.312 7 HE1 MET 31 HE1 MET 31 6.925 20.649 -19.953 8 HE2 MET 31 HE2 MET 31 6.183 22.091 -19.265 9 HE3 MET 31 HE3 MET 31 5.166 20.834 -19.965 10 H GLY 32 HN GLY 32 0.882 23.998 -17.545 11 HA2 GLY 32 HA2 GLY 32 2.067 26.341 -16.535 12 HA3 GLY 32 HA1 GLY 32 0.375 26.174 -16.997 13 H LYS 33 HN LYS 33 -0.419 24.200 -15.168 14 HA LYS 33 HA LYS 33 -0.842 25.803 -12.833 15 HB2 LYS 33 HB2 LYS 33 -1.527 22.929 -13.475 16 HB3 LYS 33 HB1 LYS 33 -2.011 23.744 -11.988 17 HG2 LYS 33 HG2 LYS 33 -3.189 25.463 -13.306 18 HG3 LYS 33 HG1 LYS 33 -2.699 24.657 -14.797 19 HD2 LYS 33 HD2 LYS 33 -3.930 22.639 -14.135 20 HD3 LYS 33 HD1 LYS 33 -4.397 23.407 -12.618 21 HE2 LYS 33 HE2 LYS 33 -5.599 25.158 -13.861 22 HE3 LYS 33 HE1 LYS 33 -5.122 24.412 -15.386 23 HZ1 LYS 33 HZ1 LYS 33 -6.604 22.757 -15.144 24 HZ2 LYS 33 HZ2 LYS 33 -7.401 23.870 -14.138 25 HZ3 LYS 33 HZ3 LYS 33 -6.414 22.663 -13.462 26 H ASN 34 HN ASN 34 -0.008 22.415 -12.507 27 HA ASN 34 HA ASN 34 1.996 23.112 -10.468 28 HB2 ASN 34 HB2 ASN 34 0.567 20.542 -11.168 29 HB3 ASN 34 HB1 ASN 34 1.866 20.636 -9.974 30 HD21 ASN 34 HD21 ASN 34 -0.949 19.961 -9.392 31 HD22 ASN 34 HD22 ASN 34 -1.522 21.162 -8.340 32 H ASP 35 HN ASP 35 3.886 23.569 -11.490 33 HA ASP 35 HA ASP 35 4.844 22.190 -13.794 34 HB2 ASP 35 HB2 ASP 35 5.556 24.481 -13.193 35 HB3 ASP 35 HB1 ASP 35 6.385 23.835 -11.773 36 H ASN 36 HN ASN 36 4.771 21.410 -10.484 37 HA ASN 36 HA ASN 36 7.127 19.879 -10.209 38 HB2 ASN 36 HB2 ASN 36 4.460 19.909 -8.818 39 HB3 ASN 36 HB1 ASN 36 5.634 18.649 -8.438 40 HD21 ASN 36 HD21 ASN 36 8.053 20.075 -8.543 41 HD22 ASN 36 HD22 ASN 36 8.048 21.290 -7.360 42 H ASP 37 HN ASP 37 3.985 19.160 -11.595 43 HA ASP 37 HA ASP 37 4.257 16.354 -11.736 44 HB2 ASP 37 HB2 ASP 37 2.642 18.318 -13.361 45 HB3 ASP 37 HB1 ASP 37 2.543 16.573 -13.600 46 H ALA 38 HN ALA 38 6.198 18.582 -13.052 47 HA ALA 38 HA ALA 38 6.557 17.631 -15.722 48 HB1 ALA 38 HB1 ALA 38 7.298 19.877 -14.949 49 HB2 ALA 38 HB2 ALA 38 8.578 18.960 -15.742 50 HB3 ALA 38 HB3 ALA 38 8.548 19.093 -13.983 51 H LEU 39 HN LEU 39 7.976 16.135 -16.542 52 HA LEU 39 HA LEU 39 9.334 14.387 -14.567 53 HB2 LEU 39 HB2 LEU 39 8.339 13.806 -17.364 54 HB3 LEU 39 HB1 LEU 39 9.197 12.658 -16.343 55 HG LEU 39 HG LEU 39 6.690 14.023 -15.340 56 HD11 LEU 39 HD11 LEU 39 5.495 11.898 -16.102 57 HD12 LEU 39 HD12 LEU 39 6.899 11.588 -17.125 58 HD13 LEU 39 HD13 LEU 39 5.924 13.035 -17.380 59 HD21 LEU 39 HD21 LEU 39 7.849 12.854 -13.632 60 HD22 LEU 39 HD22 LEU 39 8.190 11.483 -14.689 61 HD23 LEU 39 HD23 LEU 39 6.548 11.774 -14.120 62 H ILE 40 HN ILE 40 11.484 14.418 -14.552 63 HA ILE 40 HA ILE 40 12.907 15.526 -16.921 64 HB ILE 40 HB ILE 40 13.914 15.349 -14.082 65 HG12 ILE 40 HG12 ILE 40 11.967 16.786 -14.112 66 HG13 ILE 40 HG11 ILE 40 13.410 17.796 -14.010 67 HG21 ILE 40 HG21 ILE 40 14.838 16.972 -16.477 68 HG22 ILE 40 HG22 ILE 40 15.626 15.511 -15.879 69 HG23 ILE 40 HG23 ILE 40 15.584 16.963 -14.879 70 HD11 ILE 40 HD11 ILE 40 12.120 18.873 -15.660 71 HD12 ILE 40 HD12 ILE 40 11.570 17.354 -16.355 72 HD13 ILE 40 HD13 ILE 40 13.227 17.893 -16.620 73 H MET 41 HN MET 41 14.173 14.237 -18.019 74 HA MET 41 HA MET 41 14.846 11.578 -16.913 75 HB2 MET 41 HB2 MET 41 13.601 11.480 -18.990 76 HB3 MET 41 HB1 MET 41 14.756 12.558 -19.773 77 HG2 MET 41 HG2 MET 41 15.895 10.103 -18.491 78 HG3 MET 41 HG1 MET 41 14.941 9.861 -19.956 79 HE1 MET 41 HE1 MET 41 16.926 8.886 -21.212 80 HE2 MET 41 HE2 MET 41 17.656 9.993 -22.371 81 HE3 MET 41 HE3 MET 41 15.906 9.939 -22.200 82 H CYS 42 HN CYS 42 16.928 10.937 -16.710 83 HA CYS 42 HA CYS 42 18.975 13.022 -16.973 84 HB2 CYS 42 HB2 CYS 42 20.310 10.894 -15.891 85 HB3 CYS 42 HB1 CYS 42 19.400 12.077 -14.949 86 H MET 43 HN MET 43 20.933 12.740 -17.983 87 HA MET 43 HA MET 43 20.769 11.285 -20.496 88 HB2 MET 43 HB2 MET 43 23.198 12.352 -20.668 89 HB3 MET 43 HB1 MET 43 21.758 13.356 -20.836 90 HG2 MET 43 HG2 MET 43 21.917 14.169 -18.617 91 HG3 MET 43 HG1 MET 43 23.057 12.908 -18.145 92 HE1 MET 43 HE1 MET 43 25.026 16.261 -17.896 93 HE2 MET 43 HE2 MET 43 24.722 14.723 -17.094 94 HE3 MET 43 HE3 MET 43 23.376 15.800 -17.457 95 H ARG 44 HN ARG 44 21.577 10.234 -17.483 96 HA ARG 44 HA ARG 44 23.773 8.488 -18.438 97 HB2 ARG 44 HB2 ARG 44 23.060 9.710 -15.828 98 HB3 ARG 44 HB1 ARG 44 23.706 8.074 -15.744 99 HG2 ARG 44 HG2 ARG 44 25.657 8.828 -17.093 100 HG3 ARG 44 HG1 ARG 44 25.010 10.470 -17.066 101 HD2 ARG 44 HD2 ARG 44 25.136 10.518 -14.633 102 HD3 ARG 44 HD1 ARG 44 25.670 8.842 -14.601 103 HE ARG 44 HE ARG 44 27.800 9.566 -15.156 104 HH11 ARG 44 HH21 ARG 44 25.450 12.017 -15.821 105 HH12 ARG 44 HH22 ARG 44 26.627 13.231 -16.201 106 HH21 ARG 44 HH11 ARG 44 29.341 11.142 -15.659 107 HH22 ARG 44 HH12 ARG 44 28.831 12.735 -16.109 108 H CYS 45 HN CYS 45 21.822 7.780 -15.674 109 HA CYS 45 HA CYS 45 21.312 5.144 -16.615 110 HB2 CYS 45 HB2 CYS 45 20.623 4.694 -14.466 111 HB3 CYS 45 HB1 CYS 45 21.491 6.193 -14.160 112 H ARG 46 HN ARG 46 19.837 8.016 -17.353 113 HA ARG 46 HA ARG 46 17.926 8.589 -18.453 114 HB2 ARG 46 HB2 ARG 46 17.844 5.647 -19.116 115 HB3 ARG 46 HB1 ARG 46 16.940 6.925 -19.941 116 HG2 ARG 46 HG2 ARG 46 19.178 8.051 -20.396 117 HG3 ARG 46 HG1 ARG 46 19.945 6.567 -19.828 118 HD2 ARG 46 HD2 ARG 46 18.597 5.306 -21.535 119 HD3 ARG 46 HD1 ARG 46 18.040 6.856 -22.159 120 HE ARG 46 HE ARG 46 20.689 5.705 -22.493 121 HH11 ARG 46 HH21 ARG 46 18.681 8.520 -22.565 122 HH12 ARG 46 HH22 ARG 46 19.714 9.400 -23.640 123 HH21 ARG 46 HH11 ARG 46 22.045 6.846 -23.909 124 HH22 ARG 46 HH12 ARG 46 21.619 8.451 -24.403 125 H LYS 47 HN LYS 47 17.633 8.149 -15.695 126 HA LYS 47 HA LYS 47 15.163 6.688 -15.275 127 HB2 LYS 47 HB2 LYS 47 17.128 8.093 -13.561 128 HB3 LYS 47 HB1 LYS 47 15.470 8.302 -13.026 129 HG2 LYS 47 HG2 LYS 47 15.118 5.936 -12.881 130 HG3 LYS 47 HG1 LYS 47 16.660 5.584 -13.656 131 HD2 LYS 47 HD2 LYS 47 17.820 6.666 -11.731 132 HD3 LYS 47 HD1 LYS 47 16.258 6.908 -10.953 133 HE2 LYS 47 HE2 LYS 47 17.324 4.208 -11.818 134 HE3 LYS 47 HE1 LYS 47 17.451 4.838 -10.176 135 HZ1 LYS 47 HZ1 LYS 47 15.203 3.686 -11.510 136 HZ2 LYS 47 HZ2 LYS 47 14.834 5.207 -10.847 137 HZ3 LYS 47 HZ3 LYS 47 15.445 3.971 -9.855 138 H VAL 48 HN VAL 48 13.188 7.449 -15.544 139 HA VAL 48 HA VAL 48 12.832 10.375 -15.893 140 HB VAL 48 HB VAL 48 10.928 8.260 -16.898 141 HG11 VAL 48 HG11 VAL 48 11.621 11.071 -17.797 142 HG12 VAL 48 HG12 VAL 48 10.185 10.607 -16.884 143 HG13 VAL 48 HG13 VAL 48 10.402 10.034 -18.538 144 HG21 VAL 48 HG21 VAL 48 13.028 7.603 -17.856 145 HG22 VAL 48 HG22 VAL 48 13.462 9.279 -18.196 146 HG23 VAL 48 HG23 VAL 48 12.159 8.505 -19.097 147 H LYS 49 HN LYS 49 11.702 11.347 -14.327 148 HA LYS 49 HA LYS 49 9.362 10.266 -13.172 149 HB2 LYS 49 HB2 LYS 49 11.849 9.579 -11.888 150 HB3 LYS 49 HB1 LYS 49 10.915 10.627 -10.816 151 HG2 LYS 49 HG2 LYS 49 8.994 9.147 -10.980 152 HG3 LYS 49 HG1 LYS 49 9.817 8.151 -12.179 153 HD2 LYS 49 HD2 LYS 49 11.615 7.732 -10.440 154 HD3 LYS 49 HD1 LYS 49 10.546 8.505 -9.267 155 HE2 LYS 49 HE2 LYS 49 9.990 6.240 -9.048 156 HE3 LYS 49 HE1 LYS 49 8.754 6.834 -10.156 157 HZ1 LYS 49 HZ1 LYS 49 9.886 5.951 -11.990 158 HZ2 LYS 49 HZ2 LYS 49 9.936 4.723 -10.816 159 HZ3 LYS 49 HZ3 LYS 49 11.308 5.682 -11.106 160 H GLY 50 HN GLY 50 8.794 11.717 -11.158 161 HA2 GLY 50 HA2 GLY 50 8.890 14.432 -12.143 162 HA3 GLY 50 HA1 GLY 50 7.985 13.853 -10.754 163 H ILE 51 HN ILE 51 8.907 16.030 -9.995 164 HA ILE 51 HA ILE 51 11.585 16.471 -9.428 165 HB ILE 51 HB ILE 51 9.695 18.082 -9.077 166 HG12 ILE 51 HG12 ILE 51 11.345 17.754 -6.558 167 HG13 ILE 51 HG11 ILE 51 12.054 18.310 -8.076 168 HG21 ILE 51 HG21 ILE 51 8.378 17.976 -7.081 169 HG22 ILE 51 HG22 ILE 51 9.351 16.660 -6.428 170 HG23 ILE 51 HG23 ILE 51 8.296 16.373 -7.812 171 HD11 ILE 51 HD11 ILE 51 10.669 20.238 -8.128 172 HD12 ILE 51 HD12 ILE 51 11.239 20.121 -6.464 173 HD13 ILE 51 HD13 ILE 51 9.605 19.600 -6.875 174 H ASP 52 HN ASP 52 9.839 13.828 -8.386 175 HA ASP 52 HA ASP 52 10.842 13.567 -5.713 176 HB2 ASP 52 HB2 ASP 52 8.773 12.453 -6.462 177 HB3 ASP 52 HB1 ASP 52 9.707 11.497 -7.610 178 H SER 53 HN SER 53 11.579 11.916 -8.802 179 HA SER 53 HA SER 53 13.941 10.684 -7.690 180 HB2 SER 53 HB2 SER 53 12.528 9.675 -9.517 181 HB3 SER 53 HB1 SER 53 13.236 10.868 -10.605 182 HG SER 53 HG SER 53 15.159 9.914 -10.407 183 H TYR 54 HN TYR 54 13.377 13.768 -8.448 184 HA TYR 54 HA TYR 54 16.164 14.264 -9.335 185 HB2 TYR 54 HB2 TYR 54 13.577 15.304 -10.405 186 HB3 TYR 54 HB1 TYR 54 14.914 16.454 -10.307 187 HD1 TYR 54 HD1 TYR 54 14.206 12.934 -11.449 188 HD2 TYR 54 HD2 TYR 54 16.428 16.553 -12.081 189 HE1 TYR 54 HE1 TYR 54 15.210 11.961 -13.493 190 HE2 TYR 54 HE2 TYR 54 17.427 15.580 -14.110 191 HH TYR 54 HH TYR 54 17.084 13.879 -15.705 192 H SER 55 HN SER 55 17.282 15.755 -8.241 193 HA SER 55 HA SER 55 16.316 16.636 -5.705 194 HB2 SER 55 HB2 SER 55 18.486 17.685 -5.472 195 HB3 SER 55 HB1 SER 55 18.714 16.105 -6.226 196 HG SER 55 HG SER 55 19.686 17.222 -7.721 197 H LYS 56 HN LYS 56 16.052 18.830 -5.017 198 HA LYS 56 HA LYS 56 14.449 20.398 -6.721 199 HB2 LYS 56 HB2 LYS 56 15.904 21.092 -4.160 200 HB3 LYS 56 HB1 LYS 56 14.734 22.153 -4.949 201 HG2 LYS 56 HG2 LYS 56 13.000 20.432 -4.749 202 HG3 LYS 56 HG1 LYS 56 14.161 19.324 -4.020 203 HD2 LYS 56 HD2 LYS 56 14.497 20.932 -2.157 204 HD3 LYS 56 HD1 LYS 56 13.272 21.984 -2.870 205 HE2 LYS 56 HE2 LYS 56 12.815 19.126 -1.965 206 HE3 LYS 56 HE1 LYS 56 12.308 20.567 -1.085 207 HZ1 LYS 56 HZ1 LYS 56 10.498 19.681 -2.400 208 HZ2 LYS 56 HZ2 LYS 56 11.431 19.795 -3.816 209 HZ3 LYS 56 HZ3 LYS 56 10.957 21.202 -2.991 210 H THR 57 HN THR 57 17.871 20.610 -5.840 211 HA THR 57 HA THR 57 18.422 23.069 -7.106 212 HB THR 57 HB THR 57 20.341 20.755 -6.782 213 HG1 THR 57 HG1 THR 57 18.982 21.678 -4.901 214 HG21 THR 57 HG21 THR 57 20.652 23.756 -7.003 215 HG22 THR 57 HG22 THR 57 21.286 22.527 -8.097 216 HG23 THR 57 HG23 THR 57 21.949 22.688 -6.470 217 H GLN 58 HN GLN 58 18.761 19.715 -8.283 218 HA GLN 58 HA GLN 58 19.660 20.470 -10.883 219 HB2 GLN 58 HB2 GLN 58 18.444 17.895 -9.860 220 HB3 GLN 58 HB1 GLN 58 19.173 18.094 -11.452 221 HG2 GLN 58 HG2 GLN 58 20.615 18.627 -8.840 222 HG3 GLN 58 HG1 GLN 58 20.746 17.125 -9.752 223 HE21 GLN 58 HE21 GLN 58 22.589 19.684 -9.185 224 HE22 GLN 58 HE22 GLN 58 23.279 19.952 -10.718 225 H TRP 59 HN TRP 59 16.484 19.628 -9.537 226 HA TRP 59 HA TRP 59 15.065 19.615 -11.977 227 HB2 TRP 59 HB2 TRP 59 14.109 18.609 -9.985 228 HB3 TRP 59 HB1 TRP 59 14.144 20.160 -9.140 229 HD1 TRP 59 HD1 TRP 59 12.343 18.337 -11.993 230 HE1 TRP 59 HE1 TRP 59 10.122 19.563 -12.486 231 HE3 TRP 59 HE3 TRP 59 12.889 22.382 -8.940 232 HZ2 TRP 59 HZ2 TRP 59 8.770 21.956 -11.685 233 HZ3 TRP 59 HZ3 TRP 59 11.126 24.122 -8.819 234 HH2 TRP 59 HH2 TRP 59 9.068 23.912 -10.187 235 H SER 60 HN SER 60 15.921 22.178 -9.706 236 HA SER 60 HA SER 60 14.220 24.191 -10.708 237 HB2 SER 60 HB2 SER 60 15.738 25.762 -9.601 238 HB3 SER 60 HB1 SER 60 15.418 24.374 -8.563 239 HG SER 60 HG SER 60 17.451 23.859 -8.681 240 H LYS 61 HN LYS 61 17.127 22.810 -11.968 241 HA LYS 61 HA LYS 61 17.862 25.020 -13.664 242 HB2 LYS 61 HB2 LYS 61 18.633 22.096 -13.759 243 HB3 LYS 61 HB1 LYS 61 19.394 23.379 -14.697 244 HG2 LYS 61 HG2 LYS 61 20.107 24.504 -12.664 245 HG3 LYS 61 HG1 LYS 61 19.244 23.328 -11.677 246 HD2 LYS 61 HD2 LYS 61 20.689 21.531 -12.706 247 HD3 LYS 61 HD1 LYS 61 21.640 22.815 -13.456 248 HE2 LYS 61 HE2 LYS 61 21.122 22.630 -10.483 249 HE3 LYS 61 HE1 LYS 61 22.566 21.984 -11.262 250 HZ1 LYS 61 HZ1 LYS 61 21.789 24.773 -11.760 251 HZ2 LYS 61 HZ2 LYS 61 23.333 24.065 -11.780 252 HZ3 LYS 61 HZ3 LYS 61 22.560 24.384 -10.301 253 H THR 62 HN THR 62 15.330 22.885 -13.720 254 HA THR 62 HA THR 62 15.173 22.198 -16.479 255 HB THR 62 HB THR 62 12.775 21.737 -15.985 256 HG1 THR 62 HG1 THR 62 13.367 23.368 -13.918 257 HG21 THR 62 HG21 THR 62 13.304 20.106 -14.052 258 HG22 THR 62 HG22 THR 62 14.956 20.711 -14.174 259 HG23 THR 62 HG23 THR 62 14.205 19.917 -15.558 260 H PHE 63 HN PHE 63 14.858 25.137 -14.908 261 HA PHE 63 HA PHE 63 13.746 26.402 -17.299 262 HB2 PHE 63 HB2 PHE 63 12.255 27.813 -15.821 263 HB3 PHE 63 HB1 PHE 63 11.757 26.131 -15.999 264 HD1 PHE 63 HD2 PHE 63 13.469 28.537 -13.731 265 HD2 PHE 63 HD1 PHE 63 11.727 24.636 -14.157 266 HE1 PHE 63 HE2 PHE 63 13.598 28.209 -11.274 267 HE2 PHE 63 HE1 PHE 63 11.858 24.301 -11.707 268 HZ PHE 63 HZ PHE 63 12.794 26.091 -10.262 269 H THR 64 HN THR 64 14.192 28.641 -17.424 270 HA THR 64 HA THR 64 16.340 29.604 -15.616 271 HB THR 64 HB THR 64 17.236 30.783 -17.683 272 HG1 THR 64 HG1 THR 64 16.553 30.064 -19.633 273 HG21 THR 64 HG21 THR 64 17.253 27.784 -17.383 274 HG22 THR 64 HG22 THR 64 18.476 28.941 -16.863 275 HG23 THR 64 HG23 THR 64 18.249 28.610 -18.580 276 H PHE 65 HN PHE 65 16.652 32.060 -16.050 277 HA PHE 65 HA PHE 65 13.979 33.344 -16.148 278 HB2 PHE 65 HB2 PHE 65 15.854 33.224 -13.999 279 HB3 PHE 65 HB1 PHE 65 15.886 34.879 -14.595 280 HD1 PHE 65 HD1 PHE 65 13.701 32.192 -13.274 281 HD2 PHE 65 HD2 PHE 65 14.018 36.352 -14.292 282 HE1 PHE 65 HE1 PHE 65 11.532 32.635 -12.156 283 HE2 PHE 65 HE2 PHE 65 11.849 36.783 -13.162 284 HZ PHE 65 HZ PHE 65 10.621 34.943 -12.113 285 H VAL 66 HN VAL 66 13.797 35.278 -17.200 286 HA VAL 66 HA VAL 66 16.207 36.330 -18.560 287 HB VAL 66 HB VAL 66 13.537 36.263 -19.950 288 HG11 VAL 66 HG11 VAL 66 16.315 36.047 -21.117 289 HG12 VAL 66 HG12 VAL 66 15.613 37.608 -20.702 290 HG13 VAL 66 HG13 VAL 66 14.831 36.583 -21.905 291 HG21 VAL 66 HG21 VAL 66 15.589 34.044 -19.782 292 HG22 VAL 66 HG22 VAL 66 14.372 34.143 -21.058 293 HG23 VAL 66 HG23 VAL 66 13.877 33.967 -19.376 294 H ARG 67 HN ARG 67 16.465 38.416 -18.144 295 HA ARG 67 HA ARG 67 16.007 40.458 -17.122 296 HB2 ARG 67 HB2 ARG 67 14.486 41.796 -18.560 297 HB3 ARG 67 HB1 ARG 67 15.668 40.871 -19.491 298 HG2 ARG 67 HG2 ARG 67 14.011 39.183 -20.027 299 HG3 ARG 67 HG1 ARG 67 12.832 39.933 -18.952 300 HD2 ARG 67 HD2 ARG 67 12.824 41.944 -20.375 301 HD3 ARG 67 HD1 ARG 67 14.026 41.200 -21.434 302 HE ARG 67 HE ARG 67 12.329 39.906 -22.361 303 HH11 ARG 67 HH21 ARG 67 11.334 41.322 -19.366 304 HH12 ARG 67 HH22 ARG 67 9.675 40.849 -19.533 305 HH21 ARG 67 HH11 ARG 67 10.158 39.274 -22.584 306 HH22 ARG 67 HH12 ARG 67 9.011 39.690 -21.355 307 H GLY 68 HN GLY 68 14.604 38.348 -15.679 308 HA2 GLY 68 HA2 GLY 68 13.185 38.510 -13.835 309 HA3 GLY 68 HA1 GLY 68 12.520 40.008 -14.488 310 H ARG 69 HN ARG 69 12.847 37.035 -16.354 311 HA ARG 69 HA ARG 69 9.920 36.589 -16.209 312 HB2 ARG 69 HB2 ARG 69 10.458 37.891 -18.260 313 HB3 ARG 69 HB1 ARG 69 11.549 36.600 -18.762 314 HG2 ARG 69 HG2 ARG 69 9.701 35.004 -18.813 315 HG3 ARG 69 HG1 ARG 69 8.592 36.231 -18.201 316 HD2 ARG 69 HD2 ARG 69 8.322 36.077 -20.610 317 HD3 ARG 69 HD1 ARG 69 9.083 37.617 -20.221 318 HE ARG 69 HE ARG 69 11.055 35.625 -20.744 319 HH11 ARG 69 HH21 ARG 69 8.701 37.683 -22.224 320 HH12 ARG 69 HH22 ARG 69 9.531 37.775 -23.741 321 HH21 ARG 69 HH11 ARG 69 12.150 35.737 -22.732 322 HH22 ARG 69 HH12 ARG 69 11.484 36.674 -24.029 323 H THR 70 HN THR 70 9.524 34.574 -15.625 324 HA THR 70 HA THR 70 11.558 32.556 -15.580 325 HB THR 70 HB THR 70 8.578 32.203 -15.191 326 HG1 THR 70 HG1 THR 70 8.886 33.403 -13.513 327 HG21 THR 70 HG21 THR 70 9.399 30.346 -13.699 328 HG22 THR 70 HG22 THR 70 11.022 30.640 -14.324 329 HG23 THR 70 HG23 THR 70 9.742 30.100 -15.412 330 H VAL 71 HN VAL 71 12.064 31.107 -17.105 331 HA VAL 71 HA VAL 71 10.104 30.456 -19.216 332 HB VAL 71 HB VAL 71 11.873 30.652 -20.927 333 HG11 VAL 71 HG11 VAL 71 10.340 32.556 -20.459 334 HG12 VAL 71 HG12 VAL 71 11.927 33.105 -21.004 335 HG13 VAL 71 HG13 VAL 71 11.505 33.185 -19.294 336 HG21 VAL 71 HG21 VAL 71 13.480 31.825 -18.638 337 HG22 VAL 71 HG22 VAL 71 13.970 31.837 -20.331 338 HG23 VAL 71 HG23 VAL 71 13.816 30.310 -19.469 339 H SER 72 HN SER 72 10.186 28.365 -19.930 340 HA SER 72 HA SER 72 11.656 26.490 -18.301 341 HB2 SER 72 HB2 SER 72 9.818 26.105 -20.671 342 HB3 SER 72 HB1 SER 72 10.524 24.785 -19.737 343 HG SER 72 HG SER 72 9.561 25.961 -17.867 344 H VAL 73 HN VAL 73 13.401 25.209 -18.899 345 HA VAL 73 HA VAL 73 15.045 26.199 -21.016 346 HB VAL 73 HB VAL 73 15.325 23.779 -19.224 347 HG11 VAL 73 HG11 VAL 73 17.756 23.954 -19.997 348 HG12 VAL 73 HG12 VAL 73 17.165 24.994 -21.292 349 HG13 VAL 73 HG13 VAL 73 16.610 23.322 -21.179 350 HG21 VAL 73 HG21 VAL 73 15.952 26.666 -18.937 351 HG22 VAL 73 HG22 VAL 73 17.324 25.617 -18.580 352 HG23 VAL 73 HG23 VAL 73 15.816 25.424 -17.696 353 H SER 74 HN SER 74 15.344 25.412 -23.042 354 HA SER 74 HA SER 74 13.393 23.699 -24.192 355 HB2 SER 74 HB2 SER 74 16.054 24.682 -25.235 356 HB3 SER 74 HB1 SER 74 14.890 23.779 -26.200 357 HG SER 74 HG SER 74 13.379 25.517 -25.362 358 H ASP 75 HN ASP 75 16.733 23.194 -23.137 359 HA ASP 75 HA ASP 75 16.262 20.296 -23.099 360 HB2 ASP 75 HB2 ASP 75 17.305 20.942 -25.317 361 HB3 ASP 75 HB1 ASP 75 18.733 21.448 -24.404 362 HA PRO 76 HA PRO 76 18.669 21.803 -19.452 363 HB2 PRO 76 HB2 PRO 76 17.208 20.548 -17.515 364 HB3 PRO 76 HB1 PRO 76 16.729 22.104 -18.216 365 HG2 PRO 76 HG2 PRO 76 15.656 19.383 -18.753 366 HG3 PRO 76 HG1 PRO 76 14.814 20.941 -18.717 367 HD2 PRO 76 HD2 PRO 76 15.618 19.611 -21.040 368 HD3 PRO 76 HD1 PRO 76 15.226 21.341 -20.950 369 H LYS 77 HN LYS 77 20.553 20.743 -19.246 370 HA LYS 77 HA LYS 77 20.619 17.802 -19.317 371 HB2 LYS 77 HB2 LYS 77 22.909 19.784 -19.332 372 HB3 LYS 77 HB1 LYS 77 23.008 18.059 -19.673 373 HG2 LYS 77 HG2 LYS 77 21.277 19.927 -21.309 374 HG3 LYS 77 HG1 LYS 77 22.965 19.620 -21.707 375 HD2 LYS 77 HD2 LYS 77 22.452 17.173 -21.817 376 HD3 LYS 77 HD1 LYS 77 20.751 17.548 -21.549 377 HE2 LYS 77 HE2 LYS 77 20.954 17.384 -23.899 378 HE3 LYS 77 HE1 LYS 77 20.948 19.117 -23.574 379 HZ1 LYS 77 HZ1 LYS 77 22.716 18.456 -25.113 380 HZ2 LYS 77 HZ2 LYS 77 23.386 17.455 -23.913 381 HZ3 LYS 77 HZ3 LYS 77 23.338 19.139 -23.689 382 H VAL 78 HN VAL 78 20.152 17.003 -17.366 383 HA VAL 78 HA VAL 78 21.942 17.708 -15.140 384 HB VAL 78 HB VAL 78 19.843 17.527 -13.629 385 HG11 VAL 78 HG11 VAL 78 20.165 19.935 -15.445 386 HG12 VAL 78 HG12 VAL 78 21.152 19.603 -14.019 387 HG13 VAL 78 HG13 VAL 78 19.427 19.924 -13.843 388 HG21 VAL 78 HG21 VAL 78 17.731 17.922 -14.581 389 HG22 VAL 78 HG22 VAL 78 18.465 16.811 -15.740 390 HG23 VAL 78 HG23 VAL 78 18.412 18.536 -16.089 391 H ILE 79 HN ILE 79 21.817 16.097 -13.377 392 HA ILE 79 HA ILE 79 21.158 13.401 -14.418 393 HB ILE 79 HB ILE 79 23.074 12.542 -13.239 394 HG12 ILE 79 HG12 ILE 79 23.332 15.396 -12.243 395 HG13 ILE 79 HG11 ILE 79 23.144 13.931 -11.279 396 HG21 ILE 79 HG21 ILE 79 24.781 13.491 -14.615 397 HG22 ILE 79 HG22 ILE 79 23.966 15.052 -14.675 398 HG23 ILE 79 HG23 ILE 79 23.286 13.668 -15.533 399 HD11 ILE 79 HD11 ILE 79 25.551 14.847 -12.835 400 HD12 ILE 79 HD12 ILE 79 25.348 13.157 -12.381 401 HD13 ILE 79 HD13 ILE 79 25.446 14.399 -11.132 402 H CYS 80 HN CYS 80 19.766 12.254 -13.250 403 HA CYS 80 HA CYS 80 18.389 13.262 -11.053 404 HB2 CYS 80 HB2 CYS 80 17.349 11.135 -10.882 405 HB3 CYS 80 HB1 CYS 80 17.716 11.334 -12.595 406 H ARG 81 HN ARG 81 18.319 12.375 -8.854 407 HA ARG 81 HA ARG 81 20.902 12.471 -7.640 408 HB2 ARG 81 HB2 ARG 81 19.676 12.052 -5.534 409 HB3 ARG 81 HB1 ARG 81 18.935 13.341 -6.483 410 HG2 ARG 81 HG2 ARG 81 17.279 11.757 -7.372 411 HG3 ARG 81 HG1 ARG 81 18.023 10.447 -6.455 412 HD2 ARG 81 HD2 ARG 81 17.538 11.652 -4.353 413 HD3 ARG 81 HD1 ARG 81 16.771 12.942 -5.275 414 HE ARG 81 HE ARG 81 15.534 10.531 -5.998 415 HH11 ARG 81 HH21 ARG 81 15.972 12.572 -3.240 416 HH12 ARG 81 HH22 ARG 81 14.464 12.141 -2.508 417 HH21 ARG 81 HH11 ARG 81 13.557 9.958 -5.046 418 HH22 ARG 81 HH12 ARG 81 13.095 10.659 -3.530 419 H THR 82 HN THR 82 18.902 9.926 -8.836 420 HA THR 82 HA THR 82 20.157 7.830 -7.284 421 HB THR 82 HB THR 82 18.905 6.350 -8.962 422 HG1 THR 82 HG1 THR 82 17.344 8.539 -9.566 423 HG21 THR 82 HG21 THR 82 16.732 6.826 -7.910 424 HG22 THR 82 HG22 THR 82 17.339 8.383 -7.351 425 HG23 THR 82 HG23 THR 82 18.032 6.889 -6.720 426 H CYS 83 HN CYS 83 20.798 9.498 -10.258 427 HA CYS 83 HA CYS 83 22.298 7.485 -11.578 428 HB2 CYS 83 HB2 CYS 83 21.848 10.384 -11.876 429 HB3 CYS 83 HB1 CYS 83 23.438 9.859 -12.436 430 H GLN 84 HN GLN 84 23.395 10.278 -9.623 431 HA GLN 84 HA GLN 84 25.507 10.722 -8.753 432 HB2 GLN 84 HB2 GLN 84 24.598 8.076 -7.642 433 HB3 GLN 84 HB1 GLN 84 26.115 8.805 -7.110 434 HG2 GLN 84 HG2 GLN 84 25.051 10.653 -6.142 435 HG3 GLN 84 HG1 GLN 84 23.607 10.480 -7.144 436 HE21 GLN 84 HE21 GLN 84 22.417 10.608 -5.013 437 HE22 GLN 84 HE22 GLN 84 22.264 9.192 -4.088 438 HA PRO 85 HA PRO 85 27.797 8.473 -12.117 439 HB2 PRO 85 HB2 PRO 85 29.447 10.948 -11.741 440 HB3 PRO 85 HB1 PRO 85 28.904 10.173 -13.246 441 HG2 PRO 85 HG2 PRO 85 27.751 12.403 -12.346 442 HG3 PRO 85 HG1 PRO 85 26.804 11.127 -13.131 443 HD2 PRO 85 HD2 PRO 85 26.969 11.824 -10.225 444 HD3 PRO 85 HD1 PRO 85 25.592 11.190 -11.156 445 H LYS 86 HN LYS 86 29.011 10.131 -9.235 446 HA LYS 86 HA LYS 86 31.523 8.859 -9.113 447 HB2 LYS 86 HB2 LYS 86 30.767 10.909 -7.809 448 HB3 LYS 86 HB1 LYS 86 29.908 9.801 -6.741 449 HG2 LYS 86 HG2 LYS 86 31.950 10.005 -5.624 450 HG3 LYS 86 HG1 LYS 86 32.242 8.569 -6.603 451 HD2 LYS 86 HD2 LYS 86 33.369 9.947 -8.309 452 HD3 LYS 86 HD1 LYS 86 33.032 11.399 -7.367 453 HE2 LYS 86 HE2 LYS 86 34.388 10.542 -5.518 454 HE3 LYS 86 HE1 LYS 86 34.688 9.049 -6.408 455 HZ1 LYS 86 HZ1 LYS 86 36.469 10.107 -7.190 456 HZ2 LYS 86 HZ2 LYS 86 35.907 11.635 -6.703 457 HZ3 LYS 86 HZ3 LYS 86 35.390 10.968 -8.177 458 H GLN 87 HN GLN 87 32.112 6.873 -8.530 459 HA GLN 87 HA GLN 87 30.765 5.314 -6.574 460 HB2 GLN 87 HB2 GLN 87 29.141 5.153 -8.500 461 HB3 GLN 87 HB1 GLN 87 30.413 4.340 -9.419 462 HG2 GLN 87 HG2 GLN 87 29.047 2.628 -8.410 463 HG3 GLN 87 HG1 GLN 87 30.580 2.664 -7.543 464 HE21 GLN 87 HE21 GLN 87 27.438 4.445 -7.316 465 HE22 GLN 87 HE22 GLN 87 27.322 4.296 -5.629 466 H HIS 88 HN HIS 88 32.567 4.528 -5.675 467 HA HIS 88 HA HIS 88 34.977 3.998 -7.081 468 HB2 HIS 88 HB2 HIS 88 34.022 3.127 -4.344 469 HB3 HIS 88 HB1 HIS 88 35.663 2.873 -4.949 470 HD2 HIS 88 HD2 HIS 88 37.217 5.270 -5.207 471 HE1 HIS 88 HE1 HIS 88 34.418 7.772 -3.274 472 HE2 HIS 88 HE2 HIS 88 36.790 7.628 -4.168 473 H ASP 89 HN ASP 89 32.343 1.926 -5.923 474 HA ASP 89 HA ASP 89 33.606 -0.484 -6.963 475 HB2 ASP 89 HB2 ASP 89 30.985 0.075 -5.583 476 HB3 ASP 89 HB1 ASP 89 31.381 -1.511 -6.237 477 H SER 90 HN SER 90 33.546 -0.903 -9.038 478 HA SER 90 HA SER 90 31.058 -0.473 -10.568 479 HB2 SER 90 HB2 SER 90 32.539 1.400 -11.112 480 HB3 SER 90 HB1 SER 90 33.846 0.275 -11.489 481 HG SER 90 HG SER 90 32.016 -0.634 -12.939 482 H ILE 91 HN ILE 91 30.854 -1.810 -12.425 483 HA ILE 91 HA ILE 91 32.635 -4.188 -12.464 484 HB ILE 91 HB ILE 91 29.618 -4.179 -12.655 485 HG12 ILE 91 HG12 ILE 91 31.437 -5.407 -10.561 486 HG13 ILE 91 HG11 ILE 91 30.628 -3.848 -10.360 487 HG21 ILE 91 HG21 ILE 91 30.522 -5.895 -14.089 488 HG22 ILE 91 HG22 ILE 91 29.977 -6.691 -12.610 489 HG23 ILE 91 HG23 ILE 91 31.695 -6.373 -12.864 490 HD11 ILE 91 HD11 ILE 91 28.451 -5.055 -10.860 491 HD12 ILE 91 HD12 ILE 91 29.203 -5.472 -9.325 492 HD13 ILE 91 HD13 ILE 91 29.341 -6.562 -10.709 493 H TRP 92 HN TRP 92 33.269 -4.834 -14.433 494 HA TRP 92 HA TRP 92 32.490 -3.227 -16.733 495 HB2 TRP 92 HB2 TRP 92 34.820 -3.670 -16.626 496 HB3 TRP 92 HB1 TRP 92 34.561 -5.380 -16.267 497 HD1 TRP 92 HD1 TRP 92 33.055 -3.215 -19.098 498 HE1 TRP 92 HE1 TRP 92 33.537 -4.382 -21.347 499 HE3 TRP 92 HE3 TRP 92 35.869 -7.151 -17.462 500 HZ2 TRP 92 HZ2 TRP 92 34.938 -6.676 -22.320 501 HZ3 TRP 92 HZ3 TRP 92 36.765 -8.810 -19.071 502 HH2 TRP 92 HH2 TRP 92 36.302 -8.578 -21.495 503 H CYS 93 HN CYS 93 31.026 -3.800 -18.209 504 HA CYS 93 HA CYS 93 29.899 -6.537 -18.140 505 HB2 CYS 93 HB2 CYS 93 28.194 -4.895 -17.825 506 HB3 CYS 93 HB1 CYS 93 28.797 -3.913 -19.161 507 H THR 94 HN THR 94 29.986 -7.829 -19.899 508 HA THR 94 HA THR 94 31.594 -6.885 -22.186 509 HB THR 94 HB THR 94 32.168 -9.116 -22.567 510 HG1 THR 94 HG1 THR 94 29.753 -9.654 -21.217 511 HG21 THR 94 HG21 THR 94 32.864 -10.009 -20.432 512 HG22 THR 94 HG22 THR 94 31.618 -9.086 -19.588 513 HG23 THR 94 HG23 THR 94 32.975 -8.250 -20.345 514 H ALA 95 HN ALA 95 28.376 -7.401 -21.291 515 HA ALA 95 HA ALA 95 27.428 -8.212 -23.917 516 HB1 ALA 95 HB1 ALA 95 25.876 -7.338 -21.468 517 HB2 ALA 95 HB2 ALA 95 26.303 -9.004 -21.855 518 HB3 ALA 95 HB3 ALA 95 25.208 -8.107 -22.906 519 H CYS 96 HN CYS 96 27.757 -5.283 -22.007 520 HA CYS 96 HA CYS 96 26.336 -3.708 -24.058 521 HB2 CYS 96 HB2 CYS 96 27.327 -2.938 -21.301 522 HB3 CYS 96 HB1 CYS 96 26.442 -1.880 -22.406 523 H GLN 97 HN GLN 97 29.466 -4.235 -22.582 524 HA GLN 97 HA GLN 97 31.576 -3.756 -23.392 525 HB2 GLN 97 HB2 GLN 97 30.324 -3.732 -25.697 526 HB3 GLN 97 HB1 GLN 97 30.437 -1.980 -25.544 527 HG2 GLN 97 HG2 GLN 97 32.887 -2.166 -25.264 528 HG3 GLN 97 HG1 GLN 97 32.769 -3.916 -25.457 529 HE21 GLN 97 HE21 GLN 97 33.243 -4.558 -27.555 530 HE22 GLN 97 HE22 GLN 97 32.914 -3.653 -28.951 531 H GLN 98 HN GLN 98 29.904 -2.158 -21.517 532 HA GLN 98 HA GLN 98 31.585 0.266 -21.517 533 HB2 GLN 98 HB2 GLN 98 29.345 0.797 -22.547 534 HB3 GLN 98 HB1 GLN 98 28.600 0.340 -21.015 535 HG2 GLN 98 HG2 GLN 98 29.835 2.073 -19.839 536 HG3 GLN 98 HG1 GLN 98 30.736 2.471 -21.300 537 HE21 GLN 98 HE21 GLN 98 29.172 4.444 -19.949 538 HE22 GLN 98 HE22 GLN 98 27.863 4.862 -20.944 539 H THR 99 HN THR 99 31.752 1.267 -19.437 540 HA THR 99 HA THR 99 31.689 -0.679 -17.269 541 HB THR 99 HB THR 99 32.637 2.196 -17.252 542 HG1 THR 99 HG1 THR 99 33.847 1.026 -18.704 543 HG21 THR 99 HG21 THR 99 32.189 1.316 -15.024 544 HG22 THR 99 HG22 THR 99 33.933 1.392 -15.276 545 HG23 THR 99 HG23 THR 99 33.091 -0.153 -15.392 546 H LYS 100 HN LYS 100 30.403 -0.617 -15.506 547 HA LYS 100 HA LYS 100 28.501 1.622 -15.190 548 HB2 LYS 100 HB2 LYS 100 27.818 -1.319 -15.205 549 HB3 LYS 100 HB1 LYS 100 26.726 -0.049 -14.661 550 HG2 LYS 100 HG2 LYS 100 27.954 -0.182 -17.428 551 HG3 LYS 100 HG1 LYS 100 26.333 -0.748 -17.030 552 HD2 LYS 100 HD2 LYS 100 26.022 1.688 -16.052 553 HD3 LYS 100 HD1 LYS 100 27.391 2.075 -17.097 554 HE2 LYS 100 HE2 LYS 100 26.187 1.171 -19.030 555 HE3 LYS 100 HE1 LYS 100 24.815 0.785 -17.994 556 HZ1 LYS 100 HZ1 LYS 100 24.845 3.223 -17.380 557 HZ2 LYS 100 HZ2 LYS 100 24.302 2.839 -18.944 558 HZ3 LYS 100 HZ3 LYS 100 25.870 3.451 -18.713 559 H GLY 101 HN GLY 101 27.846 2.053 -13.154 560 HA2 GLY 101 HA2 GLY 101 29.666 1.328 -11.069 561 HA3 GLY 101 HA1 GLY 101 28.207 2.293 -10.879 562 H ILE 102 HN ILE 102 28.825 0.573 -8.912 563 HA ILE 102 HA ILE 102 27.674 -2.019 -9.215 564 HB ILE 102 HB ILE 102 29.359 -1.444 -7.476 565 HG12 ILE 102 HG12 ILE 102 26.781 -2.387 -6.198 566 HG13 ILE 102 HG11 ILE 102 27.675 -3.391 -7.345 567 HG21 ILE 102 HG21 ILE 102 28.322 0.782 -6.921 568 HG22 ILE 102 HG22 ILE 102 28.693 -0.207 -5.511 569 HG23 ILE 102 HG23 ILE 102 27.032 -0.086 -6.086 570 HD11 ILE 102 HD11 ILE 102 28.719 -2.278 -4.724 571 HD12 ILE 102 HD12 ILE 102 29.705 -3.146 -5.902 572 HD13 ILE 102 HD13 ILE 102 28.374 -3.969 -5.087 573 H ASN 103 HN ASN 103 26.375 1.124 -8.564 574 HA ASN 103 HA ASN 103 24.006 0.398 -7.211 575 HB2 ASN 103 HB2 ASN 103 24.656 2.726 -9.026 576 HB3 ASN 103 HB1 ASN 103 23.157 2.591 -8.110 577 HD21 ASN 103 HD21 ASN 103 24.546 1.285 -5.774 578 HD22 ASN 103 HD22 ASN 103 25.414 2.541 -5.013 579 H GLU 104 HN GLU 104 24.735 0.743 -10.672 580 HA GLU 104 HA GLU 104 22.030 -0.088 -11.418 581 HB2 GLU 104 HB2 GLU 104 24.453 0.649 -13.075 582 HB3 GLU 104 HB1 GLU 104 22.870 0.241 -13.738 583 HG2 GLU 104 HG2 GLU 104 23.376 2.498 -11.777 584 HG3 GLU 104 HG1 GLU 104 23.227 2.709 -13.522 585 H PHE 105 HN PHE 105 24.319 -1.776 -10.130 586 HA PHE 105 HA PHE 105 24.022 -4.075 -11.979 587 HB2 PHE 105 HB2 PHE 105 26.412 -2.779 -11.047 588 HB3 PHE 105 HB1 PHE 105 26.354 -4.390 -10.335 589 HD1 PHE 105 HD2 PHE 105 25.423 -6.239 -12.097 590 HD2 PHE 105 HD1 PHE 105 27.494 -2.623 -13.121 591 HE1 PHE 105 HE2 PHE 105 26.102 -7.240 -14.257 592 HE2 PHE 105 HE1 PHE 105 28.172 -3.619 -15.276 593 HZ PHE 105 HZ PHE 105 27.475 -5.931 -15.853 594 H SER 106 HN SER 106 23.421 -5.985 -11.132 595 HA SER 106 HA SER 106 22.300 -5.980 -8.475 596 HB2 SER 106 HB2 SER 106 22.432 -7.962 -10.722 597 HB3 SER 106 HB1 SER 106 21.870 -8.463 -9.127 598 HG SER 106 HG SER 106 20.120 -7.759 -10.330 599 H LYS 107 HN LYS 107 22.774 -7.701 -6.915 600 HA LYS 107 HA LYS 107 25.569 -7.803 -6.312 601 HB2 LYS 107 HB2 LYS 107 23.110 -9.026 -5.069 602 HB3 LYS 107 HB1 LYS 107 24.724 -9.410 -4.475 603 HG2 LYS 107 HG2 LYS 107 23.825 -7.563 -3.170 604 HG3 LYS 107 HG1 LYS 107 25.146 -6.959 -4.176 605 HD2 LYS 107 HD2 LYS 107 23.649 -5.938 -5.716 606 HD3 LYS 107 HD1 LYS 107 22.264 -6.826 -5.080 607 HE2 LYS 107 HE2 LYS 107 23.859 -4.740 -3.564 608 HE3 LYS 107 HE1 LYS 107 22.276 -4.478 -4.299 609 HZ1 LYS 107 HZ1 LYS 107 21.945 -6.729 -2.810 610 HZ2 LYS 107 HZ2 LYS 107 21.451 -5.164 -2.368 611 HZ3 LYS 107 HZ3 LYS 107 22.947 -5.770 -1.834 612 H ALA 108 HN ALA 108 23.205 -10.201 -7.443 613 HA ALA 108 HA ALA 108 24.934 -12.431 -7.401 614 HB1 ALA 108 HB1 ALA 108 23.281 -13.548 -8.702 615 HB2 ALA 108 HB2 ALA 108 22.652 -12.027 -9.336 616 HB3 ALA 108 HB3 ALA 108 22.407 -12.444 -7.639 617 H GLN 109 HN GLN 109 24.493 -9.849 -9.703 618 HA GLN 109 HA GLN 109 25.641 -11.007 -11.979 619 HB2 GLN 109 HB2 GLN 109 25.074 -8.272 -10.994 620 HB3 GLN 109 HB1 GLN 109 26.361 -8.367 -12.199 621 HG2 GLN 109 HG2 GLN 109 24.140 -8.029 -13.246 622 HG3 GLN 109 HG1 GLN 109 24.862 -9.564 -13.731 623 HE21 GLN 109 HE21 GLN 109 21.920 -8.517 -13.248 624 HE22 GLN 109 HE22 GLN 109 21.227 -9.784 -12.357 625 H ARG 110 HN ARG 110 27.073 -9.858 -9.049 626 HA ARG 110 HA ARG 110 29.752 -9.618 -10.039 627 HB2 ARG 110 HB2 ARG 110 28.600 -9.796 -7.252 628 HB3 ARG 110 HB1 ARG 110 30.331 -9.668 -7.565 629 HG2 ARG 110 HG2 ARG 110 30.022 -7.578 -8.745 630 HG3 ARG 110 HG1 ARG 110 28.265 -7.713 -8.611 631 HD2 ARG 110 HD2 ARG 110 29.103 -6.186 -6.900 632 HD3 ARG 110 HD1 ARG 110 28.485 -7.653 -6.134 633 HE ARG 110 HE ARG 110 31.266 -7.925 -6.660 634 HH11 ARG 110 HH21 ARG 110 28.982 -6.289 -4.644 635 HH12 ARG 110 HH22 ARG 110 30.064 -6.143 -3.299 636 HH21 ARG 110 HH11 ARG 110 32.691 -7.740 -4.903 637 HH22 ARG 110 HH12 ARG 110 32.166 -6.965 -3.447 638 H HIS 111 HN HIS 111 27.848 -12.162 -8.506 639 HA HIS 111 HA HIS 111 29.915 -13.980 -7.955 640 HB2 HIS 111 HB2 HIS 111 27.608 -14.204 -7.093 641 HB3 HIS 111 HB1 HIS 111 27.054 -14.605 -8.722 642 HD2 HIS 111 HD2 HIS 111 28.874 -16.317 -5.733 643 HE1 HIS 111 HE1 HIS 111 28.711 -19.120 -8.886 644 HE2 HIS 111 HE2 HIS 111 29.272 -18.803 -6.429 645 H VAL 112 HN VAL 112 27.923 -13.589 -10.883 646 HA VAL 112 HA VAL 112 29.032 -15.804 -12.266 647 HB VAL 112 HB VAL 112 28.027 -14.727 -14.278 648 HG11 VAL 112 HG11 VAL 112 26.168 -14.524 -11.890 649 HG12 VAL 112 HG12 VAL 112 26.708 -16.074 -12.539 650 HG13 VAL 112 HG13 VAL 112 25.757 -14.981 -13.545 651 HG21 VAL 112 HG21 VAL 112 27.238 -12.574 -12.320 652 HG22 VAL 112 HG22 VAL 112 26.858 -12.613 -14.038 653 HG23 VAL 112 HG23 VAL 112 28.523 -12.370 -13.507 654 H LEU 113 HN LEU 113 30.626 -15.888 -13.828 655 HA LEU 113 HA LEU 113 32.879 -14.213 -13.432 656 HB2 LEU 113 HB2 LEU 113 32.166 -16.338 -15.447 657 HB3 LEU 113 HB1 LEU 113 33.667 -15.415 -15.595 658 HG LEU 113 HG LEU 113 34.325 -16.098 -13.326 659 HD11 LEU 113 HD11 LEU 113 32.885 -17.998 -12.309 660 HD12 LEU 113 HD12 LEU 113 31.610 -17.426 -13.386 661 HD13 LEU 113 HD13 LEU 113 32.279 -16.348 -12.160 662 HD21 LEU 113 HD21 LEU 113 33.471 -18.380 -15.135 663 HD22 LEU 113 HD22 LEU 113 34.607 -18.539 -13.797 664 HD23 LEU 113 HD23 LEU 113 35.013 -17.527 -15.182 665 H ASP 114 HN ASP 114 30.115 -14.003 -15.515 666 HA ASP 114 HA ASP 114 31.330 -11.662 -16.887 667 HB2 ASP 114 HB2 ASP 114 31.020 -13.650 -18.377 668 HB3 ASP 114 HB1 ASP 114 29.286 -13.554 -18.062 669 HA PRO 115 HA PRO 115 27.655 -10.280 -14.391 670 HB2 PRO 115 HB2 PRO 115 29.213 -7.738 -14.625 671 HB3 PRO 115 HB1 PRO 115 28.463 -8.469 -13.191 672 HG2 PRO 115 HG2 PRO 115 31.105 -8.521 -13.547 673 HG3 PRO 115 HG1 PRO 115 30.244 -9.895 -12.824 674 HD2 PRO 115 HD2 PRO 115 31.340 -9.607 -15.605 675 HD3 PRO 115 HD1 PRO 115 31.281 -11.045 -14.557 676 H ARG 116 HN ARG 116 25.859 -9.259 -15.175 677 HA ARG 116 HA ARG 116 26.070 -7.789 -17.748 678 HB2 ARG 116 HB2 ARG 116 23.988 -9.832 -16.930 679 HB3 ARG 116 HB1 ARG 116 23.914 -8.842 -18.392 680 HG2 ARG 116 HG2 ARG 116 26.068 -9.804 -19.137 681 HG3 ARG 116 HG1 ARG 116 26.117 -10.808 -17.691 682 HD2 ARG 116 HD2 ARG 116 23.971 -11.855 -18.376 683 HD3 ARG 116 HD1 ARG 116 23.993 -10.887 -19.852 684 HE ARG 116 HE ARG 116 26.406 -12.412 -19.517 685 HH11 ARG 116 HH21 ARG 116 23.095 -12.502 -20.513 686 HH12 ARG 116 HH22 ARG 116 23.313 -13.834 -21.599 687 HH21 ARG 116 HH11 ARG 116 26.701 -14.162 -20.936 688 HH22 ARG 116 HH12 ARG 116 25.355 -14.774 -21.838 689 H CYS 117 HN CYS 117 25.342 -5.772 -17.542 690 HA CYS 117 HA CYS 117 24.133 -4.694 -15.276 691 HB2 CYS 117 HB2 CYS 117 23.461 -3.461 -17.920 692 HB3 CYS 117 HB1 CYS 117 24.072 -2.703 -16.446 693 H GLN 118 HN GLN 118 22.015 -3.996 -14.847 694 HA GLN 118 HA GLN 118 19.988 -5.863 -15.279 695 HB2 GLN 118 HB2 GLN 118 20.009 -3.003 -14.363 696 HB3 GLN 118 HB1 GLN 118 18.460 -3.800 -14.663 697 HG2 GLN 118 HG2 GLN 118 19.250 -4.004 -12.283 698 HG3 GLN 118 HG1 GLN 118 18.994 -5.558 -13.078 699 HE21 GLN 118 HE21 GLN 118 20.609 -6.867 -12.128 700 HE22 GLN 118 HE22 GLN 118 22.262 -6.478 -12.134 701 H ILE 119 HN ILE 119 21.282 -3.690 -17.488 702 HA ILE 119 HA ILE 119 18.846 -3.307 -19.050 703 HB ILE 119 HB ILE 119 21.722 -2.473 -19.461 704 HG12 ILE 119 HG12 ILE 119 20.738 -0.209 -19.119 705 HG13 ILE 119 HG11 ILE 119 19.172 -0.960 -18.813 706 HG21 ILE 119 HG21 ILE 119 20.872 -2.751 -21.668 707 HG22 ILE 119 HG22 ILE 119 20.653 -1.038 -21.311 708 HG23 ILE 119 HG23 ILE 119 19.280 -2.142 -21.213 709 HD11 ILE 119 HD11 ILE 119 20.780 -0.329 -16.801 710 HD12 ILE 119 HD12 ILE 119 21.532 -1.873 -17.195 711 HD13 ILE 119 HD13 ILE 119 19.824 -1.807 -16.752 712 H CYS 120 HN CYS 120 21.990 -4.961 -19.481 713 HA CYS 120 HA CYS 120 21.347 -6.041 -22.031 714 HB2 CYS 120 HB2 CYS 120 23.283 -7.731 -21.220 715 HB3 CYS 120 HB1 CYS 120 23.634 -6.075 -21.722 716 H VAL 121 HN VAL 121 20.745 -7.134 -18.761 717 HA VAL 121 HA VAL 121 20.070 -9.829 -19.500 718 HB VAL 121 HB VAL 121 19.324 -10.086 -17.222 719 HG11 VAL 121 HG11 VAL 121 21.766 -8.312 -17.500 720 HG12 VAL 121 HG12 VAL 121 21.720 -10.072 -17.440 721 HG13 VAL 121 HG13 VAL 121 21.329 -9.129 -16.002 722 HG21 VAL 121 HG21 VAL 121 18.006 -8.104 -16.904 723 HG22 VAL 121 HG22 VAL 121 19.399 -7.064 -17.195 724 HG23 VAL 121 HG23 VAL 121 19.315 -8.035 -15.726 725 H HIS 122 HN HIS 122 18.312 -6.810 -19.054 726 HA HIS 122 HA HIS 122 15.694 -7.869 -19.090 727 HB2 HIS 122 HB2 HIS 122 16.399 -5.515 -18.431 728 HB3 HIS 122 HB1 HIS 122 16.505 -5.162 -20.160 729 HD2 HIS 122 HD2 HIS 122 13.751 -5.837 -17.444 730 HE1 HIS 122 HE1 HIS 122 11.802 -4.902 -21.071 731 HE2 HIS 122 HE2 HIS 122 11.463 -5.317 -18.588 732 H SER 123 HN SER 123 17.977 -8.161 -21.410 733 HA SER 123 HA SER 123 16.247 -7.723 -23.729 734 HB2 SER 123 HB2 SER 123 18.174 -8.095 -25.049 735 HB3 SER 123 HB1 SER 123 18.742 -7.173 -23.660 736 HG SER 123 HG SER 123 18.969 -9.536 -22.814 737 H GLN 124 HN GLN 124 18.029 -10.423 -22.211 738 HA GLN 124 HA GLN 124 15.968 -12.283 -23.211 739 HB2 GLN 124 HB2 GLN 124 18.067 -12.171 -24.732 740 HB3 GLN 124 HB1 GLN 124 18.892 -12.999 -23.413 741 HG2 GLN 124 HG2 GLN 124 17.209 -14.811 -23.498 742 HG3 GLN 124 HG1 GLN 124 16.388 -13.982 -24.818 743 HE21 GLN 124 HE21 GLN 124 19.820 -14.880 -24.097 744 HE22 GLN 124 HE22 GLN 124 20.114 -15.527 -25.638 745 H ARG 125 HN ARG 125 16.288 -11.239 -20.607 746 HA ARG 125 HA ARG 125 16.492 -11.892 -18.407 747 HB2 ARG 125 HB2 ARG 125 15.958 -14.525 -19.791 748 HB3 ARG 125 HB1 ARG 125 16.030 -14.362 -18.033 749 HG2 ARG 125 HG2 ARG 125 14.231 -12.689 -18.097 750 HG3 ARG 125 HG1 ARG 125 14.176 -12.800 -19.857 751 HD2 ARG 125 HD2 ARG 125 13.555 -15.173 -19.703 752 HD3 ARG 125 HD1 ARG 125 13.642 -15.093 -17.946 753 HE ARG 125 HE ARG 125 11.837 -13.138 -19.022 754 HH11 ARG 125 HH21 ARG 125 12.247 -16.473 -18.197 755 HH12 ARG 125 HH22 ARG 125 10.563 -16.752 -17.910 756 HH21 ARG 125 HH11 ARG 125 9.626 -13.494 -18.643 757 HH22 ARG 125 HH12 ARG 125 9.078 -15.066 -18.160 758 H ASN 126 HN ASN 126 17.807 -14.946 -19.499 759 HA ASN 126 HA ASN 126 20.565 -14.182 -19.144 760 HB2 ASN 126 HB2 ASN 126 19.741 -14.340 -16.790 761 HB3 ASN 126 HB1 ASN 126 19.335 -16.029 -17.088 762 HD21 ASN 126 HD21 ASN 126 20.936 -16.984 -15.719 763 HD22 ASN 126 HD22 ASN 126 22.602 -16.812 -15.994 Start of MODEL 14 1 H MET 31 HT1 MET 31 -3.010 11.436 -8.368 2 HA MET 31 HA MET 31 -4.144 12.966 -6.678 3 HB2 MET 31 HB2 MET 31 -1.160 12.426 -6.751 4 HB3 MET 31 HB1 MET 31 -2.020 12.985 -5.310 5 HG2 MET 31 HG2 MET 31 -3.442 11.006 -5.339 6 HG3 MET 31 HG1 MET 31 -2.708 10.465 -6.849 7 HE1 MET 31 HE1 MET 31 -0.976 10.612 -2.648 8 HE2 MET 31 HE2 MET 31 -2.337 11.497 -3.331 9 HE3 MET 31 HE3 MET 31 -0.693 12.065 -3.616 10 H GLY 32 HN GLY 32 -1.298 14.439 -6.036 11 HA2 GLY 32 HA2 GLY 32 -2.320 17.071 -6.815 12 HA3 GLY 32 HA1 GLY 32 -0.992 16.747 -5.704 13 H LYS 33 HN LYS 33 -1.883 17.414 -8.951 14 HA LYS 33 HA LYS 33 0.850 16.927 -9.957 15 HB2 LYS 33 HB2 LYS 33 -1.758 17.532 -11.367 16 HB3 LYS 33 HB1 LYS 33 -0.200 17.410 -12.187 17 HG2 LYS 33 HG2 LYS 33 0.066 15.106 -11.351 18 HG3 LYS 33 HG1 LYS 33 -1.485 15.226 -10.520 19 HD2 LYS 33 HD2 LYS 33 -2.626 15.584 -12.672 20 HD3 LYS 33 HD1 LYS 33 -1.078 15.485 -13.513 21 HE2 LYS 33 HE2 LYS 33 -0.774 13.180 -12.708 22 HE3 LYS 33 HE1 LYS 33 -2.306 13.273 -11.841 23 HZ1 LYS 33 HZ1 LYS 33 -3.487 13.491 -13.864 24 HZ2 LYS 33 HZ2 LYS 33 -2.415 12.187 -14.069 25 HZ3 LYS 33 HZ3 LYS 33 -2.063 13.697 -14.765 26 H ASN 34 HN ASN 34 2.084 18.560 -10.844 27 HA ASN 34 HA ASN 34 1.096 21.284 -10.973 28 HB2 ASN 34 HB2 ASN 34 1.679 20.963 -8.559 29 HB3 ASN 34 HB1 ASN 34 3.340 20.617 -9.054 30 HD21 ASN 34 HD21 ASN 34 0.829 23.159 -9.618 31 HD22 ASN 34 HD22 ASN 34 1.930 24.450 -9.574 32 H ASP 35 HN ASP 35 2.957 22.790 -11.597 33 HA ASP 35 HA ASP 35 4.185 21.805 -13.937 34 HB2 ASP 35 HB2 ASP 35 4.655 24.292 -12.286 35 HB3 ASP 35 HB1 ASP 35 5.517 23.969 -13.795 36 H ASN 36 HN ASN 36 5.394 22.294 -10.652 37 HA ASN 36 HA ASN 36 8.119 21.754 -11.163 38 HB2 ASN 36 HB2 ASN 36 6.539 21.254 -8.629 39 HB3 ASN 36 HB1 ASN 36 8.298 21.349 -8.756 40 HD21 ASN 36 HD21 ASN 36 5.850 23.165 -7.654 41 HD22 ASN 36 HD22 ASN 36 6.388 24.717 -8.076 42 H ASP 37 HN ASP 37 5.369 19.668 -10.455 43 HA ASP 37 HA ASP 37 6.856 17.274 -10.098 44 HB2 ASP 37 HB2 ASP 37 4.473 17.644 -9.379 45 HB3 ASP 37 HB1 ASP 37 4.007 17.522 -11.075 46 H ALA 38 HN ALA 38 7.221 19.045 -12.610 47 HA ALA 38 HA ALA 38 6.422 17.792 -14.921 48 HB1 ALA 38 HB1 ALA 38 7.557 19.775 -15.323 49 HB2 ALA 38 HB2 ALA 38 8.794 18.601 -15.768 50 HB3 ALA 38 HB3 ALA 38 8.847 19.384 -14.189 51 H LEU 39 HN LEU 39 8.250 16.707 -16.432 52 HA LEU 39 HA LEU 39 9.618 14.557 -14.946 53 HB2 LEU 39 HB2 LEU 39 7.685 14.144 -17.225 54 HB3 LEU 39 HB1 LEU 39 8.758 12.901 -16.603 55 HG LEU 39 HG LEU 39 6.745 14.381 -14.880 56 HD11 LEU 39 HD11 LEU 39 5.587 13.105 -16.638 57 HD12 LEU 39 HD12 LEU 39 5.336 12.377 -15.053 58 HD13 LEU 39 HD13 LEU 39 6.485 11.659 -16.181 59 HD21 LEU 39 HD21 LEU 39 8.641 12.097 -14.464 60 HD22 LEU 39 HD22 LEU 39 7.142 12.135 -13.545 61 HD23 LEU 39 HD23 LEU 39 8.295 13.457 -13.402 62 H ILE 40 HN ILE 40 11.645 14.891 -15.472 63 HA ILE 40 HA ILE 40 12.342 15.545 -18.281 64 HB ILE 40 HB ILE 40 13.977 15.899 -15.759 65 HG12 ILE 40 HG12 ILE 40 12.103 17.477 -15.881 66 HG13 ILE 40 HG11 ILE 40 13.624 18.318 -16.177 67 HG21 ILE 40 HG21 ILE 40 14.534 16.464 -18.673 68 HG22 ILE 40 HG22 ILE 40 15.504 15.528 -17.538 69 HG23 ILE 40 HG23 ILE 40 15.407 17.281 -17.378 70 HD11 ILE 40 HD11 ILE 40 12.322 19.184 -17.892 71 HD12 ILE 40 HD12 ILE 40 11.388 17.701 -18.080 72 HD13 ILE 40 HD13 ILE 40 13.024 17.796 -18.723 73 H MET 41 HN MET 41 14.006 14.420 -19.309 74 HA MET 41 HA MET 41 14.258 11.634 -18.463 75 HB2 MET 41 HB2 MET 41 13.690 12.254 -20.820 76 HB3 MET 41 HB1 MET 41 15.282 13.001 -20.964 77 HG2 MET 41 HG2 MET 41 16.369 10.871 -20.484 78 HG3 MET 41 HG1 MET 41 14.800 10.103 -20.217 79 HE1 MET 41 HE1 MET 41 16.779 8.768 -22.178 80 HE2 MET 41 HE2 MET 41 15.638 8.352 -23.453 81 HE3 MET 41 HE3 MET 41 15.138 8.258 -21.766 82 H CYS 42 HN CYS 42 16.066 10.718 -17.716 83 HA CYS 42 HA CYS 42 18.235 12.414 -16.876 84 HB2 CYS 42 HB2 CYS 42 17.236 10.294 -15.710 85 HB3 CYS 42 HB1 CYS 42 18.311 9.405 -16.789 86 H MET 43 HN MET 43 20.376 12.332 -17.584 87 HA MET 43 HA MET 43 20.685 11.449 -20.376 88 HB2 MET 43 HB2 MET 43 22.913 12.735 -20.097 89 HB3 MET 43 HB1 MET 43 21.416 13.665 -20.120 90 HG2 MET 43 HG2 MET 43 21.387 13.778 -17.695 91 HG3 MET 43 HG1 MET 43 22.807 12.732 -17.592 92 HE1 MET 43 HE1 MET 43 24.903 13.097 -18.526 93 HE2 MET 43 HE2 MET 43 25.739 14.643 -18.620 94 HE3 MET 43 HE3 MET 43 24.843 14.052 -20.014 95 H ARG 44 HN ARG 44 21.285 10.235 -17.319 96 HA ARG 44 HA ARG 44 23.658 8.692 -18.190 97 HB2 ARG 44 HB2 ARG 44 23.733 10.071 -16.065 98 HB3 ARG 44 HB1 ARG 44 22.563 8.940 -15.400 99 HG2 ARG 44 HG2 ARG 44 24.092 7.071 -15.786 100 HG3 ARG 44 HG1 ARG 44 25.253 8.156 -16.547 101 HD2 ARG 44 HD2 ARG 44 25.373 9.437 -14.396 102 HD3 ARG 44 HD1 ARG 44 24.350 8.206 -13.658 103 HE ARG 44 HE ARG 44 26.654 7.065 -14.932 104 HH11 ARG 44 HH21 ARG 44 25.485 8.724 -12.130 105 HH12 ARG 44 HH22 ARG 44 26.704 8.093 -11.075 106 HH21 ARG 44 HH11 ARG 44 28.259 6.231 -13.555 107 HH22 ARG 44 HH12 ARG 44 28.275 6.681 -11.882 108 H CYS 45 HN CYS 45 20.808 8.136 -16.086 109 HA CYS 45 HA CYS 45 20.810 5.309 -16.899 110 HB2 CYS 45 HB2 CYS 45 19.386 4.924 -15.010 111 HB3 CYS 45 HB1 CYS 45 20.686 5.985 -14.471 112 H ARG 46 HN ARG 46 19.427 8.139 -17.929 113 HA ARG 46 HA ARG 46 17.608 8.655 -19.229 114 HB2 ARG 46 HB2 ARG 46 17.823 5.712 -19.835 115 HB3 ARG 46 HB1 ARG 46 16.821 6.855 -20.742 116 HG2 ARG 46 HG2 ARG 46 18.836 8.205 -21.247 117 HG3 ARG 46 HG1 ARG 46 19.827 7.039 -20.374 118 HD2 ARG 46 HD2 ARG 46 18.075 6.314 -22.729 119 HD3 ARG 46 HD1 ARG 46 19.789 6.699 -22.869 120 HE ARG 46 HE ARG 46 19.576 4.715 -20.922 121 HH11 ARG 46 HH21 ARG 46 18.843 5.159 -24.275 122 HH12 ARG 46 HH22 ARG 46 19.092 3.497 -24.692 123 HH21 ARG 46 HH11 ARG 46 19.902 2.532 -21.463 124 HH22 ARG 46 HH12 ARG 46 19.689 2.010 -23.100 125 H LYS 47 HN LYS 47 17.136 7.888 -16.426 126 HA LYS 47 HA LYS 47 14.505 6.593 -16.506 127 HB2 LYS 47 HB2 LYS 47 16.179 6.030 -14.731 128 HB3 LYS 47 HB1 LYS 47 16.016 7.679 -14.122 129 HG2 LYS 47 HG2 LYS 47 13.640 7.335 -13.715 130 HG3 LYS 47 HG1 LYS 47 13.723 5.724 -14.427 131 HD2 LYS 47 HD2 LYS 47 15.339 5.048 -12.671 132 HD3 LYS 47 HD1 LYS 47 15.189 6.647 -11.939 133 HE2 LYS 47 HE2 LYS 47 12.866 4.750 -12.381 134 HE3 LYS 47 HE1 LYS 47 13.729 4.924 -10.851 135 HZ1 LYS 47 HZ1 LYS 47 12.514 7.228 -12.253 136 HZ2 LYS 47 HZ2 LYS 47 13.034 7.135 -10.639 137 HZ3 LYS 47 HZ3 LYS 47 11.646 6.292 -11.137 138 H VAL 48 HN VAL 48 12.720 7.734 -16.753 139 HA VAL 48 HA VAL 48 12.747 10.636 -16.495 140 HB VAL 48 HB VAL 48 10.244 10.227 -17.201 141 HG11 VAL 48 HG11 VAL 48 11.857 11.216 -18.705 142 HG12 VAL 48 HG12 VAL 48 11.012 9.941 -19.584 143 HG13 VAL 48 HG13 VAL 48 12.641 9.657 -18.970 144 HG21 VAL 48 HG21 VAL 48 9.774 8.116 -18.185 145 HG22 VAL 48 HG22 VAL 48 10.552 7.720 -16.652 146 HG23 VAL 48 HG23 VAL 48 11.471 7.633 -18.157 147 H LYS 49 HN LYS 49 11.904 11.775 -14.894 148 HA LYS 49 HA LYS 49 9.874 10.827 -13.133 149 HB2 LYS 49 HB2 LYS 49 12.624 10.203 -12.444 150 HB3 LYS 49 HB1 LYS 49 11.917 11.272 -11.238 151 HG2 LYS 49 HG2 LYS 49 10.455 8.797 -12.189 152 HG3 LYS 49 HG1 LYS 49 11.618 8.731 -10.873 153 HD2 LYS 49 HD2 LYS 49 10.350 10.436 -9.641 154 HD3 LYS 49 HD1 LYS 49 9.185 10.538 -10.957 155 HE2 LYS 49 HE2 LYS 49 8.614 8.158 -10.640 156 HE3 LYS 49 HE1 LYS 49 9.774 8.064 -9.313 157 HZ1 LYS 49 HZ1 LYS 49 7.206 8.644 -8.972 158 HZ2 LYS 49 HZ2 LYS 49 7.829 10.213 -9.154 159 HZ3 LYS 49 HZ3 LYS 49 8.428 9.194 -7.934 160 H GLY 50 HN GLY 50 9.690 12.378 -11.203 161 HA2 GLY 50 HA2 GLY 50 10.092 15.134 -12.202 162 HA3 GLY 50 HA1 GLY 50 8.847 14.623 -11.066 163 H ILE 51 HN ILE 51 9.790 16.566 -9.914 164 HA ILE 51 HA ILE 51 12.329 16.723 -8.847 165 HB ILE 51 HB ILE 51 10.533 18.440 -8.632 166 HG12 ILE 51 HG12 ILE 51 11.656 17.671 -5.928 167 HG13 ILE 51 HG11 ILE 51 12.654 18.363 -7.208 168 HG21 ILE 51 HG21 ILE 51 9.587 16.765 -6.300 169 HG22 ILE 51 HG22 ILE 51 8.810 16.731 -7.883 170 HG23 ILE 51 HG23 ILE 51 8.845 18.227 -6.949 171 HD11 ILE 51 HD11 ILE 51 10.213 19.622 -5.934 172 HD12 ILE 51 HD12 ILE 51 11.076 20.298 -7.314 173 HD13 ILE 51 HD13 ILE 51 11.885 20.154 -5.756 174 H ASP 52 HN ASP 52 10.159 14.198 -8.316 175 HA ASP 52 HA ASP 52 10.744 13.576 -5.590 176 HB2 ASP 52 HB2 ASP 52 8.754 12.710 -6.726 177 HB3 ASP 52 HB1 ASP 52 9.774 11.824 -7.856 178 H SER 53 HN SER 53 11.965 12.416 -8.701 179 HA SER 53 HA SER 53 14.147 10.954 -7.339 180 HB2 SER 53 HB2 SER 53 12.661 10.104 -9.381 181 HB3 SER 53 HB1 SER 53 13.934 10.893 -10.310 182 HG SER 53 HG SER 53 14.811 9.392 -8.182 183 H TYR 54 HN TYR 54 13.680 14.004 -8.263 184 HA TYR 54 HA TYR 54 16.506 14.404 -9.078 185 HB2 TYR 54 HB2 TYR 54 13.969 15.478 -10.194 186 HB3 TYR 54 HB1 TYR 54 15.276 16.646 -9.999 187 HD1 TYR 54 HD1 TYR 54 14.670 13.168 -11.321 188 HD2 TYR 54 HD2 TYR 54 16.879 16.832 -11.678 189 HE1 TYR 54 HE1 TYR 54 15.792 12.297 -13.350 190 HE2 TYR 54 HE2 TYR 54 17.994 15.961 -13.688 191 HH TYR 54 HH TYR 54 17.549 14.247 -15.464 192 H SER 55 HN SER 55 17.682 15.743 -7.882 193 HA SER 55 HA SER 55 16.778 16.706 -5.397 194 HB2 SER 55 HB2 SER 55 19.147 16.208 -5.904 195 HB3 SER 55 HB1 SER 55 19.185 17.571 -7.025 196 HG SER 55 HG SER 55 19.731 18.629 -5.284 197 H LYS 56 HN LYS 56 16.597 18.917 -4.706 198 HA LYS 56 HA LYS 56 14.871 20.466 -6.292 199 HB2 LYS 56 HB2 LYS 56 16.564 21.224 -3.901 200 HB3 LYS 56 HB1 LYS 56 15.309 22.251 -4.596 201 HG2 LYS 56 HG2 LYS 56 13.635 20.481 -4.199 202 HG3 LYS 56 HG1 LYS 56 14.888 19.455 -3.500 203 HD2 LYS 56 HD2 LYS 56 15.289 21.104 -1.731 204 HD3 LYS 56 HD1 LYS 56 14.085 22.182 -2.443 205 HE2 LYS 56 HE2 LYS 56 13.087 20.933 -0.584 206 HE3 LYS 56 HE1 LYS 56 12.354 20.431 -2.108 207 HZ1 LYS 56 HZ1 LYS 56 13.477 18.436 -2.094 208 HZ2 LYS 56 HZ2 LYS 56 13.146 18.651 -0.442 209 HZ3 LYS 56 HZ3 LYS 56 14.694 18.991 -1.052 210 H THR 57 HN THR 57 18.366 20.681 -5.735 211 HA THR 57 HA THR 57 18.805 23.117 -7.087 212 HB THR 57 HB THR 57 20.734 20.799 -6.920 213 HG1 THR 57 HG1 THR 57 20.241 22.876 -5.053 214 HG21 THR 57 HG21 THR 57 21.075 23.804 -7.113 215 HG22 THR 57 HG22 THR 57 21.468 22.620 -8.360 216 HG23 THR 57 HG23 THR 57 22.394 22.660 -6.860 217 H GLN 58 HN GLN 58 19.041 19.748 -8.253 218 HA GLN 58 HA GLN 58 19.802 20.349 -10.892 219 HB2 GLN 58 HB2 GLN 58 18.254 18.007 -9.763 220 HB3 GLN 58 HB1 GLN 58 18.906 18.068 -11.401 221 HG2 GLN 58 HG2 GLN 58 21.172 18.311 -10.537 222 HG3 GLN 58 HG1 GLN 58 20.563 18.395 -8.885 223 HE21 GLN 58 HE21 GLN 58 22.019 16.281 -10.969 224 HE22 GLN 58 HE22 GLN 58 21.401 14.814 -10.367 225 H TRP 59 HN TRP 59 16.604 19.859 -9.452 226 HA TRP 59 HA TRP 59 15.125 20.074 -11.825 227 HB2 TRP 59 HB2 TRP 59 14.459 19.512 -9.256 228 HB3 TRP 59 HB1 TRP 59 13.892 21.179 -9.327 229 HD1 TRP 59 HD1 TRP 59 11.411 21.243 -9.954 230 HE1 TRP 59 HE1 TRP 59 9.863 19.856 -11.491 231 HE3 TRP 59 HE3 TRP 59 14.750 17.842 -11.761 232 HZ2 TRP 59 HZ2 TRP 59 10.034 17.616 -13.226 233 HZ3 TRP 59 HZ3 TRP 59 14.039 16.093 -13.345 234 HH2 TRP 59 HH2 TRP 59 11.680 15.975 -14.084 235 H SER 60 HN SER 60 16.327 22.526 -9.598 236 HA SER 60 HA SER 60 14.951 24.743 -10.718 237 HB2 SER 60 HB2 SER 60 17.620 24.807 -9.311 238 HB3 SER 60 HB1 SER 60 16.442 26.109 -9.434 239 HG SER 60 HG SER 60 15.097 25.020 -8.087 240 H LYS 61 HN LYS 61 17.680 22.920 -11.762 241 HA LYS 61 HA LYS 61 18.821 25.013 -13.406 242 HB2 LYS 61 HB2 LYS 61 19.331 22.039 -13.255 243 HB3 LYS 61 HB1 LYS 61 20.186 23.121 -14.345 244 HG2 LYS 61 HG2 LYS 61 20.977 24.450 -12.446 245 HG3 LYS 61 HG1 LYS 61 20.067 23.431 -11.341 246 HD2 LYS 61 HD2 LYS 61 22.304 22.594 -11.279 247 HD3 LYS 61 HD1 LYS 61 21.377 21.447 -12.246 248 HE2 LYS 61 HE2 LYS 61 22.777 23.716 -13.637 249 HE3 LYS 61 HE1 LYS 61 23.710 22.317 -13.115 250 HZ1 LYS 61 HZ1 LYS 61 22.832 21.059 -14.703 251 HZ2 LYS 61 HZ2 LYS 61 22.277 22.500 -15.412 252 HZ3 LYS 61 HZ3 LYS 61 21.255 21.599 -14.396 253 H THR 62 HN THR 62 16.396 22.559 -13.725 254 HA THR 62 HA THR 62 16.397 22.351 -16.563 255 HB THR 62 HB THR 62 14.217 21.294 -16.303 256 HG1 THR 62 HG1 THR 62 14.021 21.387 -13.639 257 HG21 THR 62 HG21 THR 62 16.245 20.590 -14.171 258 HG22 THR 62 HG22 THR 62 16.115 19.902 -15.789 259 HG23 THR 62 HG23 THR 62 14.868 19.570 -14.587 260 H PHE 63 HN PHE 63 15.612 24.916 -14.586 261 HA PHE 63 HA PHE 63 13.699 26.068 -16.502 262 HB2 PHE 63 HB2 PHE 63 14.228 26.763 -13.604 263 HB3 PHE 63 HB1 PHE 63 13.092 27.612 -14.653 264 HD1 PHE 63 HD2 PHE 63 11.088 26.440 -15.540 265 HD2 PHE 63 HD1 PHE 63 13.719 24.617 -12.689 266 HE1 PHE 63 HE2 PHE 63 9.353 24.732 -15.032 267 HE2 PHE 63 HE1 PHE 63 11.996 22.910 -12.173 268 HZ PHE 63 HZ PHE 63 9.812 22.967 -13.346 269 H THR 64 HN THR 64 13.859 28.584 -16.346 270 HA THR 64 HA THR 64 16.563 29.607 -16.148 271 HB THR 64 HB THR 64 15.940 30.447 -18.741 272 HG1 THR 64 HG1 THR 64 14.461 28.389 -18.290 273 HG21 THR 64 HG21 THR 64 17.657 28.091 -17.893 274 HG22 THR 64 HG22 THR 64 18.177 29.773 -17.970 275 HG23 THR 64 HG23 THR 64 17.749 28.916 -19.449 276 H PHE 65 HN PHE 65 16.659 31.843 -16.185 277 HA PHE 65 HA PHE 65 14.056 33.203 -15.851 278 HB2 PHE 65 HB2 PHE 65 16.434 33.160 -14.240 279 HB3 PHE 65 HB1 PHE 65 16.258 34.795 -14.865 280 HD1 PHE 65 HD1 PHE 65 13.525 35.407 -14.989 281 HD2 PHE 65 HD2 PHE 65 15.518 32.940 -12.093 282 HE1 PHE 65 HE1 PHE 65 11.708 35.840 -13.363 283 HE2 PHE 65 HE2 PHE 65 13.697 33.378 -10.467 284 HZ PHE 65 HZ PHE 65 11.792 34.832 -11.111 285 H VAL 66 HN VAL 66 13.535 34.890 -17.084 286 HA VAL 66 HA VAL 66 15.582 36.056 -18.873 287 HB VAL 66 HB VAL 66 12.847 35.017 -19.627 288 HG11 VAL 66 HG11 VAL 66 12.908 37.139 -20.688 289 HG12 VAL 66 HG12 VAL 66 13.501 36.023 -21.917 290 HG13 VAL 66 HG13 VAL 66 14.638 37.019 -21.009 291 HG21 VAL 66 HG21 VAL 66 15.551 34.585 -20.911 292 HG22 VAL 66 HG22 VAL 66 14.067 33.680 -21.197 293 HG23 VAL 66 HG23 VAL 66 14.910 33.528 -19.654 294 H ARG 67 HN ARG 67 15.748 38.107 -18.260 295 HA ARG 67 HA ARG 67 15.179 40.166 -17.366 296 HB2 ARG 67 HB2 ARG 67 13.022 39.734 -19.443 297 HB3 ARG 67 HB1 ARG 67 13.438 41.297 -18.729 298 HG2 ARG 67 HG2 ARG 67 15.776 41.009 -19.548 299 HG3 ARG 67 HG1 ARG 67 15.289 39.505 -20.332 300 HD2 ARG 67 HD2 ARG 67 14.031 42.205 -20.891 301 HD3 ARG 67 HD1 ARG 67 15.293 41.472 -21.885 302 HE ARG 67 HE ARG 67 12.495 40.693 -21.779 303 HH11 ARG 67 HH21 ARG 67 15.751 39.824 -22.565 304 HH12 ARG 67 HH22 ARG 67 15.296 38.611 -23.715 305 HH21 ARG 67 HH11 ARG 67 11.890 39.105 -23.289 306 HH22 ARG 67 HH12 ARG 67 13.110 38.204 -24.125 307 H GLY 68 HN GLY 68 14.233 38.143 -15.669 308 HA2 GLY 68 HA2 GLY 68 12.913 38.114 -13.765 309 HA3 GLY 68 HA1 GLY 68 12.087 39.560 -14.350 310 H ARG 69 HN ARG 69 12.359 36.884 -16.520 311 HA ARG 69 HA ARG 69 9.511 36.184 -16.049 312 HB2 ARG 69 HB2 ARG 69 10.095 37.424 -18.220 313 HB3 ARG 69 HB1 ARG 69 10.943 35.958 -18.693 314 HG2 ARG 69 HG2 ARG 69 8.846 35.526 -19.598 315 HG3 ARG 69 HG1 ARG 69 8.664 34.779 -18.015 316 HD2 ARG 69 HD2 ARG 69 7.644 36.902 -17.178 317 HD3 ARG 69 HD1 ARG 69 7.755 37.563 -18.804 318 HE ARG 69 HE ARG 69 5.892 35.518 -17.873 319 HH11 ARG 69 HH21 ARG 69 7.393 37.167 -20.522 320 HH12 ARG 69 HH22 ARG 69 6.138 36.778 -21.651 321 HH21 ARG 69 HH11 ARG 69 4.254 35.003 -19.343 322 HH22 ARG 69 HH12 ARG 69 4.358 35.549 -20.982 323 H THR 70 HN THR 70 9.186 34.177 -15.415 324 HA THR 70 HA THR 70 11.312 32.258 -15.305 325 HB THR 70 HB THR 70 8.349 31.848 -14.840 326 HG1 THR 70 HG1 THR 70 10.275 33.168 -13.451 327 HG21 THR 70 HG21 THR 70 10.823 30.288 -14.059 328 HG22 THR 70 HG22 THR 70 9.495 29.743 -15.084 329 HG23 THR 70 HG23 THR 70 9.228 30.003 -13.361 330 H VAL 71 HN VAL 71 11.915 30.868 -16.829 331 HA VAL 71 HA VAL 71 9.956 29.948 -18.835 332 HB VAL 71 HB VAL 71 11.730 30.224 -20.593 333 HG11 VAL 71 HG11 VAL 71 11.292 32.602 -20.914 334 HG12 VAL 71 HG12 VAL 71 10.879 32.785 -19.209 335 HG13 VAL 71 HG13 VAL 71 9.840 31.832 -20.271 336 HG21 VAL 71 HG21 VAL 71 13.023 32.063 -18.558 337 HG22 VAL 71 HG22 VAL 71 13.621 31.642 -20.162 338 HG23 VAL 71 HG23 VAL 71 13.606 30.434 -18.886 339 H SER 72 HN SER 72 10.196 27.856 -19.461 340 HA SER 72 HA SER 72 11.956 26.200 -17.885 341 HB2 SER 72 HB2 SER 72 9.674 25.462 -18.424 342 HB3 SER 72 HB1 SER 72 10.093 25.454 -20.137 343 HG SER 72 HG SER 72 11.941 24.052 -19.236 344 H VAL 73 HN VAL 73 13.660 24.893 -18.661 345 HA VAL 73 HA VAL 73 15.170 26.046 -20.791 346 HB VAL 73 HB VAL 73 15.586 23.463 -19.286 347 HG11 VAL 73 HG11 VAL 73 17.292 25.046 -21.216 348 HG12 VAL 73 HG12 VAL 73 16.897 23.331 -21.269 349 HG13 VAL 73 HG13 VAL 73 18.008 23.941 -20.046 350 HG21 VAL 73 HG21 VAL 73 15.534 25.723 -18.033 351 HG22 VAL 73 HG22 VAL 73 17.024 26.089 -18.894 352 HG23 VAL 73 HG23 VAL 73 16.953 24.707 -17.804 353 H SER 74 HN SER 74 15.349 25.415 -22.905 354 HA SER 74 HA SER 74 13.351 23.782 -24.070 355 HB2 SER 74 HB2 SER 74 14.303 25.434 -25.462 356 HB3 SER 74 HB1 SER 74 15.946 24.915 -25.095 357 HG SER 74 HG SER 74 15.199 24.163 -27.140 358 H ASP 75 HN ASP 75 16.775 23.170 -23.339 359 HA ASP 75 HA ASP 75 16.245 20.286 -23.325 360 HB2 ASP 75 HB2 ASP 75 18.424 21.538 -25.011 361 HB3 ASP 75 HB1 ASP 75 18.153 19.806 -24.781 362 HA PRO 76 HA PRO 76 19.171 21.657 -20.036 363 HB2 PRO 76 HB2 PRO 76 17.848 20.660 -17.891 364 HB3 PRO 76 HB1 PRO 76 17.414 22.208 -18.633 365 HG2 PRO 76 HG2 PRO 76 16.083 19.558 -18.879 366 HG3 PRO 76 HG1 PRO 76 15.366 21.178 -18.815 367 HD2 PRO 76 HD2 PRO 76 15.788 19.702 -21.165 368 HD3 PRO 76 HD1 PRO 76 15.522 21.457 -21.105 369 H LYS 77 HN LYS 77 20.747 20.432 -18.974 370 HA LYS 77 HA LYS 77 20.620 17.489 -19.364 371 HB2 LYS 77 HB2 LYS 77 22.950 19.394 -19.611 372 HB3 LYS 77 HB1 LYS 77 23.141 17.645 -19.477 373 HG2 LYS 77 HG2 LYS 77 21.740 17.329 -21.471 374 HG3 LYS 77 HG1 LYS 77 21.528 19.076 -21.604 375 HD2 LYS 77 HD2 LYS 77 23.925 19.382 -21.929 376 HD3 LYS 77 HD1 LYS 77 24.201 17.654 -21.697 377 HE2 LYS 77 HE2 LYS 77 22.828 17.154 -23.665 378 HE3 LYS 77 HE1 LYS 77 22.515 18.873 -23.897 379 HZ1 LYS 77 HZ1 LYS 77 25.306 18.058 -23.689 380 HZ2 LYS 77 HZ2 LYS 77 24.592 19.247 -24.671 381 HZ3 LYS 77 HZ3 LYS 77 24.492 17.609 -25.107 382 H VAL 78 HN VAL 78 20.129 16.714 -17.437 383 HA VAL 78 HA VAL 78 21.982 17.194 -15.222 384 HB VAL 78 HB VAL 78 19.905 17.353 -13.672 385 HG11 VAL 78 HG11 VAL 78 20.631 19.671 -15.492 386 HG12 VAL 78 HG12 VAL 78 21.533 19.180 -14.058 387 HG13 VAL 78 HG13 VAL 78 19.892 19.803 -13.895 388 HG21 VAL 78 HG21 VAL 78 18.631 18.601 -16.110 389 HG22 VAL 78 HG22 VAL 78 17.877 18.123 -14.585 390 HG23 VAL 78 HG23 VAL 78 18.381 16.893 -15.749 391 H ILE 79 HN ILE 79 21.773 15.588 -13.515 392 HA ILE 79 HA ILE 79 20.720 13.015 -14.545 393 HB ILE 79 HB ILE 79 22.372 12.037 -12.870 394 HG12 ILE 79 HG12 ILE 79 23.436 14.877 -12.959 395 HG13 ILE 79 HG11 ILE 79 22.659 14.134 -11.562 396 HG21 ILE 79 HG21 ILE 79 23.490 13.730 -15.121 397 HG22 ILE 79 HG22 ILE 79 22.775 12.130 -15.314 398 HG23 ILE 79 HG23 ILE 79 24.267 12.324 -14.395 399 HD11 ILE 79 HD11 ILE 79 25.254 13.307 -12.879 400 HD12 ILE 79 HD12 ILE 79 24.416 12.302 -11.698 401 HD13 ILE 79 HD13 ILE 79 25.024 13.892 -11.230 402 H CYS 80 HN CYS 80 19.907 11.505 -12.919 403 HA CYS 80 HA CYS 80 18.107 12.843 -11.093 404 HB2 CYS 80 HB2 CYS 80 17.185 10.626 -10.695 405 HB3 CYS 80 HB1 CYS 80 17.399 10.870 -12.430 406 H ARG 81 HN ARG 81 17.851 11.977 -8.834 407 HA ARG 81 HA ARG 81 20.196 12.439 -7.350 408 HB2 ARG 81 HB2 ARG 81 17.560 11.169 -6.595 409 HB3 ARG 81 HB1 ARG 81 18.845 11.483 -5.429 410 HG2 ARG 81 HG2 ARG 81 18.801 13.868 -5.976 411 HG3 ARG 81 HG1 ARG 81 17.575 13.580 -7.207 412 HD2 ARG 81 HD2 ARG 81 16.516 14.386 -5.151 413 HD3 ARG 81 HD1 ARG 81 16.041 12.719 -5.465 414 HE ARG 81 HE ARG 81 17.234 12.062 -3.568 415 HH11 ARG 81 HH21 ARG 81 17.945 15.331 -4.456 416 HH12 ARG 81 HH22 ARG 81 18.804 15.686 -2.996 417 HH21 ARG 81 HH11 ARG 81 18.361 12.520 -1.652 418 HH22 ARG 81 HH12 ARG 81 19.040 14.094 -1.407 419 H THR 82 HN THR 82 18.619 9.410 -8.338 420 HA THR 82 HA THR 82 20.240 7.665 -6.827 421 HB THR 82 HB THR 82 19.486 5.946 -8.459 422 HG1 THR 82 HG1 THR 82 19.458 7.123 -10.332 423 HG21 THR 82 HG21 THR 82 17.226 7.819 -7.737 424 HG22 THR 82 HG22 THR 82 18.058 6.829 -6.539 425 HG23 THR 82 HG23 THR 82 17.174 6.061 -7.858 426 H CYS 83 HN CYS 83 20.729 9.304 -9.878 427 HA CYS 83 HA CYS 83 22.985 7.710 -10.684 428 HB2 CYS 83 HB2 CYS 83 21.618 10.171 -11.687 429 HB3 CYS 83 HB1 CYS 83 23.273 9.863 -12.229 430 H GLN 84 HN GLN 84 22.501 10.295 -8.497 431 HA GLN 84 HA GLN 84 25.399 10.498 -8.066 432 HB2 GLN 84 HB2 GLN 84 25.088 13.010 -7.789 433 HB3 GLN 84 HB1 GLN 84 25.075 12.394 -9.440 434 HG2 GLN 84 HG2 GLN 84 22.789 12.727 -9.705 435 HG3 GLN 84 HG1 GLN 84 22.455 12.596 -7.977 436 HE21 GLN 84 HE21 GLN 84 25.071 14.650 -9.162 437 HE22 GLN 84 HE22 GLN 84 24.316 16.126 -8.802 438 HA PRO 85 HA PRO 85 22.819 10.325 -4.197 439 HB2 PRO 85 HB2 PRO 85 23.774 7.980 -3.185 440 HB3 PRO 85 HB1 PRO 85 22.441 8.046 -4.359 441 HG2 PRO 85 HG2 PRO 85 25.305 7.353 -4.785 442 HG3 PRO 85 HG1 PRO 85 23.855 6.699 -5.564 443 HD2 PRO 85 HD2 PRO 85 25.547 8.620 -6.697 444 HD3 PRO 85 HD1 PRO 85 23.872 8.316 -7.209 445 H LYS 86 HN LYS 86 23.641 11.726 -2.761 446 HA LYS 86 HA LYS 86 26.502 11.829 -2.219 447 HB2 LYS 86 HB2 LYS 86 25.953 13.835 -0.922 448 HB3 LYS 86 HB1 LYS 86 25.232 13.917 -2.530 449 HG2 LYS 86 HG2 LYS 86 23.084 13.096 -1.584 450 HG3 LYS 86 HG1 LYS 86 23.809 13.101 0.024 451 HD2 LYS 86 HD2 LYS 86 24.241 15.523 -0.176 452 HD3 LYS 86 HD1 LYS 86 23.503 15.519 -1.778 453 HE2 LYS 86 HE2 LYS 86 21.377 14.729 -0.796 454 HE3 LYS 86 HE1 LYS 86 22.114 14.756 0.806 455 HZ1 LYS 86 HZ1 LYS 86 20.786 16.770 0.194 456 HZ2 LYS 86 HZ2 LYS 86 21.986 17.137 -0.952 457 HZ3 LYS 86 HZ3 LYS 86 22.376 17.082 0.700 458 H GLN 87 HN GLN 87 23.826 10.209 -0.985 459 HA GLN 87 HA GLN 87 25.303 9.505 1.463 460 HB2 GLN 87 HB2 GLN 87 23.725 11.293 2.105 461 HB3 GLN 87 HB1 GLN 87 22.391 10.343 1.438 462 HG2 GLN 87 HG2 GLN 87 22.752 8.580 3.046 463 HG3 GLN 87 HG1 GLN 87 24.238 9.334 3.618 464 HE21 GLN 87 HE21 GLN 87 22.086 8.767 5.406 465 HE22 GLN 87 HE22 GLN 87 21.429 10.238 5.939 466 H HIS 88 HN HIS 88 24.619 7.506 2.405 467 HA HIS 88 HA HIS 88 22.718 5.841 0.971 468 HB2 HIS 88 HB2 HIS 88 24.855 5.655 -0.337 469 HB3 HIS 88 HB1 HIS 88 25.618 4.991 1.113 470 HD2 HIS 88 HD2 HIS 88 22.952 3.922 -1.579 471 HE1 HIS 88 HE1 HIS 88 23.772 0.583 0.872 472 HE2 HIS 88 HE2 HIS 88 22.565 1.365 -1.221 473 H ASP 89 HN ASP 89 22.293 3.838 2.071 474 HA ASP 89 HA ASP 89 22.601 4.079 4.952 475 HB2 ASP 89 HB2 ASP 89 21.112 2.138 3.174 476 HB3 ASP 89 HB1 ASP 89 21.168 1.987 4.930 477 H SER 90 HN SER 90 22.831 1.665 5.968 478 HA SER 90 HA SER 90 25.541 1.013 5.819 479 HB2 SER 90 HB2 SER 90 23.117 -0.438 6.860 480 HB3 SER 90 HB1 SER 90 24.705 -1.208 6.892 481 HG SER 90 HG SER 90 24.976 -0.092 8.649 482 H ILE 91 HN ILE 91 26.280 -1.328 5.299 483 HA ILE 91 HA ILE 91 25.169 -2.173 2.678 484 HB ILE 91 HB ILE 91 28.076 -2.025 3.510 485 HG12 ILE 91 HG12 ILE 91 26.658 -0.539 1.287 486 HG13 ILE 91 HG11 ILE 91 26.810 0.133 2.912 487 HG21 ILE 91 HG21 ILE 91 27.721 -3.928 2.069 488 HG22 ILE 91 HG22 ILE 91 28.418 -2.636 1.082 489 HG23 ILE 91 HG23 ILE 91 26.690 -2.984 0.992 490 HD11 ILE 91 HD11 ILE 91 28.651 0.961 1.583 491 HD12 ILE 91 HD12 ILE 91 29.062 -0.672 1.063 492 HD13 ILE 91 HD13 ILE 91 29.295 -0.199 2.743 493 H TRP 92 HN TRP 92 24.734 -4.277 2.501 494 HA TRP 92 HA TRP 92 25.168 -6.006 4.799 495 HB2 TRP 92 HB2 TRP 92 23.005 -5.966 3.535 496 HB3 TRP 92 HB1 TRP 92 23.858 -6.656 2.149 497 HD1 TRP 92 HD1 TRP 92 25.227 -9.049 2.759 498 HE1 TRP 92 HE1 TRP 92 24.386 -11.025 4.168 499 HE3 TRP 92 HE3 TRP 92 21.536 -6.717 5.392 500 HZ2 TRP 92 HZ2 TRP 92 22.402 -11.549 6.165 501 HZ3 TRP 92 HZ3 TRP 92 20.184 -7.976 7.045 502 HH2 TRP 92 HH2 TRP 92 20.612 -10.387 7.435 503 H CYS 93 HN CYS 93 26.855 -7.308 5.017 504 HA CYS 93 HA CYS 93 28.655 -7.774 2.760 505 HB2 CYS 93 HB2 CYS 93 29.565 -7.146 4.980 506 HB3 CYS 93 HB1 CYS 93 28.902 -8.638 5.646 507 H THR 94 HN THR 94 28.834 -9.659 1.688 508 HA THR 94 HA THR 94 27.016 -11.839 2.415 509 HB THR 94 HB THR 94 27.254 -12.598 0.226 510 HG1 THR 94 HG1 THR 94 29.145 -12.686 -0.667 511 HG21 THR 94 HG21 THR 94 27.941 -9.675 -0.128 512 HG22 THR 94 HG22 THR 94 26.350 -10.222 0.403 513 HG23 THR 94 HG23 THR 94 26.959 -10.692 -1.184 514 H ALA 95 HN ALA 95 30.259 -10.946 2.888 515 HA ALA 95 HA ALA 95 31.270 -13.686 3.034 516 HB1 ALA 95 HB1 ALA 95 33.417 -12.690 3.425 517 HB2 ALA 95 HB2 ALA 95 32.693 -11.121 3.773 518 HB3 ALA 95 HB3 ALA 95 32.648 -11.767 2.133 519 H CYS 96 HN CYS 96 29.815 -11.332 5.075 520 HA CYS 96 HA CYS 96 30.616 -12.861 7.490 521 HB2 CYS 96 HB2 CYS 96 29.906 -9.921 7.299 522 HB3 CYS 96 HB1 CYS 96 30.347 -10.790 8.771 523 H GLN 97 HN GLN 97 28.125 -11.935 5.417 524 HA GLN 97 HA GLN 97 25.831 -12.117 5.492 525 HB2 GLN 97 HB2 GLN 97 26.585 -14.085 7.662 526 HB3 GLN 97 HB1 GLN 97 24.955 -13.911 7.010 527 HG2 GLN 97 HG2 GLN 97 25.774 -14.446 4.761 528 HG3 GLN 97 HG1 GLN 97 27.422 -14.568 5.377 529 HE21 GLN 97 HE21 GLN 97 26.805 -16.862 4.251 530 HE22 GLN 97 HE22 GLN 97 26.277 -18.041 5.352 531 H GLN 98 HN GLN 98 27.017 -9.978 6.990 532 HA GLN 98 HA GLN 98 24.837 -9.497 8.907 533 HB2 GLN 98 HB2 GLN 98 27.792 -9.238 9.503 534 HB3 GLN 98 HB1 GLN 98 26.543 -8.448 10.467 535 HG2 GLN 98 HG2 GLN 98 25.523 -10.614 10.974 536 HG3 GLN 98 HG1 GLN 98 26.696 -11.432 9.944 537 HE21 GLN 98 HE21 GLN 98 26.102 -11.124 13.100 538 HE22 GLN 98 HE22 GLN 98 27.677 -11.017 13.722 539 H THR 99 HN THR 99 24.496 -7.262 9.384 540 HA THR 99 HA THR 99 25.000 -5.566 7.083 541 HB THR 99 HB THR 99 23.501 -4.973 9.643 542 HG1 THR 99 HG1 THR 99 22.447 -5.589 7.099 543 HG21 THR 99 HG21 THR 99 23.708 -3.569 6.971 544 HG22 THR 99 HG22 THR 99 24.154 -2.930 8.553 545 HG23 THR 99 HG23 THR 99 22.458 -3.210 8.161 546 H LYS 100 HN LYS 100 26.315 -3.824 6.991 547 HA LYS 100 HA LYS 100 27.735 -2.969 9.431 548 HB2 LYS 100 HB2 LYS 100 28.939 -3.829 6.811 549 HB3 LYS 100 HB1 LYS 100 29.819 -2.808 7.948 550 HG2 LYS 100 HG2 LYS 100 28.583 -5.405 8.854 551 HG3 LYS 100 HG1 LYS 100 30.150 -5.383 8.058 552 HD2 LYS 100 HD2 LYS 100 31.013 -3.815 9.757 553 HD3 LYS 100 HD1 LYS 100 29.457 -3.834 10.577 554 HE2 LYS 100 HE2 LYS 100 30.888 -5.390 11.726 555 HE3 LYS 100 HE1 LYS 100 29.702 -6.333 10.823 556 HZ1 LYS 100 HZ1 LYS 100 32.294 -6.803 10.694 557 HZ2 LYS 100 HZ2 LYS 100 32.179 -5.657 9.445 558 HZ3 LYS 100 HZ3 LYS 100 31.254 -7.081 9.382 559 H GLY 101 HN GLY 101 28.364 -0.850 9.485 560 HA2 GLY 101 HA2 GLY 101 26.837 0.972 7.917 561 HA3 GLY 101 HA1 GLY 101 28.115 1.403 9.054 562 H ILE 102 HN ILE 102 27.861 2.815 6.759 563 HA ILE 102 HA ILE 102 29.556 1.790 4.675 564 HB ILE 102 HB ILE 102 29.352 4.089 3.739 565 HG12 ILE 102 HG12 ILE 102 27.732 4.517 6.272 566 HG13 ILE 102 HG11 ILE 102 29.210 5.368 5.805 567 HG21 ILE 102 HG21 ILE 102 26.690 2.952 4.630 568 HG22 ILE 102 HG22 ILE 102 27.677 2.230 3.362 569 HG23 ILE 102 HG23 ILE 102 27.032 3.852 3.152 570 HD11 ILE 102 HD11 ILE 102 27.464 6.846 5.189 571 HD12 ILE 102 HD12 ILE 102 26.471 5.533 4.545 572 HD13 ILE 102 HD13 ILE 102 27.918 6.054 3.677 573 H ASN 103 HN ASN 103 30.025 3.495 7.627 574 HA ASN 103 HA ASN 103 32.437 4.860 7.025 575 HB2 ASN 103 HB2 ASN 103 31.191 3.869 9.587 576 HB3 ASN 103 HB1 ASN 103 32.748 4.695 9.571 577 HD21 ASN 103 HD21 ASN 103 30.193 5.693 10.741 578 HD22 ASN 103 HD22 ASN 103 29.853 7.155 9.927 579 H GLU 104 HN GLU 104 31.773 1.621 8.317 580 HA GLU 104 HA GLU 104 34.601 0.952 8.507 581 HB2 GLU 104 HB2 GLU 104 32.078 -0.658 8.947 582 HB3 GLU 104 HB1 GLU 104 33.707 -1.297 9.168 583 HG2 GLU 104 HG2 GLU 104 34.183 0.396 10.864 584 HG3 GLU 104 HG1 GLU 104 32.600 1.134 10.603 585 H PHE 105 HN PHE 105 33.058 1.548 5.904 586 HA PHE 105 HA PHE 105 34.068 -0.802 4.413 587 HB2 PHE 105 HB2 PHE 105 31.386 0.455 4.399 588 HB3 PHE 105 HB1 PHE 105 32.043 0.118 2.807 589 HD1 PHE 105 HD2 PHE 105 31.756 -1.532 6.163 590 HD2 PHE 105 HD1 PHE 105 31.621 -1.978 1.896 591 HE1 PHE 105 HE2 PHE 105 31.195 -3.928 6.422 592 HE2 PHE 105 HE1 PHE 105 31.068 -4.370 2.167 593 HZ PHE 105 HZ PHE 105 30.859 -5.345 4.421 594 H SER 106 HN SER 106 35.174 -0.412 2.591 595 HA SER 106 HA SER 106 36.301 2.203 2.238 596 HB2 SER 106 HB2 SER 106 37.458 -0.041 1.822 597 HB3 SER 106 HB1 SER 106 36.539 -0.111 0.315 598 HG SER 106 HG SER 106 37.501 2.280 0.356 599 H LYS 107 HN LYS 107 36.335 3.305 0.118 600 HA LYS 107 HA LYS 107 33.709 3.840 -0.794 601 HB2 LYS 107 HB2 LYS 107 34.828 5.257 -2.492 602 HB3 LYS 107 HB1 LYS 107 35.384 5.573 -0.847 603 HG2 LYS 107 HG2 LYS 107 37.284 4.010 -1.244 604 HG3 LYS 107 HG1 LYS 107 36.768 3.870 -2.930 605 HD2 LYS 107 HD2 LYS 107 37.132 6.214 -3.322 606 HD3 LYS 107 HD1 LYS 107 37.385 6.521 -1.603 607 HE2 LYS 107 HE2 LYS 107 39.566 6.441 -2.478 608 HE3 LYS 107 HE1 LYS 107 39.336 4.834 -1.797 609 HZ1 LYS 107 HZ1 LYS 107 39.863 5.554 -4.468 610 HZ2 LYS 107 HZ2 LYS 107 38.358 4.767 -4.395 611 HZ3 LYS 107 HZ3 LYS 107 39.750 4.002 -3.791 612 H ALA 108 HN ALA 108 36.214 1.685 -1.873 613 HA ALA 108 HA ALA 108 34.980 1.191 -4.460 614 HB1 ALA 108 HB1 ALA 108 36.802 -0.369 -4.801 615 HB2 ALA 108 HB2 ALA 108 37.233 -0.295 -3.093 616 HB3 ALA 108 HB3 ALA 108 37.452 1.121 -4.120 617 H GLN 109 HN GLN 109 35.213 -0.368 -1.307 618 HA GLN 109 HA GLN 109 34.127 -2.875 -2.006 619 HB2 GLN 109 HB2 GLN 109 34.509 -1.339 0.530 620 HB3 GLN 109 HB1 GLN 109 33.380 -2.696 0.572 621 HG2 GLN 109 HG2 GLN 109 35.663 -3.412 1.186 622 HG3 GLN 109 HG1 GLN 109 35.123 -4.198 -0.301 623 HE21 GLN 109 HE21 GLN 109 35.892 -3.107 -2.390 624 HE22 GLN 109 HE22 GLN 109 37.417 -2.363 -2.375 625 H ARG 110 HN ARG 110 32.622 0.185 -1.140 626 HA ARG 110 HA ARG 110 29.957 -0.917 -1.052 627 HB2 ARG 110 HB2 ARG 110 29.238 1.400 -0.730 628 HB3 ARG 110 HB1 ARG 110 30.611 1.048 0.321 629 HG2 ARG 110 HG2 ARG 110 32.138 2.090 -1.309 630 HG3 ARG 110 HG1 ARG 110 30.768 2.457 -2.364 631 HD2 ARG 110 HD2 ARG 110 29.755 3.795 -0.537 632 HD3 ARG 110 HD1 ARG 110 31.181 3.483 0.456 633 HE ARG 110 HE ARG 110 32.044 4.561 -1.990 634 HH11 ARG 110 HH21 ARG 110 30.195 5.412 0.802 635 HH12 ARG 110 HH22 ARG 110 30.585 7.097 0.719 636 HH21 ARG 110 HH11 ARG 110 32.563 6.767 -2.112 637 HH22 ARG 110 HH12 ARG 110 31.928 7.866 -0.933 638 H HIS 111 HN HIS 111 32.085 -0.133 -3.512 639 HA HIS 111 HA HIS 111 30.024 0.730 -5.416 640 HB2 HIS 111 HB2 HIS 111 32.171 1.896 -5.452 641 HB3 HIS 111 HB1 HIS 111 33.010 0.368 -5.740 642 HD2 HIS 111 HD2 HIS 111 33.186 -0.314 -8.420 643 HE1 HIS 111 HE1 HIS 111 30.305 2.396 -9.897 644 HE2 HIS 111 HE2 HIS 111 32.040 0.662 -10.555 645 H VAL 112 HN VAL 112 32.347 -1.939 -4.978 646 HA VAL 112 HA VAL 112 31.825 -3.372 -7.297 647 HB VAL 112 HB VAL 112 32.519 -5.385 -5.976 648 HG11 VAL 112 HG11 VAL 112 34.759 -4.509 -5.419 649 HG12 VAL 112 HG12 VAL 112 34.130 -2.863 -5.482 650 HG13 VAL 112 HG13 VAL 112 34.195 -3.841 -6.950 651 HG21 VAL 112 HG21 VAL 112 31.382 -4.597 -3.853 652 HG22 VAL 112 HG22 VAL 112 32.679 -3.422 -3.692 653 HG23 VAL 112 HG23 VAL 112 33.046 -5.141 -3.629 654 H LEU 113 HN LEU 113 30.753 -5.677 -7.129 655 HA LEU 113 HA LEU 113 27.932 -5.184 -6.571 656 HB2 LEU 113 HB2 LEU 113 29.275 -7.607 -7.787 657 HB3 LEU 113 HB1 LEU 113 27.546 -7.242 -7.801 658 HG LEU 113 HG LEU 113 29.717 -5.556 -9.088 659 HD11 LEU 113 HD11 LEU 113 29.175 -7.782 -10.170 660 HD12 LEU 113 HD12 LEU 113 28.900 -6.372 -11.192 661 HD13 LEU 113 HD13 LEU 113 27.535 -7.180 -10.419 662 HD21 LEU 113 HD21 LEU 113 27.527 -4.549 -10.165 663 HD22 LEU 113 HD22 LEU 113 28.037 -4.008 -8.570 664 HD23 LEU 113 HD23 LEU 113 26.745 -5.199 -8.723 665 H ASP 114 HN ASP 114 30.605 -6.676 -5.040 666 HA ASP 114 HA ASP 114 28.788 -7.937 -3.073 667 HB2 ASP 114 HB2 ASP 114 31.331 -9.128 -4.204 668 HB3 ASP 114 HB1 ASP 114 30.410 -9.794 -2.856 669 HA PRO 115 HA PRO 115 31.724 -4.878 -1.149 670 HB2 PRO 115 HB2 PRO 115 29.372 -4.738 0.688 671 HB3 PRO 115 HB1 PRO 115 30.332 -3.416 -0.012 672 HG2 PRO 115 HG2 PRO 115 27.885 -3.963 -0.895 673 HG3 PRO 115 HG1 PRO 115 29.177 -3.485 -2.019 674 HD2 PRO 115 HD2 PRO 115 28.046 -6.223 -1.504 675 HD3 PRO 115 HD1 PRO 115 28.590 -5.496 -3.036 676 H ARG 116 HN ARG 116 33.074 -5.284 0.524 677 HA ARG 116 HA ARG 116 32.366 -7.396 2.481 678 HB2 ARG 116 HB2 ARG 116 35.088 -7.201 1.194 679 HB3 ARG 116 HB1 ARG 116 34.440 -8.507 2.192 680 HG2 ARG 116 HG2 ARG 116 32.720 -8.942 0.433 681 HG3 ARG 116 HG1 ARG 116 33.493 -7.719 -0.575 682 HD2 ARG 116 HD2 ARG 116 35.618 -9.010 -0.465 683 HD3 ARG 116 HD1 ARG 116 34.781 -10.263 0.457 684 HE ARG 116 HE ARG 116 34.506 -9.717 -2.397 685 HH11 ARG 116 HH21 ARG 116 33.262 -11.259 0.444 686 HH12 ARG 116 HH22 ARG 116 32.346 -12.439 -0.433 687 HH21 ARG 116 HH11 ARG 116 33.305 -11.259 -3.549 688 HH22 ARG 116 HH12 ARG 116 32.370 -12.440 -2.693 689 H CYS 117 HN CYS 117 32.857 -6.923 4.506 690 HA CYS 117 HA CYS 117 33.745 -4.369 5.293 691 HB2 CYS 117 HB2 CYS 117 34.139 -6.631 7.208 692 HB3 CYS 117 HB1 CYS 117 33.353 -5.068 7.451 693 H GLN 118 HN GLN 118 35.670 -3.677 6.260 694 HA GLN 118 HA GLN 118 38.040 -4.482 5.013 695 HB2 GLN 118 HB2 GLN 118 37.377 -2.786 7.387 696 HB3 GLN 118 HB1 GLN 118 39.056 -3.308 7.216 697 HG2 GLN 118 HG2 GLN 118 38.570 -1.107 6.104 698 HG3 GLN 118 HG1 GLN 118 39.194 -2.331 4.999 699 HE21 GLN 118 HE21 GLN 118 38.092 -2.085 3.044 700 HE22 GLN 118 HE22 GLN 118 36.414 -1.870 2.903 701 H ILE 119 HN ILE 119 36.294 -6.114 7.382 702 HA ILE 119 HA ILE 119 38.583 -7.401 8.650 703 HB ILE 119 HB ILE 119 35.667 -8.122 8.915 704 HG12 ILE 119 HG12 ILE 119 35.820 -5.752 9.349 705 HG13 ILE 119 HG11 ILE 119 35.733 -6.575 10.908 706 HG21 ILE 119 HG21 ILE 119 38.075 -8.412 10.735 707 HG22 ILE 119 HG22 ILE 119 37.289 -9.715 9.843 708 HG23 ILE 119 HG23 ILE 119 36.427 -8.890 11.142 709 HD11 ILE 119 HD11 ILE 119 37.481 -5.025 11.212 710 HD12 ILE 119 HD12 ILE 119 38.120 -5.285 9.588 711 HD13 ILE 119 HD13 ILE 119 38.338 -6.518 10.828 712 H CYS 120 HN CYS 120 35.944 -8.326 6.424 713 HA CYS 120 HA CYS 120 36.738 -11.071 6.233 714 HB2 CYS 120 HB2 CYS 120 35.254 -10.708 3.982 715 HB3 CYS 120 HB1 CYS 120 34.537 -10.919 5.582 716 H VAL 121 HN VAL 121 37.614 -8.141 4.515 717 HA VAL 121 HA VAL 121 38.811 -9.447 2.270 718 HB VAL 121 HB VAL 121 39.732 -7.284 1.720 719 HG11 VAL 121 HG11 VAL 121 36.939 -7.234 2.883 720 HG12 VAL 121 HG12 VAL 121 37.413 -7.405 1.194 721 HG13 VAL 121 HG13 VAL 121 37.616 -5.857 2.015 722 HG21 VAL 121 HG21 VAL 121 39.003 -6.613 4.575 723 HG22 VAL 121 HG22 VAL 121 39.396 -5.389 3.370 724 HG23 VAL 121 HG23 VAL 121 40.606 -6.576 3.846 725 H HIS 122 HN HIS 122 39.996 -8.312 5.396 726 HA HIS 122 HA HIS 122 42.750 -9.008 4.770 727 HB2 HIS 122 HB2 HIS 122 41.419 -8.016 7.301 728 HB3 HIS 122 HB1 HIS 122 43.153 -8.312 7.138 729 HD2 HIS 122 HD2 HIS 122 43.852 -6.870 4.346 730 HE1 HIS 122 HE1 HIS 122 41.747 -3.517 5.811 731 HE2 HIS 122 HE2 HIS 122 43.417 -4.310 4.071 732 H SER 123 HN SER 123 40.071 -10.753 5.576 733 HA SER 123 HA SER 123 41.665 -12.838 6.975 734 HB2 SER 123 HB2 SER 123 38.737 -12.154 7.331 735 HB3 SER 123 HB1 SER 123 39.549 -13.536 8.062 736 HG SER 123 HG SER 123 41.062 -11.496 8.598 737 H GLN 124 HN GLN 124 38.575 -12.493 5.200 738 HA GLN 124 HA GLN 124 38.920 -15.144 4.032 739 HB2 GLN 124 HB2 GLN 124 36.709 -13.094 3.755 740 HB3 GLN 124 HB1 GLN 124 36.682 -14.712 3.052 741 HG2 GLN 124 HG2 GLN 124 37.010 -14.150 6.012 742 HG3 GLN 124 HG1 GLN 124 35.476 -14.557 5.248 743 HE21 GLN 124 HE21 GLN 124 36.249 -16.588 3.462 744 HE22 GLN 124 HE22 GLN 124 36.864 -17.905 4.337 745 H ARG 125 HN ARG 125 40.583 -12.662 3.344 746 HA ARG 125 HA ARG 125 41.585 -11.781 1.473 747 HB2 ARG 125 HB2 ARG 125 40.377 -14.170 0.057 748 HB3 ARG 125 HB1 ARG 125 41.773 -13.225 -0.463 749 HG2 ARG 125 HG2 ARG 125 41.696 -14.736 2.163 750 HG3 ARG 125 HG1 ARG 125 42.311 -15.439 0.671 751 HD2 ARG 125 HD2 ARG 125 43.911 -13.508 0.503 752 HD3 ARG 125 HD1 ARG 125 43.385 -12.993 2.102 753 HE ARG 125 HE ARG 125 45.016 -15.335 1.483 754 HH11 ARG 125 HH21 ARG 125 43.099 -13.579 3.776 755 HH12 ARG 125 HH22 ARG 125 43.826 -14.327 5.157 756 HH21 ARG 125 HH11 ARG 125 45.965 -16.313 3.284 757 HH22 ARG 125 HH12 ARG 125 45.448 -15.878 4.879 758 H ASN 126 HN ASN 126 41.068 -11.245 -0.973 759 HA ASN 126 HA ASN 126 38.748 -9.572 -0.903 760 HB2 ASN 126 HB2 ASN 126 40.713 -10.247 -3.097 761 HB3 ASN 126 HB1 ASN 126 39.399 -9.088 -3.290 762 HD21 ASN 126 HD21 ASN 126 42.215 -8.363 -3.424 763 HD22 ASN 126 HD22 ASN 126 42.530 -7.321 -2.122 Start of MODEL 15 1 H MET 31 HT1 MET 31 -5.473 26.867 -7.458 2 HA MET 31 HA MET 31 -4.316 25.631 -9.009 3 HB2 MET 31 HB2 MET 31 -4.397 28.520 -9.924 4 HB3 MET 31 HB1 MET 31 -4.110 27.156 -11.010 5 HG2 MET 31 HG2 MET 31 -6.273 26.172 -10.356 6 HG3 MET 31 HG1 MET 31 -6.563 27.524 -9.260 7 HE1 MET 31 HE1 MET 31 -8.748 28.456 -10.226 8 HE2 MET 31 HE2 MET 31 -8.724 26.894 -11.040 9 HE3 MET 31 HE3 MET 31 -9.130 28.347 -11.949 10 H GLY 32 HN GLY 32 -2.409 25.498 -10.508 11 HA2 GLY 32 HA2 GLY 32 -0.146 25.808 -11.025 12 HA3 GLY 32 HA1 GLY 32 -0.027 26.987 -9.720 13 H LYS 33 HN LYS 33 -1.612 24.464 -8.392 14 HA LYS 33 HA LYS 33 0.569 23.643 -6.782 15 HB2 LYS 33 HB2 LYS 33 -1.810 23.546 -6.074 16 HB3 LYS 33 HB1 LYS 33 -2.067 22.223 -7.213 17 HG2 LYS 33 HG2 LYS 33 -0.385 20.862 -6.053 18 HG3 LYS 33 HG1 LYS 33 -0.053 22.191 -4.942 19 HD2 LYS 33 HD2 LYS 33 -2.762 20.866 -5.266 20 HD3 LYS 33 HD1 LYS 33 -1.613 20.479 -3.985 21 HE2 LYS 33 HE2 LYS 33 -2.855 22.080 -2.862 22 HE3 LYS 33 HE1 LYS 33 -1.710 23.165 -3.648 23 HZ1 LYS 33 HZ1 LYS 33 -3.281 23.966 -4.992 24 HZ2 LYS 33 HZ2 LYS 33 -4.386 23.307 -3.884 25 HZ3 LYS 33 HZ3 LYS 33 -3.969 22.445 -5.288 26 H ASN 34 HN ASN 34 -0.992 22.231 -9.620 27 HA ASN 34 HA ASN 34 0.697 19.861 -9.538 28 HB2 ASN 34 HB2 ASN 34 -1.342 20.838 -11.552 29 HB3 ASN 34 HB1 ASN 34 -0.482 19.299 -11.664 30 HD21 ASN 34 HD21 ASN 34 -3.291 20.764 -10.420 31 HD22 ASN 34 HD22 ASN 34 -3.730 19.544 -9.324 32 H ASP 35 HN ASP 35 1.376 22.923 -10.254 33 HA ASP 35 HA ASP 35 2.544 22.838 -12.831 34 HB2 ASP 35 HB2 ASP 35 2.004 24.910 -11.477 35 HB3 ASP 35 HB1 ASP 35 3.455 24.567 -10.528 36 H ASN 36 HN ASN 36 3.687 21.916 -9.647 37 HA ASN 36 HA ASN 36 6.435 21.582 -10.484 38 HB2 ASN 36 HB2 ASN 36 6.792 20.695 -8.248 39 HB3 ASN 36 HB1 ASN 36 5.821 22.168 -8.151 40 HD21 ASN 36 HD21 ASN 36 5.334 20.900 -5.950 41 HD22 ASN 36 HD22 ASN 36 3.967 19.894 -5.994 42 H ASP 37 HN ASP 37 3.926 20.014 -11.557 43 HA ASP 37 HA ASP 37 4.725 17.262 -11.038 44 HB2 ASP 37 HB2 ASP 37 2.322 17.974 -11.282 45 HB3 ASP 37 HB1 ASP 37 2.653 18.279 -12.987 46 H ALA 38 HN ALA 38 6.282 19.425 -12.647 47 HA ALA 38 HA ALA 38 6.461 18.515 -15.323 48 HB1 ALA 38 HB1 ALA 38 8.652 19.723 -15.330 49 HB2 ALA 38 HB2 ALA 38 8.445 20.005 -13.601 50 HB3 ALA 38 HB3 ALA 38 7.303 20.701 -14.752 51 H LEU 39 HN LEU 39 7.959 17.156 -16.333 52 HA LEU 39 HA LEU 39 9.417 15.309 -14.524 53 HB2 LEU 39 HB2 LEU 39 8.150 14.718 -17.202 54 HB3 LEU 39 HB1 LEU 39 9.052 13.571 -16.213 55 HG LEU 39 HG LEU 39 6.680 15.041 -15.044 56 HD11 LEU 39 HD11 LEU 39 5.290 13.058 -15.690 57 HD12 LEU 39 HD12 LEU 39 6.620 12.513 -16.710 58 HD13 LEU 39 HD13 LEU 39 5.800 14.033 -17.069 59 HD21 LEU 39 HD21 LEU 39 6.564 12.841 -13.761 60 HD22 LEU 39 HD22 LEU 39 7.956 13.863 -13.430 61 HD23 LEU 39 HD23 LEU 39 8.127 12.454 -14.474 62 H ILE 40 HN ILE 40 11.532 15.052 -14.860 63 HA ILE 40 HA ILE 40 12.730 16.406 -17.214 64 HB ILE 40 HB ILE 40 13.817 15.798 -14.458 65 HG12 ILE 40 HG12 ILE 40 14.178 18.286 -14.499 66 HG13 ILE 40 HG11 ILE 40 13.344 18.339 -16.054 67 HG21 ILE 40 HG21 ILE 40 15.226 16.593 -17.005 68 HG22 ILE 40 HG22 ILE 40 15.656 15.325 -15.855 69 HG23 ILE 40 HG23 ILE 40 15.881 17.019 -15.423 70 HD11 ILE 40 HD11 ILE 40 12.060 18.705 -13.717 71 HD12 ILE 40 HD12 ILE 40 11.906 16.953 -13.825 72 HD13 ILE 40 HD13 ILE 40 11.285 17.981 -15.116 73 H MET 41 HN MET 41 14.103 15.331 -18.545 74 HA MET 41 HA MET 41 14.145 12.390 -18.291 75 HB2 MET 41 HB2 MET 41 13.391 13.486 -20.421 76 HB3 MET 41 HB1 MET 41 15.025 14.123 -20.615 77 HG2 MET 41 HG2 MET 41 15.942 11.856 -20.621 78 HG3 MET 41 HG1 MET 41 14.336 11.183 -20.335 79 HE1 MET 41 HE1 MET 41 14.740 10.012 -23.912 80 HE2 MET 41 HE2 MET 41 14.020 9.676 -22.339 81 HE3 MET 41 HE3 MET 41 15.760 9.920 -22.470 82 H CYS 42 HN CYS 42 15.875 11.417 -17.498 83 HA CYS 42 HA CYS 42 18.281 12.816 -16.863 84 HB2 CYS 42 HB2 CYS 42 17.341 10.819 -15.618 85 HB3 CYS 42 HB1 CYS 42 17.907 9.818 -16.957 86 H MET 43 HN MET 43 20.196 12.908 -17.890 87 HA MET 43 HA MET 43 20.285 12.084 -20.678 88 HB2 MET 43 HB2 MET 43 22.486 13.225 -20.680 89 HB3 MET 43 HB1 MET 43 21.196 14.261 -20.065 90 HG2 MET 43 HG2 MET 43 21.849 13.584 -17.736 91 HG3 MET 43 HG1 MET 43 23.225 12.720 -18.427 92 HE1 MET 43 HE1 MET 43 24.661 13.832 -16.946 93 HE2 MET 43 HE2 MET 43 25.488 15.344 -17.308 94 HE3 MET 43 HE3 MET 43 25.609 13.991 -18.429 95 H ARG 44 HN ARG 44 20.645 10.354 -17.988 96 HA ARG 44 HA ARG 44 22.835 8.692 -19.112 97 HB2 ARG 44 HB2 ARG 44 23.500 9.834 -17.010 98 HB3 ARG 44 HB1 ARG 44 22.157 9.059 -16.181 99 HG2 ARG 44 HG2 ARG 44 23.084 6.831 -16.826 100 HG3 ARG 44 HG1 ARG 44 24.457 7.651 -17.570 101 HD2 ARG 44 HD2 ARG 44 23.660 7.871 -14.655 102 HD3 ARG 44 HD1 ARG 44 24.971 6.874 -15.277 103 HE ARG 44 HE ARG 44 25.443 9.463 -16.190 104 HH11 ARG 44 HH21 ARG 44 25.142 7.752 -13.196 105 HH12 ARG 44 HH22 ARG 44 26.228 8.790 -12.334 106 HH21 ARG 44 HH11 ARG 44 26.868 10.830 -15.065 107 HH22 ARG 44 HH12 ARG 44 27.204 10.533 -13.392 108 H CYS 45 HN CYS 45 20.924 7.877 -16.321 109 HA CYS 45 HA CYS 45 20.195 5.355 -17.352 110 HB2 CYS 45 HB2 CYS 45 18.958 5.058 -15.326 111 HB3 CYS 45 HB1 CYS 45 20.403 5.984 -14.916 112 H ARG 46 HN ARG 46 18.965 8.407 -17.998 113 HA ARG 46 HA ARG 46 17.093 9.152 -19.090 114 HB2 ARG 46 HB2 ARG 46 17.196 6.294 -20.035 115 HB3 ARG 46 HB1 ARG 46 16.064 7.485 -20.681 116 HG2 ARG 46 HG2 ARG 46 17.979 8.944 -21.293 117 HG3 ARG 46 HG1 ARG 46 19.091 7.715 -20.691 118 HD2 ARG 46 HD2 ARG 46 17.066 7.272 -22.900 119 HD3 ARG 46 HD1 ARG 46 18.779 7.592 -23.159 120 HE ARG 46 HE ARG 46 17.599 5.103 -22.238 121 HH11 ARG 46 HH21 ARG 46 20.412 7.105 -22.451 122 HH12 ARG 46 HH22 ARG 46 21.529 5.792 -22.279 123 HH21 ARG 46 HH11 ARG 46 19.055 3.377 -22.011 124 HH22 ARG 46 HH12 ARG 46 20.760 3.680 -22.029 125 H LYS 47 HN LYS 47 16.714 8.332 -16.390 126 HA LYS 47 HA LYS 47 14.122 6.990 -16.320 127 HB2 LYS 47 HB2 LYS 47 16.012 8.028 -14.222 128 HB3 LYS 47 HB1 LYS 47 14.366 7.598 -13.796 129 HG2 LYS 47 HG2 LYS 47 14.691 5.342 -14.718 130 HG3 LYS 47 HG1 LYS 47 16.347 5.741 -15.164 131 HD2 LYS 47 HD2 LYS 47 16.856 6.188 -12.772 132 HD3 LYS 47 HD1 LYS 47 15.206 5.724 -12.353 133 HE2 LYS 47 HE2 LYS 47 15.627 3.484 -13.390 134 HE3 LYS 47 HE1 LYS 47 17.306 3.960 -13.646 135 HZ1 LYS 47 HZ1 LYS 47 17.659 3.178 -11.610 136 HZ2 LYS 47 HZ2 LYS 47 16.000 3.101 -11.248 137 HZ3 LYS 47 HZ3 LYS 47 16.852 4.554 -11.033 138 H VAL 48 HN VAL 48 12.431 8.164 -16.950 139 HA VAL 48 HA VAL 48 12.355 11.045 -16.579 140 HB VAL 48 HB VAL 48 10.293 9.117 -17.666 141 HG11 VAL 48 HG11 VAL 48 9.177 11.104 -16.895 142 HG12 VAL 48 HG12 VAL 48 9.348 11.253 -18.645 143 HG13 VAL 48 HG13 VAL 48 10.436 12.137 -17.574 144 HG21 VAL 48 HG21 VAL 48 11.018 10.018 -19.853 145 HG22 VAL 48 HG22 VAL 48 12.350 9.223 -19.013 146 HG23 VAL 48 HG23 VAL 48 12.248 10.983 -19.036 147 H LYS 49 HN LYS 49 11.755 11.932 -14.733 148 HA LYS 49 HA LYS 49 9.417 10.976 -13.306 149 HB2 LYS 49 HB2 LYS 49 12.152 10.436 -12.392 150 HB3 LYS 49 HB1 LYS 49 11.172 11.249 -11.174 151 HG2 LYS 49 HG2 LYS 49 10.092 8.852 -12.662 152 HG3 LYS 49 HG1 LYS 49 11.134 8.642 -11.258 153 HD2 LYS 49 HD2 LYS 49 9.614 9.882 -9.850 154 HD3 LYS 49 HD1 LYS 49 8.636 10.361 -11.235 155 HE2 LYS 49 HE2 LYS 49 7.512 8.529 -10.140 156 HE3 LYS 49 HE1 LYS 49 8.176 7.927 -11.661 157 HZ1 LYS 49 HZ1 LYS 49 9.699 6.666 -10.610 158 HZ2 LYS 49 HZ2 LYS 49 8.568 6.722 -9.341 159 HZ3 LYS 49 HZ3 LYS 49 9.911 7.763 -9.333 160 H GLY 50 HN GLY 50 9.155 12.374 -11.249 161 HA2 GLY 50 HA2 GLY 50 9.414 15.173 -12.128 162 HA3 GLY 50 HA1 GLY 50 8.310 14.570 -10.897 163 H ILE 51 HN ILE 51 9.249 16.543 -9.798 164 HA ILE 51 HA ILE 51 11.877 16.765 -8.938 165 HB ILE 51 HB ILE 51 10.009 18.418 -8.566 166 HG12 ILE 51 HG12 ILE 51 11.486 17.718 -6.014 167 HG13 ILE 51 HG11 ILE 51 12.279 18.469 -7.397 168 HG21 ILE 51 HG21 ILE 51 9.408 16.754 -6.110 169 HG22 ILE 51 HG22 ILE 51 8.471 16.615 -7.598 170 HG23 ILE 51 HG23 ILE 51 8.514 18.146 -6.722 171 HD11 ILE 51 HD11 ILE 51 9.989 19.576 -5.765 172 HD12 ILE 51 HD12 ILE 51 10.536 20.290 -7.282 173 HD13 ILE 51 HD13 ILE 51 11.621 20.226 -5.895 174 H ASP 52 HN ASP 52 9.827 14.186 -8.328 175 HA ASP 52 HA ASP 52 10.553 13.547 -5.655 176 HB2 ASP 52 HB2 ASP 52 8.520 12.655 -6.680 177 HB3 ASP 52 HB1 ASP 52 9.484 11.803 -7.886 178 H SER 53 HN SER 53 11.601 12.355 -8.823 179 HA SER 53 HA SER 53 13.816 10.874 -7.577 180 HB2 SER 53 HB2 SER 53 13.368 11.059 -10.534 181 HB3 SER 53 HB1 SER 53 14.084 9.752 -9.600 182 HG SER 53 HG SER 53 12.144 8.949 -9.633 183 H TYR 54 HN TYR 54 13.347 13.980 -8.382 184 HA TYR 54 HA TYR 54 16.203 14.394 -9.083 185 HB2 TYR 54 HB2 TYR 54 13.726 15.468 -10.363 186 HB3 TYR 54 HB1 TYR 54 15.061 16.604 -10.166 187 HD1 TYR 54 HD2 TYR 54 14.449 13.070 -11.297 188 HD2 TYR 54 HD1 TYR 54 16.690 16.691 -11.828 189 HE1 TYR 54 HE2 TYR 54 15.602 12.068 -13.238 190 HE2 TYR 54 HE1 TYR 54 17.846 15.688 -13.757 191 HH TYR 54 HH TYR 54 17.816 13.971 -15.230 192 H SER 55 HN SER 55 17.283 15.874 -7.942 193 HA SER 55 HA SER 55 16.092 16.866 -5.528 194 HB2 SER 55 HB2 SER 55 18.349 16.293 -5.278 195 HB3 SER 55 HB1 SER 55 18.811 17.059 -6.798 196 HG SER 55 HG SER 55 18.534 18.121 -4.285 197 H LYS 56 HN LYS 56 16.291 19.174 -4.899 198 HA LYS 56 HA LYS 56 14.878 20.832 -6.698 199 HB2 LYS 56 HB2 LYS 56 16.382 21.467 -4.154 200 HB3 LYS 56 HB1 LYS 56 15.396 22.638 -5.030 201 HG2 LYS 56 HG2 LYS 56 13.425 21.208 -4.781 202 HG3 LYS 56 HG1 LYS 56 14.392 19.983 -3.961 203 HD2 LYS 56 HD2 LYS 56 14.910 21.599 -2.164 204 HD3 LYS 56 HD1 LYS 56 13.930 22.819 -2.983 205 HE2 LYS 56 HE2 LYS 56 11.943 21.369 -2.770 206 HE3 LYS 56 HE1 LYS 56 12.920 20.150 -1.952 207 HZ1 LYS 56 HZ1 LYS 56 12.811 21.262 -0.048 208 HZ2 LYS 56 HZ2 LYS 56 11.591 22.208 -0.759 209 HZ3 LYS 56 HZ3 LYS 56 13.204 22.741 -0.781 210 H THR 57 HN THR 57 18.299 20.576 -5.870 211 HA THR 57 HA THR 57 19.214 22.917 -7.108 212 HB THR 57 HB THR 57 20.698 20.286 -6.961 213 HG1 THR 57 HG1 THR 57 19.730 21.882 -5.022 214 HG21 THR 57 HG21 THR 57 21.614 23.174 -6.983 215 HG22 THR 57 HG22 THR 57 21.785 22.024 -8.308 216 HG23 THR 57 HG23 THR 57 22.668 21.772 -6.802 217 H GLN 58 HN GLN 58 19.039 19.619 -8.421 218 HA GLN 58 HA GLN 58 19.819 20.462 -11.058 219 HB2 GLN 58 HB2 GLN 58 18.700 17.947 -11.397 220 HB3 GLN 58 HB1 GLN 58 20.381 18.246 -10.957 221 HG2 GLN 58 HG2 GLN 58 19.900 18.014 -8.622 222 HG3 GLN 58 HG1 GLN 58 18.161 17.999 -8.917 223 HE21 GLN 58 HE21 GLN 58 20.840 15.994 -8.426 224 HE22 GLN 58 HE22 GLN 58 20.178 14.549 -9.038 225 H TRP 59 HN TRP 59 16.764 19.578 -9.501 226 HA TRP 59 HA TRP 59 15.139 19.629 -11.775 227 HB2 TRP 59 HB2 TRP 59 14.399 18.736 -9.597 228 HB3 TRP 59 HB1 TRP 59 14.416 20.365 -8.926 229 HD1 TRP 59 HD1 TRP 59 12.578 18.212 -11.505 230 HE1 TRP 59 HE1 TRP 59 10.280 19.290 -11.996 231 HE3 TRP 59 HE3 TRP 59 13.055 22.537 -8.836 232 HZ2 TRP 59 HZ2 TRP 59 8.842 21.670 -11.327 233 HZ3 TRP 59 HZ3 TRP 59 11.208 24.189 -8.775 234 HH2 TRP 59 HH2 TRP 59 9.105 23.762 -10.017 235 H SER 60 HN SER 60 16.131 22.206 -9.567 236 HA SER 60 HA SER 60 14.530 24.209 -10.902 237 HB2 SER 60 HB2 SER 60 16.687 24.488 -8.800 238 HB3 SER 60 HB1 SER 60 15.622 25.779 -9.354 239 HG SER 60 HG SER 60 13.864 24.573 -8.595 240 H LYS 61 HN LYS 61 17.457 22.711 -11.528 241 HA LYS 61 HA LYS 61 18.856 24.978 -12.644 242 HB2 LYS 61 HB2 LYS 61 20.036 23.012 -11.701 243 HB3 LYS 61 HB1 LYS 61 19.402 22.031 -13.021 244 HG2 LYS 61 HG2 LYS 61 20.527 23.428 -14.658 245 HG3 LYS 61 HG1 LYS 61 21.072 24.530 -13.395 246 HD2 LYS 61 HD2 LYS 61 21.791 21.674 -12.924 247 HD3 LYS 61 HD1 LYS 61 22.564 22.401 -14.333 248 HE2 LYS 61 HE2 LYS 61 22.591 23.583 -11.543 249 HE3 LYS 61 HE1 LYS 61 23.926 22.698 -12.279 250 HZ1 LYS 61 HZ1 LYS 61 22.852 24.863 -13.874 251 HZ2 LYS 61 HZ2 LYS 61 24.467 24.428 -13.578 252 HZ3 LYS 61 HZ3 LYS 61 23.609 25.350 -12.437 253 H THR 62 HN THR 62 16.780 22.402 -13.814 254 HA THR 62 HA THR 62 17.294 22.791 -16.578 255 HB THR 62 HB THR 62 15.365 21.385 -16.954 256 HG1 THR 62 HG1 THR 62 14.381 22.642 -14.943 257 HG21 THR 62 HG21 THR 62 16.092 19.464 -15.824 258 HG22 THR 62 HG22 THR 62 16.470 20.359 -14.352 259 HG23 THR 62 HG23 THR 62 17.524 20.494 -15.760 260 H PHE 63 HN PHE 63 16.269 25.053 -14.617 261 HA PHE 63 HA PHE 63 14.312 26.194 -16.523 262 HB2 PHE 63 HB2 PHE 63 14.451 26.467 -13.508 263 HB3 PHE 63 HB1 PHE 63 13.406 27.434 -14.549 264 HD1 PHE 63 HD1 PHE 63 11.536 26.424 -15.750 265 HD2 PHE 63 HD2 PHE 63 14.029 24.108 -13.152 266 HE1 PHE 63 HE1 PHE 63 9.849 24.590 -15.766 267 HE2 PHE 63 HE2 PHE 63 12.357 22.276 -13.143 268 HZ PHE 63 HZ PHE 63 10.259 22.517 -14.462 269 H THR 64 HN THR 64 14.499 28.370 -16.969 270 HA THR 64 HA THR 64 16.940 29.748 -15.985 271 HB THR 64 HB THR 64 16.930 30.779 -18.388 272 HG1 THR 64 HG1 THR 64 16.092 28.454 -19.433 273 HG21 THR 64 HG21 THR 64 17.878 28.054 -17.542 274 HG22 THR 64 HG22 THR 64 18.815 29.508 -17.884 275 HG23 THR 64 HG23 THR 64 18.118 28.577 -19.210 276 H PHE 65 HN PHE 65 16.845 32.058 -16.135 277 HA PHE 65 HA PHE 65 14.076 33.086 -15.846 278 HB2 PHE 65 HB2 PHE 65 16.056 33.181 -13.983 279 HB3 PHE 65 HB1 PHE 65 16.397 34.677 -14.846 280 HD1 PHE 65 HD1 PHE 65 13.396 32.778 -13.634 281 HD2 PHE 65 HD2 PHE 65 15.321 36.597 -14.036 282 HE1 PHE 65 HE1 PHE 65 11.487 33.853 -12.485 283 HE2 PHE 65 HE2 PHE 65 13.416 37.670 -12.866 284 HZ PHE 65 HZ PHE 65 11.496 36.302 -12.103 285 H VAL 66 HN VAL 66 13.372 34.161 -17.532 286 HA VAL 66 HA VAL 66 15.204 36.023 -18.911 287 HB VAL 66 HB VAL 66 14.472 35.316 -21.063 288 HG11 VAL 66 HG11 VAL 66 14.977 32.870 -19.334 289 HG12 VAL 66 HG12 VAL 66 16.218 33.904 -20.040 290 HG13 VAL 66 HG13 VAL 66 15.172 32.945 -21.085 291 HG21 VAL 66 HG21 VAL 66 12.827 33.308 -21.147 292 HG22 VAL 66 HG22 VAL 66 12.156 34.897 -20.781 293 HG23 VAL 66 HG23 VAL 66 12.436 33.741 -19.483 294 H ARG 67 HN ARG 67 14.247 37.862 -19.757 295 HA ARG 67 HA ARG 67 12.767 39.616 -19.739 296 HB2 ARG 67 HB2 ARG 67 10.825 37.311 -20.035 297 HB3 ARG 67 HB1 ARG 67 10.391 39.013 -20.242 298 HG2 ARG 67 HG2 ARG 67 12.024 39.232 -22.060 299 HG3 ARG 67 HG1 ARG 67 12.529 37.556 -21.829 300 HD2 ARG 67 HD2 ARG 67 10.957 37.667 -23.690 301 HD3 ARG 67 HD1 ARG 67 10.203 36.817 -22.338 302 HE ARG 67 HE ARG 67 9.603 39.602 -22.224 303 HH11 ARG 67 HH21 ARG 67 8.902 36.674 -23.929 304 HH12 ARG 67 HH22 ARG 67 7.303 37.158 -24.384 305 HH21 ARG 67 HH11 ARG 67 7.507 40.246 -22.817 306 HH22 ARG 67 HH12 ARG 67 6.513 39.181 -23.754 307 H GLY 68 HN GLY 68 13.409 38.039 -17.184 308 HA2 GLY 68 HA2 GLY 68 13.001 38.514 -14.958 309 HA3 GLY 68 HA1 GLY 68 11.735 39.633 -15.457 310 H ARG 69 HN ARG 69 11.717 36.377 -16.662 311 HA ARG 69 HA ARG 69 9.606 35.605 -14.725 312 HB2 ARG 69 HB2 ARG 69 9.465 35.248 -17.730 313 HB3 ARG 69 HB1 ARG 69 8.267 34.700 -16.557 314 HG2 ARG 69 HG2 ARG 69 7.847 37.010 -15.863 315 HG3 ARG 69 HG1 ARG 69 9.095 37.582 -16.974 316 HD2 ARG 69 HD2 ARG 69 6.950 37.879 -18.057 317 HD3 ARG 69 HD1 ARG 69 7.791 36.556 -18.857 318 HE ARG 69 HE ARG 69 6.213 35.057 -17.985 319 HH11 ARG 69 HH21 ARG 69 5.884 38.236 -16.653 320 HH12 ARG 69 HH22 ARG 69 4.349 37.919 -15.917 321 HH21 ARG 69 HH11 ARG 69 4.198 34.634 -17.020 322 HH22 ARG 69 HH12 ARG 69 3.396 35.880 -16.124 323 H THR 70 HN THR 70 9.183 33.276 -14.727 324 HA THR 70 HA THR 70 11.692 31.789 -14.902 325 HB THR 70 HB THR 70 8.967 30.910 -13.914 326 HG1 THR 70 HG1 THR 70 9.667 31.522 -11.956 327 HG21 THR 70 HG21 THR 70 11.736 29.702 -13.807 328 HG22 THR 70 HG22 THR 70 10.259 28.978 -14.446 329 HG23 THR 70 HG23 THR 70 10.448 29.209 -12.707 330 H VAL 71 HN VAL 71 12.214 30.492 -16.539 331 HA VAL 71 HA VAL 71 10.066 29.385 -18.257 332 HB VAL 71 HB VAL 71 11.554 29.826 -20.226 333 HG11 VAL 71 HG11 VAL 71 9.636 31.314 -19.564 334 HG12 VAL 71 HG12 VAL 71 10.915 32.158 -20.436 335 HG13 VAL 71 HG13 VAL 71 10.785 32.324 -18.684 336 HG21 VAL 71 HG21 VAL 71 13.613 30.132 -18.699 337 HG22 VAL 71 HG22 VAL 71 13.009 31.759 -18.402 338 HG23 VAL 71 HG23 VAL 71 13.440 31.259 -20.038 339 H SER 72 HN SER 72 10.589 27.448 -19.303 340 HA SER 72 HA SER 72 12.407 25.760 -17.815 341 HB2 SER 72 HB2 SER 72 11.429 23.959 -18.948 342 HB3 SER 72 HB1 SER 72 10.109 25.128 -18.850 343 HG SER 72 HG SER 72 11.628 24.287 -21.031 344 H VAL 73 HN VAL 73 14.065 24.427 -18.837 345 HA VAL 73 HA VAL 73 15.651 26.007 -20.713 346 HB VAL 73 HB VAL 73 16.247 23.531 -19.105 347 HG11 VAL 73 HG11 VAL 73 17.888 25.046 -21.144 348 HG12 VAL 73 HG12 VAL 73 17.551 23.319 -21.089 349 HG13 VAL 73 HG13 VAL 73 18.636 24.040 -19.902 350 HG21 VAL 73 HG21 VAL 73 16.073 25.871 -18.029 351 HG22 VAL 73 HG22 VAL 73 17.530 26.255 -18.943 352 HG23 VAL 73 HG23 VAL 73 17.558 24.964 -17.744 353 H SER 74 HN SER 74 15.921 25.506 -22.811 354 HA SER 74 HA SER 74 14.258 23.643 -24.109 355 HB2 SER 74 HB2 SER 74 15.226 25.634 -25.217 356 HB3 SER 74 HB1 SER 74 16.821 24.893 -25.122 357 HG SER 74 HG SER 74 16.128 24.250 -27.059 358 H ASP 75 HN ASP 75 17.691 23.492 -23.210 359 HA ASP 75 HA ASP 75 17.603 20.557 -23.618 360 HB2 ASP 75 HB2 ASP 75 19.974 20.714 -24.383 361 HB3 ASP 75 HB1 ASP 75 18.789 21.408 -25.495 362 HA PRO 76 HA PRO 76 19.233 21.561 -19.421 363 HB2 PRO 76 HB2 PRO 76 17.606 19.883 -18.010 364 HB3 PRO 76 HB1 PRO 76 17.108 21.508 -18.504 365 HG2 PRO 76 HG2 PRO 76 16.372 18.874 -19.667 366 HG3 PRO 76 HG1 PRO 76 15.406 20.351 -19.522 367 HD2 PRO 76 HD2 PRO 76 16.705 19.490 -21.846 368 HD3 PRO 76 HD1 PRO 76 16.124 21.144 -21.558 369 H LYS 77 HN LYS 77 20.890 20.479 -18.492 370 HA LYS 77 HA LYS 77 21.237 17.594 -19.135 371 HB2 LYS 77 HB2 LYS 77 23.256 19.829 -19.024 372 HB3 LYS 77 HB1 LYS 77 23.724 18.132 -18.914 373 HG2 LYS 77 HG2 LYS 77 22.577 17.695 -21.070 374 HG3 LYS 77 HG1 LYS 77 22.172 19.408 -21.188 375 HD2 LYS 77 HD2 LYS 77 24.542 20.005 -21.220 376 HD3 LYS 77 HD1 LYS 77 24.992 18.314 -20.995 377 HE2 LYS 77 HE2 LYS 77 23.901 17.737 -23.124 378 HE3 LYS 77 HE1 LYS 77 23.465 19.428 -23.359 379 HZ1 LYS 77 HZ1 LYS 77 25.459 19.019 -24.569 380 HZ2 LYS 77 HZ2 LYS 77 26.202 18.283 -23.231 381 HZ3 LYS 77 HZ3 LYS 77 25.881 19.950 -23.216 382 H VAL 78 HN VAL 78 20.402 16.789 -17.276 383 HA VAL 78 HA VAL 78 22.069 17.150 -14.871 384 HB VAL 78 HB VAL 78 19.847 17.095 -13.527 385 HG11 VAL 78 HG11 VAL 78 20.798 19.502 -15.103 386 HG12 VAL 78 HG12 VAL 78 21.282 19.029 -13.474 387 HG13 VAL 78 HG13 VAL 78 19.643 19.605 -13.773 388 HG21 VAL 78 HG21 VAL 78 18.787 18.384 -16.047 389 HG22 VAL 78 HG22 VAL 78 17.893 17.862 -14.619 390 HG23 VAL 78 HG23 VAL 78 18.557 16.664 -15.733 391 H ILE 79 HN ILE 79 21.534 15.486 -13.195 392 HA ILE 79 HA ILE 79 20.635 12.955 -14.456 393 HB ILE 79 HB ILE 79 22.749 12.704 -12.385 394 HG12 ILE 79 HG12 ILE 79 23.320 14.020 -15.054 395 HG13 ILE 79 HG11 ILE 79 23.612 14.703 -13.456 396 HG21 ILE 79 HG21 ILE 79 21.787 10.870 -13.831 397 HG22 ILE 79 HG22 ILE 79 23.543 11.000 -13.896 398 HG23 ILE 79 HG23 ILE 79 22.566 11.637 -15.212 399 HD11 ILE 79 HD11 ILE 79 25.120 12.689 -13.020 400 HD12 ILE 79 HD12 ILE 79 25.725 13.867 -14.187 401 HD13 ILE 79 HD13 ILE 79 25.008 12.354 -14.748 402 H CYS 80 HN CYS 80 20.162 11.256 -12.808 403 HA CYS 80 HA CYS 80 18.364 12.365 -10.837 404 HB2 CYS 80 HB2 CYS 80 18.988 9.432 -10.938 405 HB3 CYS 80 HB1 CYS 80 17.437 10.248 -10.717 406 H ARG 81 HN ARG 81 18.392 11.795 -8.593 407 HA ARG 81 HA ARG 81 20.805 12.304 -7.281 408 HB2 ARG 81 HB2 ARG 81 18.309 10.914 -6.280 409 HB3 ARG 81 HB1 ARG 81 19.636 11.435 -5.240 410 HG2 ARG 81 HG2 ARG 81 19.334 13.758 -5.999 411 HG3 ARG 81 HG1 ARG 81 18.017 13.246 -7.056 412 HD2 ARG 81 HD2 ARG 81 18.035 12.852 -4.057 413 HD3 ARG 81 HD1 ARG 81 17.231 14.189 -4.873 414 HE ARG 81 HE ARG 81 16.281 11.867 -6.065 415 HH11 ARG 81 HH21 ARG 81 16.378 13.324 -2.925 416 HH12 ARG 81 HH22 ARG 81 14.892 12.609 -2.396 417 HH21 ARG 81 HH11 ARG 81 14.333 10.924 -5.375 418 HH22 ARG 81 HH12 ARG 81 13.734 11.251 -3.783 419 H THR 82 HN THR 82 19.210 9.213 -8.005 420 HA THR 82 HA THR 82 20.984 7.518 -6.642 421 HB THR 82 HB THR 82 19.605 6.842 -9.245 422 HG1 THR 82 HG1 THR 82 17.767 6.745 -8.187 423 HG21 THR 82 HG21 THR 82 21.215 5.206 -8.223 424 HG22 THR 82 HG22 THR 82 19.562 4.603 -8.324 425 HG23 THR 82 HG23 THR 82 20.197 5.179 -6.783 426 H CYS 83 HN CYS 83 21.104 8.880 -9.907 427 HA CYS 83 HA CYS 83 23.367 7.425 -10.794 428 HB2 CYS 83 HB2 CYS 83 22.255 10.096 -11.683 429 HB3 CYS 83 HB1 CYS 83 23.530 9.202 -12.518 430 H GLN 84 HN GLN 84 22.972 10.204 -8.759 431 HA GLN 84 HA GLN 84 25.873 10.328 -8.356 432 HB2 GLN 84 HB2 GLN 84 25.679 12.882 -8.460 433 HB3 GLN 84 HB1 GLN 84 25.716 11.998 -9.984 434 HG2 GLN 84 HG2 GLN 84 23.329 12.144 -10.219 435 HG3 GLN 84 HG1 GLN 84 23.156 12.823 -8.601 436 HE21 GLN 84 HE21 GLN 84 23.098 15.071 -8.501 437 HE22 GLN 84 HE22 GLN 84 23.656 16.110 -9.720 438 HA PRO 85 HA PRO 85 23.391 10.822 -4.485 439 HB2 PRO 85 HB2 PRO 85 24.568 8.809 -3.059 440 HB3 PRO 85 HB1 PRO 85 23.217 8.532 -4.182 441 HG2 PRO 85 HG2 PRO 85 26.126 8.010 -4.551 442 HG3 PRO 85 HG1 PRO 85 24.731 7.098 -5.152 443 HD2 PRO 85 HD2 PRO 85 26.240 8.893 -6.663 444 HD3 PRO 85 HD1 PRO 85 24.596 8.361 -7.073 445 H LYS 86 HN LYS 86 24.024 11.895 -2.617 446 HA LYS 86 HA LYS 86 26.932 12.375 -2.244 447 HB2 LYS 86 HB2 LYS 86 24.689 14.407 -2.155 448 HB3 LYS 86 HB1 LYS 86 26.346 14.716 -1.634 449 HG2 LYS 86 HG2 LYS 86 27.170 14.164 -3.890 450 HG3 LYS 86 HG1 LYS 86 25.519 13.838 -4.416 451 HD2 LYS 86 HD2 LYS 86 24.898 16.176 -3.872 452 HD3 LYS 86 HD1 LYS 86 26.569 16.498 -3.408 453 HE2 LYS 86 HE2 LYS 86 25.722 15.526 -6.152 454 HE3 LYS 86 HE1 LYS 86 26.045 17.213 -5.752 455 HZ1 LYS 86 HZ1 LYS 86 28.279 16.413 -4.952 456 HZ2 LYS 86 HZ2 LYS 86 28.032 16.368 -6.632 457 HZ3 LYS 86 HZ3 LYS 86 27.937 14.938 -5.718 458 H GLN 87 HN GLN 87 23.873 13.250 -0.618 459 HA GLN 87 HA GLN 87 25.042 12.865 1.981 460 HB2 GLN 87 HB2 GLN 87 22.197 13.373 1.084 461 HB3 GLN 87 HB1 GLN 87 22.701 13.292 2.776 462 HG2 GLN 87 HG2 GLN 87 24.263 15.146 2.426 463 HG3 GLN 87 HG1 GLN 87 23.841 15.204 0.716 464 HE21 GLN 87 HE21 GLN 87 23.289 17.565 1.549 465 HE22 GLN 87 HE22 GLN 87 21.690 17.797 2.070 466 H HIS 88 HN HIS 88 25.594 10.535 1.005 467 HA HIS 88 HA HIS 88 23.777 8.703 2.392 468 HB2 HIS 88 HB2 HIS 88 24.610 8.184 -0.471 469 HB3 HIS 88 HB1 HIS 88 23.525 7.210 0.526 470 HD2 HIS 88 HD2 HIS 88 23.388 10.364 -1.737 471 HE1 HIS 88 HE1 HIS 88 19.585 9.945 0.049 472 HE2 HIS 88 HE2 HIS 88 20.913 11.198 -1.716 473 H ASP 89 HN ASP 89 26.850 9.543 1.053 474 HA ASP 89 HA ASP 89 28.087 7.019 1.926 475 HB2 ASP 89 HB2 ASP 89 29.232 9.404 0.459 476 HB3 ASP 89 HB1 ASP 89 30.122 7.936 0.863 477 H SER 90 HN SER 90 27.030 9.427 3.604 478 HA SER 90 HA SER 90 29.435 9.633 5.330 479 HB2 SER 90 HB2 SER 90 29.087 11.772 4.193 480 HB3 SER 90 HB1 SER 90 27.413 11.807 4.751 481 HG SER 90 HG SER 90 29.118 12.954 6.032 482 H ILE 91 HN ILE 91 29.122 9.306 7.472 483 HA ILE 91 HA ILE 91 26.327 8.834 8.385 484 HB ILE 91 HB ILE 91 28.849 7.407 9.266 485 HG12 ILE 91 HG12 ILE 91 26.462 6.336 7.726 486 HG13 ILE 91 HG11 ILE 91 27.961 6.860 6.947 487 HG21 ILE 91 HG21 ILE 91 27.083 5.920 10.374 488 HG22 ILE 91 HG22 ILE 91 25.931 7.218 10.051 489 HG23 ILE 91 HG23 ILE 91 27.315 7.513 11.102 490 HD11 ILE 91 HD11 ILE 91 27.834 4.763 9.128 491 HD12 ILE 91 HD12 ILE 91 29.239 5.214 8.166 492 HD13 ILE 91 HD13 ILE 91 27.878 4.392 7.403 493 H TRP 92 HN TRP 92 25.686 10.018 10.048 494 HA TRP 92 HA TRP 92 27.494 11.930 11.243 495 HB2 TRP 92 HB2 TRP 92 25.327 12.786 10.874 496 HB3 TRP 92 HB1 TRP 92 24.548 11.341 11.526 497 HD1 TRP 92 HD1 TRP 92 27.119 13.867 12.923 498 HE1 TRP 92 HE1 TRP 92 26.426 14.489 15.326 499 HE3 TRP 92 HE3 TRP 92 22.884 11.074 13.330 500 HZ2 TRP 92 HZ2 TRP 92 24.304 13.899 17.164 501 HZ3 TRP 92 HZ3 TRP 92 21.538 11.119 15.411 502 HH2 TRP 92 HH2 TRP 92 22.244 12.527 17.325 503 H CYS 93 HN CYS 93 28.848 11.330 12.798 504 HA CYS 93 HA CYS 93 28.183 9.138 14.623 505 HB2 CYS 93 HB2 CYS 93 30.417 9.066 13.869 506 HB3 CYS 93 HB1 CYS 93 30.659 10.792 14.130 507 H THR 94 HN THR 94 27.576 9.402 16.702 508 HA THR 94 HA THR 94 27.136 12.144 17.663 509 HB THR 94 HB THR 94 25.566 11.248 19.133 510 HG1 THR 94 HG1 THR 94 27.384 9.295 19.323 511 HG21 THR 94 HG21 THR 94 25.572 9.156 16.948 512 HG22 THR 94 HG22 THR 94 25.039 10.816 16.689 513 HG23 THR 94 HG23 THR 94 24.183 9.784 17.834 514 H ALA 95 HN ALA 95 29.506 9.755 17.863 515 HA ALA 95 HA ALA 95 30.292 10.362 20.619 516 HB1 ALA 95 HB1 ALA 95 32.227 8.775 19.954 517 HB2 ALA 95 HB2 ALA 95 31.262 8.440 18.519 518 HB3 ALA 95 HB3 ALA 95 30.610 8.092 20.114 519 H CYS 96 HN CYS 96 30.785 11.630 17.518 520 HA CYS 96 HA CYS 96 33.266 13.003 18.407 521 HB2 CYS 96 HB2 CYS 96 32.464 12.143 15.618 522 HB3 CYS 96 HB1 CYS 96 33.845 13.175 15.996 523 H GLN 97 HN GLN 97 30.189 13.211 16.712 524 HA GLN 97 HA GLN 97 28.753 15.024 16.546 525 HB2 GLN 97 HB2 GLN 97 30.122 15.854 18.649 526 HB3 GLN 97 HB1 GLN 97 30.881 16.939 17.487 527 HG2 GLN 97 HG2 GLN 97 29.021 18.126 18.389 528 HG3 GLN 97 HG1 GLN 97 28.551 17.621 16.766 529 HE21 GLN 97 HE21 GLN 97 26.295 17.335 17.073 530 HE22 GLN 97 HE22 GLN 97 25.637 16.238 18.189 531 H GLN 98 HN GLN 98 30.503 14.044 14.503 532 HA GLN 98 HA GLN 98 30.451 16.367 12.737 533 HB2 GLN 98 HB2 GLN 98 32.746 16.125 12.005 534 HB3 GLN 98 HB1 GLN 98 32.739 16.354 13.756 535 HG2 GLN 98 HG2 GLN 98 32.760 13.813 13.958 536 HG3 GLN 98 HG1 GLN 98 33.103 13.769 12.230 537 HE21 GLN 98 HE21 GLN 98 35.148 14.884 11.509 538 HE22 GLN 98 HE22 GLN 98 36.437 15.018 12.604 539 H THR 99 HN THR 99 30.958 15.702 10.458 540 HA THR 99 HA THR 99 29.511 13.250 9.871 541 HB THR 99 HB THR 99 30.183 14.118 7.425 542 HG1 THR 99 HG1 THR 99 31.292 15.891 9.025 543 HG21 THR 99 HG21 THR 99 27.906 14.044 8.103 544 HG22 THR 99 HG22 THR 99 28.202 15.709 7.597 545 HG23 THR 99 HG23 THR 99 28.149 15.306 9.314 546 H LYS 100 HN LYS 100 30.308 11.421 8.950 547 HA LYS 100 HA LYS 100 33.191 11.291 8.343 548 HB2 LYS 100 HB2 LYS 100 31.638 9.607 10.285 549 HB3 LYS 100 HB1 LYS 100 33.066 8.950 9.489 550 HG2 LYS 100 HG2 LYS 100 33.208 11.639 10.850 551 HG3 LYS 100 HG1 LYS 100 33.330 10.161 11.805 552 HD2 LYS 100 HD2 LYS 100 35.192 9.398 10.329 553 HD3 LYS 100 HD1 LYS 100 35.115 10.931 9.468 554 HE2 LYS 100 HE2 LYS 100 35.641 10.629 12.428 555 HE3 LYS 100 HE1 LYS 100 36.868 10.937 11.200 556 HZ1 LYS 100 HZ1 LYS 100 35.155 12.869 10.635 557 HZ2 LYS 100 HZ2 LYS 100 36.422 13.063 11.751 558 HZ3 LYS 100 HZ3 LYS 100 34.850 12.724 12.297 559 H GLY 101 HN GLY 101 33.777 9.861 6.768 560 HA2 GLY 101 HA2 GLY 101 31.704 9.101 4.922 561 HA3 GLY 101 HA1 GLY 101 33.427 8.787 4.742 562 H ILE 102 HN ILE 102 31.698 6.850 3.992 563 HA ILE 102 HA ILE 102 31.232 4.962 6.124 564 HB ILE 102 HB ILE 102 30.461 3.473 4.323 565 HG12 ILE 102 HG12 ILE 102 31.240 5.806 2.548 566 HG13 ILE 102 HG11 ILE 102 32.043 4.232 2.586 567 HG21 ILE 102 HG21 ILE 102 28.508 4.774 3.764 568 HG22 ILE 102 HG22 ILE 102 29.377 6.286 4.019 569 HG23 ILE 102 HG23 ILE 102 29.004 5.241 5.391 570 HD11 ILE 102 HD11 ILE 102 29.276 4.912 1.611 571 HD12 ILE 102 HD12 ILE 102 29.665 3.264 2.116 572 HD13 ILE 102 HD13 ILE 102 30.550 4.014 0.784 573 H ASN 103 HN ASN 103 33.883 5.827 4.236 574 HA ASN 103 HA ASN 103 35.115 3.316 3.798 575 HB2 ASN 103 HB2 ASN 103 36.233 6.108 4.067 576 HB3 ASN 103 HB1 ASN 103 37.228 4.709 3.670 577 HD21 ASN 103 HD21 ASN 103 33.993 4.509 2.471 578 HD22 ASN 103 HD22 ASN 103 34.340 4.938 0.856 579 H GLU 104 HN GLU 104 35.384 5.673 6.442 580 HA GLU 104 HA GLU 104 37.050 3.799 7.988 581 HB2 GLU 104 HB2 GLU 104 36.252 6.668 8.525 582 HB3 GLU 104 HB1 GLU 104 37.316 5.698 9.543 583 HG2 GLU 104 HG2 GLU 104 37.845 6.241 6.612 584 HG3 GLU 104 HG1 GLU 104 38.532 7.202 7.923 585 H PHE 105 HN PHE 105 34.025 3.676 7.397 586 HA PHE 105 HA PHE 105 33.204 3.308 10.233 587 HB2 PHE 105 HB2 PHE 105 32.027 4.948 8.186 588 HB3 PHE 105 HB1 PHE 105 30.888 3.657 8.555 589 HD1 PHE 105 HD2 PHE 105 30.172 3.299 10.929 590 HD2 PHE 105 HD1 PHE 105 32.451 6.710 9.690 591 HE1 PHE 105 HE2 PHE 105 29.551 4.468 13.010 592 HE2 PHE 105 HE1 PHE 105 31.840 7.879 11.773 593 HZ PHE 105 HZ PHE 105 30.381 6.763 13.448 594 H SER 106 HN SER 106 32.334 1.417 10.784 595 HA SER 106 HA SER 106 32.647 -0.817 9.059 596 HB2 SER 106 HB2 SER 106 31.413 -0.414 11.768 597 HB3 SER 106 HB1 SER 106 31.283 -1.969 10.945 598 HG SER 106 HG SER 106 33.234 -1.253 12.398 599 H LYS 107 HN LYS 107 31.077 -2.146 8.122 600 HA LYS 107 HA LYS 107 28.909 -0.829 6.889 601 HB2 LYS 107 HB2 LYS 107 30.051 -2.852 5.981 602 HB3 LYS 107 HB1 LYS 107 29.289 -3.810 7.250 603 HG2 LYS 107 HG2 LYS 107 27.065 -3.183 6.431 604 HG3 LYS 107 HG1 LYS 107 27.796 -2.153 5.195 605 HD2 LYS 107 HD2 LYS 107 28.908 -4.132 4.210 606 HD3 LYS 107 HD1 LYS 107 28.151 -5.156 5.430 607 HE2 LYS 107 HE2 LYS 107 25.930 -4.548 4.615 608 HE3 LYS 107 HE1 LYS 107 26.638 -3.439 3.442 609 HZ1 LYS 107 HZ1 LYS 107 27.316 -6.317 3.508 610 HZ2 LYS 107 HZ2 LYS 107 27.588 -5.201 2.257 611 HZ3 LYS 107 HZ3 LYS 107 26.008 -5.719 2.609 612 H ALA 108 HN ALA 108 29.071 -3.015 9.676 613 HA ALA 108 HA ALA 108 26.264 -3.169 10.100 614 HB1 ALA 108 HB1 ALA 108 28.033 -4.740 11.023 615 HB2 ALA 108 HB2 ALA 108 26.795 -4.225 12.169 616 HB3 ALA 108 HB3 ALA 108 28.398 -3.489 12.212 617 H GLN 109 HN GLN 109 28.792 -1.015 11.291 618 HA GLN 109 HA GLN 109 27.282 0.306 13.266 619 HB2 GLN 109 HB2 GLN 109 29.675 1.116 11.624 620 HB3 GLN 109 HB1 GLN 109 28.958 2.208 12.813 621 HG2 GLN 109 HG2 GLN 109 29.825 -0.620 13.472 622 HG3 GLN 109 HG1 GLN 109 30.868 0.790 13.693 623 HE21 GLN 109 HE21 GLN 109 28.906 -1.186 15.446 624 HE22 GLN 109 HE22 GLN 109 28.341 -0.084 16.606 625 H ARG 110 HN ARG 110 27.091 0.409 9.860 626 HA ARG 110 HA ARG 110 25.879 3.048 9.729 627 HB2 ARG 110 HB2 ARG 110 27.276 2.178 7.859 628 HB3 ARG 110 HB1 ARG 110 26.091 0.897 7.602 629 HG2 ARG 110 HG2 ARG 110 24.355 2.551 7.124 630 HG3 ARG 110 HG1 ARG 110 25.487 3.865 7.464 631 HD2 ARG 110 HD2 ARG 110 26.937 3.016 5.621 632 HD3 ARG 110 HD1 ARG 110 25.704 1.810 5.247 633 HE ARG 110 HE ARG 110 25.561 4.676 4.710 634 HH11 ARG 110 HH21 ARG 110 23.928 1.638 5.003 635 HH12 ARG 110 HH22 ARG 110 22.576 2.114 4.031 636 HH21 ARG 110 HH11 ARG 110 23.789 5.308 3.435 637 HH22 ARG 110 HH12 ARG 110 22.497 4.191 3.144 638 H HIS 111 HN HIS 111 24.888 -0.195 10.286 639 HA HIS 111 HA HIS 111 22.130 0.258 9.430 640 HB2 HIS 111 HB2 HIS 111 23.589 -2.100 10.631 641 HB3 HIS 111 HB1 HIS 111 21.840 -2.095 10.374 642 HD2 HIS 111 HD2 HIS 111 21.540 -0.932 7.404 643 HE1 HIS 111 HE1 HIS 111 24.541 -3.662 6.248 644 HE2 HIS 111 HE2 HIS 111 22.681 -2.158 5.401 645 H VAL 112 HN VAL 112 23.949 -0.159 12.450 646 HA VAL 112 HA VAL 112 21.830 -0.289 14.236 647 HB VAL 112 HB VAL 112 23.446 0.630 15.903 648 HG11 VAL 112 HG11 VAL 112 24.915 -1.252 15.818 649 HG12 VAL 112 HG12 VAL 112 24.801 -1.357 14.061 650 HG13 VAL 112 HG13 VAL 112 23.418 -1.796 15.064 651 HG21 VAL 112 HG21 VAL 112 25.071 1.031 13.396 652 HG22 VAL 112 HG22 VAL 112 25.792 1.014 15.001 653 HG23 VAL 112 HG23 VAL 112 24.616 2.258 14.571 654 H LEU 113 HN LEU 113 20.845 1.290 15.556 655 HA LEU 113 HA LEU 113 19.964 3.596 14.187 656 HB2 LEU 113 HB2 LEU 113 19.851 3.088 17.170 657 HB3 LEU 113 HB1 LEU 113 18.810 4.167 16.232 658 HG LEU 113 HG LEU 113 18.987 1.160 15.868 659 HD11 LEU 113 HD11 LEU 113 17.894 1.868 17.995 660 HD12 LEU 113 HD12 LEU 113 16.762 1.105 16.876 661 HD13 LEU 113 HD13 LEU 113 16.774 2.860 17.058 662 HD21 LEU 113 HD21 LEU 113 16.790 1.738 14.551 663 HD22 LEU 113 HD22 LEU 113 18.343 2.014 13.772 664 HD23 LEU 113 HD23 LEU 113 17.461 3.368 14.480 665 H ASP 114 HN ASP 114 22.601 3.032 16.437 666 HA ASP 114 HA ASP 114 23.286 5.903 16.268 667 HB2 ASP 114 HB2 ASP 114 23.751 3.988 18.530 668 HB3 ASP 114 HB1 ASP 114 24.427 5.613 18.428 669 HA PRO 115 HA PRO 115 26.761 3.702 14.263 670 HB2 PRO 115 HB2 PRO 115 27.518 5.760 12.630 671 HB3 PRO 115 HB1 PRO 115 26.158 4.687 12.248 672 HG2 PRO 115 HG2 PRO 115 26.134 7.453 13.325 673 HG3 PRO 115 HG1 PRO 115 25.007 6.671 12.200 674 HD2 PRO 115 HD2 PRO 115 24.543 7.058 14.906 675 HD3 PRO 115 HD1 PRO 115 23.703 5.851 13.906 676 H ARG 116 HN ARG 116 28.861 3.662 14.870 677 HA ARG 116 HA ARG 116 30.035 6.070 16.156 678 HB2 ARG 116 HB2 ARG 116 30.098 3.214 17.143 679 HB3 ARG 116 HB1 ARG 116 31.159 4.488 17.756 680 HG2 ARG 116 HG2 ARG 116 29.206 5.809 18.430 681 HG3 ARG 116 HG1 ARG 116 28.127 4.583 17.770 682 HD2 ARG 116 HD2 ARG 116 29.053 2.927 19.357 683 HD3 ARG 116 HD1 ARG 116 30.110 4.172 20.026 684 HE ARG 116 HE ARG 116 27.511 5.164 20.185 685 HH11 ARG 116 HH21 ARG 116 29.359 2.486 21.362 686 HH12 ARG 116 HH22 ARG 116 28.455 2.328 22.830 687 HH21 ARG 116 HH11 ARG 116 26.319 4.964 22.110 688 HH22 ARG 116 HH12 ARG 116 26.734 3.731 23.254 689 H CYS 117 HN CYS 117 31.901 6.648 15.288 690 HA CYS 117 HA CYS 117 33.118 5.583 13.092 691 HB2 CYS 117 HB2 CYS 117 34.549 6.875 15.420 692 HB3 CYS 117 HB1 CYS 117 35.170 6.741 13.771 693 H GLN 118 HN GLN 118 34.655 4.059 12.612 694 HA GLN 118 HA GLN 118 34.738 1.674 13.952 695 HB2 GLN 118 HB2 GLN 118 35.713 2.255 11.660 696 HB3 GLN 118 HB1 GLN 118 37.163 2.771 12.528 697 HG2 GLN 118 HG2 GLN 118 37.567 0.503 11.957 698 HG3 GLN 118 HG1 GLN 118 37.111 0.469 13.659 699 HE21 GLN 118 HE21 GLN 118 36.176 -0.547 10.449 700 HE22 GLN 118 HE22 GLN 118 34.769 -1.376 10.910 701 H ILE 119 HN ILE 119 36.453 4.600 14.710 702 HA ILE 119 HA ILE 119 38.206 3.271 16.629 703 HB ILE 119 HB ILE 119 38.999 5.180 15.201 704 HG12 ILE 119 HG12 ILE 119 40.093 6.389 17.126 705 HG13 ILE 119 HG11 ILE 119 39.034 5.501 18.220 706 HG21 ILE 119 HG21 ILE 119 37.307 6.876 17.044 707 HG22 ILE 119 HG22 ILE 119 36.820 6.437 15.408 708 HG23 ILE 119 HG23 ILE 119 38.267 7.408 15.664 709 HD11 ILE 119 HD11 ILE 119 40.137 3.502 17.897 710 HD12 ILE 119 HD12 ILE 119 41.477 4.602 17.594 711 HD13 ILE 119 HD13 ILE 119 40.607 3.888 16.239 712 H CYS 120 HN CYS 120 35.410 5.396 16.560 713 HA CYS 120 HA CYS 120 35.262 6.139 19.232 714 HB2 CYS 120 HB2 CYS 120 33.187 5.747 17.086 715 HB3 CYS 120 HB1 CYS 120 32.655 6.016 18.746 716 H VAL 121 HN VAL 121 34.168 3.164 17.686 717 HA VAL 121 HA VAL 121 32.948 2.055 20.008 718 HB VAL 121 HB VAL 121 33.074 -0.090 18.747 719 HG11 VAL 121 HG11 VAL 121 31.575 0.607 16.976 720 HG12 VAL 121 HG12 VAL 121 32.207 2.252 17.034 721 HG13 VAL 121 HG13 VAL 121 31.267 1.620 18.386 722 HG21 VAL 121 HG21 VAL 121 33.944 0.099 16.378 723 HG22 VAL 121 HG22 VAL 121 35.192 0.172 17.620 724 HG23 VAL 121 HG23 VAL 121 34.646 1.650 16.832 725 H HIS 122 HN HIS 122 36.175 1.837 18.590 726 HA HIS 122 HA HIS 122 37.098 0.037 20.702 727 HB2 HIS 122 HB2 HIS 122 38.462 1.250 18.291 728 HB3 HIS 122 HB1 HIS 122 39.290 0.229 19.473 729 HD2 HIS 122 HD2 HIS 122 37.983 -2.454 19.699 730 HE1 HIS 122 HE1 HIS 122 36.519 -2.265 15.744 731 HE2 HIS 122 HE2 HIS 122 36.943 -3.803 17.720 732 H SER 123 HN SER 123 36.492 3.229 20.580 733 HA SER 123 HA SER 123 38.912 4.314 21.686 734 HB2 SER 123 HB2 SER 123 36.093 5.382 21.546 735 HB3 SER 123 HB1 SER 123 37.447 6.289 22.205 736 HG SER 123 HG SER 123 38.487 5.811 20.116 737 H GLN 124 HN GLN 124 35.662 3.934 23.118 738 HA GLN 124 HA GLN 124 36.907 3.097 25.657 739 HB2 GLN 124 HB2 GLN 124 35.415 4.659 26.895 740 HB3 GLN 124 HB1 GLN 124 36.617 5.493 25.908 741 HG2 GLN 124 HG2 GLN 124 34.960 5.852 24.142 742 HG3 GLN 124 HG1 GLN 124 33.753 4.961 25.067 743 HE21 GLN 124 HE21 GLN 124 33.745 7.867 24.230 744 HE22 GLN 124 HE22 GLN 124 33.576 8.738 25.677 745 H ARG 125 HN ARG 125 35.473 1.618 23.640 746 HA ARG 125 HA ARG 125 33.746 0.114 23.433 747 HB2 ARG 125 HB2 ARG 125 33.902 0.367 26.443 748 HB3 ARG 125 HB1 ARG 125 32.931 -0.850 25.607 749 HG2 ARG 125 HG2 ARG 125 34.949 -1.710 24.489 750 HG3 ARG 125 HG1 ARG 125 35.929 -0.491 25.306 751 HD2 ARG 125 HD2 ARG 125 35.223 -1.430 27.496 752 HD3 ARG 125 HD1 ARG 125 34.318 -2.681 26.648 753 HE ARG 125 HE ARG 125 37.213 -2.520 26.936 754 HH11 ARG 125 HH21 ARG 125 34.486 -3.865 25.288 755 HH12 ARG 125 HH22 ARG 125 35.341 -5.260 24.722 756 HH21 ARG 125 HH11 ARG 125 38.344 -4.346 26.199 757 HH22 ARG 125 HH12 ARG 125 37.526 -5.532 25.237 758 H ASN 126 HN ASN 126 31.407 -0.291 24.814 759 HA ASN 126 HA ASN 126 29.842 1.980 23.939 760 HB2 ASN 126 HB2 ASN 126 29.043 -0.627 25.253 761 HB3 ASN 126 HB1 ASN 126 27.912 0.573 24.629 762 HD21 ASN 126 HD21 ASN 126 29.751 1.220 22.312 763 HD22 ASN 126 HD22 ASN 126 29.583 -0.088 21.245 Start of MODEL 16 1 H MET 31 HT1 MET 31 -5.701 16.895 -5.737 2 HA MET 31 HA MET 31 -3.298 15.423 -6.669 3 HB2 MET 31 HB2 MET 31 -6.125 14.529 -6.045 4 HB3 MET 31 HB1 MET 31 -4.988 13.566 -6.997 5 HG2 MET 31 HG2 MET 31 -3.415 13.507 -5.130 6 HG3 MET 31 HG1 MET 31 -4.462 14.563 -4.182 7 HE1 MET 31 HE1 MET 31 -5.694 11.381 -6.514 8 HE2 MET 31 HE2 MET 31 -5.022 10.214 -5.380 9 HE3 MET 31 HE3 MET 31 -3.979 11.446 -6.083 10 H GLY 32 HN GLY 32 -3.589 17.564 -8.053 11 HA2 GLY 32 HA2 GLY 32 -4.640 16.714 -10.589 12 HA3 GLY 32 HA1 GLY 32 -5.595 18.007 -9.868 13 H LYS 33 HN LYS 33 -4.372 18.488 -12.246 14 HA LYS 33 HA LYS 33 -2.818 19.791 -13.352 15 HB2 LYS 33 HB2 LYS 33 -4.227 21.442 -12.150 16 HB3 LYS 33 HB1 LYS 33 -3.081 21.424 -10.817 17 HG2 LYS 33 HG2 LYS 33 -1.279 22.130 -12.399 18 HG3 LYS 33 HG1 LYS 33 -2.483 22.229 -13.680 19 HD2 LYS 33 HD2 LYS 33 -2.720 23.764 -11.085 20 HD3 LYS 33 HD1 LYS 33 -1.924 24.425 -12.510 21 HE2 LYS 33 HE2 LYS 33 -4.104 23.889 -13.775 22 HE3 LYS 33 HE1 LYS 33 -4.831 23.657 -12.184 23 HZ1 LYS 33 HZ1 LYS 33 -5.193 25.889 -12.764 24 HZ2 LYS 33 HZ2 LYS 33 -3.585 26.112 -13.266 25 HZ3 LYS 33 HZ3 LYS 33 -3.944 25.910 -11.616 26 H ASN 34 HN ASN 34 -1.586 20.803 -10.223 27 HA ASN 34 HA ASN 34 0.518 20.710 -9.321 28 HB2 ASN 34 HB2 ASN 34 0.362 17.941 -10.529 29 HB3 ASN 34 HB1 ASN 34 1.609 18.469 -9.395 30 HD21 ASN 34 HD21 ASN 34 -0.429 20.182 -7.899 31 HD22 ASN 34 HD22 ASN 34 -1.333 19.069 -6.993 32 H ASP 35 HN ASP 35 1.449 22.313 -10.612 33 HA ASP 35 HA ASP 35 2.504 21.841 -13.207 34 HB2 ASP 35 HB2 ASP 35 3.045 23.969 -11.131 35 HB3 ASP 35 HB1 ASP 35 3.818 23.962 -12.720 36 H ASN 36 HN ASN 36 3.578 20.974 -10.089 37 HA ASN 36 HA ASN 36 6.404 20.821 -10.798 38 HB2 ASN 36 HB2 ASN 36 6.708 19.973 -8.532 39 HB3 ASN 36 HB1 ASN 36 5.707 21.427 -8.497 40 HD21 ASN 36 HD21 ASN 36 5.088 20.303 -6.305 41 HD22 ASN 36 HD22 ASN 36 3.781 19.222 -6.364 42 H ASP 37 HN ASP 37 3.967 19.144 -11.899 43 HA ASP 37 HA ASP 37 4.816 16.432 -11.297 44 HB2 ASP 37 HB2 ASP 37 2.411 17.104 -11.699 45 HB3 ASP 37 HB1 ASP 37 2.838 17.336 -13.394 46 H ALA 38 HN ALA 38 6.326 18.647 -12.939 47 HA ALA 38 HA ALA 38 6.708 17.604 -15.545 48 HB1 ALA 38 HB1 ALA 38 8.559 19.290 -13.856 49 HB2 ALA 38 HB2 ALA 38 7.347 19.891 -14.988 50 HB3 ALA 38 HB3 ALA 38 8.743 18.993 -15.584 51 H LEU 39 HN LEU 39 8.235 16.204 -16.391 52 HA LEU 39 HA LEU 39 9.836 14.681 -14.419 53 HB2 LEU 39 HB2 LEU 39 8.551 13.680 -16.969 54 HB3 LEU 39 HB1 LEU 39 9.581 12.735 -15.889 55 HG LEU 39 HG LEU 39 7.765 13.637 -14.069 56 HD11 LEU 39 HD11 LEU 39 5.520 13.592 -15.014 57 HD12 LEU 39 HD12 LEU 39 6.169 13.280 -16.625 58 HD13 LEU 39 HD13 LEU 39 6.470 14.830 -15.838 59 HD21 LEU 39 HD21 LEU 39 6.625 11.453 -14.307 60 HD22 LEU 39 HD22 LEU 39 8.376 11.281 -14.434 61 HD23 LEU 39 HD23 LEU 39 7.378 11.236 -15.888 62 H ILE 40 HN ILE 40 11.920 14.834 -14.676 63 HA ILE 40 HA ILE 40 13.007 15.937 -17.181 64 HB ILE 40 HB ILE 40 14.222 15.501 -14.448 65 HG12 ILE 40 HG12 ILE 40 14.348 17.965 -14.476 66 HG13 ILE 40 HG11 ILE 40 13.579 17.990 -16.064 67 HG21 ILE 40 HG21 ILE 40 15.447 16.416 -17.066 68 HG22 ILE 40 HG22 ILE 40 16.027 15.156 -15.975 69 HG23 ILE 40 HG23 ILE 40 16.142 16.850 -15.504 70 HD11 ILE 40 HD11 ILE 40 12.199 16.592 -13.782 71 HD12 ILE 40 HD12 ILE 40 11.499 17.363 -15.209 72 HD13 ILE 40 HD13 ILE 40 12.127 18.349 -13.897 73 H MET 41 HN MET 41 14.397 14.882 -18.487 74 HA MET 41 HA MET 41 14.521 11.975 -18.213 75 HB2 MET 41 HB2 MET 41 13.971 13.084 -20.392 76 HB3 MET 41 HB1 MET 41 15.612 13.733 -20.420 77 HG2 MET 41 HG2 MET 41 16.543 11.472 -20.373 78 HG3 MET 41 HG1 MET 41 14.922 10.785 -20.249 79 HE1 MET 41 HE1 MET 41 15.379 9.238 -22.284 80 HE2 MET 41 HE2 MET 41 17.011 9.899 -22.347 81 HE3 MET 41 HE3 MET 41 16.054 9.794 -23.822 82 H CYS 42 HN CYS 42 16.182 10.961 -17.305 83 HA CYS 42 HA CYS 42 18.640 12.412 -16.673 84 HB2 CYS 42 HB2 CYS 42 17.571 10.870 -15.038 85 HB3 CYS 42 HB1 CYS 42 17.893 9.524 -16.133 86 H MET 43 HN MET 43 20.093 12.603 -18.282 87 HA MET 43 HA MET 43 20.207 10.906 -20.553 88 HB2 MET 43 HB2 MET 43 22.260 12.069 -21.098 89 HB3 MET 43 HB1 MET 43 21.096 13.232 -20.464 90 HG2 MET 43 HG2 MET 43 23.012 13.812 -19.259 91 HG3 MET 43 HG1 MET 43 22.249 12.672 -18.145 92 HE1 MET 43 HE1 MET 43 24.931 11.934 -16.949 93 HE2 MET 43 HE2 MET 43 24.787 13.505 -17.733 94 HE3 MET 43 HE3 MET 43 26.161 12.466 -18.101 95 H ARG 44 HN ARG 44 21.142 10.320 -17.389 96 HA ARG 44 HA ARG 44 23.422 8.626 -18.028 97 HB2 ARG 44 HB2 ARG 44 23.065 10.014 -15.865 98 HB3 ARG 44 HB1 ARG 44 22.000 8.703 -15.380 99 HG2 ARG 44 HG2 ARG 44 24.016 7.926 -14.511 100 HG3 ARG 44 HG1 ARG 44 24.062 7.177 -16.100 101 HD2 ARG 44 HD2 ARG 44 25.432 9.039 -16.945 102 HD3 ARG 44 HD1 ARG 44 25.351 9.821 -15.367 103 HE ARG 44 HE ARG 44 26.393 7.151 -15.202 104 HH11 ARG 44 HH21 ARG 44 27.087 10.446 -15.982 105 HH12 ARG 44 HH22 ARG 44 28.778 10.320 -15.624 106 HH21 ARG 44 HH11 ARG 44 28.602 6.972 -14.729 107 HH22 ARG 44 HH12 ARG 44 29.636 8.351 -14.914 108 H CYS 45 HN CYS 45 20.396 7.984 -16.244 109 HA CYS 45 HA CYS 45 20.447 5.213 -17.271 110 HB2 CYS 45 HB2 CYS 45 18.947 4.697 -15.400 111 HB3 CYS 45 HB1 CYS 45 20.420 5.476 -14.821 112 H ARG 46 HN ARG 46 19.338 7.868 -18.489 113 HA ARG 46 HA ARG 46 17.434 8.573 -19.627 114 HB2 ARG 46 HB2 ARG 46 17.318 5.616 -20.206 115 HB3 ARG 46 HB1 ARG 46 16.599 6.911 -21.173 116 HG2 ARG 46 HG2 ARG 46 18.920 7.892 -21.420 117 HG3 ARG 46 HG1 ARG 46 19.549 6.428 -20.665 118 HD2 ARG 46 HD2 ARG 46 18.397 5.091 -22.434 119 HD3 ARG 46 HD1 ARG 46 17.942 6.600 -23.218 120 HE ARG 46 HE ARG 46 20.601 5.409 -23.152 121 HH11 ARG 46 HH21 ARG 46 18.625 8.191 -23.740 122 HH12 ARG 46 HH22 ARG 46 19.789 8.972 -24.756 123 HH21 ARG 46 HH11 ARG 46 22.129 6.426 -24.483 124 HH22 ARG 46 HH12 ARG 46 21.774 7.974 -25.176 125 H LYS 47 HN LYS 47 17.018 7.814 -16.797 126 HA LYS 47 HA LYS 47 14.338 6.635 -16.777 127 HB2 LYS 47 HB2 LYS 47 16.020 6.046 -15.030 128 HB3 LYS 47 HB1 LYS 47 15.968 7.723 -14.478 129 HG2 LYS 47 HG2 LYS 47 13.594 7.534 -13.975 130 HG3 LYS 47 HG1 LYS 47 13.554 5.904 -14.647 131 HD2 LYS 47 HD2 LYS 47 13.710 5.649 -12.264 132 HD3 LYS 47 HD1 LYS 47 15.295 5.254 -12.922 133 HE2 LYS 47 HE2 LYS 47 16.233 7.308 -12.212 134 HE3 LYS 47 HE1 LYS 47 14.651 8.052 -11.977 135 HZ1 LYS 47 HZ1 LYS 47 14.991 7.492 -9.851 136 HZ2 LYS 47 HZ2 LYS 47 16.168 6.323 -10.226 137 HZ3 LYS 47 HZ3 LYS 47 14.517 5.937 -10.339 138 H VAL 48 HN VAL 48 12.479 7.752 -16.468 139 HA VAL 48 HA VAL 48 12.673 10.708 -16.319 140 HB VAL 48 HB VAL 48 10.153 10.367 -17.143 141 HG11 VAL 48 HG11 VAL 48 11.073 10.289 -19.528 142 HG12 VAL 48 HG12 VAL 48 12.672 10.140 -18.799 143 HG13 VAL 48 HG13 VAL 48 11.694 11.577 -18.496 144 HG21 VAL 48 HG21 VAL 48 9.840 8.381 -18.461 145 HG22 VAL 48 HG22 VAL 48 10.429 7.847 -16.888 146 HG23 VAL 48 HG23 VAL 48 11.530 7.912 -18.264 147 H LYS 49 HN LYS 49 12.212 11.545 -14.437 148 HA LYS 49 HA LYS 49 9.982 10.521 -12.848 149 HB2 LYS 49 HB2 LYS 49 12.846 10.358 -12.103 150 HB3 LYS 49 HB1 LYS 49 11.746 10.909 -10.840 151 HG2 LYS 49 HG2 LYS 49 11.112 8.431 -12.436 152 HG3 LYS 49 HG1 LYS 49 12.223 8.349 -11.073 153 HD2 LYS 49 HD2 LYS 49 10.498 9.321 -9.600 154 HD3 LYS 49 HD1 LYS 49 9.374 9.397 -10.955 155 HE2 LYS 49 HE2 LYS 49 8.892 7.391 -9.697 156 HE3 LYS 49 HE1 LYS 49 9.639 6.913 -11.222 157 HZ1 LYS 49 HZ1 LYS 49 10.766 6.890 -8.513 158 HZ2 LYS 49 HZ2 LYS 49 11.810 7.101 -9.837 159 HZ3 LYS 49 HZ3 LYS 49 10.850 5.705 -9.723 160 H GLY 50 HN GLY 50 9.541 11.971 -10.984 161 HA2 GLY 50 HA2 GLY 50 9.654 14.745 -11.921 162 HA3 GLY 50 HA1 GLY 50 8.613 14.105 -10.659 163 H ILE 51 HN ILE 51 9.574 16.300 -9.831 164 HA ILE 51 HA ILE 51 12.165 16.600 -8.940 165 HB ILE 51 HB ILE 51 10.294 18.274 -8.753 166 HG12 ILE 51 HG12 ILE 51 11.766 17.820 -6.143 167 HG13 ILE 51 HG11 ILE 51 12.544 18.459 -7.591 168 HG21 ILE 51 HG21 ILE 51 9.668 16.868 -6.150 169 HG22 ILE 51 HG22 ILE 51 8.749 16.573 -7.626 170 HG23 ILE 51 HG23 ILE 51 8.779 18.186 -6.915 171 HD11 ILE 51 HD11 ILE 51 10.054 19.698 -6.413 172 HD12 ILE 51 HD12 ILE 51 11.155 20.394 -7.600 173 HD13 ILE 51 HD13 ILE 51 11.678 20.191 -5.929 174 H ASP 52 HN ASP 52 10.017 14.136 -8.011 175 HA ASP 52 HA ASP 52 10.775 13.744 -5.307 176 HB2 ASP 52 HB2 ASP 52 8.751 12.765 -6.390 177 HB3 ASP 52 HB1 ASP 52 9.807 11.691 -7.305 178 H SER 53 HN SER 53 11.947 12.483 -8.374 179 HA SER 53 HA SER 53 14.168 11.107 -6.974 180 HB2 SER 53 HB2 SER 53 14.340 9.652 -8.736 181 HB3 SER 53 HB1 SER 53 12.646 10.092 -8.914 182 HG SER 53 HG SER 53 14.545 10.386 -10.670 183 H TYR 54 HN TYR 54 13.667 14.090 -7.993 184 HA TYR 54 HA TYR 54 16.450 14.474 -8.948 185 HB2 TYR 54 HB2 TYR 54 13.879 15.422 -10.096 186 HB3 TYR 54 HB1 TYR 54 15.137 16.656 -9.993 187 HD1 TYR 54 HD1 TYR 54 14.686 13.069 -11.049 188 HD2 TYR 54 HD2 TYR 54 16.689 16.803 -11.736 189 HE1 TYR 54 HE1 TYR 54 15.812 12.101 -13.029 190 HE2 TYR 54 HE2 TYR 54 17.814 15.830 -13.701 191 HH TYR 54 HH TYR 54 18.238 12.817 -14.288 192 H SER 55 HN SER 55 17.626 15.978 -7.964 193 HA SER 55 HA SER 55 16.760 17.029 -5.467 194 HB2 SER 55 HB2 SER 55 19.098 16.505 -5.787 195 HB3 SER 55 HB1 SER 55 19.198 17.599 -7.169 196 HG SER 55 HG SER 55 19.306 18.123 -4.489 197 H LYS 56 HN LYS 56 16.434 19.199 -4.890 198 HA LYS 56 HA LYS 56 14.860 20.729 -6.633 199 HB2 LYS 56 HB2 LYS 56 14.998 20.836 -4.083 200 HB3 LYS 56 HB1 LYS 56 16.411 21.863 -4.309 201 HG2 LYS 56 HG2 LYS 56 15.101 23.459 -5.609 202 HG3 LYS 56 HG1 LYS 56 13.684 22.419 -5.517 203 HD2 LYS 56 HD2 LYS 56 15.046 23.423 -3.015 204 HD3 LYS 56 HD1 LYS 56 13.843 24.404 -3.849 205 HE2 LYS 56 HE2 LYS 56 12.267 22.406 -3.684 206 HE3 LYS 56 HE1 LYS 56 13.450 21.665 -2.607 207 HZ1 LYS 56 HZ1 LYS 56 11.832 24.085 -2.192 208 HZ2 LYS 56 HZ2 LYS 56 13.304 23.896 -1.366 209 HZ3 LYS 56 HZ3 LYS 56 12.058 22.759 -1.161 210 H THR 57 HN THR 57 18.299 20.936 -5.819 211 HA THR 57 HA THR 57 18.851 23.347 -7.170 212 HB THR 57 HB THR 57 20.656 20.967 -6.679 213 HG1 THR 57 HG1 THR 57 20.303 23.383 -5.242 214 HG21 THR 57 HG21 THR 57 21.738 22.294 -8.311 215 HG22 THR 57 HG22 THR 57 22.412 22.850 -6.779 216 HG23 THR 57 HG23 THR 57 21.166 23.799 -7.588 217 H GLN 58 HN GLN 58 19.166 19.958 -8.261 218 HA GLN 58 HA GLN 58 19.976 20.633 -10.903 219 HB2 GLN 58 HB2 GLN 58 18.805 18.110 -9.726 220 HB3 GLN 58 HB1 GLN 58 19.353 18.240 -11.397 221 HG2 GLN 58 HG2 GLN 58 21.603 18.837 -10.645 222 HG3 GLN 58 HG1 GLN 58 21.073 18.804 -8.965 223 HE21 GLN 58 HE21 GLN 58 23.092 17.055 -10.473 224 HE22 GLN 58 HE22 GLN 58 22.571 15.463 -10.161 225 H TRP 59 HN TRP 59 16.847 19.967 -9.412 226 HA TRP 59 HA TRP 59 15.351 19.900 -11.824 227 HB2 TRP 59 HB2 TRP 59 14.558 18.989 -9.645 228 HB3 TRP 59 HB1 TRP 59 14.398 20.646 -9.051 229 HD1 TRP 59 HD1 TRP 59 13.010 18.312 -11.763 230 HE1 TRP 59 HE1 TRP 59 10.665 19.160 -12.460 231 HE3 TRP 59 HE3 TRP 59 12.795 22.617 -9.042 232 HZ2 TRP 59 HZ2 TRP 59 8.941 21.374 -11.923 233 HZ3 TRP 59 HZ3 TRP 59 10.794 24.076 -9.143 234 HH2 TRP 59 HH2 TRP 59 8.868 23.459 -10.579 235 H SER 60 HN SER 60 16.231 22.473 -9.569 236 HA SER 60 HA SER 60 14.598 24.510 -10.611 237 HB2 SER 60 HB2 SER 60 15.795 24.666 -8.447 238 HB3 SER 60 HB1 SER 60 17.319 24.791 -9.320 239 HG SER 60 HG SER 60 15.475 26.689 -8.800 240 H LYS 61 HN LYS 61 17.237 22.922 -12.004 241 HA LYS 61 HA LYS 61 18.124 25.161 -13.651 242 HB2 LYS 61 HB2 LYS 61 18.881 22.234 -13.652 243 HB3 LYS 61 HB1 LYS 61 19.590 23.445 -14.713 244 HG2 LYS 61 HG2 LYS 61 20.366 24.725 -12.785 245 HG3 LYS 61 HG1 LYS 61 19.606 23.575 -11.691 246 HD2 LYS 61 HD2 LYS 61 21.050 21.775 -12.636 247 HD3 LYS 61 HD1 LYS 61 21.859 22.989 -13.627 248 HE2 LYS 61 HE2 LYS 61 22.547 24.203 -11.614 249 HE3 LYS 61 HE1 LYS 61 21.704 23.026 -10.606 250 HZ1 LYS 61 HZ1 LYS 61 23.407 21.627 -10.749 251 HZ2 LYS 61 HZ2 LYS 61 24.308 22.872 -11.473 252 HZ3 LYS 61 HZ3 LYS 61 23.472 21.752 -12.440 253 H THR 62 HN THR 62 15.620 22.932 -13.700 254 HA THR 62 HA THR 62 15.450 22.344 -16.482 255 HB THR 62 HB THR 62 13.096 21.741 -15.987 256 HG1 THR 62 HG1 THR 62 13.633 23.351 -13.839 257 HG21 THR 62 HG21 THR 62 14.660 20.029 -15.500 258 HG22 THR 62 HG22 THR 62 13.639 20.141 -14.065 259 HG23 THR 62 HG23 THR 62 15.247 20.865 -14.060 260 H PHE 63 HN PHE 63 15.272 25.284 -14.991 261 HA PHE 63 HA PHE 63 14.113 26.538 -17.285 262 HB2 PHE 63 HB2 PHE 63 12.469 27.831 -15.851 263 HB3 PHE 63 HB1 PHE 63 12.050 26.145 -16.152 264 HD1 PHE 63 HD1 PHE 63 13.579 28.456 -13.659 265 HD2 PHE 63 HD2 PHE 63 11.873 24.584 -14.384 266 HE1 PHE 63 HE1 PHE 63 13.539 28.015 -11.217 267 HE2 PHE 63 HE2 PHE 63 11.835 24.132 -11.947 268 HZ PHE 63 HZ PHE 63 12.668 25.855 -10.361 269 H THR 64 HN THR 64 14.323 28.881 -17.158 270 HA THR 64 HA THR 64 16.333 29.809 -15.200 271 HB THR 64 HB THR 64 17.432 31.032 -17.086 272 HG1 THR 64 HG1 THR 64 15.607 29.462 -18.542 273 HG21 THR 64 HG21 THR 64 17.348 28.032 -17.037 274 HG22 THR 64 HG22 THR 64 18.568 29.108 -16.361 275 HG23 THR 64 HG23 THR 64 18.438 28.908 -18.108 276 H PHE 65 HN PHE 65 16.552 32.252 -15.347 277 HA PHE 65 HA PHE 65 13.847 33.430 -15.596 278 HB2 PHE 65 HB2 PHE 65 15.649 33.415 -13.444 279 HB3 PHE 65 HB1 PHE 65 15.822 35.030 -14.116 280 HD1 PHE 65 HD2 PHE 65 13.047 32.588 -13.492 281 HD2 PHE 65 HD1 PHE 65 14.416 36.646 -13.153 282 HE1 PHE 65 HE2 PHE 65 10.893 33.229 -12.451 283 HE2 PHE 65 HE1 PHE 65 12.258 37.283 -12.108 284 HZ PHE 65 HZ PHE 65 10.498 35.579 -11.768 285 H VAL 66 HN VAL 66 13.500 34.782 -17.187 286 HA VAL 66 HA VAL 66 15.750 36.374 -18.270 287 HB VAL 66 HB VAL 66 13.653 34.834 -19.810 288 HG11 VAL 66 HG11 VAL 66 13.777 36.932 -20.916 289 HG12 VAL 66 HG12 VAL 66 14.892 35.893 -21.803 290 HG13 VAL 66 HG13 VAL 66 15.513 37.068 -20.643 291 HG21 VAL 66 HG21 VAL 66 16.680 34.833 -20.000 292 HG22 VAL 66 HG22 VAL 66 15.561 33.717 -20.783 293 HG23 VAL 66 HG23 VAL 66 15.766 33.675 -19.032 294 H ARG 67 HN ARG 67 15.333 38.474 -18.490 295 HA ARG 67 HA ARG 67 14.226 40.470 -18.180 296 HB2 ARG 67 HB2 ARG 67 12.298 38.913 -19.913 297 HB3 ARG 67 HB1 ARG 67 12.127 40.639 -19.570 298 HG2 ARG 67 HG2 ARG 67 14.397 41.028 -20.499 299 HG3 ARG 67 HG1 ARG 67 14.517 39.311 -20.887 300 HD2 ARG 67 HD2 ARG 67 12.324 41.123 -21.930 301 HD3 ARG 67 HD1 ARG 67 13.798 40.746 -22.827 302 HE ARG 67 HE ARG 67 11.519 39.019 -22.461 303 HH11 ARG 67 HH21 ARG 67 14.942 39.195 -22.942 304 HH12 ARG 67 HH22 ARG 67 15.058 37.635 -23.685 305 HH21 ARG 67 HH11 ARG 67 11.664 36.969 -23.435 306 HH22 ARG 67 HH12 ARG 67 13.202 36.375 -23.963 307 H GLY 68 HN GLY 68 13.756 38.360 -16.141 308 HA2 GLY 68 HA2 GLY 68 12.581 38.325 -14.157 309 HA3 GLY 68 HA1 GLY 68 11.628 39.690 -14.740 310 H ARG 69 HN ARG 69 11.928 36.815 -16.676 311 HA ARG 69 HA ARG 69 9.202 35.944 -15.898 312 HB2 ARG 69 HB2 ARG 69 9.123 37.260 -18.001 313 HB3 ARG 69 HB1 ARG 69 10.265 36.129 -18.728 314 HG2 ARG 69 HG2 ARG 69 8.705 34.285 -18.427 315 HG3 ARG 69 HG1 ARG 69 7.580 35.337 -17.567 316 HD2 ARG 69 HD2 ARG 69 6.846 35.092 -19.879 317 HD3 ARG 69 HD1 ARG 69 7.387 36.746 -19.608 318 HE ARG 69 HE ARG 69 9.196 36.353 -21.037 319 HH11 ARG 69 HH21 ARG 69 7.518 33.435 -20.244 320 HH12 ARG 69 HH22 ARG 69 8.329 32.479 -21.440 321 HH21 ARG 69 HH11 ARG 69 10.264 35.108 -22.609 322 HH22 ARG 69 HH12 ARG 69 9.884 33.427 -22.780 323 H THR 70 HN THR 70 9.019 33.835 -15.524 324 HA THR 70 HA THR 70 11.282 32.130 -15.510 325 HB THR 70 HB THR 70 8.388 31.263 -15.440 326 HG1 THR 70 HG1 THR 70 9.289 33.035 -13.938 327 HG21 THR 70 HG21 THR 70 10.029 29.454 -15.608 328 HG22 THR 70 HG22 THR 70 9.328 29.478 -13.990 329 HG23 THR 70 HG23 THR 70 10.942 30.135 -14.262 330 H VAL 71 HN VAL 71 12.119 30.868 -17.058 331 HA VAL 71 HA VAL 71 10.469 30.179 -19.419 332 HB VAL 71 HB VAL 71 12.605 30.540 -20.780 333 HG11 VAL 71 HG11 VAL 71 11.124 32.843 -19.484 334 HG12 VAL 71 HG12 VAL 71 10.749 32.059 -21.020 335 HG13 VAL 71 HG13 VAL 71 12.207 33.039 -20.862 336 HG21 VAL 71 HG21 VAL 71 14.021 30.714 -18.659 337 HG22 VAL 71 HG22 VAL 71 13.336 32.323 -18.441 338 HG23 VAL 71 HG23 VAL 71 14.304 31.959 -19.871 339 H SER 72 HN SER 72 10.663 28.122 -20.096 340 HA SER 72 HA SER 72 12.244 26.304 -18.495 341 HB2 SER 72 HB2 SER 72 11.152 24.551 -19.752 342 HB3 SER 72 HB1 SER 72 9.954 25.742 -19.233 343 HG SER 72 HG SER 72 9.642 25.290 -21.402 344 H VAL 73 HN VAL 73 14.160 25.386 -19.035 345 HA VAL 73 HA VAL 73 15.554 26.390 -21.330 346 HB VAL 73 HB VAL 73 17.408 24.957 -20.543 347 HG11 VAL 73 HG11 VAL 73 16.238 26.317 -18.130 348 HG12 VAL 73 HG12 VAL 73 16.738 27.270 -19.525 349 HG13 VAL 73 HG13 VAL 73 17.913 26.273 -18.669 350 HG21 VAL 73 HG21 VAL 73 16.925 23.880 -18.227 351 HG22 VAL 73 HG22 VAL 73 16.402 23.031 -19.676 352 HG23 VAL 73 HG23 VAL 73 15.241 23.949 -18.726 353 H SER 74 HN SER 74 15.465 25.549 -23.334 354 HA SER 74 HA SER 74 14.068 23.112 -23.878 355 HB2 SER 74 HB2 SER 74 14.082 24.995 -25.463 356 HB3 SER 74 HB1 SER 74 15.815 24.792 -25.690 357 HG SER 74 HG SER 74 14.363 23.726 -27.253 358 H ASP 75 HN ASP 75 16.877 23.371 -22.405 359 HA ASP 75 HA ASP 75 17.868 20.822 -23.454 360 HB2 ASP 75 HB2 ASP 75 20.195 21.707 -23.579 361 HB3 ASP 75 HB1 ASP 75 19.114 22.419 -24.781 362 HA PRO 76 HA PRO 76 18.276 21.347 -18.856 363 HB2 PRO 76 HB2 PRO 76 16.495 19.435 -18.072 364 HB3 PRO 76 HB1 PRO 76 16.004 21.096 -18.448 365 HG2 PRO 76 HG2 PRO 76 15.707 18.623 -20.073 366 HG3 PRO 76 HG1 PRO 76 14.651 20.042 -19.972 367 HD2 PRO 76 HD2 PRO 76 16.506 19.536 -22.031 368 HD3 PRO 76 HD1 PRO 76 15.750 21.107 -21.692 369 H LYS 77 HN LYS 77 20.392 20.474 -19.214 370 HA LYS 77 HA LYS 77 20.647 17.548 -19.389 371 HB2 LYS 77 HB2 LYS 77 23.161 18.239 -19.473 372 HB3 LYS 77 HB1 LYS 77 22.145 18.541 -20.882 373 HG2 LYS 77 HG2 LYS 77 21.808 20.864 -20.191 374 HG3 LYS 77 HG1 LYS 77 22.741 20.587 -18.718 375 HD2 LYS 77 HD2 LYS 77 23.798 20.286 -21.542 376 HD3 LYS 77 HD1 LYS 77 24.086 21.678 -20.501 377 HE2 LYS 77 HE2 LYS 77 26.000 20.489 -19.990 378 HE3 LYS 77 HE1 LYS 77 24.924 19.707 -18.830 379 HZ1 LYS 77 HZ1 LYS 77 24.818 18.604 -21.494 380 HZ2 LYS 77 HZ2 LYS 77 24.929 17.814 -19.993 381 HZ3 LYS 77 HZ3 LYS 77 26.326 18.429 -20.740 382 H VAL 78 HN VAL 78 20.029 16.921 -17.325 383 HA VAL 78 HA VAL 78 22.020 17.451 -15.221 384 HB VAL 78 HB VAL 78 19.998 17.480 -13.594 385 HG11 VAL 78 HG11 VAL 78 21.436 19.429 -14.007 386 HG12 VAL 78 HG12 VAL 78 19.748 19.934 -13.897 387 HG13 VAL 78 HG13 VAL 78 20.530 19.806 -15.472 388 HG21 VAL 78 HG21 VAL 78 17.880 18.046 -14.442 389 HG22 VAL 78 HG22 VAL 78 18.457 16.874 -15.632 390 HG23 VAL 78 HG23 VAL 78 18.534 18.596 -15.986 391 H ILE 79 HN ILE 79 21.971 15.841 -13.522 392 HA ILE 79 HA ILE 79 21.161 13.190 -14.546 393 HB ILE 79 HB ILE 79 23.200 13.962 -12.441 394 HG12 ILE 79 HG12 ILE 79 23.611 12.733 -15.181 395 HG13 ILE 79 HG11 ILE 79 23.733 14.466 -14.876 396 HG21 ILE 79 HG21 ILE 79 22.379 11.829 -11.837 397 HG22 ILE 79 HG22 ILE 79 23.810 11.473 -12.795 398 HG23 ILE 79 HG23 ILE 79 22.206 11.316 -13.512 399 HD11 ILE 79 HD11 ILE 79 25.924 13.121 -14.784 400 HD12 ILE 79 HD12 ILE 79 25.315 12.454 -13.268 401 HD13 ILE 79 HD13 ILE 79 25.591 14.190 -13.421 402 H CYS 80 HN CYS 80 20.299 11.642 -13.040 403 HA CYS 80 HA CYS 80 18.376 12.836 -11.227 404 HB2 CYS 80 HB2 CYS 80 17.408 10.659 -11.072 405 HB3 CYS 80 HB1 CYS 80 17.863 10.890 -12.757 406 H ARG 81 HN ARG 81 18.034 11.726 -9.047 407 HA ARG 81 HA ARG 81 20.451 12.018 -7.523 408 HB2 ARG 81 HB2 ARG 81 17.645 11.193 -6.769 409 HB3 ARG 81 HB1 ARG 81 18.954 11.421 -5.607 410 HG2 ARG 81 HG2 ARG 81 19.191 13.740 -6.212 411 HG3 ARG 81 HG1 ARG 81 18.083 13.553 -7.570 412 HD2 ARG 81 HD2 ARG 81 16.902 14.591 -5.704 413 HD3 ARG 81 HD1 ARG 81 16.268 12.972 -5.976 414 HE ARG 81 HE ARG 81 18.358 12.911 -4.041 415 HH11 ARG 81 HH21 ARG 81 15.063 13.838 -4.559 416 HH12 ARG 81 HH22 ARG 81 14.597 13.626 -2.905 417 HH21 ARG 81 HH11 ARG 81 17.754 12.631 -1.869 418 HH22 ARG 81 HH12 ARG 81 16.122 12.943 -1.382 419 H THR 82 HN THR 82 18.713 9.391 -8.951 420 HA THR 82 HA THR 82 19.688 7.297 -7.283 421 HB THR 82 HB THR 82 18.822 7.056 -10.166 422 HG1 THR 82 HG1 THR 82 17.049 6.570 -8.110 423 HG21 THR 82 HG21 THR 82 18.881 5.165 -7.799 424 HG22 THR 82 HG22 THR 82 19.825 5.037 -9.285 425 HG23 THR 82 HG23 THR 82 18.078 4.805 -9.326 426 H CYS 83 HN CYS 83 20.833 8.783 -10.271 427 HA CYS 83 HA CYS 83 23.019 6.932 -10.602 428 HB2 CYS 83 HB2 CYS 83 22.243 9.506 -11.957 429 HB3 CYS 83 HB1 CYS 83 23.748 8.666 -12.337 430 H GLN 84 HN GLN 84 22.530 9.279 -8.367 431 HA GLN 84 HA GLN 84 24.602 11.005 -8.172 432 HB2 GLN 84 HB2 GLN 84 23.079 9.416 -6.201 433 HB3 GLN 84 HB1 GLN 84 24.640 9.953 -5.602 434 HG2 GLN 84 HG2 GLN 84 24.107 12.244 -5.967 435 HG3 GLN 84 HG1 GLN 84 22.699 11.839 -6.951 436 HE21 GLN 84 HE21 GLN 84 23.917 11.087 -3.629 437 HE22 GLN 84 HE22 GLN 84 22.407 11.289 -2.879 438 HA PRO 85 HA PRO 85 27.739 7.720 -6.516 439 HB2 PRO 85 HB2 PRO 85 27.040 5.063 -6.978 440 HB3 PRO 85 HB1 PRO 85 26.753 5.920 -5.449 441 HG2 PRO 85 HG2 PRO 85 24.871 5.433 -7.724 442 HG3 PRO 85 HG1 PRO 85 24.584 5.296 -5.977 443 HD2 PRO 85 HD2 PRO 85 23.742 7.448 -7.322 444 HD3 PRO 85 HD1 PRO 85 24.418 7.617 -5.687 445 H LYS 86 HN LYS 86 29.470 7.143 -7.774 446 HA LYS 86 HA LYS 86 28.987 6.870 -10.682 447 HB2 LYS 86 HB2 LYS 86 31.307 7.642 -10.942 448 HB3 LYS 86 HB1 LYS 86 30.355 8.805 -10.018 449 HG2 LYS 86 HG2 LYS 86 31.251 7.859 -7.912 450 HG3 LYS 86 HG1 LYS 86 32.229 6.724 -8.842 451 HD2 LYS 86 HD2 LYS 86 33.390 8.600 -9.933 452 HD3 LYS 86 HD1 LYS 86 32.415 9.744 -9.007 453 HE2 LYS 86 HE2 LYS 86 33.317 8.815 -6.906 454 HE3 LYS 86 HE1 LYS 86 34.297 7.677 -7.832 455 HZ1 LYS 86 HZ1 LYS 86 34.520 10.514 -8.491 456 HZ2 LYS 86 HZ2 LYS 86 35.704 9.296 -8.524 457 HZ3 LYS 86 HZ3 LYS 86 35.235 9.990 -7.045 458 H GLN 87 HN GLN 87 30.233 5.345 -11.861 459 HA GLN 87 HA GLN 87 31.182 3.040 -10.248 460 HB2 GLN 87 HB2 GLN 87 30.498 1.623 -12.125 461 HB3 GLN 87 HB1 GLN 87 29.134 2.588 -11.557 462 HG2 GLN 87 HG2 GLN 87 29.606 4.246 -13.362 463 HG3 GLN 87 HG1 GLN 87 30.872 3.181 -13.970 464 HE21 GLN 87 HE21 GLN 87 29.219 3.384 -15.928 465 HE22 GLN 87 HE22 GLN 87 28.030 2.176 -15.996 466 H HIS 88 HN HIS 88 32.209 1.710 -12.598 467 HA HIS 88 HA HIS 88 34.861 2.682 -12.574 468 HB2 HIS 88 HB2 HIS 88 33.459 0.776 -14.467 469 HB3 HIS 88 HB1 HIS 88 35.207 1.051 -14.436 470 HD2 HIS 88 HD2 HIS 88 36.558 -0.368 -12.451 471 HE1 HIS 88 HE1 HIS 88 33.159 -1.801 -10.396 472 HE2 HIS 88 HE2 HIS 88 35.692 -1.926 -10.544 473 H ASP 89 HN ASP 89 36.056 3.746 -14.159 474 HA ASP 89 HA ASP 89 34.556 5.010 -16.373 475 HB2 ASP 89 HB2 ASP 89 34.824 6.547 -14.363 476 HB3 ASP 89 HB1 ASP 89 36.558 6.496 -14.671 477 H SER 90 HN SER 90 35.831 5.619 -18.151 478 HA SER 90 HA SER 90 38.625 4.681 -18.207 479 HB2 SER 90 HB2 SER 90 36.428 3.844 -20.109 480 HB3 SER 90 HB1 SER 90 38.148 3.664 -20.468 481 HG SER 90 HG SER 90 36.746 2.587 -18.239 482 H ILE 91 HN ILE 91 39.846 5.547 -19.984 483 HA ILE 91 HA ILE 91 38.695 8.017 -21.165 484 HB ILE 91 HB ILE 91 41.477 7.632 -20.039 485 HG12 ILE 91 HG12 ILE 91 39.284 9.550 -19.199 486 HG13 ILE 91 HG11 ILE 91 39.542 7.983 -18.421 487 HG21 ILE 91 HG21 ILE 91 41.634 10.106 -20.585 488 HG22 ILE 91 HG22 ILE 91 40.152 9.920 -21.521 489 HG23 ILE 91 HG23 ILE 91 41.607 9.044 -21.994 490 HD11 ILE 91 HD11 ILE 91 41.913 8.666 -17.992 491 HD12 ILE 91 HD12 ILE 91 40.733 9.659 -17.143 492 HD13 ILE 91 HD13 ILE 91 41.518 10.272 -18.599 493 H TRP 92 HN TRP 92 38.953 8.240 -23.293 494 HA TRP 92 HA TRP 92 40.238 6.116 -24.792 495 HB2 TRP 92 HB2 TRP 92 38.074 7.135 -25.505 496 HB3 TRP 92 HB1 TRP 92 38.932 8.651 -25.811 497 HD1 TRP 92 HD1 TRP 92 41.120 8.356 -27.578 498 HE1 TRP 92 HE1 TRP 92 41.204 7.003 -29.757 499 HE3 TRP 92 HE3 TRP 92 37.202 5.194 -26.778 500 HZ2 TRP 92 HZ2 TRP 92 39.794 4.847 -31.003 501 HZ3 TRP 92 HZ3 TRP 92 36.592 3.494 -28.478 502 HH2 TRP 92 HH2 TRP 92 37.882 3.319 -30.588 503 H CYS 93 HN CYS 93 42.283 6.136 -25.443 504 HA CYS 93 HA CYS 93 43.873 8.585 -25.198 505 HB2 CYS 93 HB2 CYS 93 44.761 6.478 -24.285 506 HB3 CYS 93 HB1 CYS 93 44.726 5.774 -25.902 507 H THR 94 HN THR 94 44.601 9.761 -26.859 508 HA THR 94 HA THR 94 43.869 8.956 -29.580 509 HB THR 94 HB THR 94 44.108 11.201 -30.168 510 HG1 THR 94 HG1 THR 94 45.445 12.607 -29.037 511 HG21 THR 94 HG21 THR 94 43.505 11.358 -27.203 512 HG22 THR 94 HG22 THR 94 42.340 10.847 -28.424 513 HG23 THR 94 HG23 THR 94 42.982 12.490 -28.450 514 H ALA 95 HN ALA 95 46.509 8.705 -27.484 515 HA ALA 95 HA ALA 95 48.536 8.852 -29.601 516 HB1 ALA 95 HB1 ALA 95 50.146 8.790 -27.883 517 HB2 ALA 95 HB2 ALA 95 49.023 8.068 -26.731 518 HB3 ALA 95 HB3 ALA 95 48.837 9.755 -27.202 519 H CYS 96 HN CYS 96 46.489 6.564 -28.102 520 HA CYS 96 HA CYS 96 48.115 4.326 -29.177 521 HB2 CYS 96 HB2 CYS 96 46.326 4.301 -26.729 522 HB3 CYS 96 HB1 CYS 96 47.205 2.916 -27.381 523 H GLN 97 HN GLN 97 45.241 6.074 -29.304 524 HA GLN 97 HA GLN 97 43.226 5.755 -30.375 525 HB2 GLN 97 HB2 GLN 97 44.961 3.782 -31.874 526 HB3 GLN 97 HB1 GLN 97 43.312 4.188 -32.350 527 HG2 GLN 97 HG2 GLN 97 43.921 6.540 -32.582 528 HG3 GLN 97 HG1 GLN 97 45.555 6.196 -32.015 529 HE21 GLN 97 HE21 GLN 97 44.525 7.195 -34.729 530 HE22 GLN 97 HE22 GLN 97 45.209 6.119 -35.850 531 H GLN 98 HN GLN 98 43.580 4.364 -27.929 532 HA GLN 98 HA GLN 98 41.612 2.231 -28.312 533 HB2 GLN 98 HB2 GLN 98 44.310 1.829 -27.006 534 HB3 GLN 98 HB1 GLN 98 42.945 0.744 -26.744 535 HG2 GLN 98 HG2 GLN 98 42.810 0.366 -29.200 536 HG3 GLN 98 HG1 GLN 98 44.227 1.391 -29.416 537 HE21 GLN 98 HE21 GLN 98 45.899 -0.047 -29.933 538 HE22 GLN 98 HE22 GLN 98 46.281 -1.434 -29.031 539 H THR 99 HN THR 99 40.654 1.522 -26.268 540 HA THR 99 HA THR 99 40.229 3.806 -24.513 541 HB THR 99 HB THR 99 38.945 1.068 -24.556 542 HG1 THR 99 HG1 THR 99 37.231 2.873 -25.164 543 HG21 THR 99 HG21 THR 99 38.733 1.927 -22.344 544 HG22 THR 99 HG22 THR 99 37.215 2.321 -23.148 545 HG23 THR 99 HG23 THR 99 38.445 3.565 -22.930 546 H LYS 100 HN LYS 100 40.701 3.896 -22.351 547 HA LYS 100 HA LYS 100 42.150 1.631 -21.136 548 HB2 LYS 100 HB2 LYS 100 43.112 4.462 -21.465 549 HB3 LYS 100 HB1 LYS 100 43.706 3.461 -20.141 550 HG2 LYS 100 HG2 LYS 100 43.757 2.404 -22.965 551 HG3 LYS 100 HG1 LYS 100 45.011 3.501 -22.407 552 HD2 LYS 100 HD2 LYS 100 45.564 1.992 -20.557 553 HD3 LYS 100 HD1 LYS 100 44.283 0.888 -21.045 554 HE2 LYS 100 HE2 LYS 100 45.393 0.534 -23.204 555 HE3 LYS 100 HE1 LYS 100 46.673 1.655 -22.738 556 HZ1 LYS 100 HZ1 LYS 100 46.099 -1.039 -21.729 557 HZ2 LYS 100 HZ2 LYS 100 46.810 0.090 -20.676 558 HZ3 LYS 100 HZ3 LYS 100 47.589 -0.332 -22.127 559 H GLY 101 HN GLY 101 41.954 1.431 -18.949 560 HA2 GLY 101 HA2 GLY 101 39.621 2.541 -17.767 561 HA3 GLY 101 HA1 GLY 101 40.845 1.588 -16.934 562 H ILE 102 HN ILE 102 39.641 3.687 -15.676 563 HA ILE 102 HA ILE 102 41.161 6.110 -15.885 564 HB ILE 102 HB ILE 102 38.832 6.052 -15.032 565 HG12 ILE 102 HG12 ILE 102 40.725 7.013 -12.870 566 HG13 ILE 102 HG11 ILE 102 40.572 7.841 -14.425 567 HG21 ILE 102 HG21 ILE 102 39.195 3.892 -13.747 568 HG22 ILE 102 HG22 ILE 102 38.334 5.155 -12.865 569 HG23 ILE 102 HG23 ILE 102 40.038 4.851 -12.530 570 HD11 ILE 102 HD11 ILE 102 38.144 8.107 -14.034 571 HD12 ILE 102 HD12 ILE 102 39.087 8.866 -12.751 572 HD13 ILE 102 HD13 ILE 102 38.313 7.306 -12.472 573 H ASN 103 HN ASN 103 41.572 3.100 -14.223 574 HA ASN 103 HA ASN 103 43.213 3.981 -12.085 575 HB2 ASN 103 HB2 ASN 103 42.962 1.332 -13.511 576 HB3 ASN 103 HB1 ASN 103 43.994 1.576 -12.103 577 HD21 ASN 103 HD21 ASN 103 41.766 -0.218 -12.012 578 HD22 ASN 103 HD22 ASN 103 40.598 0.436 -10.950 579 H GLU 104 HN GLU 104 43.945 2.888 -15.383 580 HA GLU 104 HA GLU 104 46.814 3.185 -15.005 581 HB2 GLU 104 HB2 GLU 104 45.121 2.535 -17.424 582 HB3 GLU 104 HB1 GLU 104 46.884 2.625 -17.449 583 HG2 GLU 104 HG2 GLU 104 47.030 0.866 -15.757 584 HG3 GLU 104 HG1 GLU 104 45.271 0.806 -15.635 585 H PHE 105 HN PHE 105 44.687 5.453 -14.965 586 HA PHE 105 HA PHE 105 46.228 7.299 -16.696 587 HB2 PHE 105 HB2 PHE 105 43.304 6.768 -16.597 588 HB3 PHE 105 HB1 PHE 105 43.750 8.471 -16.617 589 HD1 PHE 105 HD1 PHE 105 44.745 5.270 -18.320 590 HD2 PHE 105 HD2 PHE 105 43.989 9.477 -18.696 591 HE1 PHE 105 HE1 PHE 105 45.222 5.146 -20.746 592 HE2 PHE 105 HE2 PHE 105 44.465 9.346 -21.113 593 HZ PHE 105 HZ PHE 105 45.086 7.188 -22.135 594 H SER 106 HN SER 106 46.782 9.197 -15.850 595 HA SER 106 HA SER 106 46.445 9.550 -12.975 596 HB2 SER 106 HB2 SER 106 48.662 9.916 -13.860 597 HB3 SER 106 HB1 SER 106 48.046 11.073 -15.042 598 HG SER 106 HG SER 106 48.716 12.318 -13.391 599 H LYS 107 HN LYS 107 46.162 11.941 -12.290 600 HA LYS 107 HA LYS 107 43.539 12.760 -13.093 601 HB2 LYS 107 HB2 LYS 107 45.602 14.079 -11.318 602 HB3 LYS 107 HB1 LYS 107 43.954 14.670 -11.540 603 HG2 LYS 107 HG2 LYS 107 43.058 12.527 -10.726 604 HG3 LYS 107 HG1 LYS 107 44.703 11.912 -10.519 605 HD2 LYS 107 HD2 LYS 107 45.170 13.716 -8.899 606 HD3 LYS 107 HD1 LYS 107 43.522 14.316 -9.095 607 HE2 LYS 107 HE2 LYS 107 42.636 12.162 -8.283 608 HE3 LYS 107 HE1 LYS 107 44.280 11.557 -8.090 609 HZ1 LYS 107 HZ1 LYS 107 44.591 12.742 -6.232 610 HZ2 LYS 107 HZ2 LYS 107 42.894 12.784 -6.162 611 HZ3 LYS 107 HZ3 LYS 107 43.754 14.097 -6.813 612 H ALA 108 HN ALA 108 46.809 13.920 -13.733 613 HA ALA 108 HA ALA 108 46.091 16.342 -15.011 614 HB1 ALA 108 HB1 ALA 108 48.546 14.693 -15.607 615 HB2 ALA 108 HB2 ALA 108 48.387 15.695 -14.165 616 HB3 ALA 108 HB3 ALA 108 48.349 16.438 -15.765 617 H GLN 109 HN GLN 109 46.456 13.047 -16.173 618 HA GLN 109 HA GLN 109 46.475 13.511 -18.936 619 HB2 GLN 109 HB2 GLN 109 45.391 11.198 -17.317 620 HB3 GLN 109 HB1 GLN 109 45.489 11.196 -19.083 621 HG2 GLN 109 HG2 GLN 109 47.885 11.466 -19.023 622 HG3 GLN 109 HG1 GLN 109 47.863 11.706 -17.274 623 HE21 GLN 109 HE21 GLN 109 46.426 9.226 -19.491 624 HE22 GLN 109 HE22 GLN 109 47.008 7.900 -18.606 625 H ARG 110 HN ARG 110 43.748 13.140 -16.703 626 HA ARG 110 HA ARG 110 41.788 13.437 -18.819 627 HB2 ARG 110 HB2 ARG 110 40.151 13.440 -16.931 628 HB3 ARG 110 HB1 ARG 110 41.210 12.031 -16.936 629 HG2 ARG 110 HG2 ARG 110 42.625 13.015 -15.238 630 HG3 ARG 110 HG1 ARG 110 41.705 14.525 -15.284 631 HD2 ARG 110 HD2 ARG 110 39.685 13.272 -14.547 632 HD3 ARG 110 HD1 ARG 110 40.659 11.804 -14.443 633 HE ARG 110 HE ARG 110 41.922 13.774 -12.894 634 HH11 ARG 110 HH21 ARG 110 38.977 11.967 -13.018 635 HH12 ARG 110 HH22 ARG 110 38.731 11.981 -11.305 636 HH21 ARG 110 HH11 ARG 110 41.606 13.803 -10.641 637 HH22 ARG 110 HH12 ARG 110 40.221 13.020 -9.958 638 H HIS 111 HN HIS 111 43.550 15.481 -16.675 639 HA HIS 111 HA HIS 111 41.756 17.694 -16.628 640 HB2 HIS 111 HB2 HIS 111 43.645 17.334 -15.016 641 HB3 HIS 111 HB1 HIS 111 44.764 17.761 -16.318 642 HD2 HIS 111 HD2 HIS 111 45.028 20.505 -16.753 643 HE1 HIS 111 HE1 HIS 111 41.918 21.767 -14.193 644 HE2 HIS 111 HE2 HIS 111 43.834 22.555 -15.662 645 H VAL 112 HN VAL 112 44.401 16.719 -18.746 646 HA VAL 112 HA VAL 112 44.371 19.145 -20.288 647 HB VAL 112 HB VAL 112 45.881 17.890 -21.812 648 HG11 VAL 112 HG11 VAL 112 46.579 17.464 -18.895 649 HG12 VAL 112 HG12 VAL 112 46.671 19.034 -19.700 650 HG13 VAL 112 HG13 VAL 112 47.703 17.704 -20.232 651 HG21 VAL 112 HG21 VAL 112 44.711 15.641 -21.329 652 HG22 VAL 112 HG22 VAL 112 45.647 15.606 -19.837 653 HG23 VAL 112 HG23 VAL 112 46.471 15.614 -21.394 654 H LEU 113 HN LEU 113 44.033 19.008 -22.715 655 HA LEU 113 HA LEU 113 41.373 17.933 -23.204 656 HB2 LEU 113 HB2 LEU 113 41.861 19.043 -25.519 657 HB3 LEU 113 HB1 LEU 113 41.593 20.076 -24.112 658 HG LEU 113 HG LEU 113 44.423 19.204 -24.628 659 HD11 LEU 113 HD11 LEU 113 43.717 19.797 -26.883 660 HD12 LEU 113 HD12 LEU 113 44.750 21.072 -26.239 661 HD13 LEU 113 HD13 LEU 113 43.003 21.298 -26.298 662 HD21 LEU 113 HD21 LEU 113 43.389 21.976 -23.989 663 HD22 LEU 113 HD22 LEU 113 44.961 21.272 -23.608 664 HD23 LEU 113 HD23 LEU 113 43.524 20.745 -22.735 665 H ASP 114 HN ASP 114 44.535 16.819 -23.527 666 HA ASP 114 HA ASP 114 43.665 14.754 -25.463 667 HB2 ASP 114 HB2 ASP 114 45.185 16.562 -26.478 668 HB3 ASP 114 HB1 ASP 114 46.457 15.901 -25.455 669 HA PRO 115 HA PRO 115 45.285 12.948 -21.484 670 HB2 PRO 115 HB2 PRO 115 43.248 10.906 -22.281 671 HB3 PRO 115 HB1 PRO 115 43.519 11.668 -20.697 672 HG2 PRO 115 HG2 PRO 115 41.434 12.334 -22.206 673 HG3 PRO 115 HG1 PRO 115 42.313 13.561 -21.266 674 HD2 PRO 115 HD2 PRO 115 42.462 12.979 -24.213 675 HD3 PRO 115 HD1 PRO 115 42.473 14.549 -23.373 676 H ARG 116 HN ARG 116 46.837 11.398 -21.337 677 HA ARG 116 HA ARG 116 47.175 9.466 -23.556 678 HB2 ARG 116 HB2 ARG 116 49.497 11.020 -22.407 679 HB3 ARG 116 HB1 ARG 116 49.475 9.990 -23.843 680 HG2 ARG 116 HG2 ARG 116 47.976 11.567 -24.978 681 HG3 ARG 116 HG1 ARG 116 47.920 12.572 -23.534 682 HD2 ARG 116 HD2 ARG 116 49.524 13.568 -25.023 683 HD3 ARG 116 HD1 ARG 116 50.412 12.826 -23.694 684 HE ARG 116 HE ARG 116 51.240 11.209 -25.182 685 HH11 ARG 116 HH21 ARG 116 48.837 13.238 -26.642 686 HH12 ARG 116 HH22 ARG 116 49.182 12.715 -28.257 687 HH21 ARG 116 HH11 ARG 116 51.685 10.516 -27.299 688 HH22 ARG 116 HH12 ARG 116 50.790 11.176 -28.628 689 H CYS 117 HN CYS 117 47.489 7.483 -22.824 690 HA CYS 117 HA CYS 117 47.470 6.721 -20.164 691 HB2 CYS 117 HB2 CYS 117 49.029 5.022 -22.087 692 HB3 CYS 117 HB1 CYS 117 47.793 4.551 -20.917 693 H GLN 118 HN GLN 118 49.097 5.898 -18.762 694 HA GLN 118 HA GLN 118 51.354 7.538 -18.479 695 HB2 GLN 118 HB2 GLN 118 50.754 4.802 -17.346 696 HB3 GLN 118 HB1 GLN 118 52.144 5.784 -16.862 697 HG2 GLN 118 HG2 GLN 118 50.653 7.599 -16.171 698 HG3 GLN 118 HG1 GLN 118 49.251 6.671 -16.700 699 HE21 GLN 118 HE21 GLN 118 48.966 7.247 -14.142 700 HE22 GLN 118 HE22 GLN 118 49.436 5.986 -13.112 701 H ILE 119 HN ILE 119 50.828 5.054 -20.687 702 HA ILE 119 HA ILE 119 53.623 4.224 -20.913 703 HB ILE 119 HB ILE 119 51.336 3.521 -22.747 704 HG12 ILE 119 HG12 ILE 119 50.583 2.982 -20.519 705 HG13 ILE 119 HG11 ILE 119 51.126 1.480 -21.269 706 HG21 ILE 119 HG21 ILE 119 52.709 1.493 -23.099 707 HG22 ILE 119 HG22 ILE 119 53.922 2.132 -21.991 708 HG23 ILE 119 HG23 ILE 119 53.604 2.955 -23.518 709 HD11 ILE 119 HD11 ILE 119 52.110 1.410 -19.127 710 HD12 ILE 119 HD12 ILE 119 52.503 3.130 -19.152 711 HD13 ILE 119 HD13 ILE 119 53.417 2.003 -20.153 712 H CYS 120 HN CYS 120 51.288 6.213 -22.654 713 HA CYS 120 HA CYS 120 53.010 6.644 -24.935 714 HB2 CYS 120 HB2 CYS 120 51.043 8.663 -24.989 715 HB3 CYS 120 HB1 CYS 120 50.947 7.095 -25.796 716 H VAL 121 HN VAL 121 52.376 8.258 -21.897 717 HA VAL 121 HA VAL 121 53.537 10.764 -22.578 718 HB VAL 121 HB VAL 121 53.574 11.190 -20.179 719 HG11 VAL 121 HG11 VAL 121 51.148 10.498 -19.677 720 HG12 VAL 121 HG12 VAL 121 51.159 9.719 -21.258 721 HG13 VAL 121 HG13 VAL 121 51.407 11.460 -21.130 722 HG21 VAL 121 HG21 VAL 121 53.043 8.223 -20.002 723 HG22 VAL 121 HG22 VAL 121 52.837 9.324 -18.643 724 HG23 VAL 121 HG23 VAL 121 54.432 9.086 -19.358 725 H HIS 122 HN HIS 122 54.820 7.777 -21.222 726 HA HIS 122 HA HIS 122 57.495 8.906 -20.930 727 HB2 HIS 122 HB2 HIS 122 56.322 6.173 -20.389 728 HB3 HIS 122 HB1 HIS 122 58.043 6.529 -20.220 729 HD2 HIS 122 HD2 HIS 122 55.414 6.223 -17.769 730 HE1 HIS 122 HE1 HIS 122 57.265 9.827 -16.581 731 HE2 HIS 122 HE2 HIS 122 55.684 7.977 -15.852 732 H SER 123 HN SER 123 55.775 7.954 -23.509 733 HA SER 123 HA SER 123 57.959 6.485 -24.845 734 HB2 SER 123 HB2 SER 123 55.645 5.591 -25.007 735 HB3 SER 123 HB1 SER 123 55.154 7.075 -25.821 736 HG SER 123 HG SER 123 56.057 6.369 -27.583 737 H GLN 124 HN GLN 124 55.796 9.271 -25.429 738 HA GLN 124 HA GLN 124 57.682 10.309 -27.439 739 HB2 GLN 124 HB2 GLN 124 54.861 11.109 -26.694 740 HB3 GLN 124 HB1 GLN 124 55.843 11.945 -27.900 741 HG2 GLN 124 HG2 GLN 124 56.057 9.866 -29.192 742 HG3 GLN 124 HG1 GLN 124 55.113 9.004 -27.980 743 HE21 GLN 124 HE21 GLN 124 53.137 8.589 -29.018 744 HE22 GLN 124 HE22 GLN 124 52.193 9.776 -29.782 745 H ARG 125 HN ARG 125 57.579 10.412 -24.251 746 HA ARG 125 HA ARG 125 58.317 11.858 -22.624 747 HB2 ARG 125 HB2 ARG 125 59.491 13.323 -24.999 748 HB3 ARG 125 HB1 ARG 125 59.967 13.531 -23.311 749 HG2 ARG 125 HG2 ARG 125 60.603 11.128 -23.218 750 HG3 ARG 125 HG1 ARG 125 60.205 10.977 -24.930 751 HD2 ARG 125 HD2 ARG 125 62.268 12.889 -23.804 752 HD3 ARG 125 HD1 ARG 125 62.640 11.334 -24.544 753 HE ARG 125 HE ARG 125 61.982 13.762 -25.925 754 HH11 ARG 125 HH21 ARG 125 61.737 10.310 -25.983 755 HH12 ARG 125 HH22 ARG 125 61.640 10.209 -27.708 756 HH21 ARG 125 HH11 ARG 125 61.856 13.637 -28.187 757 HH22 ARG 125 HH12 ARG 125 61.707 12.093 -28.957 758 H ASN 126 HN ASN 126 55.972 12.608 -24.736 759 HA ASN 126 HA ASN 126 54.492 14.354 -25.034 760 HB2 ASN 126 HB2 ASN 126 53.875 13.379 -22.829 761 HB3 ASN 126 HB1 ASN 126 54.913 14.569 -22.046 762 HD21 ASN 126 HD21 ASN 126 52.220 14.502 -24.459 763 HD22 ASN 126 HD22 ASN 126 51.473 15.907 -23.869 Start of MODEL 17 1 H MET 31 HT1 MET 31 -6.647 17.436 -11.898 2 HA MET 31 HA MET 31 -5.355 15.841 -12.756 3 HB2 MET 31 HB2 MET 31 -6.898 16.504 -14.600 4 HB3 MET 31 HB1 MET 31 -5.647 17.583 -15.224 5 HG2 MET 31 HG2 MET 31 -4.121 15.651 -15.489 6 HG3 MET 31 HG1 MET 31 -5.384 14.579 -14.885 7 HE1 MET 31 HE1 MET 31 -6.931 13.267 -16.675 8 HE2 MET 31 HE2 MET 31 -8.049 14.409 -17.417 9 HE3 MET 31 HE3 MET 31 -7.659 14.555 -15.706 10 H GLY 32 HN GLY 32 -4.167 19.024 -13.796 11 HA2 GLY 32 HA2 GLY 32 -1.451 18.286 -13.055 12 HA3 GLY 32 HA1 GLY 32 -1.698 18.585 -14.773 13 H LYS 33 HN LYS 33 -3.283 20.219 -12.062 14 HA LYS 33 HA LYS 33 -2.899 22.800 -13.142 15 HB2 LYS 33 HB2 LYS 33 -4.676 22.200 -11.505 16 HB3 LYS 33 HB1 LYS 33 -3.437 22.061 -10.256 17 HG2 LYS 33 HG2 LYS 33 -2.809 24.411 -10.588 18 HG3 LYS 33 HG1 LYS 33 -4.000 24.562 -11.881 19 HD2 LYS 33 HD2 LYS 33 -5.801 24.019 -10.271 20 HD3 LYS 33 HD1 LYS 33 -4.603 23.908 -8.980 21 HE2 LYS 33 HE2 LYS 33 -3.958 26.274 -9.411 22 HE3 LYS 33 HE1 LYS 33 -5.221 26.371 -10.639 23 HZ1 LYS 33 HZ1 LYS 33 -6.073 25.368 -8.060 24 HZ2 LYS 33 HZ2 LYS 33 -6.834 26.471 -9.105 25 HZ3 LYS 33 HZ3 LYS 33 -5.590 26.994 -8.071 26 H ASN 34 HN ASN 34 -1.173 21.009 -10.606 27 HA ASN 34 HA ASN 34 0.637 23.132 -9.985 28 HB2 ASN 34 HB2 ASN 34 0.710 20.154 -9.462 29 HB3 ASN 34 HB1 ASN 34 1.953 21.268 -8.886 30 HD21 ASN 34 HD21 ASN 34 0.171 19.744 -7.137 31 HD22 ASN 34 HD22 ASN 34 -0.774 20.870 -6.288 32 H ASP 35 HN ASP 35 2.567 23.646 -10.856 33 HA ASP 35 HA ASP 35 3.333 22.343 -13.355 34 HB2 ASP 35 HB2 ASP 35 4.303 24.819 -11.925 35 HB3 ASP 35 HB1 ASP 35 5.055 24.201 -13.398 36 H ASN 36 HN ASN 36 3.918 21.754 -10.176 37 HA ASN 36 HA ASN 36 6.770 21.165 -10.410 38 HB2 ASN 36 HB2 ASN 36 4.779 20.853 -8.159 39 HB3 ASN 36 HB1 ASN 36 6.467 20.345 -8.049 40 HD21 ASN 36 HD21 ASN 36 5.306 22.460 -6.414 41 HD22 ASN 36 HD22 ASN 36 6.095 23.905 -6.827 42 H ASP 37 HN ASP 37 4.123 19.707 -11.561 43 HA ASP 37 HA ASP 37 4.789 16.969 -10.763 44 HB2 ASP 37 HB2 ASP 37 2.599 18.083 -12.523 45 HB3 ASP 37 HB1 ASP 37 2.807 16.373 -12.150 46 H ALA 38 HN ALA 38 6.004 19.090 -12.888 47 HA ALA 38 HA ALA 38 6.140 17.563 -15.296 48 HB1 ALA 38 HB1 ALA 38 8.088 19.691 -14.415 49 HB2 ALA 38 HB2 ALA 38 6.507 20.058 -15.106 50 HB3 ALA 38 HB3 ALA 38 7.706 19.193 -16.064 51 H LEU 39 HN LEU 39 7.601 16.082 -15.980 52 HA LEU 39 HA LEU 39 9.682 15.250 -14.042 53 HB2 LEU 39 HB2 LEU 39 8.564 13.540 -16.253 54 HB3 LEU 39 HB1 LEU 39 9.459 13.044 -14.813 55 HG LEU 39 HG LEU 39 7.350 14.296 -13.607 56 HD11 LEU 39 HD11 LEU 39 6.404 14.685 -15.968 57 HD12 LEU 39 HD12 LEU 39 5.312 13.964 -14.787 58 HD13 LEU 39 HD13 LEU 39 6.092 12.950 -16.005 59 HD21 LEU 39 HD21 LEU 39 7.418 11.439 -14.630 60 HD22 LEU 39 HD22 LEU 39 6.341 12.027 -13.362 61 HD23 LEU 39 HD23 LEU 39 8.087 12.023 -13.106 62 H ILE 40 HN ILE 40 11.732 15.267 -14.599 63 HA ILE 40 HA ILE 40 12.409 16.191 -17.325 64 HB ILE 40 HB ILE 40 13.995 16.092 -14.751 65 HG12 ILE 40 HG12 ILE 40 14.007 18.568 -15.106 66 HG13 ILE 40 HG11 ILE 40 12.966 18.340 -16.516 67 HG21 ILE 40 HG21 ILE 40 15.705 17.361 -16.191 68 HG22 ILE 40 HG22 ILE 40 14.830 16.733 -17.586 69 HG23 ILE 40 HG23 ILE 40 15.594 15.622 -16.451 70 HD11 ILE 40 HD11 ILE 40 11.919 18.883 -14.138 71 HD12 ILE 40 HD12 ILE 40 12.096 17.147 -13.897 72 HD13 ILE 40 HD13 ILE 40 11.122 17.762 -15.234 73 H MET 41 HN MET 41 14.037 15.169 -18.554 74 HA MET 41 HA MET 41 14.167 12.256 -18.126 75 HB2 MET 41 HB2 MET 41 13.466 13.151 -20.339 76 HB3 MET 41 HB1 MET 41 15.051 13.909 -20.507 77 HG2 MET 41 HG2 MET 41 16.153 11.747 -20.397 78 HG3 MET 41 HG1 MET 41 14.617 10.941 -20.068 79 HE1 MET 41 HE1 MET 41 14.471 9.258 -22.178 80 HE2 MET 41 HE2 MET 41 16.160 9.705 -21.956 81 HE3 MET 41 HE3 MET 41 15.470 9.680 -23.577 82 H CYS 42 HN CYS 42 15.954 11.261 -17.447 83 HA CYS 42 HA CYS 42 18.258 12.759 -16.643 84 HB2 CYS 42 HB2 CYS 42 17.313 10.674 -15.515 85 HB3 CYS 42 HB1 CYS 42 18.065 9.753 -16.822 86 H MET 43 HN MET 43 20.213 12.937 -17.566 87 HA MET 43 HA MET 43 20.492 12.201 -20.363 88 HB2 MET 43 HB2 MET 43 22.763 13.260 -20.094 89 HB3 MET 43 HB1 MET 43 21.406 14.319 -19.712 90 HG2 MET 43 HG2 MET 43 22.172 14.606 -17.584 91 HG3 MET 43 HG1 MET 43 22.180 12.863 -17.306 92 HE1 MET 43 HE1 MET 43 24.028 15.628 -19.344 93 HE2 MET 43 HE2 MET 43 25.576 15.644 -18.502 94 HE3 MET 43 HE3 MET 43 24.098 16.014 -17.620 95 H ARG 44 HN ARG 44 20.731 10.406 -17.662 96 HA ARG 44 HA ARG 44 22.962 8.753 -18.717 97 HB2 ARG 44 HB2 ARG 44 22.089 9.194 -15.860 98 HB3 ARG 44 HB1 ARG 44 23.284 8.000 -16.363 99 HG2 ARG 44 HG2 ARG 44 23.504 10.969 -16.939 100 HG3 ARG 44 HG1 ARG 44 24.272 10.185 -15.561 101 HD2 ARG 44 HD2 ARG 44 25.250 8.566 -17.431 102 HD3 ARG 44 HD1 ARG 44 24.908 9.936 -18.487 103 HE ARG 44 HE ARG 44 26.313 10.814 -16.189 104 HH11 ARG 44 HH21 ARG 44 26.645 9.010 -19.122 105 HH12 ARG 44 HH22 ARG 44 28.328 9.369 -19.317 106 HH21 ARG 44 HH11 ARG 44 28.521 11.288 -16.434 107 HH22 ARG 44 HH12 ARG 44 29.389 10.659 -17.794 108 H CYS 45 HN CYS 45 20.855 7.882 -16.089 109 HA CYS 45 HA CYS 45 20.214 5.376 -17.252 110 HB2 CYS 45 HB2 CYS 45 18.787 5.038 -15.337 111 HB3 CYS 45 HB1 CYS 45 20.256 5.852 -14.795 112 H ARG 46 HN ARG 46 19.213 8.301 -18.234 113 HA ARG 46 HA ARG 46 17.307 9.136 -19.257 114 HB2 ARG 46 HB2 ARG 46 17.527 6.330 -20.327 115 HB3 ARG 46 HB1 ARG 46 16.428 7.540 -20.994 116 HG2 ARG 46 HG2 ARG 46 18.353 9.046 -21.408 117 HG3 ARG 46 HG1 ARG 46 19.443 7.813 -20.770 118 HD2 ARG 46 HD2 ARG 46 17.584 7.373 -23.118 119 HD3 ARG 46 HD1 ARG 46 19.278 7.826 -23.277 120 HE ARG 46 HE ARG 46 19.147 5.551 -21.635 121 HH11 ARG 46 HH21 ARG 46 18.472 6.536 -24.884 122 HH12 ARG 46 HH22 ARG 46 18.790 4.978 -25.569 123 HH21 ARG 46 HH11 ARG 46 19.564 3.505 -22.527 124 HH22 ARG 46 HH12 ARG 46 19.408 3.261 -24.235 125 H LYS 47 HN LYS 47 16.789 8.145 -16.624 126 HA LYS 47 HA LYS 47 14.178 6.818 -16.856 127 HB2 LYS 47 HB2 LYS 47 15.947 6.139 -15.146 128 HB3 LYS 47 HB1 LYS 47 15.590 7.655 -14.321 129 HG2 LYS 47 HG2 LYS 47 14.078 6.250 -13.239 130 HG3 LYS 47 HG1 LYS 47 13.068 6.826 -14.564 131 HD2 LYS 47 HD2 LYS 47 12.734 4.525 -14.765 132 HD3 LYS 47 HD1 LYS 47 14.108 4.731 -15.848 133 HE2 LYS 47 HE2 LYS 47 15.652 4.109 -14.038 134 HE3 LYS 47 HE1 LYS 47 14.294 3.937 -12.928 135 HZ1 LYS 47 HZ1 LYS 47 15.092 1.833 -13.962 136 HZ2 LYS 47 HZ2 LYS 47 14.531 2.416 -15.456 137 HZ3 LYS 47 HZ3 LYS 47 13.440 2.149 -14.183 138 H VAL 48 HN VAL 48 12.471 8.079 -17.171 139 HA VAL 48 HA VAL 48 12.514 10.887 -16.525 140 HB VAL 48 HB VAL 48 10.052 9.325 -17.286 141 HG11 VAL 48 HG11 VAL 48 10.083 11.825 -16.684 142 HG12 VAL 48 HG12 VAL 48 9.316 11.372 -18.205 143 HG13 VAL 48 HG13 VAL 48 10.943 12.054 -18.206 144 HG21 VAL 48 HG21 VAL 48 10.786 9.832 -19.682 145 HG22 VAL 48 HG22 VAL 48 11.655 8.531 -18.867 146 HG23 VAL 48 HG23 VAL 48 12.393 10.124 -19.020 147 H LYS 49 HN LYS 49 12.241 11.599 -14.520 148 HA LYS 49 HA LYS 49 10.104 10.442 -12.845 149 HB2 LYS 49 HB2 LYS 49 13.002 10.772 -12.140 150 HB3 LYS 49 HB1 LYS 49 11.754 10.781 -10.891 151 HG2 LYS 49 HG2 LYS 49 11.772 8.554 -12.924 152 HG3 LYS 49 HG1 LYS 49 12.922 8.501 -11.590 153 HD2 LYS 49 HD2 LYS 49 11.048 8.741 -9.980 154 HD3 LYS 49 HD1 LYS 49 9.906 8.733 -11.321 155 HE2 LYS 49 HE2 LYS 49 11.845 6.499 -10.683 156 HE3 LYS 49 HE1 LYS 49 10.126 6.497 -10.282 157 HZ1 LYS 49 HZ1 LYS 49 9.678 5.794 -12.316 158 HZ2 LYS 49 HZ2 LYS 49 11.334 5.773 -12.694 159 HZ3 LYS 49 HZ3 LYS 49 10.411 7.169 -12.985 160 H GLY 50 HN GLY 50 9.553 11.839 -11.003 161 HA2 GLY 50 HA2 GLY 50 9.502 14.629 -11.887 162 HA3 GLY 50 HA1 GLY 50 8.502 13.910 -10.643 163 H ILE 51 HN ILE 51 9.297 16.123 -9.742 164 HA ILE 51 HA ILE 51 11.872 16.586 -8.861 165 HB ILE 51 HB ILE 51 9.893 18.117 -8.604 166 HG12 ILE 51 HG12 ILE 51 11.371 17.676 -5.998 167 HG13 ILE 51 HG11 ILE 51 12.136 18.386 -7.421 168 HG21 ILE 51 HG21 ILE 51 8.479 16.264 -7.548 169 HG22 ILE 51 HG22 ILE 51 8.389 17.846 -6.774 170 HG23 ILE 51 HG23 ILE 51 9.374 16.568 -6.060 171 HD11 ILE 51 HD11 ILE 51 10.448 20.165 -7.455 172 HD12 ILE 51 HD12 ILE 51 11.279 20.129 -5.901 173 HD13 ILE 51 HD13 ILE 51 9.656 19.451 -6.050 174 H ASP 52 HN ASP 52 9.953 13.934 -8.048 175 HA ASP 52 HA ASP 52 10.728 13.500 -5.357 176 HB2 ASP 52 HB2 ASP 52 8.778 12.400 -6.393 177 HB3 ASP 52 HB1 ASP 52 9.857 11.508 -7.463 178 H SER 53 HN SER 53 11.988 12.435 -8.468 179 HA SER 53 HA SER 53 14.301 11.172 -7.114 180 HB2 SER 53 HB2 SER 53 12.893 10.053 -9.008 181 HB3 SER 53 HB1 SER 53 13.878 11.056 -10.067 182 HG SER 53 HG SER 53 15.400 9.663 -9.779 183 H TYR 54 HN TYR 54 13.470 14.113 -8.309 184 HA TYR 54 HA TYR 54 16.241 14.738 -9.198 185 HB2 TYR 54 HB2 TYR 54 13.556 15.619 -10.164 186 HB3 TYR 54 HB1 TYR 54 14.813 16.856 -10.121 187 HD1 TYR 54 HD1 TYR 54 14.907 13.181 -10.903 188 HD2 TYR 54 HD2 TYR 54 15.652 17.169 -12.272 189 HE1 TYR 54 HE1 TYR 54 15.898 12.268 -12.955 190 HE2 TYR 54 HE2 TYR 54 16.650 16.258 -14.346 191 HH TYR 54 HH TYR 54 17.624 13.128 -14.692 192 H SER 55 HN SER 55 17.398 15.992 -7.936 193 HA SER 55 HA SER 55 16.525 16.932 -5.456 194 HB2 SER 55 HB2 SER 55 18.664 17.830 -5.219 195 HB3 SER 55 HB1 SER 55 18.941 16.609 -6.462 196 HG SER 55 HG SER 55 19.559 18.199 -7.670 197 H LYS 56 HN LYS 56 16.238 19.114 -4.704 198 HA LYS 56 HA LYS 56 14.395 20.606 -6.213 199 HB2 LYS 56 HB2 LYS 56 14.583 20.691 -3.740 200 HB3 LYS 56 HB1 LYS 56 16.104 21.568 -3.906 201 HG2 LYS 56 HG2 LYS 56 14.960 23.382 -5.090 202 HG3 LYS 56 HG1 LYS 56 13.438 22.496 -5.013 203 HD2 LYS 56 HD2 LYS 56 13.537 22.566 -2.537 204 HD3 LYS 56 HD1 LYS 56 15.039 23.490 -2.639 205 HE2 LYS 56 HE2 LYS 56 12.461 24.400 -3.936 206 HE3 LYS 56 HE1 LYS 56 12.936 24.883 -2.308 207 HZ1 LYS 56 HZ1 LYS 56 13.853 25.861 -4.813 208 HZ2 LYS 56 HZ2 LYS 56 15.154 25.302 -3.875 209 HZ3 LYS 56 HZ3 LYS 56 14.106 26.489 -3.258 210 H THR 57 HN THR 57 17.844 21.182 -5.561 211 HA THR 57 HA THR 57 18.051 23.589 -7.021 212 HB THR 57 HB THR 57 20.149 21.493 -6.409 213 HG1 THR 57 HG1 THR 57 19.747 24.001 -5.186 214 HG21 THR 57 HG21 THR 57 21.645 23.600 -6.700 215 HG22 THR 57 HG22 THR 57 20.292 24.249 -7.628 216 HG23 THR 57 HG23 THR 57 21.089 22.764 -8.149 217 H GLN 58 HN GLN 58 18.601 20.204 -7.952 218 HA GLN 58 HA GLN 58 19.440 20.743 -10.602 219 HB2 GLN 58 HB2 GLN 58 19.903 18.582 -9.657 220 HB3 GLN 58 HB1 GLN 58 18.191 18.294 -9.341 221 HG2 GLN 58 HG2 GLN 58 17.687 18.077 -11.636 222 HG3 GLN 58 HG1 GLN 58 19.213 18.798 -12.125 223 HE21 GLN 58 HE21 GLN 58 21.191 17.434 -11.020 224 HE22 GLN 58 HE22 GLN 58 21.064 15.752 -11.252 225 H TRP 59 HN TRP 59 16.277 19.732 -9.322 226 HA TRP 59 HA TRP 59 14.855 19.736 -11.703 227 HB2 TRP 59 HB2 TRP 59 13.959 18.915 -9.529 228 HB3 TRP 59 HB1 TRP 59 13.825 20.585 -8.978 229 HD1 TRP 59 HD1 TRP 59 12.411 18.196 -11.635 230 HE1 TRP 59 HE1 TRP 59 10.116 19.091 -12.387 231 HE3 TRP 59 HE3 TRP 59 12.304 22.623 -9.099 232 HZ2 TRP 59 HZ2 TRP 59 8.460 21.380 -11.989 233 HZ3 TRP 59 HZ3 TRP 59 10.356 24.143 -9.301 234 HH2 TRP 59 HH2 TRP 59 8.432 23.526 -10.741 235 H SER 60 HN SER 60 15.745 22.406 -9.610 236 HA SER 60 HA SER 60 14.177 24.341 -11.103 237 HB2 SER 60 HB2 SER 60 14.557 24.527 -8.630 238 HB3 SER 60 HB1 SER 60 16.257 24.844 -8.964 239 HG SER 60 HG SER 60 15.435 26.829 -8.980 240 H LYS 61 HN LYS 61 17.270 22.931 -11.284 241 HA LYS 61 HA LYS 61 18.718 25.087 -12.448 242 HB2 LYS 61 HB2 LYS 61 19.776 23.086 -11.418 243 HB3 LYS 61 HB1 LYS 61 19.207 22.133 -12.789 244 HG2 LYS 61 HG2 LYS 61 20.497 23.435 -14.340 245 HG3 LYS 61 HG1 LYS 61 20.922 24.608 -13.093 246 HD2 LYS 61 HD2 LYS 61 21.618 21.728 -12.583 247 HD3 LYS 61 HD1 LYS 61 22.591 22.607 -13.765 248 HE2 LYS 61 HE2 LYS 61 22.060 23.522 -10.923 249 HE3 LYS 61 HE1 LYS 61 23.554 22.773 -11.485 250 HZ1 LYS 61 HZ1 LYS 61 22.550 25.460 -11.916 251 HZ2 LYS 61 HZ2 LYS 61 23.260 24.724 -13.273 252 HZ3 LYS 61 HZ3 LYS 61 24.148 24.899 -11.835 253 H THR 62 HN THR 62 16.714 22.497 -13.730 254 HA THR 62 HA THR 62 17.359 22.925 -16.456 255 HB THR 62 HB THR 62 15.534 21.458 -16.954 256 HG1 THR 62 HG1 THR 62 14.679 22.094 -14.332 257 HG21 THR 62 HG21 THR 62 16.426 20.525 -14.235 258 HG22 THR 62 HG22 THR 62 17.574 20.615 -15.572 259 HG23 THR 62 HG23 THR 62 16.156 19.576 -15.692 260 H PHE 63 HN PHE 63 16.235 25.183 -14.573 261 HA PHE 63 HA PHE 63 14.316 26.270 -16.544 262 HB2 PHE 63 HB2 PHE 63 14.377 26.526 -13.528 263 HB3 PHE 63 HB1 PHE 63 13.409 27.568 -14.570 264 HD1 PHE 63 HD2 PHE 63 13.909 24.102 -13.402 265 HD2 PHE 63 HD1 PHE 63 11.455 26.753 -15.711 266 HE1 PHE 63 HE2 PHE 63 12.161 22.359 -13.502 267 HE2 PHE 63 HE1 PHE 63 9.687 25.004 -15.830 268 HZ PHE 63 HZ PHE 63 10.039 22.806 -14.728 269 H THR 64 HN THR 64 14.511 28.436 -17.038 270 HA THR 64 HA THR 64 16.917 29.844 -16.022 271 HB THR 64 HB THR 64 17.013 30.792 -18.440 272 HG1 THR 64 HG1 THR 64 15.586 28.376 -18.852 273 HG21 THR 64 HG21 THR 64 18.825 29.456 -17.788 274 HG22 THR 64 HG22 THR 64 18.199 28.598 -19.195 275 HG23 THR 64 HG23 THR 64 17.822 28.023 -17.571 276 H PHE 65 HN PHE 65 16.823 32.155 -16.301 277 HA PHE 65 HA PHE 65 14.049 33.184 -16.115 278 HB2 PHE 65 HB2 PHE 65 16.185 33.414 -14.305 279 HB3 PHE 65 HB1 PHE 65 16.140 34.984 -15.100 280 HD1 PHE 65 HD2 PHE 65 13.708 32.436 -13.797 281 HD2 PHE 65 HD1 PHE 65 14.752 36.590 -14.122 282 HE1 PHE 65 HE2 PHE 65 11.720 33.045 -12.452 283 HE2 PHE 65 HE1 PHE 65 12.757 37.191 -12.778 284 HZ PHE 65 HZ PHE 65 11.244 35.428 -11.960 285 H VAL 66 HN VAL 66 13.360 34.521 -17.617 286 HA VAL 66 HA VAL 66 15.319 36.085 -19.166 287 HB VAL 66 HB VAL 66 14.531 33.998 -20.391 288 HG11 VAL 66 HG11 VAL 66 12.150 34.274 -19.530 289 HG12 VAL 66 HG12 VAL 66 12.304 33.965 -21.259 290 HG13 VAL 66 HG13 VAL 66 11.974 35.594 -20.685 291 HG21 VAL 66 HG21 VAL 66 14.353 35.180 -22.491 292 HG22 VAL 66 HG22 VAL 66 15.457 36.097 -21.467 293 HG23 VAL 66 HG23 VAL 66 13.794 36.638 -21.678 294 H ARG 67 HN ARG 67 14.738 38.152 -19.582 295 HA ARG 67 HA ARG 67 13.600 40.124 -19.234 296 HB2 ARG 67 HB2 ARG 67 11.475 38.274 -20.319 297 HB3 ARG 67 HB1 ARG 67 11.168 39.989 -20.023 298 HG2 ARG 67 HG2 ARG 67 12.967 40.618 -21.539 299 HG3 ARG 67 HG1 ARG 67 13.414 38.928 -21.765 300 HD2 ARG 67 HD2 ARG 67 12.061 39.675 -23.657 301 HD3 ARG 67 HD1 ARG 67 11.162 38.482 -22.716 302 HE ARG 67 HE ARG 67 10.529 41.067 -21.763 303 HH11 ARG 67 HH21 ARG 67 10.143 39.022 -24.527 304 HH12 ARG 67 HH22 ARG 67 8.640 39.730 -25.015 305 HH21 ARG 67 HH11 ARG 67 8.557 42.000 -22.395 306 HH22 ARG 67 HH12 ARG 67 7.742 41.417 -23.807 307 H GLY 68 HN GLY 68 13.705 38.120 -16.971 308 HA2 GLY 68 HA2 GLY 68 13.088 38.305 -14.759 309 HA3 GLY 68 HA1 GLY 68 11.956 39.580 -15.205 310 H ARG 69 HN ARG 69 11.908 36.527 -16.871 311 HA ARG 69 HA ARG 69 9.468 35.717 -15.391 312 HB2 ARG 69 HB2 ARG 69 9.941 35.546 -18.378 313 HB3 ARG 69 HB1 ARG 69 8.509 34.975 -17.524 314 HG2 ARG 69 HG2 ARG 69 9.417 37.849 -17.305 315 HG3 ARG 69 HG1 ARG 69 8.392 37.315 -18.637 316 HD2 ARG 69 HD2 ARG 69 6.775 36.408 -16.935 317 HD3 ARG 69 HD1 ARG 69 7.759 37.143 -15.676 318 HE ARG 69 HE ARG 69 6.982 39.019 -17.708 319 HH11 ARG 69 HH21 ARG 69 6.058 37.344 -14.822 320 HH12 ARG 69 HH22 ARG 69 4.921 38.551 -14.321 321 HH21 ARG 69 HH11 ARG 69 5.493 40.603 -17.058 322 HH22 ARG 69 HH12 ARG 69 4.601 40.396 -15.587 323 H THR 70 HN THR 70 9.086 33.527 -15.192 324 HA THR 70 HA THR 70 11.482 31.902 -15.171 325 HB THR 70 HB THR 70 8.650 31.050 -14.528 326 HG1 THR 70 HG1 THR 70 9.024 32.706 -13.173 327 HG21 THR 70 HG21 THR 70 10.316 29.248 -14.803 328 HG22 THR 70 HG22 THR 70 9.806 29.393 -13.122 329 HG23 THR 70 HG23 THR 70 11.365 30.044 -13.630 330 H VAL 71 HN VAL 71 12.123 30.618 -16.769 331 HA VAL 71 HA VAL 71 10.124 29.492 -18.636 332 HB VAL 71 HB VAL 71 11.796 29.909 -20.489 333 HG11 VAL 71 HG11 VAL 71 9.723 31.314 -20.008 334 HG12 VAL 71 HG12 VAL 71 11.005 32.136 -20.888 335 HG13 VAL 71 HG13 VAL 71 10.789 32.440 -19.166 336 HG21 VAL 71 HG21 VAL 71 13.710 30.349 -18.911 337 HG22 VAL 71 HG22 VAL 71 12.943 31.880 -18.489 338 HG23 VAL 71 HG23 VAL 71 13.501 31.596 -20.136 339 H SER 72 HN SER 72 10.464 27.450 -19.203 340 HA SER 72 HA SER 72 12.405 25.917 -17.734 341 HB2 SER 72 HB2 SER 72 10.100 25.110 -18.361 342 HB3 SER 72 HB1 SER 72 10.698 24.948 -20.012 343 HG SER 72 HG SER 72 11.639 23.652 -17.670 344 H VAL 73 HN VAL 73 14.139 24.686 -18.563 345 HA VAL 73 HA VAL 73 15.530 25.945 -20.744 346 HB VAL 73 HB VAL 73 16.191 23.556 -19.040 347 HG11 VAL 73 HG11 VAL 73 17.346 23.272 -21.133 348 HG12 VAL 73 HG12 VAL 73 18.516 23.912 -19.983 349 HG13 VAL 73 HG13 VAL 73 17.784 24.978 -21.184 350 HG21 VAL 73 HG21 VAL 73 17.615 25.040 -17.837 351 HG22 VAL 73 HG22 VAL 73 16.106 25.930 -18.048 352 HG23 VAL 73 HG23 VAL 73 17.489 26.282 -19.084 353 H SER 74 HN SER 74 15.597 25.302 -22.825 354 HA SER 74 HA SER 74 13.851 23.265 -23.776 355 HB2 SER 74 HB2 SER 74 14.895 23.747 -25.978 356 HB3 SER 74 HB1 SER 74 14.351 25.202 -25.148 357 HG SER 74 HG SER 74 16.960 24.207 -25.528 358 H ASP 75 HN ASP 75 17.309 23.402 -23.127 359 HA ASP 75 HA ASP 75 17.461 20.479 -23.581 360 HB2 ASP 75 HB2 ASP 75 18.407 21.766 -25.518 361 HB3 ASP 75 HB1 ASP 75 19.611 22.430 -24.409 362 HA PRO 76 HA PRO 76 19.339 21.667 -19.533 363 HB2 PRO 76 HB2 PRO 76 17.802 20.082 -17.931 364 HB3 PRO 76 HB1 PRO 76 17.294 21.695 -18.455 365 HG2 PRO 76 HG2 PRO 76 16.417 19.030 -19.435 366 HG3 PRO 76 HG1 PRO 76 15.497 20.539 -19.300 367 HD2 PRO 76 HD2 PRO 76 16.625 19.525 -21.669 368 HD3 PRO 76 HD1 PRO 76 16.068 21.194 -21.431 369 H LYS 77 HN LYS 77 20.963 20.544 -18.532 370 HA LYS 77 HA LYS 77 21.202 17.637 -19.089 371 HB2 LYS 77 HB2 LYS 77 23.342 19.762 -19.285 372 HB3 LYS 77 HB1 LYS 77 23.663 18.027 -19.251 373 HG2 LYS 77 HG2 LYS 77 22.342 17.690 -21.267 374 HG3 LYS 77 HG1 LYS 77 21.855 19.385 -21.271 375 HD2 LYS 77 HD2 LYS 77 23.662 19.119 -22.868 376 HD3 LYS 77 HD1 LYS 77 24.278 20.016 -21.481 377 HE2 LYS 77 HE2 LYS 77 25.471 18.154 -20.652 378 HE3 LYS 77 HE1 LYS 77 24.541 17.011 -21.622 379 HZ1 LYS 77 HZ1 LYS 77 26.865 17.586 -22.395 380 HZ2 LYS 77 HZ2 LYS 77 26.233 19.096 -22.851 381 HZ3 LYS 77 HZ3 LYS 77 25.630 17.671 -23.554 382 H VAL 78 HN VAL 78 20.693 16.871 -17.108 383 HA VAL 78 HA VAL 78 22.563 17.512 -14.932 384 HB VAL 78 HB VAL 78 20.859 17.829 -13.315 385 HG11 VAL 78 HG11 VAL 78 21.394 19.798 -14.759 386 HG12 VAL 78 HG12 VAL 78 19.740 19.859 -14.138 387 HG13 VAL 78 HG13 VAL 78 20.044 19.362 -15.805 388 HG21 VAL 78 HG21 VAL 78 18.978 17.020 -15.548 389 HG22 VAL 78 HG22 VAL 78 18.407 17.813 -14.079 390 HG23 VAL 78 HG23 VAL 78 19.188 16.234 -13.984 391 H ILE 79 HN ILE 79 22.664 15.872 -13.295 392 HA ILE 79 HA ILE 79 21.872 13.212 -14.330 393 HB ILE 79 HB ILE 79 23.986 13.989 -12.309 394 HG12 ILE 79 HG12 ILE 79 24.249 12.875 -15.120 395 HG13 ILE 79 HG11 ILE 79 24.453 14.579 -14.708 396 HG21 ILE 79 HG21 ILE 79 24.646 11.571 -12.573 397 HG22 ILE 79 HG22 ILE 79 23.153 11.318 -13.473 398 HG23 ILE 79 HG23 ILE 79 23.093 11.798 -11.776 399 HD11 ILE 79 HD11 ILE 79 26.298 14.031 -13.208 400 HD12 ILE 79 HD12 ILE 79 26.623 13.355 -14.805 401 HD13 ILE 79 HD13 ILE 79 26.057 12.310 -13.501 402 H CYS 80 HN CYS 80 20.161 12.309 -13.420 403 HA CYS 80 HA CYS 80 18.727 13.233 -11.257 404 HB2 CYS 80 HB2 CYS 80 17.548 11.176 -11.291 405 HB3 CYS 80 HB1 CYS 80 18.084 11.421 -12.954 406 H ARG 81 HN ARG 81 18.386 12.080 -9.141 407 HA ARG 81 HA ARG 81 20.883 11.971 -7.718 408 HB2 ARG 81 HB2 ARG 81 18.043 11.443 -6.825 409 HB3 ARG 81 HB1 ARG 81 19.437 11.521 -5.748 410 HG2 ARG 81 HG2 ARG 81 19.871 13.827 -6.400 411 HG3 ARG 81 HG1 ARG 81 18.573 13.767 -7.591 412 HD2 ARG 81 HD2 ARG 81 17.629 14.839 -5.688 413 HD3 ARG 81 HD1 ARG 81 17.013 13.191 -5.654 414 HE ARG 81 HE ARG 81 19.399 13.315 -4.142 415 HH11 ARG 81 HH21 ARG 81 16.110 14.392 -4.135 416 HH12 ARG 81 HH22 ARG 81 15.984 14.438 -2.409 417 HH21 ARG 81 HH11 ARG 81 19.242 13.375 -1.878 418 HH22 ARG 81 HH12 ARG 81 17.757 13.862 -1.131 419 H THR 82 HN THR 82 18.863 9.690 -9.287 420 HA THR 82 HA THR 82 19.603 7.398 -7.705 421 HB THR 82 HB THR 82 18.473 7.453 -10.508 422 HG1 THR 82 HG1 THR 82 16.759 8.197 -9.590 423 HG21 THR 82 HG21 THR 82 17.539 5.242 -9.748 424 HG22 THR 82 HG22 THR 82 18.533 5.383 -8.298 425 HG23 THR 82 HG23 THR 82 19.296 5.270 -9.885 426 H CYS 83 HN CYS 83 20.945 9.105 -10.429 427 HA CYS 83 HA CYS 83 22.681 6.918 -11.226 428 HB2 CYS 83 HB2 CYS 83 22.150 9.708 -12.149 429 HB3 CYS 83 HB1 CYS 83 23.690 8.967 -12.601 430 H GLN 84 HN GLN 84 22.679 9.166 -8.750 431 HA GLN 84 HA GLN 84 25.182 10.201 -8.562 432 HB2 GLN 84 HB2 GLN 84 23.261 9.158 -6.511 433 HB3 GLN 84 HB1 GLN 84 24.873 9.639 -5.977 434 HG2 GLN 84 HG2 GLN 84 24.579 11.866 -6.760 435 HG3 GLN 84 HG1 GLN 84 23.148 11.428 -7.694 436 HE21 GLN 84 HE21 GLN 84 23.646 13.338 -5.274 437 HE22 GLN 84 HE22 GLN 84 22.409 12.915 -4.192 438 HA PRO 85 HA PRO 85 28.031 6.841 -8.337 439 HB2 PRO 85 HB2 PRO 85 29.992 7.920 -6.722 440 HB3 PRO 85 HB1 PRO 85 29.748 8.396 -8.417 441 HG2 PRO 85 HG2 PRO 85 28.841 9.766 -5.918 442 HG3 PRO 85 HG1 PRO 85 29.522 10.461 -7.402 443 HD2 PRO 85 HD2 PRO 85 26.853 10.488 -6.881 444 HD3 PRO 85 HD1 PRO 85 27.500 10.374 -8.534 445 H LYS 86 HN LYS 86 27.128 5.143 -7.237 446 HA LYS 86 HA LYS 86 26.431 3.832 -5.456 447 HB2 LYS 86 HB2 LYS 86 28.914 3.524 -5.603 448 HB3 LYS 86 HB1 LYS 86 29.091 4.760 -4.355 449 HG2 LYS 86 HG2 LYS 86 27.789 3.426 -2.787 450 HG3 LYS 86 HG1 LYS 86 27.466 2.220 -4.033 451 HD2 LYS 86 HD2 LYS 86 29.892 1.764 -4.210 452 HD3 LYS 86 HD1 LYS 86 30.200 2.948 -2.939 453 HE2 LYS 86 HE2 LYS 86 28.868 1.637 -1.356 454 HE3 LYS 86 HE1 LYS 86 28.479 0.472 -2.621 455 HZ1 LYS 86 HZ1 LYS 86 31.299 1.060 -2.106 456 HZ2 LYS 86 HZ2 LYS 86 30.568 -0.386 -2.613 457 HZ3 LYS 86 HZ3 LYS 86 30.474 0.090 -0.985 458 H GLN 87 HN GLN 87 24.684 4.765 -4.472 459 HA GLN 87 HA GLN 87 25.232 6.227 -1.976 460 HB2 GLN 87 HB2 GLN 87 24.796 7.941 -3.726 461 HB3 GLN 87 HB1 GLN 87 23.232 7.179 -4.043 462 HG2 GLN 87 HG2 GLN 87 22.478 7.635 -1.793 463 HG3 GLN 87 HG1 GLN 87 24.079 8.202 -1.322 464 HE21 GLN 87 HE21 GLN 87 21.660 9.827 -1.153 465 HE22 GLN 87 HE22 GLN 87 21.863 11.134 -2.217 466 H HIS 88 HN HIS 88 24.472 4.698 -0.625 467 HA HIS 88 HA HIS 88 21.660 3.810 -0.999 468 HB2 HIS 88 HB2 HIS 88 23.986 2.224 0.122 469 HB3 HIS 88 HB1 HIS 88 22.301 1.695 0.105 470 HD2 HIS 88 HD2 HIS 88 21.326 0.893 -2.440 471 HE1 HIS 88 HE1 HIS 88 24.991 1.346 -4.486 472 HE2 HIS 88 HE2 HIS 88 22.620 0.455 -4.665 473 H ASP 89 HN ASP 89 20.403 3.658 0.849 474 HA ASP 89 HA ASP 89 21.570 4.706 3.360 475 HB2 ASP 89 HB2 ASP 89 20.304 6.468 2.058 476 HB3 ASP 89 HB1 ASP 89 18.853 5.497 2.313 477 H SER 90 HN SER 90 20.644 2.004 2.221 478 HA SER 90 HA SER 90 18.305 1.163 3.485 479 HB2 SER 90 HB2 SER 90 19.215 -0.335 1.918 480 HB3 SER 90 HB1 SER 90 20.822 -0.260 2.643 481 HG SER 90 HG SER 90 18.517 -1.627 3.480 482 H ILE 91 HN ILE 91 18.303 -0.507 5.304 483 HA ILE 91 HA ILE 91 20.150 0.288 7.487 484 HB ILE 91 HB ILE 91 17.145 -0.050 7.659 485 HG12 ILE 91 HG12 ILE 91 18.830 2.365 8.374 486 HG13 ILE 91 HG11 ILE 91 18.189 2.134 6.744 487 HG21 ILE 91 HG21 ILE 91 17.647 0.732 10.082 488 HG22 ILE 91 HG22 ILE 91 19.311 0.236 9.749 489 HG23 ILE 91 HG23 ILE 91 18.010 -0.950 9.677 490 HD11 ILE 91 HD11 ILE 91 16.542 2.213 9.284 491 HD12 ILE 91 HD12 ILE 91 15.922 1.979 7.651 492 HD13 ILE 91 HD13 ILE 91 16.667 3.511 8.093 493 H TRP 92 HN TRP 92 21.003 -1.349 8.586 494 HA TRP 92 HA TRP 92 20.322 -4.071 7.772 495 HB2 TRP 92 HB2 TRP 92 22.690 -3.337 7.940 496 HB3 TRP 92 HB1 TRP 92 22.466 -3.104 9.678 497 HD1 TRP 92 HD1 TRP 92 21.776 -5.344 11.096 498 HE1 TRP 92 HE1 TRP 92 22.476 -7.786 10.751 499 HE3 TRP 92 HE3 TRP 92 23.303 -5.107 6.243 500 HZ2 TRP 92 HZ2 TRP 92 23.517 -9.444 8.655 501 HZ3 TRP 92 HZ3 TRP 92 24.139 -7.136 5.087 502 HH2 TRP 92 HH2 TRP 92 24.246 -9.302 6.288 503 H CYS 93 HN CYS 93 18.846 -5.196 8.814 504 HA CYS 93 HA CYS 93 17.954 -4.444 11.479 505 HB2 CYS 93 HB2 CYS 93 16.249 -5.166 9.953 506 HB3 CYS 93 HB1 CYS 93 17.132 -6.639 9.567 507 H THR 94 HN THR 94 18.541 -5.414 13.347 508 HA THR 94 HA THR 94 20.681 -7.407 13.232 509 HB THR 94 HB THR 94 21.036 -6.930 15.536 510 HG1 THR 94 HG1 THR 94 19.498 -6.208 16.806 511 HG21 THR 94 HG21 THR 94 21.267 -4.480 15.529 512 HG22 THR 94 HG22 THR 94 20.170 -4.376 14.152 513 HG23 THR 94 HG23 THR 94 21.744 -5.154 13.971 514 H ALA 95 HN ALA 95 17.275 -7.300 13.656 515 HA ALA 95 HA ALA 95 17.140 -9.752 15.224 516 HB1 ALA 95 HB1 ALA 95 15.399 -8.285 15.757 517 HB2 ALA 95 HB2 ALA 95 14.619 -9.413 14.649 518 HB3 ALA 95 HB3 ALA 95 15.144 -7.827 14.075 519 H CYS 96 HN CYS 96 17.508 -8.909 11.954 520 HA CYS 96 HA CYS 96 16.451 -11.538 11.068 521 HB2 CYS 96 HB2 CYS 96 16.697 -8.905 9.616 522 HB3 CYS 96 HB1 CYS 96 16.422 -10.436 8.784 523 H GLN 97 HN GLN 97 19.120 -9.241 10.922 524 HA GLN 97 HA GLN 97 21.374 -9.666 10.628 525 HB2 GLN 97 HB2 GLN 97 20.633 -12.095 11.409 526 HB3 GLN 97 HB1 GLN 97 20.871 -12.488 9.708 527 HG2 GLN 97 HG2 GLN 97 22.959 -12.907 10.787 528 HG3 GLN 97 HG1 GLN 97 23.156 -11.402 9.892 529 HE21 GLN 97 HE21 GLN 97 24.372 -9.985 11.150 530 HE22 GLN 97 HE22 GLN 97 24.167 -9.748 12.818 531 H GLN 98 HN GLN 98 19.398 -8.818 8.599 532 HA GLN 98 HA GLN 98 21.081 -9.290 6.241 533 HB2 GLN 98 HB2 GLN 98 18.105 -9.778 6.410 534 HB3 GLN 98 HB1 GLN 98 18.929 -9.499 4.878 535 HG2 GLN 98 HG2 GLN 98 19.728 -11.660 6.847 536 HG3 GLN 98 HG1 GLN 98 18.653 -11.935 5.481 537 HE21 GLN 98 HE21 GLN 98 19.575 -11.794 3.307 538 HE22 GLN 98 HE22 GLN 98 21.255 -11.841 3.064 539 H THR 99 HN THR 99 20.747 -7.717 4.547 540 HA THR 99 HA THR 99 20.371 -5.081 5.654 541 HB THR 99 HB THR 99 20.852 -5.900 2.780 542 HG1 THR 99 HG1 THR 99 22.393 -6.418 4.668 543 HG21 THR 99 HG21 THR 99 21.236 -3.288 4.271 544 HG22 THR 99 HG22 THR 99 20.042 -3.606 3.012 545 HG23 THR 99 HG23 THR 99 21.760 -3.589 2.613 546 H LYS 100 HN LYS 100 18.589 -3.890 5.613 547 HA LYS 100 HA LYS 100 16.391 -4.664 3.772 548 HB2 LYS 100 HB2 LYS 100 16.417 -4.328 6.684 549 HB3 LYS 100 HB1 LYS 100 15.189 -3.318 5.924 550 HG2 LYS 100 HG2 LYS 100 14.149 -5.414 6.412 551 HG3 LYS 100 HG1 LYS 100 14.424 -5.391 4.671 552 HD2 LYS 100 HD2 LYS 100 16.471 -6.718 4.952 553 HD3 LYS 100 HD1 LYS 100 16.253 -6.707 6.703 554 HE2 LYS 100 HE2 LYS 100 14.109 -7.887 6.453 555 HE3 LYS 100 HE1 LYS 100 14.312 -7.890 4.700 556 HZ1 LYS 100 HZ1 LYS 100 16.633 -8.902 5.930 557 HZ2 LYS 100 HZ2 LYS 100 15.577 -9.680 4.850 558 HZ3 LYS 100 HZ3 LYS 100 15.286 -9.743 6.522 559 H GLY 101 HN GLY 101 15.417 -3.124 2.621 560 HA2 GLY 101 HA2 GLY 101 16.729 -0.706 2.104 561 HA3 GLY 101 HA1 GLY 101 15.068 -1.064 1.639 562 H ILE 102 HN ILE 102 16.085 1.447 2.516 563 HA ILE 102 HA ILE 102 15.393 1.953 5.236 564 HB ILE 102 HB ILE 102 16.908 3.425 4.020 565 HG12 ILE 102 HG12 ILE 102 14.397 5.009 4.609 566 HG13 ILE 102 HG11 ILE 102 15.317 4.232 5.903 567 HG21 ILE 102 HG21 ILE 102 16.197 4.782 2.191 568 HG22 ILE 102 HG22 ILE 102 14.503 4.362 2.449 569 HG23 ILE 102 HG23 ILE 102 15.627 3.153 1.829 570 HD11 ILE 102 HD11 ILE 102 17.351 5.441 5.165 571 HD12 ILE 102 HD12 ILE 102 16.059 6.554 5.619 572 HD13 ILE 102 HD13 ILE 102 16.404 6.249 3.916 573 H ASN 103 HN ASN 103 13.649 2.130 2.190 574 HA ASN 103 HA ASN 103 11.373 3.518 3.023 575 HB2 ASN 103 HB2 ASN 103 11.837 1.400 0.928 576 HB3 ASN 103 HB1 ASN 103 10.227 2.062 1.198 577 HD21 ASN 103 HD21 ASN 103 10.876 4.769 1.746 578 HD22 ASN 103 HD22 ASN 103 11.564 5.459 0.344 579 H GLU 104 HN GLU 104 12.172 0.078 3.269 580 HA GLU 104 HA GLU 104 9.621 -0.595 4.471 581 HB2 GLU 104 HB2 GLU 104 12.169 -2.169 4.066 582 HB3 GLU 104 HB1 GLU 104 10.704 -2.832 4.792 583 HG2 GLU 104 HG2 GLU 104 9.432 -2.381 2.775 584 HG3 GLU 104 HG1 GLU 104 10.811 -1.555 2.047 585 H PHE 105 HN PHE 105 11.647 1.359 5.704 586 HA PHE 105 HA PHE 105 11.645 0.132 8.407 587 HB2 PHE 105 HB2 PHE 105 13.882 1.138 6.832 588 HB3 PHE 105 HB1 PHE 105 13.733 2.050 8.334 589 HD1 PHE 105 HD2 PHE 105 14.007 -1.390 6.934 590 HD2 PHE 105 HD1 PHE 105 14.320 1.097 10.414 591 HE1 PHE 105 HE2 PHE 105 15.006 -3.261 8.194 592 HE2 PHE 105 HE1 PHE 105 15.306 -0.788 11.675 593 HZ PHE 105 HZ PHE 105 15.654 -2.974 10.563 594 H SER 106 HN SER 106 11.369 1.548 10.158 595 HA SER 106 HA SER 106 9.776 3.911 9.484 596 HB2 SER 106 HB2 SER 106 8.643 2.768 11.143 597 HB3 SER 106 HB1 SER 106 10.126 2.162 11.878 598 HG SER 106 HG SER 106 9.840 3.751 13.225 599 H LYS 107 HN LYS 107 10.122 5.904 10.689 600 HA LYS 107 HA LYS 107 12.831 6.788 10.522 601 HB2 LYS 107 HB2 LYS 107 10.435 8.133 11.789 602 HB3 LYS 107 HB1 LYS 107 11.962 8.916 11.381 603 HG2 LYS 107 HG2 LYS 107 10.213 7.496 9.353 604 HG3 LYS 107 HG1 LYS 107 10.134 9.234 9.660 605 HD2 LYS 107 HD2 LYS 107 12.702 9.205 9.200 606 HD3 LYS 107 HD1 LYS 107 12.404 7.627 8.475 607 HE2 LYS 107 HE2 LYS 107 12.218 9.111 6.666 608 HE3 LYS 107 HE1 LYS 107 10.543 8.807 7.130 609 HZ1 LYS 107 HZ1 LYS 107 10.274 10.935 7.627 610 HZ2 LYS 107 HZ2 LYS 107 11.812 11.248 6.976 611 HZ3 LYS 107 HZ3 LYS 107 11.637 10.943 8.639 612 H ALA 108 HN ALA 108 10.683 5.992 13.210 613 HA ALA 108 HA ALA 108 12.427 6.800 15.282 614 HB1 ALA 108 HB1 ALA 108 10.301 4.646 15.331 615 HB2 ALA 108 HB2 ALA 108 10.020 6.363 15.620 616 HB3 ALA 108 HB3 ALA 108 11.016 5.432 16.739 617 H GLN 109 HN GLN 109 12.068 3.773 13.510 618 HA GLN 109 HA GLN 109 13.649 2.132 15.117 619 HB2 GLN 109 HB2 GLN 109 13.136 2.111 12.146 620 HB3 GLN 109 HB1 GLN 109 14.053 0.843 12.969 621 HG2 GLN 109 HG2 GLN 109 11.276 1.680 13.832 622 HG3 GLN 109 HG1 GLN 109 11.563 0.382 12.670 623 HE21 GLN 109 HE21 GLN 109 14.188 0.273 14.693 624 HE22 GLN 109 HE22 GLN 109 13.616 -0.840 15.838 625 H ARG 110 HN ARG 110 14.533 4.678 12.974 626 HA ARG 110 HA ARG 110 17.291 3.898 12.683 627 HB2 ARG 110 HB2 ARG 110 15.846 6.485 12.063 628 HB3 ARG 110 HB1 ARG 110 17.537 6.167 11.677 629 HG2 ARG 110 HG2 ARG 110 16.924 4.305 10.260 630 HG3 ARG 110 HG1 ARG 110 15.225 4.458 10.722 631 HD2 ARG 110 HD2 ARG 110 15.565 5.520 8.549 632 HD3 ARG 110 HD1 ARG 110 15.206 6.754 9.755 633 HE ARG 110 HE ARG 110 18.022 6.368 9.514 634 HH11 ARG 110 HH21 ARG 110 15.245 7.731 7.961 635 HH12 ARG 110 HH22 ARG 110 16.140 8.965 7.138 636 HH21 ARG 110 HH11 ARG 110 19.202 7.984 8.439 637 HH22 ARG 110 HH12 ARG 110 18.379 9.107 7.408 638 H HIS 111 HN HIS 111 15.388 5.761 14.917 639 HA HIS 111 HA HIS 111 17.528 7.279 16.047 640 HB2 HIS 111 HB2 HIS 111 14.782 6.556 17.087 641 HB3 HIS 111 HB1 HIS 111 15.902 7.627 17.937 642 HD2 HIS 111 HD2 HIS 111 16.444 8.459 14.339 643 HE1 HIS 111 HE1 HIS 111 13.213 10.922 15.484 644 HE2 HIS 111 HE2 HIS 111 14.967 10.511 13.694 645 H VAL 112 HN VAL 112 15.992 4.191 16.876 646 HA VAL 112 HA VAL 112 17.398 3.803 19.308 647 HB VAL 112 HB VAL 112 16.662 1.433 19.060 648 HG11 VAL 112 HG11 VAL 112 14.299 1.915 19.246 649 HG12 VAL 112 HG12 VAL 112 14.477 3.409 18.324 650 HG13 VAL 112 HG13 VAL 112 15.170 3.280 19.944 651 HG21 VAL 112 HG21 VAL 112 16.907 1.398 16.552 652 HG22 VAL 112 HG22 VAL 112 15.480 2.424 16.466 653 HG23 VAL 112 HG23 VAL 112 15.347 0.794 17.114 654 H LEU 113 HN LEU 113 19.129 2.392 19.745 655 HA LEU 113 HA LEU 113 21.300 2.565 17.947 656 HB2 LEU 113 HB2 LEU 113 21.012 0.643 20.266 657 HB3 LEU 113 HB1 LEU 113 22.515 1.226 19.536 658 HG LEU 113 HG LEU 113 20.460 2.971 20.926 659 HD11 LEU 113 HD11 LEU 113 23.158 1.905 21.798 660 HD12 LEU 113 HD12 LEU 113 21.597 1.627 22.571 661 HD13 LEU 113 HD13 LEU 113 22.327 3.232 22.611 662 HD21 LEU 113 HD21 LEU 113 22.542 4.574 20.791 663 HD22 LEU 113 HD22 LEU 113 21.517 4.381 19.374 664 HD23 LEU 113 HD23 LEU 113 23.050 3.515 19.474 665 H ASP 114 HN ASP 114 18.837 0.127 18.465 666 HA ASP 114 HA ASP 114 20.111 -1.563 16.375 667 HB2 ASP 114 HB2 ASP 114 18.547 -2.345 18.829 668 HB3 ASP 114 HB1 ASP 114 18.851 -3.445 17.483 669 HA PRO 115 HA PRO 115 16.132 0.058 14.658 670 HB2 PRO 115 HB2 PRO 115 17.594 -0.669 12.152 671 HB3 PRO 115 HB1 PRO 115 16.742 0.838 12.561 672 HG2 PRO 115 HG2 PRO 115 19.411 0.711 12.504 673 HG3 PRO 115 HG1 PRO 115 18.551 1.700 13.705 674 HD2 PRO 115 HD2 PRO 115 19.885 -0.967 14.059 675 HD3 PRO 115 HD1 PRO 115 19.802 0.416 15.176 676 H ARG 116 HN ARG 116 14.406 -1.103 13.853 677 HA ARG 116 HA ARG 116 14.859 -3.962 13.184 678 HB2 ARG 116 HB2 ARG 116 12.656 -2.785 14.901 679 HB3 ARG 116 HB1 ARG 116 12.744 -4.468 14.369 680 HG2 ARG 116 HG2 ARG 116 14.897 -4.735 15.527 681 HG3 ARG 116 HG1 ARG 116 14.841 -3.051 16.043 682 HD2 ARG 116 HD2 ARG 116 12.745 -3.505 17.271 683 HD3 ARG 116 HD1 ARG 116 12.826 -5.197 16.774 684 HE ARG 116 HE ARG 116 15.214 -4.318 18.128 685 HH11 ARG 116 HH21 ARG 116 11.964 -5.451 18.489 686 HH12 ARG 116 HH22 ARG 116 12.226 -6.125 20.062 687 HH21 ARG 116 HH11 ARG 116 15.566 -5.200 20.193 688 HH22 ARG 116 HH12 ARG 116 14.266 -5.983 21.027 689 H CYS 117 HN CYS 117 13.685 -4.780 11.520 690 HA CYS 117 HA CYS 117 12.528 -2.941 9.663 691 HB2 CYS 117 HB2 CYS 117 12.053 -4.941 8.322 692 HB3 CYS 117 HB1 CYS 117 13.702 -4.993 8.947 693 H GLN 118 HN GLN 118 10.374 -2.789 8.973 694 HA GLN 118 HA GLN 118 8.412 -2.663 10.917 695 HB2 GLN 118 HB2 GLN 118 8.096 -3.104 7.938 696 HB3 GLN 118 HB1 GLN 118 6.782 -2.645 9.027 697 HG2 GLN 118 HG2 GLN 118 9.341 -1.057 8.681 698 HG3 GLN 118 HG1 GLN 118 7.831 -0.692 7.848 699 HE21 GLN 118 HE21 GLN 118 9.563 0.438 10.357 700 HE22 GLN 118 HE22 GLN 118 8.319 0.891 11.419 701 H ILE 119 HN ILE 119 9.757 -5.441 9.542 702 HA ILE 119 HA ILE 119 7.395 -7.121 9.948 703 HB ILE 119 HB ILE 119 10.184 -8.037 9.254 704 HG12 ILE 119 HG12 ILE 119 9.647 -6.326 7.633 705 HG13 ILE 119 HG11 ILE 119 9.364 -7.890 6.864 706 HG21 ILE 119 HG21 ILE 119 7.432 -9.143 8.635 707 HG22 ILE 119 HG22 ILE 119 8.493 -9.737 9.912 708 HG23 ILE 119 HG23 ILE 119 8.971 -9.896 8.220 709 HD11 ILE 119 HD11 ILE 119 7.440 -6.623 6.315 710 HD12 ILE 119 HD12 ILE 119 7.333 -5.929 7.932 711 HD13 ILE 119 HD13 ILE 119 6.915 -7.622 7.672 712 H CYS 120 HN CYS 120 10.614 -6.640 11.348 713 HA CYS 120 HA CYS 120 10.420 -8.712 13.271 714 HB2 CYS 120 HB2 CYS 120 12.208 -6.332 12.878 715 HB3 CYS 120 HB1 CYS 120 12.234 -7.157 14.441 716 H VAL 121 HN VAL 121 9.414 -5.364 13.253 717 HA VAL 121 HA VAL 121 8.902 -5.199 16.070 718 HB VAL 121 HB VAL 121 7.858 -3.084 15.576 719 HG11 VAL 121 HG11 VAL 121 10.232 -3.650 13.775 720 HG12 VAL 121 HG12 VAL 121 10.287 -3.078 15.442 721 HG13 VAL 121 HG13 VAL 121 9.652 -2.034 14.171 722 HG21 VAL 121 HG21 VAL 121 7.619 -2.449 13.101 723 HG22 VAL 121 HG22 VAL 121 6.443 -3.606 13.726 724 HG23 VAL 121 HG23 VAL 121 7.803 -4.167 12.759 725 H HIS 122 HN HIS 122 6.934 -5.843 13.206 726 HA HIS 122 HA HIS 122 4.508 -6.161 14.772 727 HB2 HIS 122 HB2 HIS 122 5.132 -6.562 11.840 728 HB3 HIS 122 HB1 HIS 122 3.540 -6.860 12.547 729 HD2 HIS 122 HD2 HIS 122 4.661 -4.135 10.551 730 HE1 HIS 122 HE1 HIS 122 3.048 -2.059 13.855 731 HE2 HIS 122 HE2 HIS 122 3.815 -1.831 11.444 732 H SER 123 HN SER 123 7.177 -8.057 14.162 733 HA SER 123 HA SER 123 6.040 -10.601 13.675 734 HB2 SER 123 HB2 SER 123 8.423 -10.200 13.366 735 HB3 SER 123 HB1 SER 123 8.614 -9.842 15.080 736 HG SER 123 HG SER 123 9.117 -12.055 14.337 737 H GLN 124 HN GLN 124 7.103 -9.072 16.720 738 HA GLN 124 HA GLN 124 5.074 -10.631 18.173 739 HB2 GLN 124 HB2 GLN 124 8.029 -10.621 18.815 740 HB3 GLN 124 HB1 GLN 124 6.781 -11.166 19.936 741 HG2 GLN 124 HG2 GLN 124 6.031 -12.843 18.281 742 HG3 GLN 124 HG1 GLN 124 7.291 -12.306 17.173 743 HE21 GLN 124 HE21 GLN 124 7.706 -14.846 17.617 744 HE22 GLN 124 HE22 GLN 124 8.844 -15.158 18.836 745 H ARG 125 HN ARG 125 5.122 -7.884 17.453 746 HA ARG 125 HA ARG 125 4.858 -5.784 18.366 747 HB2 ARG 125 HB2 ARG 125 4.445 -7.282 20.960 748 HB3 ARG 125 HB1 ARG 125 3.799 -5.699 20.517 749 HG2 ARG 125 HG2 ARG 125 3.121 -8.279 19.069 750 HG3 ARG 125 HG1 ARG 125 2.110 -7.545 20.311 751 HD2 ARG 125 HD2 ARG 125 2.159 -5.418 18.867 752 HD3 ARG 125 HD1 ARG 125 2.818 -6.437 17.591 753 HE ARG 125 HE ARG 125 0.398 -7.488 18.756 754 HH11 ARG 125 HH21 ARG 125 1.809 -5.351 16.427 755 HH12 ARG 125 HH22 ARG 125 0.435 -5.368 15.374 756 HH21 ARG 125 HH11 ARG 125 -1.408 -7.513 17.383 757 HH22 ARG 125 HH12 ARG 125 -1.387 -6.591 15.916 758 H ASN 126 HN ASN 126 7.526 -7.257 18.543 759 HA ASN 126 HA ASN 126 8.911 -5.167 19.942 760 HB2 ASN 126 HB2 ASN 126 8.306 -6.543 21.868 761 HB3 ASN 126 HB1 ASN 126 8.991 -7.967 21.088 762 HD21 ASN 126 HD21 ASN 126 9.765 -5.056 22.879 763 HD22 ASN 126 HD22 ASN 126 11.438 -5.325 22.963 Start of MODEL 18 1 H MET 31 HT1 MET 31 -1.095 10.713 -7.100 2 HA MET 31 HA MET 31 -3.843 11.095 -6.606 3 HB2 MET 31 HB2 MET 31 -1.241 11.396 -5.103 4 HB3 MET 31 HB1 MET 31 -2.776 11.831 -4.342 5 HG2 MET 31 HG2 MET 31 -2.200 9.501 -3.818 6 HG3 MET 31 HG1 MET 31 -3.645 9.560 -4.829 7 HE1 MET 31 HE1 MET 31 0.296 9.641 -5.215 8 HE2 MET 31 HE2 MET 31 0.519 7.996 -5.797 9 HE3 MET 31 HE3 MET 31 -0.241 8.271 -4.233 10 H GLY 32 HN GLY 32 -1.191 13.390 -5.947 11 HA2 GLY 32 HA2 GLY 32 -3.065 15.625 -6.086 12 HA3 GLY 32 HA1 GLY 32 -1.377 15.697 -5.587 13 H LYS 33 HN LYS 33 -3.278 16.968 -7.775 14 HA LYS 33 HA LYS 33 -1.336 16.758 -10.016 15 HB2 LYS 33 HB2 LYS 33 -4.256 17.528 -10.182 16 HB3 LYS 33 HB1 LYS 33 -3.155 17.221 -11.525 17 HG2 LYS 33 HG2 LYS 33 -3.974 15.169 -9.447 18 HG3 LYS 33 HG1 LYS 33 -4.642 15.279 -11.074 19 HD2 LYS 33 HD2 LYS 33 -2.199 15.083 -11.892 20 HD3 LYS 33 HD1 LYS 33 -1.828 14.553 -10.250 21 HE2 LYS 33 HE2 LYS 33 -3.377 12.702 -10.428 22 HE3 LYS 33 HE1 LYS 33 -3.929 13.263 -12.006 23 HZ1 LYS 33 HZ1 LYS 33 -1.664 11.684 -11.368 24 HZ2 LYS 33 HZ2 LYS 33 -1.186 13.097 -12.182 25 HZ3 LYS 33 HZ3 LYS 33 -2.321 12.049 -12.890 26 H ASN 34 HN ASN 34 -0.037 18.461 -9.917 27 HA ASN 34 HA ASN 34 -1.202 21.130 -10.017 28 HB2 ASN 34 HB2 ASN 34 0.816 20.382 -7.885 29 HB3 ASN 34 HB1 ASN 34 0.173 21.999 -8.194 30 HD21 ASN 34 HD21 ASN 34 -0.202 19.479 -6.099 31 HD22 ASN 34 HD22 ASN 34 -1.840 19.675 -5.704 32 H ASP 35 HN ASP 35 1.585 22.099 -9.228 33 HA ASP 35 HA ASP 35 2.644 22.138 -11.909 34 HB2 ASP 35 HB2 ASP 35 4.381 23.597 -10.935 35 HB3 ASP 35 HB1 ASP 35 2.756 24.138 -10.501 36 H ASN 36 HN ASN 36 2.784 19.877 -9.536 37 HA ASN 36 HA ASN 36 5.602 19.162 -9.838 38 HB2 ASN 36 HB2 ASN 36 5.092 17.379 -8.238 39 HB3 ASN 36 HB1 ASN 36 4.523 18.939 -7.635 40 HD21 ASN 36 HD21 ASN 36 3.062 17.381 -6.306 41 HD22 ASN 36 HD22 ASN 36 1.594 16.918 -7.020 42 H ASP 37 HN ASP 37 3.228 18.953 -11.909 43 HA ASP 37 HA ASP 37 3.271 16.124 -12.551 44 HB2 ASP 37 HB2 ASP 37 2.065 18.517 -13.949 45 HB3 ASP 37 HB1 ASP 37 1.920 16.862 -14.537 46 H ALA 38 HN ALA 38 5.535 18.369 -12.815 47 HA ALA 38 HA ALA 38 6.354 18.067 -15.563 48 HB1 ALA 38 HB1 ALA 38 8.391 19.250 -14.845 49 HB2 ALA 38 HB2 ALA 38 7.861 19.129 -13.168 50 HB3 ALA 38 HB3 ALA 38 6.933 20.092 -14.318 51 H LEU 39 HN LEU 39 7.717 16.604 -16.424 52 HA LEU 39 HA LEU 39 9.132 14.740 -14.597 53 HB2 LEU 39 HB2 LEU 39 7.685 14.090 -17.172 54 HB3 LEU 39 HB1 LEU 39 8.697 12.964 -16.280 55 HG LEU 39 HG LEU 39 6.380 14.389 -14.958 56 HD11 LEU 39 HD11 LEU 39 6.357 11.772 -16.489 57 HD12 LEU 39 HD12 LEU 39 5.403 13.213 -16.835 58 HD13 LEU 39 HD13 LEU 39 5.082 12.272 -15.379 59 HD21 LEU 39 HD21 LEU 39 8.095 11.987 -14.341 60 HD22 LEU 39 HD22 LEU 39 6.509 12.170 -13.602 61 HD23 LEU 39 HD23 LEU 39 7.752 13.385 -13.326 62 H ILE 40 HN ILE 40 11.236 14.923 -14.844 63 HA ILE 40 HA ILE 40 12.333 15.895 -17.416 64 HB ILE 40 HB ILE 40 13.583 15.747 -14.662 65 HG12 ILE 40 HG12 ILE 40 13.510 18.271 -14.965 66 HG13 ILE 40 HG11 ILE 40 12.481 18.002 -16.370 67 HG21 ILE 40 HG21 ILE 40 14.616 16.635 -17.364 68 HG22 ILE 40 HG22 ILE 40 15.343 15.482 -16.245 69 HG23 ILE 40 HG23 ILE 40 15.332 17.201 -15.855 70 HD11 ILE 40 HD11 ILE 40 11.655 16.658 -13.827 71 HD12 ILE 40 HD12 ILE 40 10.670 17.386 -15.094 72 HD13 ILE 40 HD13 ILE 40 11.474 18.408 -13.910 73 H MET 41 HN MET 41 13.745 14.717 -18.590 74 HA MET 41 HA MET 41 13.999 11.883 -17.877 75 HB2 MET 41 HB2 MET 41 13.349 12.917 -20.226 76 HB3 MET 41 HB1 MET 41 15.096 13.058 -20.423 77 HG2 MET 41 HG2 MET 41 15.337 10.646 -19.898 78 HG3 MET 41 HG1 MET 41 13.585 10.518 -19.746 79 HE1 MET 41 HE1 MET 41 16.404 9.798 -21.842 80 HE2 MET 41 HE2 MET 41 16.525 11.542 -22.064 81 HE3 MET 41 HE3 MET 41 16.157 10.509 -23.444 82 H CYS 42 HN CYS 42 15.890 10.902 -17.361 83 HA CYS 42 HA CYS 42 18.126 12.564 -16.608 84 HB2 CYS 42 HB2 CYS 42 17.339 10.599 -15.267 85 HB3 CYS 42 HB1 CYS 42 17.921 9.548 -16.562 86 H MET 43 HN MET 43 20.107 12.671 -17.495 87 HA MET 43 HA MET 43 20.360 11.864 -20.274 88 HB2 MET 43 HB2 MET 43 22.549 13.012 -20.141 89 HB3 MET 43 HB1 MET 43 21.228 14.029 -19.570 90 HG2 MET 43 HG2 MET 43 22.421 14.332 -17.653 91 HG3 MET 43 HG1 MET 43 22.082 12.646 -17.259 92 HE1 MET 43 HE1 MET 43 24.206 14.690 -19.772 93 HE2 MET 43 HE2 MET 43 25.834 14.465 -19.139 94 HE3 MET 43 HE3 MET 43 24.624 15.292 -18.162 95 H ARG 44 HN ARG 44 20.799 10.262 -17.408 96 HA ARG 44 HA ARG 44 22.989 8.574 -18.484 97 HB2 ARG 44 HB2 ARG 44 22.177 9.334 -15.692 98 HB3 ARG 44 HB1 ARG 44 23.100 7.860 -15.976 99 HG2 ARG 44 HG2 ARG 44 24.132 10.324 -17.329 100 HG3 ARG 44 HG1 ARG 44 24.263 10.302 -15.572 101 HD2 ARG 44 HD2 ARG 44 26.285 9.359 -16.602 102 HD3 ARG 44 HD1 ARG 44 25.424 8.129 -15.675 103 HE ARG 44 HE ARG 44 24.743 8.231 -18.501 104 HH11 ARG 44 HH21 ARG 44 26.745 6.921 -16.007 105 HH12 ARG 44 HH22 ARG 44 27.165 5.496 -16.900 106 HH21 ARG 44 HH11 ARG 44 25.280 6.362 -19.678 107 HH22 ARG 44 HH12 ARG 44 26.335 5.180 -18.980 108 H CYS 45 HN CYS 45 20.883 7.756 -15.825 109 HA CYS 45 HA CYS 45 20.297 5.194 -16.900 110 HB2 CYS 45 HB2 CYS 45 18.865 4.902 -14.973 111 HB3 CYS 45 HB1 CYS 45 20.340 5.723 -14.464 112 H ARG 46 HN ARG 46 19.181 8.119 -17.875 113 HA ARG 46 HA ARG 46 17.294 8.854 -18.976 114 HB2 ARG 46 HB2 ARG 46 17.483 5.989 -19.883 115 HB3 ARG 46 HB1 ARG 46 16.399 7.180 -20.612 116 HG2 ARG 46 HG2 ARG 46 18.292 8.606 -21.196 117 HG3 ARG 46 HG1 ARG 46 19.404 7.514 -20.376 118 HD2 ARG 46 HD2 ARG 46 19.435 7.112 -22.793 119 HD3 ARG 46 HD1 ARG 46 18.793 5.713 -21.938 120 HE ARG 46 HE ARG 46 16.684 6.145 -22.873 121 HH11 ARG 46 HH21 ARG 46 18.938 8.693 -23.497 122 HH12 ARG 46 HH22 ARG 46 17.940 9.476 -24.676 123 HH21 ARG 46 HH11 ARG 46 15.367 7.166 -24.417 124 HH22 ARG 46 HH12 ARG 46 15.917 8.611 -25.197 125 H LYS 47 HN LYS 47 16.823 8.021 -16.276 126 HA LYS 47 HA LYS 47 14.256 6.628 -16.340 127 HB2 LYS 47 HB2 LYS 47 15.955 6.224 -14.533 128 HB3 LYS 47 HB1 LYS 47 15.670 7.872 -13.972 129 HG2 LYS 47 HG2 LYS 47 13.321 7.379 -13.574 130 HG3 LYS 47 HG1 LYS 47 13.511 5.764 -14.260 131 HD2 LYS 47 HD2 LYS 47 15.189 5.257 -12.474 132 HD3 LYS 47 HD1 LYS 47 14.837 6.827 -11.749 133 HE2 LYS 47 HE2 LYS 47 12.845 4.584 -12.192 134 HE3 LYS 47 HE1 LYS 47 13.521 5.080 -10.640 135 HZ1 LYS 47 HZ1 LYS 47 11.368 6.217 -12.120 136 HZ2 LYS 47 HZ2 LYS 47 12.548 7.382 -11.753 137 HZ3 LYS 47 HZ3 LYS 47 11.824 6.481 -10.508 138 H VAL 48 HN VAL 48 12.363 7.631 -16.471 139 HA VAL 48 HA VAL 48 12.295 10.562 -16.309 140 HB VAL 48 HB VAL 48 9.825 9.067 -17.034 141 HG11 VAL 48 HG11 VAL 48 9.539 10.835 -18.559 142 HG12 VAL 48 HG12 VAL 48 11.267 11.186 -18.621 143 HG13 VAL 48 HG13 VAL 48 10.334 11.602 -17.185 144 HG21 VAL 48 HG21 VAL 48 11.300 7.571 -18.132 145 HG22 VAL 48 HG22 VAL 48 12.391 8.869 -18.612 146 HG23 VAL 48 HG23 VAL 48 10.810 8.716 -19.378 147 H LYS 49 HN LYS 49 11.492 11.611 -14.630 148 HA LYS 49 HA LYS 49 9.324 10.591 -13.055 149 HB2 LYS 49 HB2 LYS 49 12.066 10.095 -12.184 150 HB3 LYS 49 HB1 LYS 49 11.171 11.043 -11.002 151 HG2 LYS 49 HG2 LYS 49 9.968 8.547 -12.204 152 HG3 LYS 49 HG1 LYS 49 11.046 8.456 -10.822 153 HD2 LYS 49 HD2 LYS 49 9.597 9.988 -9.564 154 HD3 LYS 49 HD1 LYS 49 8.519 10.124 -10.951 155 HE2 LYS 49 HE2 LYS 49 8.075 7.705 -10.847 156 HE3 LYS 49 HE1 LYS 49 9.151 7.567 -9.456 157 HZ1 LYS 49 HZ1 LYS 49 7.638 9.409 -8.493 158 HZ2 LYS 49 HZ2 LYS 49 7.112 7.794 -8.464 159 HZ3 LYS 49 HZ3 LYS 49 6.520 8.862 -9.644 160 H GLY 50 HN GLY 50 8.979 12.091 -11.104 161 HA2 GLY 50 HA2 GLY 50 9.161 14.838 -12.105 162 HA3 GLY 50 HA1 GLY 50 8.111 14.262 -10.815 163 H ILE 51 HN ILE 51 9.027 16.326 -9.851 164 HA ILE 51 HA ILE 51 11.669 16.663 -9.074 165 HB ILE 51 HB ILE 51 9.805 18.304 -8.754 166 HG12 ILE 51 HG12 ILE 51 11.249 17.755 -6.151 167 HG13 ILE 51 HG11 ILE 51 12.083 18.388 -7.572 168 HG21 ILE 51 HG21 ILE 51 9.212 16.718 -6.245 169 HG22 ILE 51 HG22 ILE 51 8.262 16.565 -7.724 170 HG23 ILE 51 HG23 ILE 51 8.329 18.110 -6.876 171 HD11 ILE 51 HD11 ILE 51 10.742 20.357 -7.593 172 HD12 ILE 51 HD12 ILE 51 11.227 20.122 -5.913 173 HD13 ILE 51 HD13 ILE 51 9.603 19.674 -6.433 174 H ASP 52 HN ASP 52 9.745 14.037 -8.293 175 HA ASP 52 HA ASP 52 10.544 13.579 -5.590 176 HB2 ASP 52 HB2 ASP 52 8.519 12.587 -6.694 177 HB3 ASP 52 HB1 ASP 52 9.602 11.566 -7.638 178 H SER 53 HN SER 53 11.573 12.295 -8.733 179 HA SER 53 HA SER 53 13.881 10.977 -7.479 180 HB2 SER 53 HB2 SER 53 13.348 10.971 -10.431 181 HB3 SER 53 HB1 SER 53 14.160 9.762 -9.446 182 HG SER 53 HG SER 53 12.296 8.948 -8.886 183 H TYR 54 HN TYR 54 13.216 13.997 -8.515 184 HA TYR 54 HA TYR 54 15.993 14.507 -9.436 185 HB2 TYR 54 HB2 TYR 54 13.347 15.534 -10.369 186 HB3 TYR 54 HB1 TYR 54 14.671 16.701 -10.324 187 HD1 TYR 54 HD1 TYR 54 14.244 13.082 -11.285 188 HD2 TYR 54 HD2 TYR 54 15.819 16.931 -12.337 189 HE1 TYR 54 HE1 TYR 54 15.151 12.132 -13.376 190 HE2 TYR 54 HE2 TYR 54 16.723 15.982 -14.427 191 HH TYR 54 HH TYR 54 15.890 12.794 -15.513 192 H SER 55 HN SER 55 17.202 15.697 -8.158 193 HA SER 55 HA SER 55 16.345 16.665 -5.669 194 HB2 SER 55 HB2 SER 55 18.654 16.227 -5.888 195 HB3 SER 55 HB1 SER 55 18.779 17.178 -7.370 196 HG SER 55 HG SER 55 18.498 19.033 -6.171 197 H LYS 56 HN LYS 56 16.194 18.854 -4.923 198 HA LYS 56 HA LYS 56 14.533 20.489 -6.506 199 HB2 LYS 56 HB2 LYS 56 16.136 21.086 -4.014 200 HB3 LYS 56 HB1 LYS 56 14.994 22.222 -4.731 201 HG2 LYS 56 HG2 LYS 56 13.187 20.559 -4.499 202 HG3 LYS 56 HG1 LYS 56 14.328 19.418 -3.785 203 HD2 LYS 56 HD2 LYS 56 14.777 21.057 -1.959 204 HD3 LYS 56 HD1 LYS 56 13.547 22.121 -2.651 205 HE2 LYS 56 HE2 LYS 56 13.045 19.278 -1.718 206 HE3 LYS 56 HE1 LYS 56 12.648 20.728 -0.793 207 HZ1 LYS 56 HZ1 LYS 56 11.336 21.426 -2.822 208 HZ2 LYS 56 HZ2 LYS 56 10.695 20.144 -1.911 209 HZ3 LYS 56 HZ3 LYS 56 11.505 19.831 -3.371 210 H THR 57 HN THR 57 18.002 20.687 -5.764 211 HA THR 57 HA THR 57 18.484 23.132 -7.098 212 HB THR 57 HB THR 57 20.447 20.856 -6.790 213 HG1 THR 57 HG1 THR 57 20.736 22.550 -4.849 214 HG21 THR 57 HG21 THR 57 21.162 22.780 -8.174 215 HG22 THR 57 HG22 THR 57 22.078 22.691 -6.671 216 HG23 THR 57 HG23 THR 57 20.777 23.870 -6.842 217 H GLN 58 HN GLN 58 18.879 19.754 -8.180 218 HA GLN 58 HA GLN 58 19.725 20.385 -10.806 219 HB2 GLN 58 HB2 GLN 58 18.282 17.907 -9.833 220 HB3 GLN 58 HB1 GLN 58 19.223 18.051 -11.319 221 HG2 GLN 58 HG2 GLN 58 20.334 18.476 -8.531 222 HG3 GLN 58 HG1 GLN 58 20.521 16.994 -9.467 223 HE21 GLN 58 HE21 GLN 58 22.359 19.474 -8.574 224 HE22 GLN 58 HE22 GLN 58 23.273 19.738 -9.986 225 H TRP 59 HN TRP 59 16.531 19.737 -9.422 226 HA TRP 59 HA TRP 59 15.075 19.774 -11.839 227 HB2 TRP 59 HB2 TRP 59 14.214 18.930 -9.645 228 HB3 TRP 59 HB1 TRP 59 14.092 20.606 -9.098 229 HD1 TRP 59 HD1 TRP 59 12.638 18.195 -11.705 230 HE1 TRP 59 HE1 TRP 59 10.361 19.115 -12.498 231 HE3 TRP 59 HE3 TRP 59 12.628 22.694 -9.306 232 HZ2 TRP 59 HZ2 TRP 59 8.760 21.459 -12.170 233 HZ3 TRP 59 HZ3 TRP 59 10.718 24.256 -9.563 234 HH2 TRP 59 HH2 TRP 59 8.784 23.643 -10.989 235 H SER 60 HN SER 60 16.091 22.320 -9.633 236 HA SER 60 HA SER 60 14.583 24.409 -10.893 237 HB2 SER 60 HB2 SER 60 16.853 24.390 -8.912 238 HB3 SER 60 HB1 SER 60 16.190 25.889 -9.558 239 HG SER 60 HG SER 60 15.270 24.849 -7.526 240 H LYS 61 HN LYS 61 17.653 22.907 -11.461 241 HA LYS 61 HA LYS 61 18.862 25.041 -12.925 242 HB2 LYS 61 HB2 LYS 61 19.392 22.092 -12.660 243 HB3 LYS 61 HB1 LYS 61 20.246 23.034 -13.878 244 HG2 LYS 61 HG2 LYS 61 21.074 24.561 -12.145 245 HG3 LYS 61 HG1 LYS 61 20.175 23.685 -10.918 246 HD2 LYS 61 HD2 LYS 61 22.332 22.765 -10.729 247 HD3 LYS 61 HD1 LYS 61 21.494 21.594 -11.744 248 HE2 LYS 61 HE2 LYS 61 22.482 22.526 -13.749 249 HE3 LYS 61 HE1 LYS 61 23.168 23.873 -12.843 250 HZ1 LYS 61 HZ1 LYS 61 24.268 21.346 -13.294 251 HZ2 LYS 61 HZ2 LYS 61 23.976 21.493 -11.628 252 HZ3 LYS 61 HZ3 LYS 61 24.934 22.644 -12.431 253 H THR 62 HN THR 62 16.436 22.726 -13.652 254 HA THR 62 HA THR 62 16.832 22.713 -16.494 255 HB THR 62 HB THR 62 14.725 21.509 -16.584 256 HG1 THR 62 HG1 THR 62 14.449 22.700 -14.095 257 HG21 THR 62 HG21 THR 62 16.101 20.567 -14.074 258 HG22 THR 62 HG22 THR 62 16.899 20.459 -15.643 259 HG23 THR 62 HG23 THR 62 15.385 19.602 -15.363 260 H PHE 63 HN PHE 63 15.820 25.099 -14.460 261 HA PHE 63 HA PHE 63 14.120 26.365 -16.532 262 HB2 PHE 63 HB2 PHE 63 13.967 26.719 -13.525 263 HB3 PHE 63 HB1 PHE 63 12.940 27.510 -14.721 264 HD1 PHE 63 HD2 PHE 63 13.764 24.327 -13.077 265 HD2 PHE 63 HD1 PHE 63 11.213 26.298 -15.900 266 HE1 PHE 63 HE2 PHE 63 12.250 22.361 -13.055 267 HE2 PHE 63 HE1 PHE 63 9.685 24.331 -15.895 268 HZ PHE 63 HZ PHE 63 10.204 22.363 -14.469 269 H THR 64 HN THR 64 14.503 28.495 -16.969 270 HA THR 64 HA THR 64 16.822 29.775 -15.637 271 HB THR 64 HB THR 64 17.284 30.788 -17.938 272 HG1 THR 64 HG1 THR 64 15.233 29.021 -18.474 273 HG21 THR 64 HG21 THR 64 18.263 28.484 -18.754 274 HG22 THR 64 HG22 THR 64 17.713 27.912 -17.178 275 HG23 THR 64 HG23 THR 64 18.884 29.225 -17.279 276 H PHE 65 HN PHE 65 16.823 32.072 -15.762 277 HA PHE 65 HA PHE 65 14.095 33.201 -15.771 278 HB2 PHE 65 HB2 PHE 65 16.162 33.361 -13.883 279 HB3 PHE 65 HB1 PHE 65 16.200 34.932 -14.672 280 HD1 PHE 65 HD1 PHE 65 13.600 32.482 -13.529 281 HD2 PHE 65 HD2 PHE 65 14.877 36.581 -13.658 282 HE1 PHE 65 HE1 PHE 65 11.580 33.151 -12.262 283 HE2 PHE 65 HE2 PHE 65 12.854 37.246 -12.381 284 HZ PHE 65 HZ PHE 65 11.209 35.535 -11.699 285 H VAL 66 HN VAL 66 13.510 34.382 -17.426 286 HA VAL 66 HA VAL 66 15.544 35.983 -18.867 287 HB VAL 66 HB VAL 66 13.338 34.267 -20.018 288 HG11 VAL 66 HG11 VAL 66 13.159 36.299 -21.240 289 HG12 VAL 66 HG12 VAL 66 14.206 35.277 -22.224 290 HG13 VAL 66 HG13 VAL 66 14.904 36.554 -21.228 291 HG21 VAL 66 HG21 VAL 66 15.584 33.251 -19.527 292 HG22 VAL 66 HG22 VAL 66 16.307 34.437 -20.613 293 HG23 VAL 66 HG23 VAL 66 15.173 33.242 -21.242 294 H ARG 67 HN ARG 67 15.041 38.056 -19.140 295 HA ARG 67 HA ARG 67 13.916 40.044 -18.873 296 HB2 ARG 67 HB2 ARG 67 11.745 38.296 -20.052 297 HB3 ARG 67 HB1 ARG 67 11.603 40.048 -19.865 298 HG2 ARG 67 HG2 ARG 67 13.598 40.373 -21.266 299 HG3 ARG 67 HG1 ARG 67 13.781 38.626 -21.431 300 HD2 ARG 67 HD2 ARG 67 12.662 39.406 -23.413 301 HD3 ARG 67 HD1 ARG 67 11.458 38.571 -22.428 302 HE ARG 67 HE ARG 67 11.441 41.321 -21.769 303 HH11 ARG 67 HH21 ARG 67 10.669 39.135 -24.339 304 HH12 ARG 67 HH22 ARG 67 9.414 40.132 -24.995 305 HH21 ARG 67 HH11 ARG 67 9.801 42.639 -22.632 306 HH22 ARG 67 HH12 ARG 67 8.923 42.115 -24.029 307 H GLY 68 HN GLY 68 13.900 38.105 -16.611 308 HA2 GLY 68 HA2 GLY 68 13.126 38.241 -14.444 309 HA3 GLY 68 HA1 GLY 68 12.027 39.523 -14.953 310 H ARG 69 HN ARG 69 11.960 36.630 -16.800 311 HA ARG 69 HA ARG 69 9.484 35.738 -15.423 312 HB2 ARG 69 HB2 ARG 69 9.019 36.831 -17.602 313 HB3 ARG 69 HB1 ARG 69 10.061 35.649 -18.395 314 HG2 ARG 69 HG2 ARG 69 8.630 33.823 -17.657 315 HG3 ARG 69 HG1 ARG 69 7.630 34.941 -16.727 316 HD2 ARG 69 HD2 ARG 69 6.507 34.479 -18.822 317 HD3 ARG 69 HD1 ARG 69 7.092 36.141 -18.860 318 HE ARG 69 HE ARG 69 9.043 34.411 -19.981 319 HH11 ARG 69 HH21 ARG 69 5.924 35.790 -20.561 320 HH12 ARG 69 HH22 ARG 69 6.081 35.767 -22.286 321 HH21 ARG 69 HH11 ARG 69 9.256 34.373 -22.242 322 HH22 ARG 69 HH12 ARG 69 7.968 34.964 -23.237 323 H THR 70 HN THR 70 9.159 33.552 -15.213 324 HA THR 70 HA THR 70 11.529 31.916 -15.250 325 HB THR 70 HB THR 70 8.669 31.102 -14.688 326 HG1 THR 70 HG1 THR 70 8.931 32.338 -13.025 327 HG21 THR 70 HG21 THR 70 11.370 29.869 -14.128 328 HG22 THR 70 HG22 THR 70 10.016 29.163 -15.009 329 HG23 THR 70 HG23 THR 70 9.911 29.387 -13.263 330 H VAL 71 HN VAL 71 12.215 30.716 -16.893 331 HA VAL 71 HA VAL 71 10.267 29.735 -18.895 332 HB VAL 71 HB VAL 71 12.138 30.125 -20.597 333 HG11 VAL 71 HG11 VAL 71 11.571 32.620 -20.716 334 HG12 VAL 71 HG12 VAL 71 10.649 32.378 -19.233 335 HG13 VAL 71 HG13 VAL 71 10.196 31.514 -20.702 336 HG21 VAL 71 HG21 VAL 71 13.084 32.036 -18.436 337 HG22 VAL 71 HG22 VAL 71 13.793 31.811 -20.034 338 HG23 VAL 71 HG23 VAL 71 13.889 30.522 -18.843 339 H SER 72 HN SER 72 10.494 27.664 -19.443 340 HA SER 72 HA SER 72 12.262 25.978 -17.959 341 HB2 SER 72 HB2 SER 72 10.345 25.506 -20.237 342 HB3 SER 72 HB1 SER 72 11.378 24.213 -19.621 343 HG SER 72 HG SER 72 10.496 24.748 -17.515 344 H VAL 73 HN VAL 73 14.119 24.951 -18.567 345 HA VAL 73 HA VAL 73 15.742 26.180 -20.536 346 HB VAL 73 HB VAL 73 16.065 23.611 -18.985 347 HG11 VAL 73 HG11 VAL 73 17.891 25.004 -20.945 348 HG12 VAL 73 HG12 VAL 73 17.404 23.312 -20.923 349 HG13 VAL 73 HG13 VAL 73 18.512 23.924 -19.697 350 HG21 VAL 73 HG21 VAL 73 16.081 25.976 -17.879 351 HG22 VAL 73 HG22 VAL 73 17.635 26.169 -18.691 352 HG23 VAL 73 HG23 VAL 73 17.410 24.876 -17.515 353 H SER 74 HN SER 74 16.250 25.576 -22.602 354 HA SER 74 HA SER 74 14.397 23.928 -24.021 355 HB2 SER 74 HB2 SER 74 15.288 25.705 -25.271 356 HB3 SER 74 HB1 SER 74 16.938 25.353 -24.768 357 HG SER 74 HG SER 74 16.364 23.201 -25.874 358 H ASP 75 HN ASP 75 17.770 23.536 -22.994 359 HA ASP 75 HA ASP 75 17.544 20.628 -23.532 360 HB2 ASP 75 HB2 ASP 75 19.902 22.442 -24.066 361 HB3 ASP 75 HB1 ASP 75 19.974 20.676 -24.105 362 HA PRO 76 HA PRO 76 18.817 21.402 -19.155 363 HB2 PRO 76 HB2 PRO 76 16.977 19.768 -17.965 364 HB3 PRO 76 HB1 PRO 76 16.616 21.438 -18.432 365 HG2 PRO 76 HG2 PRO 76 15.855 18.898 -19.770 366 HG3 PRO 76 HG1 PRO 76 14.958 20.420 -19.644 367 HD2 PRO 76 HD2 PRO 76 16.398 19.590 -21.892 368 HD3 PRO 76 HD1 PRO 76 15.911 21.268 -21.566 369 H LYS 77 HN LYS 77 20.699 20.327 -18.872 370 HA LYS 77 HA LYS 77 20.691 17.359 -19.027 371 HB2 LYS 77 HB2 LYS 77 23.034 19.235 -19.419 372 HB3 LYS 77 HB1 LYS 77 23.029 17.487 -19.646 373 HG2 LYS 77 HG2 LYS 77 21.294 19.411 -21.220 374 HG3 LYS 77 HG1 LYS 77 22.832 18.772 -21.794 375 HD2 LYS 77 HD2 LYS 77 21.806 16.435 -21.341 376 HD3 LYS 77 HD1 LYS 77 20.258 17.278 -21.268 377 HE2 LYS 77 HE2 LYS 77 20.460 16.604 -23.529 378 HE3 LYS 77 HE1 LYS 77 20.905 18.311 -23.533 379 HZ1 LYS 77 HZ1 LYS 77 23.196 17.744 -23.556 380 HZ2 LYS 77 HZ2 LYS 77 22.445 16.840 -24.783 381 HZ3 LYS 77 HZ3 LYS 77 22.866 16.099 -23.312 382 H VAL 78 HN VAL 78 20.427 16.708 -16.986 383 HA VAL 78 HA VAL 78 22.407 17.606 -14.989 384 HB VAL 78 HB VAL 78 20.625 17.623 -13.266 385 HG11 VAL 78 HG11 VAL 78 19.722 19.793 -13.876 386 HG12 VAL 78 HG12 VAL 78 20.042 19.488 -15.582 387 HG13 VAL 78 HG13 VAL 78 21.384 19.697 -14.457 388 HG21 VAL 78 HG21 VAL 78 18.278 17.667 -13.982 389 HG22 VAL 78 HG22 VAL 78 19.033 16.151 -14.471 390 HG23 VAL 78 HG23 VAL 78 18.769 17.428 -15.658 391 H ILE 79 HN ILE 79 22.628 16.082 -13.199 392 HA ILE 79 HA ILE 79 22.172 13.304 -14.100 393 HB ILE 79 HB ILE 79 23.997 14.232 -11.881 394 HG12 ILE 79 HG12 ILE 79 24.691 15.402 -13.890 395 HG13 ILE 79 HG11 ILE 79 25.815 14.074 -13.601 396 HG21 ILE 79 HG21 ILE 79 25.158 12.077 -12.525 397 HG22 ILE 79 HG22 ILE 79 23.771 11.718 -13.552 398 HG23 ILE 79 HG23 ILE 79 23.561 11.879 -11.808 399 HD11 ILE 79 HD11 ILE 79 25.339 13.909 -15.903 400 HD12 ILE 79 HD12 ILE 79 23.631 14.271 -15.667 401 HD13 ILE 79 HD13 ILE 79 24.273 12.704 -15.182 402 H CYS 80 HN CYS 80 20.446 12.357 -13.255 403 HA CYS 80 HA CYS 80 18.932 13.263 -11.105 404 HB2 CYS 80 HB2 CYS 80 17.714 11.255 -11.267 405 HB3 CYS 80 HB1 CYS 80 18.345 11.500 -12.897 406 H ARG 81 HN ARG 81 18.586 12.191 -9.003 407 HA ARG 81 HA ARG 81 20.871 12.210 -7.411 408 HB2 ARG 81 HB2 ARG 81 18.222 10.838 -6.932 409 HB3 ARG 81 HB1 ARG 81 19.455 11.093 -5.697 410 HG2 ARG 81 HG2 ARG 81 19.338 13.549 -6.155 411 HG3 ARG 81 HG1 ARG 81 18.004 13.240 -7.269 412 HD2 ARG 81 HD2 ARG 81 18.028 12.489 -4.336 413 HD3 ARG 81 HD1 ARG 81 17.204 13.891 -5.013 414 HE ARG 81 HE ARG 81 16.209 11.775 -6.441 415 HH11 ARG 81 HH21 ARG 81 16.539 12.590 -3.091 416 HH12 ARG 81 HH22 ARG 81 15.126 11.718 -2.597 417 HH21 ARG 81 HH11 ARG 81 14.357 10.626 -5.796 418 HH22 ARG 81 HH12 ARG 81 13.890 10.609 -4.128 419 H THR 82 HN THR 82 19.139 9.443 -8.830 420 HA THR 82 HA THR 82 20.632 7.384 -7.670 421 HB THR 82 HB THR 82 19.541 7.343 -10.487 422 HG1 THR 82 HG1 THR 82 17.577 6.990 -9.623 423 HG21 THR 82 HG21 THR 82 20.881 5.398 -9.759 424 HG22 THR 82 HG22 THR 82 19.185 4.970 -9.986 425 HG23 THR 82 HG23 THR 82 19.825 5.209 -8.359 426 H CYS 83 HN CYS 83 21.198 9.156 -10.703 427 HA CYS 83 HA CYS 83 23.677 7.731 -11.213 428 HB2 CYS 83 HB2 CYS 83 22.341 10.066 -12.605 429 HB3 CYS 83 HB1 CYS 83 23.844 9.315 -13.150 430 H GLN 84 HN GLN 84 22.672 10.447 -9.416 431 HA GLN 84 HA GLN 84 24.885 12.125 -9.726 432 HB2 GLN 84 HB2 GLN 84 22.762 12.785 -8.618 433 HB3 GLN 84 HB1 GLN 84 23.230 11.814 -7.222 434 HG2 GLN 84 HG2 GLN 84 25.362 13.191 -7.113 435 HG3 GLN 84 HG1 GLN 84 24.655 14.243 -8.342 436 HE21 GLN 84 HE21 GLN 84 24.513 16.062 -6.840 437 HE22 GLN 84 HE22 GLN 84 23.374 16.073 -5.580 438 HA PRO 85 HA PRO 85 27.906 9.577 -7.565 439 HB2 PRO 85 HB2 PRO 85 29.988 11.355 -7.531 440 HB3 PRO 85 HB1 PRO 85 29.497 10.467 -8.992 441 HG2 PRO 85 HG2 PRO 85 28.896 13.283 -8.194 442 HG3 PRO 85 HG1 PRO 85 29.310 12.625 -9.788 443 HD2 PRO 85 HD2 PRO 85 26.737 13.220 -9.027 444 HD3 PRO 85 HD1 PRO 85 27.134 11.967 -10.233 445 H LYS 86 HN LYS 86 28.901 9.433 -5.501 446 HA LYS 86 HA LYS 86 27.539 10.688 -3.378 447 HB2 LYS 86 HB2 LYS 86 30.282 9.413 -3.269 448 HB3 LYS 86 HB1 LYS 86 29.144 9.604 -1.935 449 HG2 LYS 86 HG2 LYS 86 28.626 7.961 -4.433 450 HG3 LYS 86 HG1 LYS 86 29.121 7.298 -2.875 451 HD2 LYS 86 HD2 LYS 86 27.049 8.516 -1.914 452 HD3 LYS 86 HD1 LYS 86 26.525 8.663 -3.591 453 HE2 LYS 86 HE2 LYS 86 26.666 6.227 -3.870 454 HE3 LYS 86 HE1 LYS 86 27.203 6.063 -2.197 455 HZ1 LYS 86 HZ1 LYS 86 24.654 5.926 -2.945 456 HZ2 LYS 86 HZ2 LYS 86 24.767 7.585 -2.598 457 HZ3 LYS 86 HZ3 LYS 86 25.148 6.437 -1.405 458 H GLN 87 HN GLN 87 31.046 10.973 -3.926 459 HA GLN 87 HA GLN 87 30.848 13.895 -3.545 460 HB2 GLN 87 HB2 GLN 87 32.676 12.034 -2.001 461 HB3 GLN 87 HB1 GLN 87 32.795 13.796 -1.995 462 HG2 GLN 87 HG2 GLN 87 30.335 12.231 -1.157 463 HG3 GLN 87 HG1 GLN 87 31.514 12.915 -0.042 464 HE21 GLN 87 HE21 GLN 87 28.519 13.562 -1.216 465 HE22 GLN 87 HE22 GLN 87 28.557 15.259 -1.216 466 H HIS 88 HN HIS 88 31.227 13.895 -5.841 467 HA HIS 88 HA HIS 88 33.997 14.193 -6.470 468 HB2 HIS 88 HB2 HIS 88 33.902 11.756 -6.631 469 HB3 HIS 88 HB1 HIS 88 32.524 11.869 -7.733 470 HD2 HIS 88 HD2 HIS 88 36.392 12.078 -7.859 471 HE1 HIS 88 HE1 HIS 88 34.971 13.173 -11.680 472 HE2 HIS 88 HE2 HIS 88 37.044 12.584 -10.336 473 H ASP 89 HN ASP 89 33.996 15.918 -7.741 474 HA ASP 89 HA ASP 89 32.430 16.048 -10.136 475 HB2 ASP 89 HB2 ASP 89 30.724 16.704 -8.455 476 HB3 ASP 89 HB1 ASP 89 31.769 18.028 -7.946 477 H SER 90 HN SER 90 34.711 16.199 -10.776 478 HA SER 90 HA SER 90 36.455 18.243 -10.035 479 HB2 SER 90 HB2 SER 90 36.244 17.073 -12.815 480 HB3 SER 90 HB1 SER 90 37.679 17.727 -12.026 481 HG SER 90 HG SER 90 37.908 15.641 -11.618 482 H ILE 91 HN ILE 91 37.150 20.084 -11.412 483 HA ILE 91 HA ILE 91 34.857 21.404 -12.762 484 HB ILE 91 HB ILE 91 36.881 22.685 -10.907 485 HG12 ILE 91 HG12 ILE 91 33.878 22.406 -10.588 486 HG13 ILE 91 HG11 ILE 91 35.029 21.268 -9.876 487 HG21 ILE 91 HG21 ILE 91 36.339 24.318 -12.540 488 HG22 ILE 91 HG22 ILE 91 35.201 24.640 -11.228 489 HG23 ILE 91 HG23 ILE 91 34.669 23.765 -12.663 490 HD11 ILE 91 HD11 ILE 91 34.935 24.257 -9.369 491 HD12 ILE 91 HD12 ILE 91 36.129 23.146 -8.702 492 HD13 ILE 91 HD13 ILE 91 34.435 22.998 -8.238 493 H TRP 92 HN TRP 92 35.282 22.370 -14.662 494 HA TRP 92 HA TRP 92 37.837 21.859 -15.900 495 HB2 TRP 92 HB2 TRP 92 35.976 21.601 -17.344 496 HB3 TRP 92 HB1 TRP 92 35.263 23.133 -16.829 497 HD1 TRP 92 HD1 TRP 92 38.845 22.373 -18.050 498 HE1 TRP 92 HE1 TRP 92 39.397 23.980 -19.994 499 HE3 TRP 92 HE3 TRP 92 34.368 24.771 -18.493 500 HZ2 TRP 92 HZ2 TRP 92 38.093 25.999 -21.546 501 HZ3 TRP 92 HZ3 TRP 92 34.044 26.527 -20.211 502 HH2 TRP 92 HH2 TRP 92 35.900 27.144 -21.736 503 H CYS 93 HN CYS 93 39.513 23.180 -15.977 504 HA CYS 93 HA CYS 93 39.174 26.014 -15.178 505 HB2 CYS 93 HB2 CYS 93 40.727 24.973 -13.731 506 HB3 CYS 93 HB1 CYS 93 41.532 24.132 -15.051 507 H THR 94 HN THR 94 39.675 27.606 -16.574 508 HA THR 94 HA THR 94 40.366 26.867 -19.315 509 HB THR 94 HB THR 94 39.687 29.052 -19.915 510 HG1 THR 94 HG1 THR 94 39.161 30.412 -17.859 511 HG21 THR 94 HG21 THR 94 37.956 28.403 -17.523 512 HG22 THR 94 HG22 THR 94 37.893 27.482 -19.026 513 HG23 THR 94 HG23 THR 94 37.473 29.195 -19.025 514 H ALA 95 HN ALA 95 41.834 28.265 -16.479 515 HA ALA 95 HA ALA 95 43.984 29.595 -17.798 516 HB1 ALA 95 HB1 ALA 95 43.444 30.268 -15.563 517 HB2 ALA 95 HB2 ALA 95 45.046 29.531 -15.514 518 HB3 ALA 95 HB3 ALA 95 43.645 28.627 -14.956 519 H CYS 96 HN CYS 96 43.492 26.316 -16.566 520 HA CYS 96 HA CYS 96 46.237 25.571 -17.323 521 HB2 CYS 96 HB2 CYS 96 44.121 24.038 -15.788 522 HB3 CYS 96 HB1 CYS 96 45.775 23.495 -16.093 523 H GLN 97 HN GLN 97 42.969 25.390 -18.348 524 HA GLN 97 HA GLN 97 41.940 24.348 -20.130 525 HB2 GLN 97 HB2 GLN 97 44.814 24.114 -21.063 526 HB3 GLN 97 HB1 GLN 97 43.411 23.743 -22.059 527 HG2 GLN 97 HG2 GLN 97 42.601 26.020 -21.861 528 HG3 GLN 97 HG1 GLN 97 43.887 26.417 -20.723 529 HE21 GLN 97 HE21 GLN 97 43.273 27.469 -23.548 530 HE22 GLN 97 HE22 GLN 97 44.740 27.285 -24.380 531 H GLN 98 HN GLN 98 42.674 22.803 -17.776 532 HA GLN 98 HA GLN 98 42.503 20.125 -18.967 533 HB2 GLN 98 HB2 GLN 98 44.612 21.017 -16.998 534 HB3 GLN 98 HB1 GLN 98 44.138 19.325 -17.155 535 HG2 GLN 98 HG2 GLN 98 45.055 21.023 -19.491 536 HG3 GLN 98 HG1 GLN 98 46.129 19.984 -18.563 537 HE21 GLN 98 HE21 GLN 98 44.528 17.719 -18.159 538 HE22 GLN 98 HE22 GLN 98 44.150 17.017 -19.659 539 H THR 99 HN THR 99 41.850 18.488 -17.356 540 HA THR 99 HA THR 99 39.656 19.463 -15.788 541 HB THR 99 HB THR 99 40.838 16.684 -15.692 542 HG1 THR 99 HG1 THR 99 40.171 16.422 -17.648 543 HG21 THR 99 HG21 THR 99 38.438 16.111 -15.283 544 HG22 THR 99 HG22 THR 99 38.071 17.837 -15.253 545 HG23 THR 99 HG23 THR 99 39.129 17.139 -14.026 546 H LYS 100 HN LYS 100 39.553 19.877 -13.654 547 HA LYS 100 HA LYS 100 41.883 19.158 -11.962 548 HB2 LYS 100 HB2 LYS 100 41.642 21.648 -12.745 549 HB3 LYS 100 HB1 LYS 100 40.342 21.704 -11.562 550 HG2 LYS 100 HG2 LYS 100 42.138 22.317 -10.210 551 HG3 LYS 100 HG1 LYS 100 42.164 20.570 -9.979 552 HD2 LYS 100 HD2 LYS 100 43.880 20.341 -11.720 553 HD3 LYS 100 HD1 LYS 100 43.824 22.076 -12.027 554 HE2 LYS 100 HE2 LYS 100 44.552 22.514 -9.715 555 HE3 LYS 100 HE1 LYS 100 44.613 20.779 -9.407 556 HZ1 LYS 100 HZ1 LYS 100 46.673 20.817 -10.180 557 HZ2 LYS 100 HZ2 LYS 100 46.530 22.436 -10.676 558 HZ3 LYS 100 HZ3 LYS 100 46.053 21.180 -11.716 559 H GLY 101 HN GLY 101 41.387 18.232 -10.070 560 HA2 GLY 101 HA2 GLY 101 38.801 17.310 -9.493 561 HA3 GLY 101 HA1 GLY 101 40.139 17.344 -8.350 562 H ILE 102 HN ILE 102 37.493 17.792 -7.625 563 HA ILE 102 HA ILE 102 36.923 20.592 -7.419 564 HB ILE 102 HB ILE 102 35.185 18.792 -7.344 565 HG12 ILE 102 HG12 ILE 102 35.163 20.466 -4.823 566 HG13 ILE 102 HG11 ILE 102 34.922 21.178 -6.422 567 HG21 ILE 102 HG21 ILE 102 34.882 17.478 -5.378 568 HG22 ILE 102 HG22 ILE 102 36.083 18.412 -4.485 569 HG23 ILE 102 HG23 ILE 102 36.592 17.338 -5.790 570 HD11 ILE 102 HD11 ILE 102 32.757 20.644 -5.386 571 HD12 ILE 102 HD12 ILE 102 33.252 18.960 -5.203 572 HD13 ILE 102 HD13 ILE 102 33.025 19.643 -6.814 573 H ASN 103 HN ASN 103 38.487 18.210 -5.368 574 HA ASN 103 HA ASN 103 38.554 19.607 -2.952 575 HB2 ASN 103 HB2 ASN 103 40.720 17.821 -4.087 576 HB3 ASN 103 HB1 ASN 103 40.478 18.215 -2.386 577 HD21 ASN 103 HD21 ASN 103 38.039 17.700 -1.659 578 HD22 ASN 103 HD22 ASN 103 37.448 16.187 -2.186 579 H GLU 104 HN GLU 104 40.717 19.789 -5.753 580 HA GLU 104 HA GLU 104 42.404 21.807 -4.497 581 HB2 GLU 104 HB2 GLU 104 42.366 20.596 -7.269 582 HB3 GLU 104 HB1 GLU 104 43.527 21.813 -6.740 583 HG2 GLU 104 HG2 GLU 104 44.336 20.348 -4.973 584 HG3 GLU 104 HG1 GLU 104 43.101 19.147 -5.361 585 H PHE 105 HN PHE 105 39.537 22.350 -4.886 586 HA PHE 105 HA PHE 105 39.837 24.870 -6.383 587 HB2 PHE 105 HB2 PHE 105 38.241 22.605 -7.212 588 HB3 PHE 105 HB1 PHE 105 37.165 23.948 -6.821 589 HD1 PHE 105 HD2 PHE 105 39.906 22.801 -9.005 590 HD2 PHE 105 HD1 PHE 105 37.237 26.007 -8.067 591 HE1 PHE 105 HE2 PHE 105 40.489 23.914 -11.133 592 HE2 PHE 105 HE1 PHE 105 37.818 27.130 -10.201 593 HZ PHE 105 HZ PHE 105 39.445 26.073 -11.743 594 H SER 106 HN SER 106 38.267 26.484 -5.834 595 HA SER 106 HA SER 106 37.510 26.333 -3.007 596 HB2 SER 106 HB2 SER 106 38.772 28.300 -3.895 597 HB3 SER 106 HB1 SER 106 37.372 28.690 -4.899 598 HG SER 106 HG SER 106 36.976 29.799 -3.090 599 H LYS 107 HN LYS 107 35.408 27.431 -2.440 600 HA LYS 107 HA LYS 107 33.264 26.077 -3.818 601 HB2 LYS 107 HB2 LYS 107 33.306 27.960 -1.462 602 HB3 LYS 107 HB1 LYS 107 31.835 27.222 -2.094 603 HG2 LYS 107 HG2 LYS 107 32.889 24.971 -1.789 604 HG3 LYS 107 HG1 LYS 107 34.263 25.762 -1.012 605 HD2 LYS 107 HD2 LYS 107 31.378 25.924 -0.082 606 HD3 LYS 107 HD1 LYS 107 32.634 24.936 0.661 607 HE2 LYS 107 HE2 LYS 107 32.345 27.931 0.650 608 HE3 LYS 107 HE1 LYS 107 32.661 26.853 2.007 609 HZ1 LYS 107 HZ1 LYS 107 34.837 26.352 0.852 610 HZ2 LYS 107 HZ2 LYS 107 34.690 27.890 1.559 611 HZ3 LYS 107 HZ3 LYS 107 34.528 27.703 -0.123 612 H ALA 108 HN ALA 108 34.300 29.436 -3.391 613 HA ALA 108 HA ALA 108 32.126 30.673 -4.679 614 HB1 ALA 108 HB1 ALA 108 33.719 32.578 -5.014 615 HB2 ALA 108 HB2 ALA 108 35.008 31.546 -4.394 616 HB3 ALA 108 HB3 ALA 108 33.653 31.986 -3.355 617 H GLN 109 HN GLN 109 35.062 29.207 -5.931 618 HA GLN 109 HA GLN 109 35.087 30.232 -8.516 619 HB2 GLN 109 HB2 GLN 109 36.075 27.775 -7.178 620 HB3 GLN 109 HB1 GLN 109 35.945 27.686 -8.939 621 HG2 GLN 109 HG2 GLN 109 38.180 28.470 -8.220 622 HG3 GLN 109 HG1 GLN 109 37.332 29.701 -9.157 623 HE21 GLN 109 HE21 GLN 109 39.353 29.616 -6.665 624 HE22 GLN 109 HE22 GLN 109 38.698 30.816 -5.660 625 H ARG 110 HN ARG 110 33.047 27.772 -7.093 626 HA ARG 110 HA ARG 110 31.953 26.878 -9.601 627 HB2 ARG 110 HB2 ARG 110 31.036 26.466 -6.747 628 HB3 ARG 110 HB1 ARG 110 30.314 25.684 -8.154 629 HG2 ARG 110 HG2 ARG 110 32.457 24.636 -8.709 630 HG3 ARG 110 HG1 ARG 110 33.230 25.461 -7.350 631 HD2 ARG 110 HD2 ARG 110 32.670 23.174 -6.699 632 HD3 ARG 110 HD1 ARG 110 31.667 24.313 -5.795 633 HE ARG 110 HE ARG 110 29.794 23.540 -6.965 634 HH11 ARG 110 HH21 ARG 110 32.745 22.333 -8.307 635 HH12 ARG 110 HH22 ARG 110 31.966 21.172 -9.331 636 HH21 ARG 110 HH11 ARG 110 28.765 22.021 -8.304 637 HH22 ARG 110 HH12 ARG 110 29.712 20.995 -9.329 638 H HIS 111 HN HIS 111 31.592 29.655 -7.788 639 HA HIS 111 HA HIS 111 28.760 30.073 -8.427 640 HB2 HIS 111 HB2 HIS 111 29.791 30.740 -6.202 641 HB3 HIS 111 HB1 HIS 111 30.650 32.009 -7.082 642 HD2 HIS 111 HD2 HIS 111 27.060 31.256 -5.762 643 HE1 HIS 111 HE1 HIS 111 26.891 34.917 -7.858 644 HE2 HIS 111 HE2 HIS 111 25.602 33.344 -6.337 645 H VAL 112 HN VAL 112 31.965 31.329 -9.297 646 HA VAL 112 HA VAL 112 30.943 33.403 -10.986 647 HB VAL 112 HB VAL 112 33.269 33.698 -11.666 648 HG11 VAL 112 HG11 VAL 112 33.152 32.993 -8.719 649 HG12 VAL 112 HG12 VAL 112 32.474 34.476 -9.396 650 HG13 VAL 112 HG13 VAL 112 34.211 34.177 -9.487 651 HG21 VAL 112 HG21 VAL 112 33.898 31.324 -11.883 652 HG22 VAL 112 HG22 VAL 112 33.724 31.123 -10.145 653 HG23 VAL 112 HG23 VAL 112 35.003 32.146 -10.783 654 H LEU 113 HN LEU 113 31.221 33.497 -13.281 655 HA LEU 113 HA LEU 113 30.201 31.228 -14.606 656 HB2 LEU 113 HB2 LEU 113 29.805 33.485 -15.459 657 HB3 LEU 113 HB1 LEU 113 31.534 33.693 -15.752 658 HG LEU 113 HG LEU 113 31.506 31.870 -17.402 659 HD11 LEU 113 HD11 LEU 113 29.895 30.320 -16.714 660 HD12 LEU 113 HD12 LEU 113 29.078 31.096 -18.068 661 HD13 LEU 113 HD13 LEU 113 28.677 31.562 -16.415 662 HD21 LEU 113 HD21 LEU 113 31.028 34.090 -18.249 663 HD22 LEU 113 HD22 LEU 113 29.331 33.944 -17.791 664 HD23 LEU 113 HD23 LEU 113 29.986 32.939 -19.084 665 H ASP 114 HN ASP 114 33.468 32.504 -14.226 666 HA ASP 114 HA ASP 114 34.504 30.191 -15.758 667 HB2 ASP 114 HB2 ASP 114 35.866 32.830 -15.266 668 HB3 ASP 114 HB1 ASP 114 36.449 31.504 -16.275 669 HA PRO 115 HA PRO 115 36.006 29.371 -11.524 670 HB2 PRO 115 HB2 PRO 115 36.157 26.658 -11.751 671 HB3 PRO 115 HB1 PRO 115 34.631 27.507 -11.437 672 HG2 PRO 115 HG2 PRO 115 35.648 26.310 -13.961 673 HG3 PRO 115 HG1 PRO 115 33.985 26.430 -13.355 674 HD2 PRO 115 HD2 PRO 115 35.123 28.103 -15.289 675 HD3 PRO 115 HD1 PRO 115 33.655 28.479 -14.354 676 H ARG 116 HN ARG 116 38.097 29.365 -10.894 677 HA ARG 116 HA ARG 116 40.149 28.233 -12.728 678 HB2 ARG 116 HB2 ARG 116 40.493 30.755 -11.099 679 HB3 ARG 116 HB1 ARG 116 41.558 30.119 -12.354 680 HG2 ARG 116 HG2 ARG 116 39.771 30.444 -14.028 681 HG3 ARG 116 HG1 ARG 116 38.728 31.109 -12.775 682 HD2 ARG 116 HD2 ARG 116 40.376 32.898 -12.356 683 HD3 ARG 116 HD1 ARG 116 41.405 32.246 -13.633 684 HE ARG 116 HE ARG 116 38.917 33.732 -13.983 685 HH11 ARG 116 HH21 ARG 116 41.354 31.686 -15.342 686 HH12 ARG 116 HH22 ARG 116 41.018 32.139 -16.979 687 HH21 ARG 116 HH11 ARG 116 38.467 34.327 -16.129 688 HH22 ARG 116 HH12 ARG 116 39.382 33.633 -17.425 689 H CYS 117 HN CYS 117 41.784 27.115 -11.789 690 HA CYS 117 HA CYS 117 41.467 25.933 -9.285 691 HB2 CYS 117 HB2 CYS 117 44.190 26.404 -10.490 692 HB3 CYS 117 HB1 CYS 117 43.624 25.018 -9.552 693 H GLN 118 HN GLN 118 42.417 26.247 -7.253 694 HA GLN 118 HA GLN 118 42.573 28.876 -6.316 695 HB2 GLN 118 HB2 GLN 118 43.748 26.326 -5.186 696 HB3 GLN 118 HB1 GLN 118 43.696 27.862 -4.310 697 HG2 GLN 118 HG2 GLN 118 41.254 27.916 -4.504 698 HG3 GLN 118 HG1 GLN 118 41.280 26.425 -5.442 699 HE21 GLN 118 HE21 GLN 118 40.353 27.295 -2.520 700 HE22 GLN 118 HE22 GLN 118 40.914 26.001 -1.581 701 H ILE 119 HN ILE 119 44.903 26.994 -7.999 702 HA ILE 119 HA ILE 119 47.176 28.624 -7.146 703 HB ILE 119 HB ILE 119 47.100 26.497 -9.291 704 HG12 ILE 119 HG12 ILE 119 46.278 25.496 -7.237 705 HG13 ILE 119 HG11 ILE 119 47.951 24.991 -7.465 706 HG21 ILE 119 HG21 ILE 119 49.521 26.339 -8.693 707 HG22 ILE 119 HG22 ILE 119 49.307 27.706 -7.600 708 HG23 ILE 119 HG23 ILE 119 49.080 27.921 -9.336 709 HD11 ILE 119 HD11 ILE 119 47.892 25.616 -5.198 710 HD12 ILE 119 HD12 ILE 119 46.835 26.992 -5.506 711 HD13 ILE 119 HD13 ILE 119 48.532 27.060 -5.978 712 H CYS 120 HN CYS 120 44.801 28.553 -9.628 713 HA CYS 120 HA CYS 120 46.362 30.097 -11.533 714 HB2 CYS 120 HB2 CYS 120 43.484 29.161 -11.520 715 HB3 CYS 120 HB1 CYS 120 44.170 30.174 -12.793 716 H VAL 121 HN VAL 121 43.975 30.650 -9.047 717 HA VAL 121 HA VAL 121 43.409 33.366 -9.824 718 HB VAL 121 HB VAL 121 42.228 33.489 -7.659 719 HG11 VAL 121 HG11 VAL 121 41.147 32.462 -9.649 720 HG12 VAL 121 HG12 VAL 121 40.574 31.744 -8.142 721 HG13 VAL 121 HG13 VAL 121 41.748 30.884 -9.137 722 HG21 VAL 121 HG21 VAL 121 43.615 32.213 -6.197 723 HG22 VAL 121 HG22 VAL 121 43.580 30.816 -7.270 724 HG23 VAL 121 HG23 VAL 121 42.138 31.262 -6.365 725 H HIS 122 HN HIS 122 45.402 31.811 -7.339 726 HA HIS 122 HA HIS 122 46.413 34.338 -6.354 727 HB2 HIS 122 HB2 HIS 122 47.241 31.483 -5.780 728 HB3 HIS 122 HB1 HIS 122 47.878 32.903 -4.945 729 HD2 HIS 122 HD2 HIS 122 44.932 34.466 -4.553 730 HE1 HIS 122 HE1 HIS 122 43.867 30.967 -2.447 731 HE2 HIS 122 HE2 HIS 122 43.257 33.397 -2.860 732 H SER 123 HN SER 123 46.936 32.784 -9.144 733 HA SER 123 HA SER 123 49.766 32.656 -9.343 734 HB2 SER 123 HB2 SER 123 48.407 31.472 -10.947 735 HB3 SER 123 HB1 SER 123 47.616 32.963 -11.451 736 HG SER 123 HG SER 123 49.706 33.694 -12.127 737 H GLN 124 HN GLN 124 47.778 34.888 -11.259 738 HA GLN 124 HA GLN 124 49.486 37.145 -10.408 739 HB2 GLN 124 HB2 GLN 124 48.896 36.334 -13.266 740 HB3 GLN 124 HB1 GLN 124 49.616 37.874 -12.794 741 HG2 GLN 124 HG2 GLN 124 50.785 35.166 -12.096 742 HG3 GLN 124 HG1 GLN 124 51.309 36.148 -13.462 743 HE21 GLN 124 HE21 GLN 124 52.520 35.358 -10.631 744 HE22 GLN 124 HE22 GLN 124 53.145 36.840 -10.088 745 H ARG 125 HN ARG 125 46.528 36.003 -11.951 746 HA ARG 125 HA ARG 125 45.172 38.473 -11.053 747 HB2 ARG 125 HB2 ARG 125 44.941 37.210 -13.796 748 HB3 ARG 125 HB1 ARG 125 43.879 38.482 -13.181 749 HG2 ARG 125 HG2 ARG 125 45.783 39.991 -12.912 750 HG3 ARG 125 HG1 ARG 125 46.895 38.720 -13.420 751 HD2 ARG 125 HD2 ARG 125 46.452 40.190 -15.311 752 HD3 ARG 125 HD1 ARG 125 45.718 38.619 -15.614 753 HE ARG 125 HE ARG 125 43.839 40.351 -14.367 754 HH11 ARG 125 HH21 ARG 125 45.511 39.761 -17.338 755 HH12 ARG 125 HH22 ARG 125 44.266 40.439 -18.333 756 HH21 ARG 125 HH11 ARG 125 42.202 41.243 -15.665 757 HH22 ARG 125 HH12 ARG 125 42.393 41.278 -17.385 758 H ASN 126 HN ASN 126 42.972 38.224 -10.579 759 HA ASN 126 HA ASN 126 42.206 35.473 -9.912 760 HB2 ASN 126 HB2 ASN 126 41.024 38.157 -9.169 761 HB3 ASN 126 HB1 ASN 126 40.357 36.607 -8.660 762 HD21 ASN 126 HD21 ASN 126 41.733 38.851 -7.068 763 HD22 ASN 126 HD22 ASN 126 42.958 38.051 -6.208 Start of MODEL 19 1 H MET 31 HT1 MET 31 0.102 27.250 -17.484 2 HA MET 31 HA MET 31 -0.676 25.167 -19.184 3 HB2 MET 31 HB2 MET 31 0.830 25.301 -16.555 4 HB3 MET 31 HB1 MET 31 0.760 23.863 -17.582 5 HG2 MET 31 HG2 MET 31 1.735 25.151 -19.450 6 HG3 MET 31 HG1 MET 31 1.828 26.576 -18.414 7 HE1 MET 31 HE1 MET 31 5.538 25.750 -18.597 8 HE2 MET 31 HE2 MET 31 4.297 27.001 -18.614 9 HE3 MET 31 HE3 MET 31 4.300 25.755 -19.859 10 H GLY 32 HN GLY 32 -1.714 26.097 -15.949 11 HA2 GLY 32 HA2 GLY 32 -3.689 25.488 -14.864 12 HA3 GLY 32 HA1 GLY 32 -3.999 24.307 -16.133 13 H LYS 33 HN LYS 33 -0.840 24.087 -14.975 14 HA LYS 33 HA LYS 33 -1.466 22.216 -12.807 15 HB2 LYS 33 HB2 LYS 33 -0.041 20.453 -13.851 16 HB3 LYS 33 HB1 LYS 33 -1.536 20.757 -14.735 17 HG2 LYS 33 HG2 LYS 33 -0.302 22.251 -16.278 18 HG3 LYS 33 HG1 LYS 33 1.194 21.888 -15.418 19 HD2 LYS 33 HD2 LYS 33 0.940 19.500 -15.972 20 HD3 LYS 33 HD1 LYS 33 -0.564 19.855 -16.823 21 HE2 LYS 33 HE2 LYS 33 0.663 21.324 -18.382 22 HE3 LYS 33 HE1 LYS 33 2.168 20.966 -17.534 23 HZ1 LYS 33 HZ1 LYS 33 0.872 19.464 -19.538 24 HZ2 LYS 33 HZ2 LYS 33 0.972 18.533 -18.121 25 HZ3 LYS 33 HZ3 LYS 33 2.379 19.189 -18.812 26 H ASN 34 HN ASN 34 0.428 21.585 -11.590 27 HA ASN 34 HA ASN 34 2.197 23.751 -11.133 28 HB2 ASN 34 HB2 ASN 34 2.175 20.883 -10.189 29 HB3 ASN 34 HB1 ASN 34 3.412 22.037 -9.683 30 HD21 ASN 34 HD21 ASN 34 1.662 20.937 -7.747 31 HD22 ASN 34 HD22 ASN 34 0.613 22.154 -7.199 32 H ASP 35 HN ASP 35 3.869 24.333 -12.341 33 HA ASP 35 HA ASP 35 4.943 22.782 -14.443 34 HB2 ASP 35 HB2 ASP 35 5.041 25.280 -14.287 35 HB3 ASP 35 HB1 ASP 35 6.268 25.105 -13.026 36 H ASN 36 HN ASN 36 5.783 23.102 -11.064 37 HA ASN 36 HA ASN 36 8.390 22.039 -11.132 38 HB2 ASN 36 HB2 ASN 36 6.252 22.002 -8.996 39 HB3 ASN 36 HB1 ASN 36 7.886 21.384 -8.734 40 HD21 ASN 36 HD21 ASN 36 8.217 23.146 -7.126 41 HD22 ASN 36 HD22 ASN 36 8.533 24.726 -7.660 42 H ASP 37 HN ASP 37 5.220 20.472 -10.911 43 HA ASP 37 HA ASP 37 6.249 17.831 -10.548 44 HB2 ASP 37 HB2 ASP 37 3.571 18.913 -11.423 45 HB3 ASP 37 HB1 ASP 37 3.895 17.183 -11.307 46 H ALA 38 HN ALA 38 7.578 19.183 -12.691 47 HA ALA 38 HA ALA 38 6.575 18.180 -15.184 48 HB1 ALA 38 HB1 ALA 38 7.816 20.201 -15.315 49 HB2 ALA 38 HB2 ALA 38 8.843 18.955 -16.025 50 HB3 ALA 38 HB3 ALA 38 9.149 19.520 -14.382 51 H LEU 39 HN LEU 39 8.405 17.017 -16.589 52 HA LEU 39 HA LEU 39 9.617 14.845 -15.003 53 HB2 LEU 39 HB2 LEU 39 7.883 14.516 -17.440 54 HB3 LEU 39 HB1 LEU 39 8.879 13.235 -16.766 55 HG LEU 39 HG LEU 39 6.808 14.733 -15.133 56 HD11 LEU 39 HD11 LEU 39 6.548 12.169 -16.718 57 HD12 LEU 39 HD12 LEU 39 5.584 13.636 -16.895 58 HD13 LEU 39 HD13 LEU 39 5.426 12.643 -15.446 59 HD21 LEU 39 HD21 LEU 39 8.197 13.691 -13.605 60 HD22 LEU 39 HD22 LEU 39 8.593 12.366 -14.693 61 HD23 LEU 39 HD23 LEU 39 7.031 12.407 -13.886 62 H ILE 40 HN ILE 40 11.709 15.142 -15.327 63 HA ILE 40 HA ILE 40 12.676 15.808 -18.051 64 HB ILE 40 HB ILE 40 14.103 16.004 -15.386 65 HG12 ILE 40 HG12 ILE 40 12.298 17.665 -15.622 66 HG13 ILE 40 HG11 ILE 40 13.873 18.451 -15.750 67 HG21 ILE 40 HG21 ILE 40 15.702 17.385 -16.838 68 HG22 ILE 40 HG22 ILE 40 14.880 16.679 -18.227 69 HG23 ILE 40 HG23 ILE 40 15.739 15.639 -17.091 70 HD11 ILE 40 HD11 ILE 40 12.774 19.400 -17.563 71 HD12 ILE 40 HD12 ILE 40 11.803 17.964 -17.861 72 HD13 ILE 40 HD13 ILE 40 13.486 17.999 -18.362 73 H MET 41 HN MET 41 14.182 14.593 -19.089 74 HA MET 41 HA MET 41 14.367 11.813 -18.178 75 HB2 MET 41 HB2 MET 41 13.761 12.417 -20.546 76 HB3 MET 41 HB1 MET 41 15.400 13.038 -20.744 77 HG2 MET 41 HG2 MET 41 16.334 10.844 -20.194 78 HG3 MET 41 HG1 MET 41 14.713 10.206 -19.905 79 HE1 MET 41 HE1 MET 41 15.200 8.295 -23.079 80 HE2 MET 41 HE2 MET 41 14.688 8.343 -21.393 81 HE3 MET 41 HE3 MET 41 16.389 8.559 -21.797 82 H CYS 42 HN CYS 42 16.171 10.866 -17.433 83 HA CYS 42 HA CYS 42 18.427 12.521 -16.739 84 HB2 CYS 42 HB2 CYS 42 17.531 10.684 -15.281 85 HB3 CYS 42 HB1 CYS 42 18.142 9.521 -16.462 86 H MET 43 HN MET 43 20.388 12.613 -17.692 87 HA MET 43 HA MET 43 20.648 11.506 -20.364 88 HB2 MET 43 HB2 MET 43 23.024 12.602 -20.079 89 HB3 MET 43 HB1 MET 43 21.604 13.638 -20.203 90 HG2 MET 43 HG2 MET 43 21.523 13.997 -17.846 91 HG3 MET 43 HG1 MET 43 22.674 12.696 -17.534 92 HE1 MET 43 HE1 MET 43 25.207 13.429 -19.820 93 HE2 MET 43 HE2 MET 43 24.811 12.503 -18.376 94 HE3 MET 43 HE3 MET 43 25.998 13.800 -18.285 95 H ARG 44 HN ARG 44 20.967 10.086 -17.455 96 HA ARG 44 HA ARG 44 23.242 8.383 -18.316 97 HB2 ARG 44 HB2 ARG 44 22.320 9.293 -15.604 98 HB3 ARG 44 HB1 ARG 44 23.300 7.836 -15.785 99 HG2 ARG 44 HG2 ARG 44 24.328 10.218 -17.274 100 HG3 ARG 44 HG1 ARG 44 24.358 10.375 -15.518 101 HD2 ARG 44 HD2 ARG 44 26.458 9.397 -16.344 102 HD3 ARG 44 HD1 ARG 44 25.580 8.244 -15.338 103 HE ARG 44 HE ARG 44 24.962 7.970 -18.140 104 HH11 ARG 44 HH21 ARG 44 27.181 7.203 -15.605 105 HH12 ARG 44 HH22 ARG 44 27.768 5.761 -16.367 106 HH21 ARG 44 HH11 ARG 44 25.716 6.079 -19.145 107 HH22 ARG 44 HH12 ARG 44 26.938 5.126 -18.371 108 H CYS 45 HN CYS 45 21.129 7.681 -15.668 109 HA CYS 45 HA CYS 45 20.602 5.057 -16.580 110 HB2 CYS 45 HB2 CYS 45 19.071 4.887 -14.705 111 HB3 CYS 45 HB1 CYS 45 20.523 5.750 -14.195 112 H ARG 46 HN ARG 46 19.336 7.981 -17.606 113 HA ARG 46 HA ARG 46 17.544 8.545 -18.929 114 HB2 ARG 46 HB2 ARG 46 17.799 5.617 -19.577 115 HB3 ARG 46 HB1 ARG 46 16.691 6.705 -20.418 116 HG2 ARG 46 HG2 ARG 46 18.577 8.138 -21.079 117 HG3 ARG 46 HG1 ARG 46 19.693 7.094 -20.199 118 HD2 ARG 46 HD2 ARG 46 17.919 6.120 -22.445 119 HD3 ARG 46 HD1 ARG 46 19.582 6.654 -22.680 120 HE ARG 46 HE ARG 46 19.582 4.724 -20.640 121 HH11 ARG 46 HH21 ARG 46 18.875 5.021 -24.014 122 HH12 ARG 46 HH22 ARG 46 19.307 3.386 -24.389 123 HH21 ARG 46 HH11 ARG 46 20.151 2.580 -21.124 124 HH22 ARG 46 HH12 ARG 46 20.029 2.004 -22.754 125 H LYS 47 HN LYS 47 16.990 7.970 -16.188 126 HA LYS 47 HA LYS 47 14.379 6.619 -16.248 127 HB2 LYS 47 HB2 LYS 47 16.024 7.730 -13.961 128 HB3 LYS 47 HB1 LYS 47 14.475 6.911 -13.779 129 HG2 LYS 47 HG2 LYS 47 16.730 5.569 -15.279 130 HG3 LYS 47 HG1 LYS 47 16.682 5.513 -13.518 131 HD2 LYS 47 HD2 LYS 47 14.351 4.591 -13.666 132 HD3 LYS 47 HD1 LYS 47 14.532 4.517 -15.416 133 HE2 LYS 47 HE2 LYS 47 16.414 3.162 -13.485 134 HE3 LYS 47 HE1 LYS 47 15.039 2.361 -14.243 135 HZ1 LYS 47 HZ1 LYS 47 16.431 3.674 -16.255 136 HZ2 LYS 47 HZ2 LYS 47 16.300 1.999 -16.004 137 HZ3 LYS 47 HZ3 LYS 47 17.592 2.865 -15.320 138 H VAL 48 HN VAL 48 12.643 7.771 -16.715 139 HA VAL 48 HA VAL 48 12.670 10.667 -16.495 140 HB VAL 48 HB VAL 48 10.463 8.782 -17.352 141 HG11 VAL 48 HG11 VAL 48 9.522 10.896 -16.720 142 HG12 VAL 48 HG12 VAL 48 9.649 10.908 -18.480 143 HG13 VAL 48 HG13 VAL 48 10.831 11.781 -17.504 144 HG21 VAL 48 HG21 VAL 48 12.599 8.741 -18.719 145 HG22 VAL 48 HG22 VAL 48 12.332 10.453 -19.056 146 HG23 VAL 48 HG23 VAL 48 11.165 9.253 -19.610 147 H LYS 49 HN LYS 49 11.782 11.856 -14.921 148 HA LYS 49 HA LYS 49 9.642 10.963 -13.279 149 HB2 LYS 49 HB2 LYS 49 11.992 9.857 -12.476 150 HB3 LYS 49 HB1 LYS 49 12.007 11.355 -11.555 151 HG2 LYS 49 HG2 LYS 49 10.826 9.929 -10.104 152 HG3 LYS 49 HG1 LYS 49 9.510 10.710 -10.971 153 HD2 LYS 49 HD2 LYS 49 9.401 8.804 -12.538 154 HD3 LYS 49 HD1 LYS 49 10.730 8.026 -11.680 155 HE2 LYS 49 HE2 LYS 49 8.118 8.811 -10.377 156 HE3 LYS 49 HE1 LYS 49 8.457 7.198 -11.005 157 HZ1 LYS 49 HZ1 LYS 49 8.917 7.520 -8.585 158 HZ2 LYS 49 HZ2 LYS 49 10.186 8.561 -9.022 159 HZ3 LYS 49 HZ3 LYS 49 10.225 6.927 -9.487 160 H GLY 50 HN GLY 50 9.546 12.499 -11.238 161 HA2 GLY 50 HA2 GLY 50 10.004 15.243 -12.270 162 HA3 GLY 50 HA1 GLY 50 8.749 14.783 -11.124 163 H ILE 51 HN ILE 51 9.732 16.700 -9.992 164 HA ILE 51 HA ILE 51 12.293 16.729 -8.906 165 HB ILE 51 HB ILE 51 10.596 18.580 -8.796 166 HG12 ILE 51 HG12 ILE 51 11.668 17.893 -6.049 167 HG13 ILE 51 HG11 ILE 51 12.727 18.410 -7.361 168 HG21 ILE 51 HG21 ILE 51 8.792 16.959 -7.920 169 HG22 ILE 51 HG22 ILE 51 8.868 18.553 -7.168 170 HG23 ILE 51 HG23 ILE 51 9.556 17.155 -6.342 171 HD11 ILE 51 HD11 ILE 51 10.394 19.942 -6.202 172 HD12 ILE 51 HD12 ILE 51 11.332 20.459 -7.604 173 HD13 ILE 51 HD13 ILE 51 12.103 20.336 -6.024 174 H ASP 52 HN ASP 52 10.079 14.313 -8.456 175 HA ASP 52 HA ASP 52 10.388 13.779 -5.676 176 HB2 ASP 52 HB2 ASP 52 9.392 11.582 -6.266 177 HB3 ASP 52 HB1 ASP 52 8.457 12.937 -6.893 178 H SER 53 HN SER 53 11.647 12.199 -8.586 179 HA SER 53 HA SER 53 13.750 10.896 -6.957 180 HB2 SER 53 HB2 SER 53 13.066 10.462 -9.844 181 HB3 SER 53 HB1 SER 53 14.219 9.533 -8.913 182 HG SER 53 HG SER 53 12.590 8.718 -7.701 183 H TYR 54 HN TYR 54 13.409 13.782 -8.341 184 HA TYR 54 HA TYR 54 16.236 13.896 -9.263 185 HB2 TYR 54 HB2 TYR 54 13.845 14.679 -10.604 186 HB3 TYR 54 HB1 TYR 54 14.645 16.173 -10.137 187 HD1 TYR 54 HD1 TYR 54 15.018 13.010 -12.020 188 HD2 TYR 54 HD2 TYR 54 16.748 16.838 -11.122 189 HE1 TYR 54 HE1 TYR 54 16.658 12.701 -13.850 190 HE2 TYR 54 HE2 TYR 54 18.392 16.520 -12.922 191 HH TYR 54 HH TYR 54 18.086 14.558 -15.363 192 H SER 55 HN SER 55 17.555 14.935 -7.953 193 HA SER 55 HA SER 55 17.025 16.146 -5.591 194 HB2 SER 55 HB2 SER 55 19.299 15.790 -6.287 195 HB3 SER 55 HB1 SER 55 19.112 16.906 -7.643 196 HG SER 55 HG SER 55 18.503 18.444 -5.834 197 H LYS 56 HN LYS 56 16.424 18.141 -4.837 198 HA LYS 56 HA LYS 56 14.674 19.692 -6.405 199 HB2 LYS 56 HB2 LYS 56 16.090 20.366 -3.823 200 HB3 LYS 56 HB1 LYS 56 14.754 21.296 -4.507 201 HG2 LYS 56 HG2 LYS 56 13.388 19.158 -4.481 202 HG3 LYS 56 HG1 LYS 56 14.691 18.419 -3.555 203 HD2 LYS 56 HD2 LYS 56 13.268 20.961 -2.715 204 HD3 LYS 56 HD1 LYS 56 12.821 19.355 -2.139 205 HE2 LYS 56 HE2 LYS 56 15.269 19.106 -1.405 206 HE3 LYS 56 HE1 LYS 56 15.414 20.840 -1.680 207 HZ1 LYS 56 HZ1 LYS 56 13.458 19.540 0.125 208 HZ2 LYS 56 HZ2 LYS 56 13.605 21.211 -0.144 209 HZ3 LYS 56 HZ3 LYS 56 14.863 20.354 0.610 210 H THR 57 HN THR 57 18.060 20.177 -5.478 211 HA THR 57 HA THR 57 18.382 22.771 -6.512 212 HB THR 57 HB THR 57 20.817 22.144 -6.641 213 HG1 THR 57 HG1 THR 57 19.667 19.689 -6.503 214 HG21 THR 57 HG21 THR 57 19.930 23.036 -4.573 215 HG22 THR 57 HG22 THR 57 21.006 21.698 -4.176 216 HG23 THR 57 HG23 THR 57 19.258 21.465 -4.133 217 H GLN 58 HN GLN 58 18.771 19.593 -8.034 218 HA GLN 58 HA GLN 58 19.746 20.535 -10.518 219 HB2 GLN 58 HB2 GLN 58 18.269 18.006 -9.766 220 HB3 GLN 58 HB1 GLN 58 18.952 18.298 -11.366 221 HG2 GLN 58 HG2 GLN 58 20.559 18.431 -8.802 222 HG3 GLN 58 HG1 GLN 58 20.461 16.995 -9.818 223 HE21 GLN 58 HE21 GLN 58 21.507 17.068 -11.934 224 HE22 GLN 58 HE22 GLN 58 22.616 18.299 -12.326 225 H TRP 59 HN TRP 59 16.486 20.007 -9.277 226 HA TRP 59 HA TRP 59 15.095 20.268 -11.680 227 HB2 TRP 59 HB2 TRP 59 14.374 19.794 -9.070 228 HB3 TRP 59 HB1 TRP 59 13.800 21.452 -9.252 229 HD1 TRP 59 HD1 TRP 59 11.368 21.489 -9.972 230 HE1 TRP 59 HE1 TRP 59 9.874 20.057 -11.523 231 HE3 TRP 59 HE3 TRP 59 14.751 17.983 -11.489 232 HZ2 TRP 59 HZ2 TRP 59 10.092 17.743 -13.152 233 HZ3 TRP 59 HZ3 TRP 59 14.075 16.160 -13.030 234 HH2 TRP 59 HH2 TRP 59 11.746 16.046 -13.863 235 H SER 60 HN SER 60 16.224 22.709 -9.385 236 HA SER 60 HA SER 60 14.930 24.936 -10.539 237 HB2 SER 60 HB2 SER 60 17.591 24.946 -9.100 238 HB3 SER 60 HB1 SER 60 16.458 26.285 -9.258 239 HG SER 60 HG SER 60 15.703 25.526 -7.445 240 H LYS 61 HN LYS 61 17.707 23.114 -11.488 241 HA LYS 61 HA LYS 61 18.852 25.174 -13.166 242 HB2 LYS 61 HB2 LYS 61 19.394 22.212 -12.957 243 HB3 LYS 61 HB1 LYS 61 20.317 23.320 -13.964 244 HG2 LYS 61 HG2 LYS 61 20.912 24.636 -11.966 245 HG3 LYS 61 HG1 LYS 61 19.985 23.525 -10.958 246 HD2 LYS 61 HD2 LYS 61 21.449 21.663 -11.677 247 HD3 LYS 61 HD1 LYS 61 22.392 22.791 -12.653 248 HE2 LYS 61 HE2 LYS 61 22.973 24.064 -10.649 249 HE3 LYS 61 HE1 LYS 61 22.003 22.981 -9.654 250 HZ1 LYS 61 HZ1 LYS 61 23.926 21.639 -11.330 251 HZ2 LYS 61 HZ2 LYS 61 23.588 21.423 -9.678 252 HZ3 LYS 61 HZ3 LYS 61 24.634 22.666 -10.179 253 H THR 62 HN THR 62 16.497 22.660 -13.488 254 HA THR 62 HA THR 62 16.594 22.351 -16.314 255 HB THR 62 HB THR 62 14.431 21.256 -16.086 256 HG1 THR 62 HG1 THR 62 13.189 22.199 -14.681 257 HG21 THR 62 HG21 THR 62 16.243 19.863 -15.430 258 HG22 THR 62 HG22 THR 62 15.039 19.687 -14.154 259 HG23 THR 62 HG23 THR 62 16.445 20.717 -13.902 260 H PHE 63 HN PHE 63 15.573 24.923 -14.390 261 HA PHE 63 HA PHE 63 13.773 25.978 -16.458 262 HB2 PHE 63 HB2 PHE 63 14.142 26.823 -13.574 263 HB3 PHE 63 HB1 PHE 63 13.007 27.543 -14.715 264 HD1 PHE 63 HD2 PHE 63 11.180 26.129 -15.704 265 HD2 PHE 63 HD1 PHE 63 13.638 24.787 -12.460 266 HE1 PHE 63 HE2 PHE 63 9.510 24.359 -15.170 267 HE2 PHE 63 HE1 PHE 63 11.977 23.022 -11.916 268 HZ PHE 63 HZ PHE 63 9.916 22.810 -13.270 269 H THR 64 HN THR 64 13.865 28.537 -16.318 270 HA THR 64 HA THR 64 16.567 29.574 -16.084 271 HB THR 64 HB THR 64 15.969 30.427 -18.685 272 HG1 THR 64 HG1 THR 64 15.241 27.709 -18.337 273 HG21 THR 64 HG21 THR 64 18.170 29.732 -17.887 274 HG22 THR 64 HG22 THR 64 17.760 28.865 -19.367 275 HG23 THR 64 HG23 THR 64 17.635 28.055 -17.805 276 H PHE 65 HN PHE 65 16.666 31.847 -16.284 277 HA PHE 65 HA PHE 65 14.032 33.191 -16.006 278 HB2 PHE 65 HB2 PHE 65 16.171 33.078 -14.164 279 HB3 PHE 65 HB1 PHE 65 16.288 34.688 -14.868 280 HD1 PHE 65 HD1 PHE 65 13.532 32.350 -13.823 281 HD2 PHE 65 HD2 PHE 65 15.127 36.337 -13.695 282 HE1 PHE 65 HE1 PHE 65 11.598 33.080 -12.458 283 HE2 PHE 65 HE2 PHE 65 13.199 37.059 -12.322 284 HZ PHE 65 HZ PHE 65 11.436 35.441 -11.715 285 H VAL 66 HN VAL 66 13.547 34.740 -17.373 286 HA VAL 66 HA VAL 66 15.713 36.071 -18.877 287 HB VAL 66 HB VAL 66 14.637 34.192 -20.198 288 HG11 VAL 66 HG11 VAL 66 12.403 34.457 -20.986 289 HG12 VAL 66 HG12 VAL 66 12.301 36.106 -20.375 290 HG13 VAL 66 HG13 VAL 66 12.322 34.749 -19.250 291 HG21 VAL 66 HG21 VAL 66 14.520 35.537 -22.228 292 HG22 VAL 66 HG22 VAL 66 15.814 36.163 -21.207 293 HG23 VAL 66 HG23 VAL 66 14.263 37.000 -21.280 294 H ARG 67 HN ARG 67 15.488 38.219 -19.027 295 HA ARG 67 HA ARG 67 14.650 40.300 -18.465 296 HB2 ARG 67 HB2 ARG 67 12.389 39.020 -20.013 297 HB3 ARG 67 HB1 ARG 67 12.416 40.732 -19.571 298 HG2 ARG 67 HG2 ARG 67 14.540 41.026 -20.771 299 HG3 ARG 67 HG1 ARG 67 14.560 39.312 -21.183 300 HD2 ARG 67 HD2 ARG 67 12.307 41.176 -21.961 301 HD3 ARG 67 HD1 ARG 67 13.686 40.838 -23.010 302 HE ARG 67 HE ARG 67 12.567 38.385 -22.184 303 HH11 ARG 67 HH21 ARG 67 11.835 41.178 -24.091 304 HH12 ARG 67 HH22 ARG 67 10.796 40.329 -25.187 305 HH21 ARG 67 HH11 ARG 67 11.208 37.265 -23.617 306 HH22 ARG 67 HH12 ARG 67 10.442 38.113 -24.919 307 H GLY 68 HN GLY 68 14.232 38.185 -16.438 308 HA2 GLY 68 HA2 GLY 68 13.323 38.220 -14.321 309 HA3 GLY 68 HA1 GLY 68 12.384 39.641 -14.777 310 H ARG 69 HN ARG 69 12.307 36.741 -16.705 311 HA ARG 69 HA ARG 69 9.585 36.116 -15.685 312 HB2 ARG 69 HB2 ARG 69 10.581 36.173 -18.542 313 HB3 ARG 69 HB1 ARG 69 9.059 35.437 -18.045 314 HG2 ARG 69 HG2 ARG 69 8.301 37.585 -17.119 315 HG3 ARG 69 HG1 ARG 69 9.831 38.332 -17.585 316 HD2 ARG 69 HD2 ARG 69 9.367 37.830 -19.950 317 HD3 ARG 69 HD1 ARG 69 7.848 37.064 -19.493 318 HE ARG 69 HE ARG 69 7.731 39.619 -18.440 319 HH11 ARG 69 HH21 ARG 69 8.169 38.147 -21.541 320 HH12 ARG 69 HH22 ARG 69 7.423 39.443 -22.414 321 HH21 ARG 69 HH11 ARG 69 6.750 41.322 -19.580 322 HH22 ARG 69 HH12 ARG 69 6.620 41.240 -21.305 323 H THR 70 HN THR 70 9.097 34.014 -15.378 324 HA THR 70 HA THR 70 11.292 32.155 -15.226 325 HB THR 70 HB THR 70 8.346 31.603 -14.814 326 HG1 THR 70 HG1 THR 70 8.990 33.292 -13.485 327 HG21 THR 70 HG21 THR 70 9.627 29.573 -14.946 328 HG22 THR 70 HG22 THR 70 9.325 29.878 -13.235 329 HG23 THR 70 HG23 THR 70 10.904 30.244 -13.931 330 H VAL 71 HN VAL 71 11.920 30.763 -16.740 331 HA VAL 71 HA VAL 71 9.983 29.847 -18.775 332 HB VAL 71 HB VAL 71 11.750 30.135 -20.520 333 HG11 VAL 71 HG11 VAL 71 9.880 31.817 -20.009 334 HG12 VAL 71 HG12 VAL 71 11.270 32.441 -20.894 335 HG13 VAL 71 HG13 VAL 71 11.108 32.764 -19.169 336 HG21 VAL 71 HG21 VAL 71 13.628 30.268 -18.793 337 HG22 VAL 71 HG22 VAL 71 13.098 31.917 -18.474 338 HG23 VAL 71 HG23 VAL 71 13.693 31.477 -20.073 339 H SER 72 HN SER 72 10.495 27.834 -19.725 340 HA SER 72 HA SER 72 12.088 26.116 -17.983 341 HB2 SER 72 HB2 SER 72 10.158 25.622 -20.243 342 HB3 SER 72 HB1 SER 72 11.169 24.330 -19.590 343 HG SER 72 HG SER 72 8.984 24.743 -18.627 344 H VAL 73 HN VAL 73 13.848 24.881 -18.664 345 HA VAL 73 HA VAL 73 15.556 26.076 -20.575 346 HB VAL 73 HB VAL 73 15.690 23.420 -19.153 347 HG11 VAL 73 HG11 VAL 73 17.627 24.795 -21.016 348 HG12 VAL 73 HG12 VAL 73 17.005 23.150 -21.122 349 HG13 VAL 73 HG13 VAL 73 18.143 23.580 -19.846 350 HG21 VAL 73 HG21 VAL 73 15.852 25.663 -17.905 351 HG22 VAL 73 HG22 VAL 73 17.377 25.896 -18.751 352 HG23 VAL 73 HG23 VAL 73 17.171 24.524 -17.663 353 H SER 74 HN SER 74 15.954 25.572 -22.687 354 HA SER 74 HA SER 74 14.004 24.225 -24.213 355 HB2 SER 74 HB2 SER 74 15.490 25.951 -25.149 356 HB3 SER 74 HB1 SER 74 16.868 24.875 -24.943 357 HG SER 74 HG SER 74 15.846 23.421 -26.366 358 H ASP 75 HN ASP 75 17.226 23.207 -23.106 359 HA ASP 75 HA ASP 75 16.434 20.389 -23.604 360 HB2 ASP 75 HB2 ASP 75 19.019 21.740 -24.374 361 HB3 ASP 75 HB1 ASP 75 18.843 19.987 -24.242 362 HA PRO 76 HA PRO 76 17.699 21.149 -19.191 363 HB2 PRO 76 HB2 PRO 76 15.965 18.720 -18.943 364 HB3 PRO 76 HB1 PRO 76 15.969 20.201 -17.966 365 HG2 PRO 76 HG2 PRO 76 14.050 19.731 -19.771 366 HG3 PRO 76 HG1 PRO 76 14.671 21.362 -19.482 367 HD2 PRO 76 HD2 PRO 76 15.213 19.523 -21.781 368 HD3 PRO 76 HD1 PRO 76 15.092 21.297 -21.760 369 H LYS 77 HN LYS 77 19.784 20.481 -19.064 370 HA LYS 77 HA LYS 77 20.370 17.581 -19.395 371 HB2 LYS 77 HB2 LYS 77 22.774 18.482 -19.715 372 HB3 LYS 77 HB1 LYS 77 21.632 18.667 -21.046 373 HG2 LYS 77 HG2 LYS 77 21.210 20.966 -20.482 374 HG3 LYS 77 HG1 LYS 77 22.111 20.828 -18.976 375 HD2 LYS 77 HD2 LYS 77 24.166 20.323 -20.298 376 HD3 LYS 77 HD1 LYS 77 23.244 20.602 -21.775 377 HE2 LYS 77 HE2 LYS 77 22.745 22.892 -21.038 378 HE3 LYS 77 HE1 LYS 77 23.651 22.609 -19.551 379 HZ1 LYS 77 HZ1 LYS 77 24.862 22.278 -22.238 380 HZ2 LYS 77 HZ2 LYS 77 25.656 22.396 -20.741 381 HZ3 LYS 77 HZ3 LYS 77 24.895 23.759 -21.412 382 H VAL 78 HN VAL 78 20.026 16.970 -17.305 383 HA VAL 78 HA VAL 78 22.059 17.813 -15.366 384 HB VAL 78 HB VAL 78 20.199 17.850 -13.589 385 HG11 VAL 78 HG11 VAL 78 19.739 20.208 -14.026 386 HG12 VAL 78 HG12 VAL 78 20.238 20.025 -15.704 387 HG13 VAL 78 HG13 VAL 78 21.423 19.857 -14.405 388 HG21 VAL 78 HG21 VAL 78 18.501 16.877 -15.225 389 HG22 VAL 78 HG22 VAL 78 18.496 18.448 -16.024 390 HG23 VAL 78 HG23 VAL 78 17.961 18.310 -14.346 391 H ILE 79 HN ILE 79 22.217 16.351 -13.522 392 HA ILE 79 HA ILE 79 21.700 13.578 -14.359 393 HB ILE 79 HB ILE 79 23.387 14.646 -12.082 394 HG12 ILE 79 HG12 ILE 79 24.171 13.621 -14.833 395 HG13 ILE 79 HG11 ILE 79 24.205 15.313 -14.334 396 HG21 ILE 79 HG21 ILE 79 22.602 12.337 -11.749 397 HG22 ILE 79 HG22 ILE 79 24.322 12.343 -12.104 398 HG23 ILE 79 HG23 ILE 79 23.165 11.903 -13.359 399 HD11 ILE 79 HD11 ILE 79 26.443 14.350 -14.118 400 HD12 ILE 79 HD12 ILE 79 25.808 13.055 -13.102 401 HD13 ILE 79 HD13 ILE 79 25.796 14.720 -12.519 402 H CYS 80 HN CYS 80 20.722 12.060 -12.971 403 HA CYS 80 HA CYS 80 18.655 13.207 -11.251 404 HB2 CYS 80 HB2 CYS 80 17.570 11.133 -11.408 405 HB3 CYS 80 HB1 CYS 80 18.318 11.332 -12.991 406 H ARG 81 HN ARG 81 18.162 11.640 -9.275 407 HA ARG 81 HA ARG 81 20.268 12.052 -7.416 408 HB2 ARG 81 HB2 ARG 81 17.695 10.476 -7.270 409 HB3 ARG 81 HB1 ARG 81 18.798 10.643 -5.904 410 HG2 ARG 81 HG2 ARG 81 18.603 13.094 -6.031 411 HG3 ARG 81 HG1 ARG 81 17.513 12.940 -7.409 412 HD2 ARG 81 HD2 ARG 81 15.917 11.683 -6.011 413 HD3 ARG 81 HD1 ARG 81 17.004 11.833 -4.633 414 HE ARG 81 HE ARG 81 16.505 14.417 -5.576 415 HH11 ARG 81 HH21 ARG 81 14.803 11.729 -4.219 416 HH12 ARG 81 HH22 ARG 81 13.594 12.704 -3.453 417 HH21 ARG 81 HH11 ARG 81 14.924 15.703 -4.574 418 HH22 ARG 81 HH12 ARG 81 13.663 14.954 -3.652 419 H THR 82 HN THR 82 18.848 9.011 -8.663 420 HA THR 82 HA THR 82 20.532 7.198 -7.477 421 HB THR 82 HB THR 82 20.031 5.696 -9.340 422 HG1 THR 82 HG1 THR 82 18.564 7.333 -10.843 423 HG21 THR 82 HG21 THR 82 17.772 7.554 -8.556 424 HG22 THR 82 HG22 THR 82 18.221 6.034 -7.783 425 HG23 THR 82 HG23 THR 82 17.532 6.028 -9.405 426 H CYS 83 HN CYS 83 21.086 8.956 -10.525 427 HA CYS 83 HA CYS 83 23.678 7.791 -10.934 428 HB2 CYS 83 HB2 CYS 83 22.255 10.119 -12.206 429 HB3 CYS 83 HB1 CYS 83 23.855 9.565 -12.712 430 H GLN 84 HN GLN 84 22.447 10.333 -9.023 431 HA GLN 84 HA GLN 84 25.200 11.320 -8.519 432 HB2 GLN 84 HB2 GLN 84 23.720 12.936 -9.795 433 HB3 GLN 84 HB1 GLN 84 22.729 13.035 -8.340 434 HG2 GLN 84 HG2 GLN 84 24.264 14.825 -8.114 435 HG3 GLN 84 HG1 GLN 84 24.940 13.550 -7.097 436 HE21 GLN 84 HE21 GLN 84 25.523 15.543 -9.886 437 HE22 GLN 84 HE22 GLN 84 27.021 14.863 -10.313 438 HA PRO 85 HA PRO 85 23.149 9.853 -4.614 439 HB2 PRO 85 HB2 PRO 85 25.081 8.059 -3.860 440 HB3 PRO 85 HB1 PRO 85 23.747 7.638 -4.956 441 HG2 PRO 85 HG2 PRO 85 26.592 8.270 -5.591 442 HG3 PRO 85 HG1 PRO 85 25.505 7.086 -6.339 443 HD2 PRO 85 HD2 PRO 85 26.102 9.559 -7.428 444 HD3 PRO 85 HD1 PRO 85 24.632 8.633 -7.804 445 H LYS 86 HN LYS 86 23.425 11.258 -2.997 446 HA LYS 86 HA LYS 86 25.724 12.868 -2.653 447 HB2 LYS 86 HB2 LYS 86 23.401 12.280 -0.813 448 HB3 LYS 86 HB1 LYS 86 24.647 13.477 -0.464 449 HG2 LYS 86 HG2 LYS 86 24.110 14.659 -2.559 450 HG3 LYS 86 HG1 LYS 86 22.866 13.462 -2.918 451 HD2 LYS 86 HD2 LYS 86 21.648 14.081 -0.880 452 HD3 LYS 86 HD1 LYS 86 22.907 15.246 -0.467 453 HE2 LYS 86 HE2 LYS 86 21.020 16.393 -1.537 454 HE3 LYS 86 HE1 LYS 86 22.443 16.471 -2.575 455 HZ1 LYS 86 HZ1 LYS 86 21.533 15.090 -4.090 456 HZ2 LYS 86 HZ2 LYS 86 20.080 15.690 -3.447 457 HZ3 LYS 86 HZ3 LYS 86 20.678 14.183 -2.939 458 H GLN 87 HN GLN 87 24.627 9.892 -1.101 459 HA GLN 87 HA GLN 87 25.848 8.286 0.013 460 HB2 GLN 87 HB2 GLN 87 27.787 9.290 -1.477 461 HB3 GLN 87 HB1 GLN 87 28.318 10.017 0.041 462 HG2 GLN 87 HG2 GLN 87 29.443 7.927 -0.097 463 HG3 GLN 87 HG1 GLN 87 28.139 7.695 1.067 464 HE21 GLN 87 HE21 GLN 87 28.553 7.454 -2.520 465 HE22 GLN 87 HE22 GLN 87 27.670 6.012 -2.660 466 H HIS 88 HN HIS 88 24.724 11.003 1.067 467 HA HIS 88 HA HIS 88 26.126 11.560 3.478 468 HB2 HIS 88 HB2 HIS 88 23.304 12.144 2.572 469 HB3 HIS 88 HB1 HIS 88 23.946 12.686 4.127 470 HD2 HIS 88 HD2 HIS 88 23.309 15.001 1.862 471 HE1 HIS 88 HE1 HIS 88 27.498 15.130 1.342 472 HE2 HIS 88 HE2 HIS 88 25.323 16.376 0.930 473 H ASP 89 HN ASP 89 23.451 9.417 2.646 474 HA ASP 89 HA ASP 89 23.827 8.009 5.207 475 HB2 ASP 89 HB2 ASP 89 21.950 9.663 5.464 476 HB3 ASP 89 HB1 ASP 89 21.093 8.802 4.185 477 H SER 90 HN SER 90 23.696 5.854 5.013 478 HA SER 90 HA SER 90 22.390 4.671 2.653 479 HB2 SER 90 HB2 SER 90 24.282 3.508 1.913 480 HB3 SER 90 HB1 SER 90 24.931 5.105 2.301 481 HG SER 90 HG SER 90 26.254 3.791 3.381 482 H ILE 91 HN ILE 91 22.246 2.289 2.853 483 HA ILE 91 HA ILE 91 22.155 1.397 5.690 484 HB ILE 91 HB ILE 91 20.095 0.907 3.530 485 HG12 ILE 91 HG12 ILE 91 19.839 2.270 6.231 486 HG13 ILE 91 HG11 ILE 91 20.089 3.146 4.715 487 HG21 ILE 91 HG21 ILE 91 20.282 -1.106 4.806 488 HG22 ILE 91 HG22 ILE 91 18.906 -0.234 5.482 489 HG23 ILE 91 HG23 ILE 91 20.461 -0.212 6.316 490 HD11 ILE 91 HD11 ILE 91 18.043 2.109 3.805 491 HD12 ILE 91 HD12 ILE 91 17.695 3.054 5.246 492 HD13 ILE 91 HD13 ILE 91 17.772 1.294 5.339 493 H TRP 92 HN TRP 92 23.149 -0.458 6.082 494 HA TRP 92 HA TRP 92 24.377 -1.906 3.872 495 HB2 TRP 92 HB2 TRP 92 25.680 -1.403 5.903 496 HB3 TRP 92 HB1 TRP 92 24.551 -2.374 6.856 497 HD1 TRP 92 HD1 TRP 92 24.419 -5.023 6.215 498 HE1 TRP 92 HE1 TRP 92 26.237 -6.612 5.355 499 HE3 TRP 92 HE3 TRP 92 27.775 -1.602 4.489 500 HZ2 TRP 92 HZ2 TRP 92 28.796 -6.445 4.068 501 HZ3 TRP 92 HZ3 TRP 92 29.899 -2.344 3.443 502 HH2 TRP 92 HH2 TRP 92 30.412 -4.761 3.231 503 H CYS 93 HN CYS 93 23.204 -3.362 2.832 504 HA CYS 93 HA CYS 93 20.958 -4.712 4.015 505 HB2 CYS 93 HB2 CYS 93 20.921 -4.282 1.638 506 HB3 CYS 93 HB1 CYS 93 22.444 -5.137 1.413 507 H THR 94 HN THR 94 20.907 -6.648 5.025 508 HA THR 94 HA THR 94 23.456 -7.992 5.538 509 HB THR 94 HB THR 94 22.299 -9.163 7.271 510 HG1 THR 94 HG1 THR 94 19.862 -8.009 6.477 511 HG21 THR 94 HG21 THR 94 21.016 -6.433 7.267 512 HG22 THR 94 HG22 THR 94 22.751 -6.637 7.507 513 HG23 THR 94 HG23 THR 94 21.612 -7.359 8.643 514 H ALA 95 HN ALA 95 20.736 -8.302 3.453 515 HA ALA 95 HA ALA 95 21.017 -11.183 3.112 516 HB1 ALA 95 HB1 ALA 95 19.240 -9.041 2.004 517 HB2 ALA 95 HB2 ALA 95 18.799 -10.530 2.834 518 HB3 ALA 95 HB3 ALA 95 19.352 -10.586 1.162 519 H CYS 96 HN CYS 96 22.566 -8.393 1.954 520 HA CYS 96 HA CYS 96 23.526 -9.835 -0.459 521 HB2 CYS 96 HB2 CYS 96 23.167 -6.882 0.054 522 HB3 CYS 96 HB1 CYS 96 24.098 -7.529 -1.298 523 H GLN 97 HN GLN 97 24.378 -7.832 2.318 524 HA GLN 97 HA GLN 97 26.331 -7.869 3.566 525 HB2 GLN 97 HB2 GLN 97 26.635 -10.231 2.459 526 HB3 GLN 97 HB1 GLN 97 27.774 -9.401 1.404 527 HG2 GLN 97 HG2 GLN 97 29.062 -8.636 3.311 528 HG3 GLN 97 HG1 GLN 97 27.905 -9.367 4.421 529 HE21 GLN 97 HE21 GLN 97 30.757 -10.063 4.198 530 HE22 GLN 97 HE22 GLN 97 30.817 -11.697 3.744 531 H GLN 98 HN GLN 98 25.523 -5.926 1.550 532 HA GLN 98 HA GLN 98 28.126 -4.632 1.192 533 HB2 GLN 98 HB2 GLN 98 27.652 -5.841 -0.939 534 HB3 GLN 98 HB1 GLN 98 26.142 -4.941 -1.076 535 HG2 GLN 98 HG2 GLN 98 27.317 -2.845 -1.236 536 HG3 GLN 98 HG1 GLN 98 28.853 -3.614 -0.839 537 HE21 GLN 98 HE21 GLN 98 28.496 -2.119 -3.261 538 HE22 GLN 98 HE22 GLN 98 28.586 -3.201 -4.565 539 H THR 99 HN THR 99 27.946 -2.346 0.744 540 HA THR 99 HA THR 99 25.884 -1.124 2.311 541 HB THR 99 HB THR 99 27.860 0.250 0.489 542 HG1 THR 99 HG1 THR 99 29.325 -0.269 1.878 543 HG21 THR 99 HG21 THR 99 27.564 2.101 2.081 544 HG22 THR 99 HG22 THR 99 26.428 1.129 3.013 545 HG23 THR 99 HG23 THR 99 26.014 1.640 1.377 546 H LYS 100 HN LYS 100 24.028 -0.159 1.686 547 HA LYS 100 HA LYS 100 23.538 0.134 -1.228 548 HB2 LYS 100 HB2 LYS 100 22.329 -1.792 0.131 549 HB3 LYS 100 HB1 LYS 100 21.308 -0.473 0.699 550 HG2 LYS 100 HG2 LYS 100 20.140 -1.054 -1.232 551 HG3 LYS 100 HG1 LYS 100 21.239 0.151 -1.907 552 HD2 LYS 100 HD2 LYS 100 22.833 -1.688 -2.491 553 HD3 LYS 100 HD1 LYS 100 21.640 -2.854 -1.920 554 HE2 LYS 100 HE2 LYS 100 21.353 -2.690 -4.293 555 HE3 LYS 100 HE1 LYS 100 20.007 -1.818 -3.558 556 HZ1 LYS 100 HZ1 LYS 100 20.807 0.175 -4.219 557 HZ2 LYS 100 HZ2 LYS 100 21.497 -0.769 -5.451 558 HZ3 LYS 100 HZ3 LYS 100 22.433 -0.298 -4.113 559 H GLY 101 HN GLY 101 22.739 2.038 -1.886 560 HA2 GLY 101 HA2 GLY 101 22.806 4.297 -0.218 561 HA3 GLY 101 HA1 GLY 101 22.045 4.238 -1.804 562 H ILE 102 HN ILE 102 21.104 5.667 0.463 563 HA ILE 102 HA ILE 102 18.932 4.274 1.702 564 HB ILE 102 HB ILE 102 19.975 6.215 2.773 565 HG12 ILE 102 HG12 ILE 102 17.113 6.865 2.012 566 HG13 ILE 102 HG11 ILE 102 17.540 5.584 3.153 567 HG21 ILE 102 HG21 ILE 102 19.723 8.435 1.879 568 HG22 ILE 102 HG22 ILE 102 18.663 7.856 0.593 569 HG23 ILE 102 HG23 ILE 102 20.373 7.427 0.588 570 HD11 ILE 102 HD11 ILE 102 17.003 7.765 4.270 571 HD12 ILE 102 HD12 ILE 102 18.390 8.480 3.447 572 HD13 ILE 102 HD13 ILE 102 18.632 7.185 4.619 573 H ASN 103 HN ASN 103 19.264 6.360 -1.117 574 HA ASN 103 HA ASN 103 16.581 6.899 -1.643 575 HB2 ASN 103 HB2 ASN 103 18.886 6.436 -3.555 576 HB3 ASN 103 HB1 ASN 103 17.321 7.093 -4.033 577 HD21 ASN 103 HD21 ASN 103 17.009 8.620 -1.469 578 HD22 ASN 103 HD22 ASN 103 18.092 9.933 -1.592 579 H GLU 104 HN GLU 104 18.553 4.109 -2.617 580 HA GLU 104 HA GLU 104 16.285 2.819 -3.914 581 HB2 GLU 104 HB2 GLU 104 19.126 1.933 -3.404 582 HB3 GLU 104 HB1 GLU 104 17.920 0.948 -4.234 583 HG2 GLU 104 HG2 GLU 104 17.629 2.702 -5.930 584 HG3 GLU 104 HG1 GLU 104 18.796 3.723 -5.089 585 H PHE 105 HN PHE 105 16.392 3.442 -0.937 586 HA PHE 105 HA PHE 105 15.737 0.692 -0.023 587 HB2 PHE 105 HB2 PHE 105 17.799 2.364 0.952 588 HB3 PHE 105 HB1 PHE 105 16.514 2.497 2.156 589 HD1 PHE 105 HD1 PHE 105 15.561 0.402 3.181 590 HD2 PHE 105 HD2 PHE 105 19.071 0.363 0.710 591 HE1 PHE 105 HE1 PHE 105 16.148 -1.843 4.050 592 HE2 PHE 105 HE2 PHE 105 19.656 -1.860 1.583 593 HZ PHE 105 HZ PHE 105 18.206 -2.977 3.255 594 H SER 106 HN SER 106 13.965 0.451 1.294 595 HA SER 106 HA SER 106 11.970 2.543 1.079 596 HB2 SER 106 HB2 SER 106 11.975 -0.291 2.079 597 HB3 SER 106 HB1 SER 106 10.605 0.773 2.398 598 HG SER 106 HG SER 106 10.021 0.220 0.457 599 H LYS 107 HN LYS 107 10.992 3.608 2.790 600 HA LYS 107 HA LYS 107 12.678 4.165 5.049 601 HB2 LYS 107 HB2 LYS 107 11.244 5.883 3.971 602 HB3 LYS 107 HB1 LYS 107 9.820 5.023 4.556 603 HG2 LYS 107 HG2 LYS 107 10.560 5.320 6.877 604 HG3 LYS 107 HG1 LYS 107 12.029 6.129 6.317 605 HD2 LYS 107 HD2 LYS 107 10.650 7.897 5.273 606 HD3 LYS 107 HD1 LYS 107 9.191 7.095 5.856 607 HE2 LYS 107 HE2 LYS 107 9.946 7.379 8.181 608 HE3 LYS 107 HE1 LYS 107 11.424 8.158 7.613 609 HZ1 LYS 107 HZ1 LYS 107 9.099 9.351 6.478 610 HZ2 LYS 107 HZ2 LYS 107 10.363 10.072 7.355 611 HZ3 LYS 107 HZ3 LYS 107 9.040 9.388 8.173 612 H ALA 108 HN ALA 108 9.674 2.381 4.520 613 HA ALA 108 HA ALA 108 9.084 1.876 7.240 614 HB1 ALA 108 HB1 ALA 108 8.356 0.276 4.774 615 HB2 ALA 108 HB2 ALA 108 7.414 1.594 5.471 616 HB3 ALA 108 HB3 ALA 108 7.622 0.088 6.366 617 H GLN 109 HN GLN 109 11.020 0.144 4.846 618 HA GLN 109 HA GLN 109 11.449 -2.205 6.349 619 HB2 GLN 109 HB2 GLN 109 13.058 -0.868 4.172 620 HB3 GLN 109 HB1 GLN 109 13.505 -2.426 4.875 621 HG2 GLN 109 HG2 GLN 109 11.276 -3.323 4.259 622 HG3 GLN 109 HG1 GLN 109 10.869 -1.777 3.514 623 HE21 GLN 109 HE21 GLN 109 11.012 -2.033 1.283 624 HE22 GLN 109 HE22 GLN 109 12.270 -2.842 0.480 625 H ARG 110 HN ARG 110 13.538 0.658 5.940 626 HA ARG 110 HA ARG 110 15.678 0.066 7.476 627 HB2 ARG 110 HB2 ARG 110 15.294 2.258 6.372 628 HB3 ARG 110 HB1 ARG 110 14.163 2.680 7.659 629 HG2 ARG 110 HG2 ARG 110 15.959 2.432 9.333 630 HG3 ARG 110 HG1 ARG 110 17.093 1.991 8.050 631 HD2 ARG 110 HD2 ARG 110 16.598 4.214 6.970 632 HD3 ARG 110 HD1 ARG 110 15.662 4.637 8.407 633 HE ARG 110 HE ARG 110 18.333 3.766 9.043 634 HH11 ARG 110 HH21 ARG 110 16.358 6.401 7.978 635 HH12 ARG 110 HH22 ARG 110 17.429 7.625 8.573 636 HH21 ARG 110 HH11 ARG 110 19.744 5.367 9.823 637 HH22 ARG 110 HH12 ARG 110 19.346 7.040 9.618 638 H HIS 111 HN HIS 111 12.424 0.423 8.588 639 HA HIS 111 HA HIS 111 12.932 0.911 11.330 640 HB2 HIS 111 HB2 HIS 111 10.715 1.200 10.189 641 HB3 HIS 111 HB1 HIS 111 10.569 -0.560 10.148 642 HD2 HIS 111 HD2 HIS 111 9.415 -1.584 12.434 643 HE1 HIS 111 HE1 HIS 111 10.146 1.690 14.996 644 HE2 HIS 111 HE2 HIS 111 9.051 -0.593 14.823 645 H VAL 112 HN VAL 112 12.553 -2.076 9.456 646 HA VAL 112 HA VAL 112 12.542 -3.882 11.609 647 HB VAL 112 HB VAL 112 13.134 -5.568 9.956 648 HG11 VAL 112 HG11 VAL 112 11.334 -5.159 8.346 649 HG12 VAL 112 HG12 VAL 112 11.339 -3.442 8.747 650 HG13 VAL 112 HG13 VAL 112 10.831 -4.629 9.952 651 HG21 VAL 112 HG21 VAL 112 13.371 -3.947 7.557 652 HG22 VAL 112 HG22 VAL 112 14.530 -5.075 8.222 653 HG23 VAL 112 HG23 VAL 112 14.585 -3.394 8.710 654 H LEU 113 HN LEU 113 14.256 -5.312 12.307 655 HA LEU 113 HA LEU 113 16.657 -3.912 12.946 656 HB2 LEU 113 HB2 LEU 113 15.997 -6.854 13.248 657 HB3 LEU 113 HB1 LEU 113 17.323 -5.997 14.043 658 HG LEU 113 HG LEU 113 14.383 -5.323 14.370 659 HD11 LEU 113 HD11 LEU 113 14.472 -6.395 16.492 660 HD12 LEU 113 HD12 LEU 113 16.228 -6.542 16.429 661 HD13 LEU 113 HD13 LEU 113 15.223 -7.531 15.372 662 HD21 LEU 113 HD21 LEU 113 15.488 -3.319 14.842 663 HD22 LEU 113 HD22 LEU 113 16.950 -4.126 15.406 664 HD23 LEU 113 HD23 LEU 113 15.515 -4.081 16.429 665 H ASP 114 HN ASP 114 15.716 -5.962 10.341 666 HA ASP 114 HA ASP 114 18.535 -6.017 9.378 667 HB2 ASP 114 HB2 ASP 114 17.952 -8.140 8.239 668 HB3 ASP 114 HB1 ASP 114 17.916 -8.255 9.997 669 HA PRO 115 HA PRO 115 15.887 -3.525 6.481 670 HB2 PRO 115 HB2 PRO 115 18.639 -2.496 5.882 671 HB3 PRO 115 HB1 PRO 115 17.132 -1.589 6.153 672 HG2 PRO 115 HG2 PRO 115 19.044 -1.691 8.011 673 HG3 PRO 115 HG1 PRO 115 17.324 -1.715 8.455 674 HD2 PRO 115 HD2 PRO 115 19.293 -3.975 8.410 675 HD3 PRO 115 HD1 PRO 115 17.943 -3.669 9.527 676 H ARG 116 HN ARG 116 15.562 -3.917 4.325 677 HA ARG 116 HA ARG 116 17.565 -5.590 2.892 678 HB2 ARG 116 HB2 ARG 116 14.550 -5.859 2.927 679 HB3 ARG 116 HB1 ARG 116 15.612 -6.695 1.788 680 HG2 ARG 116 HG2 ARG 116 16.786 -7.783 3.640 681 HG3 ARG 116 HG1 ARG 116 15.789 -6.917 4.809 682 HD2 ARG 116 HD2 ARG 116 13.773 -7.998 3.882 683 HD3 ARG 116 HD1 ARG 116 14.776 -8.876 2.725 684 HE ARG 116 HE ARG 116 14.526 -9.419 5.583 685 HH11 ARG 116 HH21 ARG 116 16.272 -9.875 2.631 686 HH12 ARG 116 HH22 ARG 116 17.038 -11.339 3.148 687 HH21 ARG 116 HH11 ARG 116 15.527 -11.339 6.270 688 HH22 ARG 116 HH12 ARG 116 16.616 -12.168 5.209 689 H CYS 117 HN CYS 117 17.959 -5.095 0.786 690 HA CYS 117 HA CYS 117 17.185 -2.479 -0.112 691 HB2 CYS 117 HB2 CYS 117 18.531 -3.058 -2.116 692 HB3 CYS 117 HB1 CYS 117 19.411 -3.348 -0.610 693 H GLN 118 HN GLN 118 16.042 -1.982 -2.059 694 HA GLN 118 HA GLN 118 13.598 -3.228 -2.380 695 HB2 GLN 118 HB2 GLN 118 15.213 -1.633 -4.380 696 HB3 GLN 118 HB1 GLN 118 13.516 -2.076 -4.609 697 HG2 GLN 118 HG2 GLN 118 14.558 -0.531 -2.217 698 HG3 GLN 118 HG1 GLN 118 13.840 0.224 -3.638 699 HE21 GLN 118 HE21 GLN 118 13.059 -0.757 -0.561 700 HE22 GLN 118 HE22 GLN 118 11.404 -1.061 -0.778 701 H ILE 119 HN ILE 119 16.618 -4.399 -3.317 702 HA ILE 119 HA ILE 119 15.597 -6.054 -5.506 703 HB ILE 119 HB ILE 119 18.336 -5.702 -4.284 704 HG12 ILE 119 HG12 ILE 119 18.850 -4.829 -6.540 705 HG13 ILE 119 HG11 ILE 119 17.173 -5.103 -7.020 706 HG21 ILE 119 HG21 ILE 119 18.315 -7.989 -4.888 707 HG22 ILE 119 HG22 ILE 119 19.015 -7.178 -6.288 708 HG23 ILE 119 HG23 ILE 119 17.327 -7.690 -6.316 709 HD11 ILE 119 HD11 ILE 119 17.749 -3.434 -4.578 710 HD12 ILE 119 HD12 ILE 119 16.365 -3.375 -5.676 711 HD13 ILE 119 HD13 ILE 119 17.918 -2.720 -6.183 712 H CYS 120 HN CYS 120 16.798 -6.405 -2.199 713 HA CYS 120 HA CYS 120 16.691 -9.246 -2.162 714 HB2 CYS 120 HB2 CYS 120 17.011 -7.096 -0.093 715 HB3 CYS 120 HB1 CYS 120 16.594 -8.724 0.454 716 H VAL 121 HN VAL 121 14.380 -6.722 -1.435 717 HA VAL 121 HA VAL 121 12.461 -8.422 -0.172 718 HB VAL 121 HB VAL 121 10.954 -6.543 -0.345 719 HG11 VAL 121 HG11 VAL 121 12.240 -4.901 0.828 720 HG12 VAL 121 HG12 VAL 121 13.732 -5.413 0.043 721 HG13 VAL 121 HG13 VAL 121 12.957 -6.461 1.229 722 HG21 VAL 121 HG21 VAL 121 11.791 -4.494 -1.630 723 HG22 VAL 121 HG22 VAL 121 11.236 -5.848 -2.613 724 HG23 VAL 121 HG23 VAL 121 12.961 -5.573 -2.384 725 H HIS 122 HN HIS 122 12.912 -7.209 -3.464 726 HA HIS 122 HA HIS 122 10.532 -8.456 -4.484 727 HB2 HIS 122 HB2 HIS 122 11.690 -6.419 -5.472 728 HB3 HIS 122 HB1 HIS 122 12.914 -7.530 -6.098 729 HD2 HIS 122 HD2 HIS 122 9.012 -6.932 -6.551 730 HE1 HIS 122 HE1 HIS 122 10.452 -9.148 -9.842 731 HE2 HIS 122 HE2 HIS 122 8.418 -7.983 -8.866 732 H SER 123 HN SER 123 13.350 -9.746 -3.394 733 HA SER 123 HA SER 123 13.502 -11.880 -5.430 734 HB2 SER 123 HB2 SER 123 15.602 -12.464 -4.449 735 HB3 SER 123 HB1 SER 123 15.584 -10.711 -4.621 736 HG SER 123 HG SER 123 15.964 -12.110 -2.432 737 H GLN 124 HN GLN 124 13.810 -11.831 -1.874 738 HA GLN 124 HA GLN 124 12.466 -14.438 -1.749 739 HB2 GLN 124 HB2 GLN 124 13.918 -12.783 0.327 740 HB3 GLN 124 HB1 GLN 124 13.141 -14.331 0.662 741 HG2 GLN 124 HG2 GLN 124 14.561 -15.426 -1.019 742 HG3 GLN 124 HG1 GLN 124 15.327 -13.882 -1.389 743 HE21 GLN 124 HE21 GLN 124 17.415 -14.063 -0.527 744 HE22 GLN 124 HE22 GLN 124 17.754 -14.547 1.064 745 H ARG 125 HN ARG 125 10.846 -12.216 -2.501 746 HA ARG 125 HA ARG 125 8.934 -11.058 -1.910 747 HB2 ARG 125 HB2 ARG 125 8.618 -13.676 -0.426 748 HB3 ARG 125 HB1 ARG 125 7.318 -12.493 -0.616 749 HG2 ARG 125 HG2 ARG 125 7.460 -12.671 -3.046 750 HG3 ARG 125 HG1 ARG 125 8.840 -13.762 -2.914 751 HD2 ARG 125 HD2 ARG 125 6.805 -15.059 -3.301 752 HD3 ARG 125 HD1 ARG 125 7.418 -15.379 -1.683 753 HE ARG 125 HE ARG 125 5.558 -14.267 -0.783 754 HH11 ARG 125 HH21 ARG 125 5.758 -13.927 -4.222 755 HH12 ARG 125 HH22 ARG 125 4.159 -13.284 -4.390 756 HH21 ARG 125 HH11 ARG 125 3.460 -13.424 -0.996 757 HH22 ARG 125 HH12 ARG 125 2.858 -12.998 -2.564 758 H ASN 126 HN ASN 126 8.816 -12.702 1.151 759 HA ASN 126 HA ASN 126 10.143 -10.725 2.712 760 HB2 ASN 126 HB2 ASN 126 8.189 -9.381 2.000 761 HB3 ASN 126 HB1 ASN 126 7.120 -10.595 2.698 762 HD21 ASN 126 HD21 ASN 126 9.783 -8.353 3.604 763 HD22 ASN 126 HD22 ASN 126 9.266 -8.156 5.210 Start of MODEL 20 1 H MET 31 HT1 MET 31 1.749 26.516 -22.905 2 HA MET 31 HA MET 31 0.938 24.315 -22.576 3 HB2 MET 31 HB2 MET 31 3.653 24.646 -21.257 4 HB3 MET 31 HB1 MET 31 3.041 23.183 -22.041 5 HG2 MET 31 HG2 MET 31 4.380 24.190 -23.705 6 HG3 MET 31 HG1 MET 31 2.743 24.681 -24.141 7 HE1 MET 31 HE1 MET 31 5.901 25.979 -24.612 8 HE2 MET 31 HE2 MET 31 5.330 27.618 -24.910 9 HE3 MET 31 HE3 MET 31 4.450 26.249 -25.585 10 H GLY 32 HN GLY 32 2.596 25.329 -19.573 11 HA2 GLY 32 HA2 GLY 32 0.384 24.565 -17.911 12 HA3 GLY 32 HA1 GLY 32 1.692 23.387 -17.856 13 H LYS 33 HN LYS 33 0.474 26.043 -16.351 14 HA LYS 33 HA LYS 33 2.760 27.597 -15.756 15 HB2 LYS 33 HB2 LYS 33 0.416 28.328 -15.351 16 HB3 LYS 33 HB1 LYS 33 0.310 27.160 -14.034 17 HG2 LYS 33 HG2 LYS 33 2.157 28.270 -12.864 18 HG3 LYS 33 HG1 LYS 33 2.335 29.412 -14.197 19 HD2 LYS 33 HD2 LYS 33 0.031 30.219 -13.810 20 HD3 LYS 33 HD1 LYS 33 -0.132 29.091 -12.463 21 HE2 LYS 33 HE2 LYS 33 1.735 30.191 -11.297 22 HE3 LYS 33 HE1 LYS 33 1.930 31.307 -12.649 23 HZ1 LYS 33 HZ1 LYS 33 0.410 32.593 -11.716 24 HZ2 LYS 33 HZ2 LYS 33 0.141 31.462 -10.477 25 HZ3 LYS 33 HZ3 LYS 33 -0.747 31.370 -11.923 26 H ASN 34 HN ASN 34 1.274 24.823 -14.112 27 HA ASN 34 HA ASN 34 3.191 24.803 -11.971 28 HB2 ASN 34 HB2 ASN 34 2.168 22.601 -11.427 29 HB3 ASN 34 HB1 ASN 34 0.969 23.889 -11.604 30 HD21 ASN 34 HD21 ASN 34 0.177 21.190 -11.948 31 HD22 ASN 34 HD22 ASN 34 -0.186 20.927 -13.585 32 H ASP 35 HN ASP 35 5.263 24.610 -12.721 33 HA ASP 35 HA ASP 35 5.932 22.487 -14.630 34 HB2 ASP 35 HB2 ASP 35 8.226 23.462 -14.466 35 HB3 ASP 35 HB1 ASP 35 7.000 24.618 -14.999 36 H ASN 36 HN ASN 36 5.444 22.664 -11.378 37 HA ASN 36 HA ASN 36 7.682 21.309 -10.296 38 HB2 ASN 36 HB2 ASN 36 5.897 22.524 -8.993 39 HB3 ASN 36 HB1 ASN 36 4.837 21.144 -9.297 40 HD21 ASN 36 HD21 ASN 36 7.925 22.060 -7.737 41 HD22 ASN 36 HD22 ASN 36 7.957 20.736 -6.676 42 H ASP 37 HN ASP 37 4.672 20.182 -11.762 43 HA ASP 37 HA ASP 37 5.212 17.407 -11.208 44 HB2 ASP 37 HB2 ASP 37 3.247 17.005 -12.685 45 HB3 ASP 37 HB1 ASP 37 2.903 18.146 -11.385 46 H ALA 38 HN ALA 38 6.810 19.416 -13.084 47 HA ALA 38 HA ALA 38 6.884 18.227 -15.641 48 HB1 ALA 38 HB1 ALA 38 7.814 20.450 -15.215 49 HB2 ALA 38 HB2 ALA 38 9.030 19.384 -15.920 50 HB3 ALA 38 HB3 ALA 38 9.059 19.736 -14.192 51 H LEU 39 HN LEU 39 8.505 16.842 -16.579 52 HA LEU 39 HA LEU 39 9.714 14.977 -14.614 53 HB2 LEU 39 HB2 LEU 39 8.722 14.504 -17.424 54 HB3 LEU 39 HB1 LEU 39 9.602 13.328 -16.468 55 HG LEU 39 HG LEU 39 7.114 14.630 -15.360 56 HD11 LEU 39 HD11 LEU 39 5.876 12.599 -16.183 57 HD12 LEU 39 HD12 LEU 39 7.287 12.196 -17.162 58 HD13 LEU 39 HD13 LEU 39 6.393 13.683 -17.476 59 HD21 LEU 39 HD21 LEU 39 8.254 13.438 -13.691 60 HD22 LEU 39 HD22 LEU 39 8.723 12.138 -14.777 61 HD23 LEU 39 HD23 LEU 39 7.053 12.287 -14.247 62 H ILE 40 HN ILE 40 11.840 14.730 -14.633 63 HA ILE 40 HA ILE 40 13.399 16.172 -16.691 64 HB ILE 40 HB ILE 40 14.344 15.041 -14.046 65 HG12 ILE 40 HG12 ILE 40 14.366 17.685 -13.629 66 HG13 ILE 40 HG11 ILE 40 13.080 17.672 -14.835 67 HG21 ILE 40 HG21 ILE 40 16.166 16.772 -14.487 68 HG22 ILE 40 HG22 ILE 40 15.572 16.818 -16.147 69 HG23 ILE 40 HG23 ILE 40 16.202 15.313 -15.476 70 HD11 ILE 40 HD11 ILE 40 12.294 15.605 -13.162 71 HD12 ILE 40 HD12 ILE 40 11.720 17.257 -13.053 72 HD13 ILE 40 HD13 ILE 40 13.056 16.725 -12.041 73 H MET 41 HN MET 41 14.500 15.129 -18.175 74 HA MET 41 HA MET 41 14.609 12.188 -18.104 75 HB2 MET 41 HB2 MET 41 13.925 13.492 -20.166 76 HB3 MET 41 HB1 MET 41 15.598 14.038 -20.286 77 HG2 MET 41 HG2 MET 41 16.379 11.723 -20.419 78 HG3 MET 41 HG1 MET 41 14.727 11.136 -20.213 79 HE1 MET 41 HE1 MET 41 14.990 9.705 -22.049 80 HE2 MET 41 HE2 MET 41 16.468 10.197 -22.875 81 HE3 MET 41 HE3 MET 41 14.954 10.116 -23.768 82 H CYS 42 HN CYS 42 16.397 11.040 -17.668 83 HA CYS 42 HA CYS 42 18.790 12.464 -16.828 84 HB2 CYS 42 HB2 CYS 42 17.681 10.458 -15.640 85 HB3 CYS 42 HB1 CYS 42 18.466 9.473 -16.876 86 H MET 43 HN MET 43 20.575 12.677 -17.941 87 HA MET 43 HA MET 43 20.734 11.686 -20.665 88 HB2 MET 43 HB2 MET 43 23.077 12.842 -20.480 89 HB3 MET 43 HB1 MET 43 21.631 13.846 -20.444 90 HG2 MET 43 HG2 MET 43 21.709 14.039 -18.051 91 HG3 MET 43 HG1 MET 43 22.969 12.802 -17.935 92 HE1 MET 43 HE1 MET 43 26.178 14.372 -18.884 93 HE2 MET 43 HE2 MET 43 25.181 13.072 -19.527 94 HE3 MET 43 HE3 MET 43 25.342 13.269 -17.787 95 H ARG 44 HN ARG 44 21.189 10.131 -17.872 96 HA ARG 44 HA ARG 44 23.483 8.543 -18.896 97 HB2 ARG 44 HB2 ARG 44 23.960 9.737 -16.769 98 HB3 ARG 44 HB1 ARG 44 22.612 8.890 -16.020 99 HG2 ARG 44 HG2 ARG 44 23.652 6.767 -16.283 100 HG3 ARG 44 HG1 ARG 44 24.859 7.411 -17.395 101 HD2 ARG 44 HD2 ARG 44 25.849 8.739 -15.605 102 HD3 ARG 44 HD1 ARG 44 24.610 8.202 -14.486 103 HE ARG 44 HE ARG 44 25.751 6.195 -14.250 104 HH11 ARG 44 HH21 ARG 44 26.848 7.960 -17.018 105 HH12 ARG 44 HH22 ARG 44 28.186 6.908 -17.331 106 HH21 ARG 44 HH11 ARG 44 27.507 4.812 -14.654 107 HH22 ARG 44 HH12 ARG 44 28.559 5.124 -15.994 108 H CYS 45 HN CYS 45 21.378 7.682 -16.236 109 HA CYS 45 HA CYS 45 20.873 5.100 -17.296 110 HB2 CYS 45 HB2 CYS 45 19.535 4.743 -15.351 111 HB3 CYS 45 HB1 CYS 45 20.900 5.740 -14.850 112 H ARG 46 HN ARG 46 19.417 8.138 -17.805 113 HA ARG 46 HA ARG 46 17.642 8.775 -19.079 114 HB2 ARG 46 HB2 ARG 46 18.639 6.857 -20.529 115 HB3 ARG 46 HB1 ARG 46 17.242 5.936 -19.960 116 HG2 ARG 46 HG2 ARG 46 15.697 7.409 -20.975 117 HG3 ARG 46 HG1 ARG 46 16.902 8.674 -21.193 118 HD2 ARG 46 HD2 ARG 46 18.085 7.350 -22.832 119 HD3 ARG 46 HD1 ARG 46 16.982 5.992 -22.581 120 HE ARG 46 HE ARG 46 15.399 8.172 -23.282 121 HH11 ARG 46 HH21 ARG 46 18.000 6.320 -24.616 122 HH12 ARG 46 HH22 ARG 46 17.509 6.559 -26.261 123 HH21 ARG 46 HH11 ARG 46 14.749 8.488 -25.434 124 HH22 ARG 46 HH12 ARG 46 15.669 7.786 -26.724 125 H LYS 47 HN LYS 47 17.230 8.066 -16.377 126 HA LYS 47 HA LYS 47 14.632 6.716 -16.319 127 HB2 LYS 47 HB2 LYS 47 16.302 6.243 -14.563 128 HB3 LYS 47 HB1 LYS 47 16.250 7.937 -14.072 129 HG2 LYS 47 HG2 LYS 47 13.863 7.742 -13.552 130 HG3 LYS 47 HG1 LYS 47 13.862 6.068 -14.109 131 HD2 LYS 47 HD2 LYS 47 15.845 6.860 -11.981 132 HD3 LYS 47 HD1 LYS 47 14.156 6.657 -11.517 133 HE2 LYS 47 HE2 LYS 47 15.790 4.578 -13.001 134 HE3 LYS 47 HE1 LYS 47 15.459 4.552 -11.268 135 HZ1 LYS 47 HZ1 LYS 47 13.040 4.653 -11.904 136 HZ2 LYS 47 HZ2 LYS 47 13.838 3.198 -12.270 137 HZ3 LYS 47 HZ3 LYS 47 13.522 4.329 -13.499 138 H VAL 48 HN VAL 48 12.846 7.856 -16.709 139 HA VAL 48 HA VAL 48 12.864 10.771 -16.401 140 HB VAL 48 HB VAL 48 10.697 8.951 -17.464 141 HG11 VAL 48 HG11 VAL 48 9.740 11.041 -16.870 142 HG12 VAL 48 HG12 VAL 48 10.054 11.155 -18.604 143 HG13 VAL 48 HG13 VAL 48 11.145 11.932 -17.457 144 HG21 VAL 48 HG21 VAL 48 12.703 8.720 -18.823 145 HG22 VAL 48 HG22 VAL 48 12.905 10.472 -18.874 146 HG23 VAL 48 HG23 VAL 48 11.536 9.717 -19.692 147 H LYS 49 HN LYS 49 12.145 11.722 -14.629 148 HA LYS 49 HA LYS 49 9.869 10.664 -13.165 149 HB2 LYS 49 HB2 LYS 49 12.659 10.505 -12.202 150 HB3 LYS 49 HB1 LYS 49 11.498 11.133 -11.031 151 HG2 LYS 49 HG2 LYS 49 10.891 8.610 -12.564 152 HG3 LYS 49 HG1 LYS 49 11.915 8.549 -11.137 153 HD2 LYS 49 HD2 LYS 49 10.154 9.579 -9.794 154 HD3 LYS 49 HD1 LYS 49 9.129 9.756 -11.214 155 HE2 LYS 49 HE2 LYS 49 8.394 7.786 -10.059 156 HE3 LYS 49 HE1 LYS 49 9.251 7.255 -11.507 157 HZ1 LYS 49 HZ1 LYS 49 11.056 6.566 -10.300 158 HZ2 LYS 49 HZ2 LYS 49 9.797 6.201 -9.220 159 HZ3 LYS 49 HZ3 LYS 49 10.734 7.600 -8.995 160 H GLY 50 HN GLY 50 9.328 12.131 -11.285 161 HA2 GLY 50 HA2 GLY 50 9.413 14.878 -12.278 162 HA3 GLY 50 HA1 GLY 50 8.374 14.258 -10.995 163 H ILE 51 HN ILE 51 9.254 16.469 -10.186 164 HA ILE 51 HA ILE 51 11.871 16.828 -9.312 165 HB ILE 51 HB ILE 51 10.039 18.529 -9.221 166 HG12 ILE 51 HG12 ILE 51 11.309 18.148 -6.500 167 HG13 ILE 51 HG11 ILE 51 12.247 18.649 -7.908 168 HG21 ILE 51 HG21 ILE 51 8.446 18.506 -7.433 169 HG22 ILE 51 HG22 ILE 51 9.257 17.158 -6.638 170 HG23 ILE 51 HG23 ILE 51 8.399 16.897 -8.156 171 HD11 ILE 51 HD11 ILE 51 9.864 20.078 -6.705 172 HD12 ILE 51 HD12 ILE 51 10.644 20.550 -8.214 173 HD13 ILE 51 HD13 ILE 51 11.541 20.627 -6.697 174 H ASP 52 HN ASP 52 9.793 14.361 -8.390 175 HA ASP 52 HA ASP 52 10.448 14.092 -5.644 176 HB2 ASP 52 HB2 ASP 52 9.369 12.152 -7.693 177 HB3 ASP 52 HB1 ASP 52 9.596 11.743 -5.994 178 H SER 53 HN SER 53 11.672 12.654 -8.608 179 HA SER 53 HA SER 53 13.809 11.261 -7.130 180 HB2 SER 53 HB2 SER 53 14.188 9.984 -9.021 181 HB3 SER 53 HB1 SER 53 12.465 10.319 -9.149 182 HG SER 53 HG SER 53 13.042 12.112 -10.487 183 H TYR 54 HN TYR 54 13.391 14.311 -8.095 184 HA TYR 54 HA TYR 54 16.280 14.699 -8.678 185 HB2 TYR 54 HB2 TYR 54 13.865 15.720 -10.097 186 HB3 TYR 54 HB1 TYR 54 15.169 16.889 -9.863 187 HD1 TYR 54 HD2 TYR 54 14.547 13.403 -11.069 188 HD2 TYR 54 HD1 TYR 54 17.007 16.889 -11.316 189 HE1 TYR 54 HE2 TYR 54 15.809 12.361 -12.920 190 HE2 TYR 54 HE1 TYR 54 18.283 15.860 -13.142 191 HH TYR 54 HH TYR 54 18.461 14.126 -14.525 192 H SER 55 HN SER 55 17.314 16.234 -7.558 193 HA SER 55 HA SER 55 16.076 17.265 -5.196 194 HB2 SER 55 HB2 SER 55 18.397 16.709 -5.068 195 HB3 SER 55 HB1 SER 55 18.778 17.711 -6.470 196 HG SER 55 HG SER 55 18.702 18.407 -3.911 197 H LYS 56 HN LYS 56 15.993 19.545 -4.625 198 HA LYS 56 HA LYS 56 14.589 21.096 -6.502 199 HB2 LYS 56 HB2 LYS 56 14.442 21.378 -4.030 200 HB3 LYS 56 HB1 LYS 56 16.064 22.073 -4.042 201 HG2 LYS 56 HG2 LYS 56 15.293 23.867 -5.550 202 HG3 LYS 56 HG1 LYS 56 13.675 23.165 -5.560 203 HD2 LYS 56 HD2 LYS 56 13.515 23.496 -3.118 204 HD3 LYS 56 HD1 LYS 56 15.129 24.214 -3.114 205 HE2 LYS 56 HE2 LYS 56 14.342 25.991 -4.639 206 HE3 LYS 56 HE1 LYS 56 12.728 25.277 -4.636 207 HZ1 LYS 56 HZ1 LYS 56 13.851 25.782 -2.019 208 HZ2 LYS 56 HZ2 LYS 56 12.285 26.076 -2.606 209 HZ3 LYS 56 HZ3 LYS 56 13.538 27.175 -2.934 210 H THR 57 HN THR 57 17.995 21.116 -5.521 211 HA THR 57 HA THR 57 18.770 23.443 -6.913 212 HB THR 57 HB THR 57 20.493 21.008 -6.416 213 HG1 THR 57 HG1 THR 57 19.950 23.196 -4.698 214 HG21 THR 57 HG21 THR 57 22.285 22.684 -6.281 215 HG22 THR 57 HG22 THR 57 21.114 23.971 -6.571 216 HG23 THR 57 HG23 THR 57 21.458 22.790 -7.836 217 H GLN 58 HN GLN 58 18.952 20.009 -7.877 218 HA GLN 58 HA GLN 58 19.944 20.542 -10.488 219 HB2 GLN 58 HB2 GLN 58 18.701 18.170 -9.116 220 HB3 GLN 58 HB1 GLN 58 18.939 18.131 -10.864 221 HG2 GLN 58 HG2 GLN 58 20.874 17.165 -9.668 222 HG3 GLN 58 HG1 GLN 58 21.324 18.608 -10.576 223 HE21 GLN 58 HE21 GLN 58 22.975 19.492 -9.274 224 HE22 GLN 58 HE22 GLN 58 22.770 19.894 -7.631 225 H TRP 59 HN TRP 59 16.685 19.908 -9.234 226 HA TRP 59 HA TRP 59 15.357 19.954 -11.711 227 HB2 TRP 59 HB2 TRP 59 14.253 19.067 -9.745 228 HB3 TRP 59 HB1 TRP 59 14.359 20.633 -8.931 229 HD1 TRP 59 HD1 TRP 59 12.731 19.033 -12.026 230 HE1 TRP 59 HE1 TRP 59 10.548 20.304 -12.569 231 HE3 TRP 59 HE3 TRP 59 13.026 22.731 -8.544 232 HZ2 TRP 59 HZ2 TRP 59 9.139 22.614 -11.634 233 HZ3 TRP 59 HZ3 TRP 59 11.254 24.461 -8.387 234 HH2 TRP 59 HH2 TRP 59 9.312 24.404 -9.926 235 H SER 60 HN SER 60 16.234 22.508 -9.442 236 HA SER 60 HA SER 60 14.735 24.614 -10.500 237 HB2 SER 60 HB2 SER 60 17.407 24.563 -9.105 238 HB3 SER 60 HB1 SER 60 16.614 26.064 -9.572 239 HG SER 60 HG SER 60 16.180 24.611 -7.424 240 H LYS 61 HN LYS 61 17.277 22.870 -11.909 241 HA LYS 61 HA LYS 61 18.206 25.032 -13.636 242 HB2 LYS 61 HB2 LYS 61 18.841 22.078 -13.640 243 HB3 LYS 61 HB1 LYS 61 19.643 23.296 -14.622 244 HG2 LYS 61 HG2 LYS 61 20.400 24.465 -12.604 245 HG3 LYS 61 HG1 LYS 61 19.561 23.291 -11.591 246 HD2 LYS 61 HD2 LYS 61 20.970 21.484 -12.529 247 HD3 LYS 61 HD1 LYS 61 21.829 22.675 -13.506 248 HE2 LYS 61 HE2 LYS 61 22.557 23.840 -11.469 249 HE3 LYS 61 HE1 LYS 61 21.673 22.676 -10.481 250 HZ1 LYS 61 HZ1 LYS 61 23.090 20.964 -11.784 251 HZ2 LYS 61 HZ2 LYS 61 23.786 21.801 -10.480 252 HZ3 LYS 61 HZ3 LYS 61 24.116 22.282 -12.076 253 H THR 62 HN THR 62 15.653 22.827 -13.581 254 HA THR 62 HA THR 62 15.400 22.175 -16.331 255 HB THR 62 HB THR 62 13.006 21.731 -15.760 256 HG1 THR 62 HG1 THR 62 13.804 23.205 -13.562 257 HG21 THR 62 HG21 THR 62 15.167 20.702 -13.914 258 HG22 THR 62 HG22 THR 62 14.580 19.955 -15.398 259 HG23 THR 62 HG23 THR 62 13.543 20.021 -13.974 260 H PHE 63 HN PHE 63 15.036 25.118 -14.694 261 HA PHE 63 HA PHE 63 13.888 26.359 -17.091 262 HB2 PHE 63 HB2 PHE 63 12.379 27.734 -15.692 263 HB3 PHE 63 HB1 PHE 63 11.969 26.020 -15.632 264 HD1 PHE 63 HD1 PHE 63 13.659 28.777 -13.800 265 HD2 PHE 63 HD2 PHE 63 12.138 24.765 -13.605 266 HE1 PHE 63 HE1 PHE 63 13.938 28.790 -11.337 267 HE2 PHE 63 HE2 PHE 63 12.419 24.776 -11.143 268 HZ PHE 63 HZ PHE 63 13.319 26.790 -10.007 269 H THR 64 HN THR 64 14.385 28.578 -17.306 270 HA THR 64 HA THR 64 16.559 29.545 -15.529 271 HB THR 64 HB THR 64 17.395 30.718 -17.624 272 HG1 THR 64 HG1 THR 64 16.009 30.543 -19.187 273 HG21 THR 64 HG21 THR 64 18.718 28.923 -16.910 274 HG22 THR 64 HG22 THR 64 18.305 28.466 -18.561 275 HG23 THR 64 HG23 THR 64 17.446 27.739 -17.206 276 H PHE 65 HN PHE 65 16.840 31.930 -15.647 277 HA PHE 65 HA PHE 65 14.177 33.211 -15.640 278 HB2 PHE 65 HB2 PHE 65 16.240 33.215 -13.755 279 HB3 PHE 65 HB1 PHE 65 16.418 34.779 -14.537 280 HD1 PHE 65 HD2 PHE 65 13.593 32.561 -13.425 281 HD2 PHE 65 HD1 PHE 65 15.243 36.526 -13.525 282 HE1 PHE 65 HE2 PHE 65 11.636 33.406 -12.162 283 HE2 PHE 65 HE1 PHE 65 13.289 37.367 -12.260 284 HZ PHE 65 HZ PHE 65 11.487 35.814 -11.587 285 H VAL 66 HN VAL 66 13.661 34.396 -17.320 286 HA VAL 66 HA VAL 66 15.784 35.952 -18.691 287 HB VAL 66 HB VAL 66 13.584 34.294 -19.931 288 HG11 VAL 66 HG11 VAL 66 13.526 36.337 -21.148 289 HG12 VAL 66 HG12 VAL 66 14.577 35.283 -22.095 290 HG13 VAL 66 HG13 VAL 66 15.275 36.531 -21.062 291 HG21 VAL 66 HG21 VAL 66 15.440 33.223 -21.090 292 HG22 VAL 66 HG22 VAL 66 15.768 33.194 -19.357 293 HG23 VAL 66 HG23 VAL 66 16.583 34.368 -20.390 294 H ARG 67 HN ARG 67 15.320 38.032 -19.034 295 HA ARG 67 HA ARG 67 14.213 40.039 -18.846 296 HB2 ARG 67 HB2 ARG 67 12.089 38.240 -20.020 297 HB3 ARG 67 HB1 ARG 67 11.826 39.971 -19.768 298 HG2 ARG 67 HG2 ARG 67 13.784 40.482 -21.166 299 HG3 ARG 67 HG1 ARG 67 14.081 38.760 -21.401 300 HD2 ARG 67 HD2 ARG 67 11.483 40.114 -22.165 301 HD3 ARG 67 HD1 ARG 67 12.827 39.894 -23.290 302 HE ARG 67 HE ARG 67 12.309 37.389 -22.205 303 HH11 ARG 67 HH21 ARG 67 10.637 39.823 -24.011 304 HH12 ARG 67 HH22 ARG 67 9.611 38.701 -24.837 305 HH21 ARG 67 HH11 ARG 67 10.966 35.911 -23.287 306 HH22 ARG 67 HH12 ARG 67 9.796 36.484 -24.427 307 H GLY 68 HN GLY 68 14.162 38.114 -16.545 308 HA2 GLY 68 HA2 GLY 68 13.406 38.303 -14.376 309 HA3 GLY 68 HA1 GLY 68 12.360 39.627 -14.890 310 H ARG 69 HN ARG 69 12.266 36.585 -16.568 311 HA ARG 69 HA ARG 69 9.761 35.832 -15.164 312 HB2 ARG 69 HB2 ARG 69 10.199 35.867 -18.159 313 HB3 ARG 69 HB1 ARG 69 8.768 35.248 -17.335 314 HG2 ARG 69 HG2 ARG 69 8.433 37.515 -16.319 315 HG3 ARG 69 HG1 ARG 69 9.785 38.104 -17.286 316 HD2 ARG 69 HD2 ARG 69 7.857 38.644 -18.547 317 HD3 ARG 69 HD1 ARG 69 8.535 37.222 -19.314 318 HE ARG 69 HE ARG 69 6.177 37.217 -17.498 319 HH11 ARG 69 HH21 ARG 69 8.091 35.804 -20.019 320 HH12 ARG 69 HH22 ARG 69 6.955 34.556 -20.370 321 HH21 ARG 69 HH11 ARG 69 4.683 35.573 -17.959 322 HH22 ARG 69 HH12 ARG 69 5.029 34.422 -19.205 323 H THR 70 HN THR 70 9.250 33.617 -15.221 324 HA THR 70 HA THR 70 11.590 31.900 -15.270 325 HB THR 70 HB THR 70 8.693 31.203 -14.727 326 HG1 THR 70 HG1 THR 70 10.278 31.229 -12.586 327 HG21 THR 70 HG21 THR 70 9.812 29.298 -13.478 328 HG22 THR 70 HG22 THR 70 11.317 29.767 -14.269 329 HG23 THR 70 HG23 THR 70 9.946 29.220 -15.235 330 H VAL 71 HN VAL 71 12.232 30.721 -16.947 331 HA VAL 71 HA VAL 71 10.250 29.943 -19.016 332 HB VAL 71 HB VAL 71 12.181 30.283 -20.668 333 HG11 VAL 71 HG11 VAL 71 11.735 32.779 -20.755 334 HG12 VAL 71 HG12 VAL 71 10.830 32.596 -19.251 335 HG13 VAL 71 HG13 VAL 71 10.290 31.769 -20.713 336 HG21 VAL 71 HG21 VAL 71 13.892 30.528 -18.806 337 HG22 VAL 71 HG22 VAL 71 13.185 32.104 -18.454 338 HG23 VAL 71 HG23 VAL 71 13.937 31.803 -20.019 339 H SER 72 HN SER 72 10.319 27.865 -19.600 340 HA SER 72 HA SER 72 11.965 26.032 -18.197 341 HB2 SER 72 HB2 SER 72 9.764 25.372 -18.948 342 HB3 SER 72 HB1 SER 72 10.217 25.671 -20.625 343 HG SER 72 HG SER 72 10.367 23.440 -19.956 344 H VAL 73 HN VAL 73 13.769 24.917 -18.828 345 HA VAL 73 HA VAL 73 15.462 26.103 -20.783 346 HB VAL 73 HB VAL 73 15.689 23.515 -19.250 347 HG11 VAL 73 HG11 VAL 73 17.538 24.860 -21.220 348 HG12 VAL 73 HG12 VAL 73 17.046 23.166 -21.153 349 HG13 VAL 73 HG13 VAL 73 18.167 23.806 -19.952 350 HG21 VAL 73 HG21 VAL 73 17.519 24.910 -18.115 351 HG22 VAL 73 HG22 VAL 73 15.858 25.369 -17.769 352 HG23 VAL 73 HG23 VAL 73 16.805 26.304 -18.918 353 H SER 74 HN SER 74 16.037 25.410 -22.823 354 HA SER 74 HA SER 74 14.102 24.121 -24.389 355 HB2 SER 74 HB2 SER 74 17.059 24.481 -24.926 356 HB3 SER 74 HB1 SER 74 15.858 24.032 -26.132 357 HG SER 74 HG SER 74 15.244 26.039 -26.222 358 H ASP 75 HN ASP 75 17.107 22.875 -22.960 359 HA ASP 75 HA ASP 75 16.029 20.146 -23.172 360 HB2 ASP 75 HB2 ASP 75 17.408 20.602 -25.205 361 HB3 ASP 75 HB1 ASP 75 18.803 20.817 -24.140 362 HA PRO 76 HA PRO 76 17.851 21.074 -19.020 363 HB2 PRO 76 HB2 PRO 76 16.064 18.752 -18.398 364 HB3 PRO 76 HB1 PRO 76 16.221 20.307 -17.556 365 HG2 PRO 76 HG2 PRO 76 14.107 19.764 -19.101 366 HG3 PRO 76 HG1 PRO 76 14.806 21.388 -19.026 367 HD2 PRO 76 HD2 PRO 76 15.059 19.334 -21.187 368 HD3 PRO 76 HD1 PRO 76 14.968 21.106 -21.316 369 H LYS 77 HN LYS 77 19.870 20.295 -18.832 370 HA LYS 77 HA LYS 77 20.328 17.373 -19.173 371 HB2 LYS 77 HB2 LYS 77 22.086 19.739 -19.814 372 HB3 LYS 77 HB1 LYS 77 22.724 18.102 -19.653 373 HG2 LYS 77 HG2 LYS 77 21.118 17.334 -21.390 374 HG3 LYS 77 HG1 LYS 77 20.556 18.996 -21.579 375 HD2 LYS 77 HD2 LYS 77 22.784 19.712 -22.273 376 HD3 LYS 77 HD1 LYS 77 23.421 18.092 -21.988 377 HE2 LYS 77 HE2 LYS 77 21.902 17.190 -23.701 378 HE3 LYS 77 HE1 LYS 77 21.273 18.809 -23.998 379 HZ1 LYS 77 HZ1 LYS 77 24.117 18.769 -24.103 380 HZ2 LYS 77 HZ2 LYS 77 23.008 19.289 -25.281 381 HZ3 LYS 77 HZ3 LYS 77 23.463 17.652 -25.200 382 H VAL 78 HN VAL 78 20.048 16.770 -17.080 383 HA VAL 78 HA VAL 78 22.184 17.597 -15.217 384 HB VAL 78 HB VAL 78 20.327 17.556 -13.382 385 HG11 VAL 78 HG11 VAL 78 20.712 19.779 -15.400 386 HG12 VAL 78 HG12 VAL 78 21.509 19.586 -13.838 387 HG13 VAL 78 HG13 VAL 78 19.796 19.988 -13.909 388 HG21 VAL 78 HG21 VAL 78 18.637 16.755 -15.204 389 HG22 VAL 78 HG22 VAL 78 18.607 18.442 -15.708 390 HG23 VAL 78 HG23 VAL 78 18.111 18.001 -14.071 391 H ILE 79 HN ILE 79 22.380 16.133 -13.368 392 HA ILE 79 HA ILE 79 21.932 13.371 -14.221 393 HB ILE 79 HB ILE 79 23.553 14.535 -11.944 394 HG12 ILE 79 HG12 ILE 79 24.224 14.787 -14.503 395 HG13 ILE 79 HG11 ILE 79 25.433 14.303 -13.318 396 HG21 ILE 79 HG21 ILE 79 23.063 11.704 -12.882 397 HG22 ILE 79 HG22 ILE 79 22.929 12.347 -11.250 398 HG23 ILE 79 HG23 ILE 79 24.516 12.135 -11.985 399 HD11 ILE 79 HD11 ILE 79 25.258 12.899 -15.496 400 HD12 ILE 79 HD12 ILE 79 23.802 12.223 -14.779 401 HD13 ILE 79 HD13 ILE 79 25.351 12.035 -13.964 402 H CYS 80 HN CYS 80 20.823 11.846 -13.048 403 HA CYS 80 HA CYS 80 18.797 12.922 -11.228 404 HB2 CYS 80 HB2 CYS 80 17.580 10.973 -11.634 405 HB3 CYS 80 HB1 CYS 80 18.402 11.240 -13.172 406 H ARG 81 HN ARG 81 18.281 11.696 -9.219 407 HA ARG 81 HA ARG 81 20.487 11.573 -7.496 408 HB2 ARG 81 HB2 ARG 81 17.693 10.411 -7.302 409 HB3 ARG 81 HB1 ARG 81 18.854 10.324 -5.979 410 HG2 ARG 81 HG2 ARG 81 19.058 12.790 -6.002 411 HG3 ARG 81 HG1 ARG 81 17.876 12.867 -7.310 412 HD2 ARG 81 HD2 ARG 81 16.177 11.845 -5.875 413 HD3 ARG 81 HD1 ARG 81 17.352 11.677 -4.572 414 HE ARG 81 HE ARG 81 17.301 14.378 -5.265 415 HH11 ARG 81 HH21 ARG 81 15.161 11.943 -4.055 416 HH12 ARG 81 HH22 ARG 81 14.189 13.054 -3.148 417 HH21 ARG 81 HH11 ARG 81 16.032 15.839 -4.077 418 HH22 ARG 81 HH12 ARG 81 14.682 15.259 -3.160 419 H THR 82 HN THR 82 18.601 8.881 -8.924 420 HA THR 82 HA THR 82 19.976 6.739 -7.878 421 HB THR 82 HB THR 82 19.063 5.446 -9.612 422 HG1 THR 82 HG1 THR 82 19.685 6.088 -11.507 423 HG21 THR 82 HG21 THR 82 17.328 7.900 -9.854 424 HG22 THR 82 HG22 THR 82 17.411 6.993 -8.343 425 HG23 THR 82 HG23 THR 82 16.839 6.207 -9.813 426 H CYS 83 HN CYS 83 20.877 8.798 -10.605 427 HA CYS 83 HA CYS 83 23.270 7.257 -11.187 428 HB2 CYS 83 HB2 CYS 83 22.024 9.751 -12.286 429 HB3 CYS 83 HB1 CYS 83 23.701 9.352 -12.683 430 H GLN 84 HN GLN 84 22.360 9.624 -8.955 431 HA GLN 84 HA GLN 84 25.152 10.563 -8.622 432 HB2 GLN 84 HB2 GLN 84 23.192 12.196 -8.957 433 HB3 GLN 84 HB1 GLN 84 22.780 11.828 -7.287 434 HG2 GLN 84 HG2 GLN 84 25.278 12.321 -6.776 435 HG3 GLN 84 HG1 GLN 84 25.297 13.068 -8.375 436 HE21 GLN 84 HE21 GLN 84 25.631 15.208 -7.366 437 HE22 GLN 84 HE22 GLN 84 24.337 16.002 -6.609 438 HA PRO 85 HA PRO 85 24.210 7.654 -5.071 439 HB2 PRO 85 HB2 PRO 85 26.619 6.311 -5.196 440 HB3 PRO 85 HB1 PRO 85 25.179 5.833 -6.122 441 HG2 PRO 85 HG2 PRO 85 27.563 7.402 -7.011 442 HG3 PRO 85 HG1 PRO 85 26.667 6.130 -7.863 443 HD2 PRO 85 HD2 PRO 85 26.326 8.747 -8.411 444 HD3 PRO 85 HD1 PRO 85 25.010 7.562 -8.546 445 H LYS 86 HN LYS 86 26.699 9.890 -5.910 446 HA LYS 86 HA LYS 86 28.140 9.834 -3.437 447 HB2 LYS 86 HB2 LYS 86 27.973 11.935 -5.612 448 HB3 LYS 86 HB1 LYS 86 29.099 11.984 -4.255 449 HG2 LYS 86 HG2 LYS 86 30.086 9.856 -4.960 450 HG3 LYS 86 HG1 LYS 86 28.926 9.737 -6.283 451 HD2 LYS 86 HD2 LYS 86 29.815 11.860 -7.223 452 HD3 LYS 86 HD1 LYS 86 31.019 11.903 -5.932 453 HE2 LYS 86 HE2 LYS 86 30.722 9.596 -7.873 454 HE3 LYS 86 HE1 LYS 86 31.868 10.918 -8.093 455 HZ1 LYS 86 HZ1 LYS 86 32.775 8.899 -6.970 456 HZ2 LYS 86 HZ2 LYS 86 31.765 9.246 -5.648 457 HZ3 LYS 86 HZ3 LYS 86 32.979 10.344 -6.106 458 H GLN 87 HN GLN 87 27.905 11.084 -1.629 459 HA GLN 87 HA GLN 87 26.205 13.367 -1.472 460 HB2 GLN 87 HB2 GLN 87 24.431 12.437 -0.076 461 HB3 GLN 87 HB1 GLN 87 24.464 11.609 -1.637 462 HG2 GLN 87 HG2 GLN 87 25.880 9.819 -0.574 463 HG3 GLN 87 HG1 GLN 87 25.622 10.606 0.981 464 HE21 GLN 87 HE21 GLN 87 24.676 7.900 0.112 465 HE22 GLN 87 HE22 GLN 87 22.987 7.938 0.275 466 H HIS 88 HN HIS 88 28.825 11.959 -0.601 467 HA HIS 88 HA HIS 88 28.826 11.888 2.237 468 HB2 HIS 88 HB2 HIS 88 31.296 11.963 2.006 469 HB3 HIS 88 HB1 HIS 88 30.558 10.757 0.943 470 HD2 HIS 88 HD2 HIS 88 32.308 14.285 0.640 471 HE1 HIS 88 HE1 HIS 88 31.879 12.666 -3.235 472 HE2 HIS 88 HE2 HIS 88 32.882 14.572 -1.889 473 H ASP 89 HN ASP 89 29.424 14.428 -0.128 474 HA ASP 89 HA ASP 89 30.570 16.360 1.542 475 HB2 ASP 89 HB2 ASP 89 30.429 16.573 -0.913 476 HB3 ASP 89 HB1 ASP 89 28.684 16.792 -0.787 477 H SER 90 HN SER 90 29.789 17.709 3.058 478 HA SER 90 HA SER 90 26.868 18.010 3.370 479 HB2 SER 90 HB2 SER 90 26.972 17.534 5.734 480 HB3 SER 90 HB1 SER 90 27.651 16.160 4.860 481 HG SER 90 HG SER 90 29.698 17.597 5.202 482 H ILE 91 HN ILE 91 26.312 19.779 4.882 483 HA ILE 91 HA ILE 91 28.427 21.873 4.986 484 HB ILE 91 HB ILE 91 25.504 22.217 4.275 485 HG12 ILE 91 HG12 ILE 91 27.955 22.860 2.610 486 HG13 ILE 91 HG11 ILE 91 27.153 21.285 2.524 487 HG21 ILE 91 HG21 ILE 91 26.403 24.615 3.818 488 HG22 ILE 91 HG22 ILE 91 27.757 24.149 4.856 489 HG23 ILE 91 HG23 ILE 91 26.114 24.147 5.497 490 HD11 ILE 91 HD11 ILE 91 25.681 23.901 2.149 491 HD12 ILE 91 HD12 ILE 91 25.110 22.270 1.807 492 HD13 ILE 91 HD13 ILE 91 26.370 22.982 0.807 493 H TRP 92 HN TRP 92 28.703 22.786 6.904 494 HA TRP 92 HA TRP 92 27.122 21.869 9.150 495 HB2 TRP 92 HB2 TRP 92 29.469 22.056 9.544 496 HB3 TRP 92 HB1 TRP 92 29.516 23.702 8.903 497 HD1 TRP 92 HD1 TRP 92 27.067 22.194 11.481 498 HE1 TRP 92 HE1 TRP 92 27.145 23.641 13.613 499 HE3 TRP 92 HE3 TRP 92 30.749 25.475 10.173 500 HZ2 TRP 92 HZ2 TRP 92 28.591 25.891 14.629 501 HZ3 TRP 92 HZ3 TRP 92 31.458 27.259 11.739 502 HH2 TRP 92 HH2 TRP 92 30.384 27.471 13.965 503 H CYS 93 HN CYS 93 25.429 22.871 10.011 504 HA CYS 93 HA CYS 93 24.833 25.648 9.175 505 HB2 CYS 93 HB2 CYS 93 23.020 24.215 8.620 506 HB3 CYS 93 HB1 CYS 93 23.098 23.384 10.176 507 H THR 94 HN THR 94 24.738 27.248 10.671 508 HA THR 94 HA THR 94 25.482 26.536 13.442 509 HB THR 94 HB THR 94 26.373 28.676 13.649 510 HG1 THR 94 HG1 THR 94 25.126 30.234 13.039 511 HG21 THR 94 HG21 THR 94 26.568 28.173 10.668 512 HG22 THR 94 HG22 THR 94 27.531 27.329 11.882 513 HG23 THR 94 HG23 THR 94 27.713 29.070 11.665 514 H ALA 95 HN ALA 95 22.741 27.173 11.655 515 HA ALA 95 HA ALA 95 21.328 28.668 13.733 516 HB1 ALA 95 HB1 ALA 95 20.226 27.518 11.163 517 HB2 ALA 95 HB2 ALA 95 20.976 29.109 11.279 518 HB3 ALA 95 HB3 ALA 95 19.501 28.761 12.180 519 H CYS 96 HN CYS 96 21.851 25.411 12.720 520 HA CYS 96 HA CYS 96 19.632 24.468 14.458 521 HB2 CYS 96 HB2 CYS 96 21.022 23.062 12.166 522 HB3 CYS 96 HB1 CYS 96 19.753 22.368 13.184 523 H GLN 97 HN GLN 97 23.048 24.167 13.663 524 HA GLN 97 HA GLN 97 24.797 23.580 15.069 525 HB2 GLN 97 HB2 GLN 97 23.016 24.174 16.939 526 HB3 GLN 97 HB1 GLN 97 22.927 22.425 17.131 527 HG2 GLN 97 HG2 GLN 97 25.380 22.342 17.413 528 HG3 GLN 97 HG1 GLN 97 25.439 24.100 17.297 529 HE21 GLN 97 HE21 GLN 97 23.581 25.109 18.900 530 HE22 GLN 97 HE22 GLN 97 23.655 24.485 20.476 531 H GLN 98 HN GLN 98 23.429 21.919 13.076 532 HA GLN 98 HA GLN 98 24.514 19.318 13.939 533 HB2 GLN 98 HB2 GLN 98 22.082 19.238 14.384 534 HB3 GLN 98 HB1 GLN 98 21.771 19.660 12.701 535 HG2 GLN 98 HG2 GLN 98 22.794 17.629 11.919 536 HG3 GLN 98 HG1 GLN 98 23.396 17.245 13.532 537 HE21 GLN 98 HE21 GLN 98 21.719 15.421 12.094 538 HE22 GLN 98 HE22 GLN 98 20.230 15.321 12.902 539 H THR 99 HN THR 99 24.971 17.886 12.160 540 HA THR 99 HA THR 99 25.946 19.337 9.850 541 HB THR 99 HB THR 99 26.010 16.368 10.445 542 HG1 THR 99 HG1 THR 99 28.356 17.476 10.712 543 HG21 THR 99 HG21 THR 99 27.447 18.132 8.450 544 HG22 THR 99 HG22 THR 99 26.395 16.759 8.107 545 HG23 THR 99 HG23 THR 99 27.974 16.496 8.848 546 H LYS 100 HN LYS 100 24.749 19.725 8.122 547 HA LYS 100 HA LYS 100 22.536 17.860 7.455 548 HB2 LYS 100 HB2 LYS 100 22.780 20.803 7.472 549 HB3 LYS 100 HB1 LYS 100 22.036 20.179 6.002 550 HG2 LYS 100 HG2 LYS 100 20.264 20.577 7.570 551 HG3 LYS 100 HG1 LYS 100 20.479 18.836 7.488 552 HD2 LYS 100 HD2 LYS 100 21.930 18.943 9.505 553 HD3 LYS 100 HD1 LYS 100 21.589 20.668 9.626 554 HE2 LYS 100 HE2 LYS 100 19.499 18.473 9.665 555 HE3 LYS 100 HE1 LYS 100 20.105 19.315 11.092 556 HZ1 LYS 100 HZ1 LYS 100 18.650 20.918 10.711 557 HZ2 LYS 100 HZ2 LYS 100 18.092 20.124 9.316 558 HZ3 LYS 100 HZ3 LYS 100 19.371 21.236 9.211 559 H GLY 101 HN GLY 101 22.382 16.981 5.489 560 HA2 GLY 101 HA2 GLY 101 24.707 16.696 3.922 561 HA3 GLY 101 HA1 GLY 101 23.084 16.215 3.427 562 H ILE 102 HN ILE 102 24.889 17.235 1.611 563 HA ILE 102 HA ILE 102 24.513 20.050 1.201 564 HB ILE 102 HB ILE 102 26.507 18.894 0.361 565 HG12 ILE 102 HG12 ILE 102 24.835 19.844 -1.980 566 HG13 ILE 102 HG11 ILE 102 25.506 20.952 -0.778 567 HG21 ILE 102 HG21 ILE 102 25.213 16.768 -0.190 568 HG22 ILE 102 HG22 ILE 102 26.386 17.278 -1.405 569 HG23 ILE 102 HG23 ILE 102 24.668 17.584 -1.654 570 HD11 ILE 102 HD11 ILE 102 26.914 20.553 -2.896 571 HD12 ILE 102 HD12 ILE 102 27.240 18.950 -2.237 572 HD13 ILE 102 HD13 ILE 102 27.742 20.388 -1.347 573 H ASN 103 HN ASN 103 22.871 17.139 0.197 574 HA ASN 103 HA ASN 103 21.451 18.132 -2.012 575 HB2 ASN 103 HB2 ASN 103 20.789 15.980 0.003 576 HB3 ASN 103 HB1 ASN 103 19.791 16.311 -1.411 577 HD21 ASN 103 HD21 ASN 103 21.184 13.801 -1.021 578 HD22 ASN 103 HD22 ASN 103 22.363 13.673 -2.250 579 H GLU 104 HN GLU 104 20.680 18.150 1.445 580 HA GLU 104 HA GLU 104 18.149 19.513 1.018 581 HB2 GLU 104 HB2 GLU 104 18.041 19.536 3.486 582 HB3 GLU 104 HB1 GLU 104 18.329 17.920 2.843 583 HG2 GLU 104 HG2 GLU 104 20.768 18.233 3.235 584 HG3 GLU 104 HG1 GLU 104 20.421 19.801 3.971 585 H PHE 105 HN PHE 105 20.956 20.662 0.381 586 HA PHE 105 HA PHE 105 20.464 23.283 1.689 587 HB2 PHE 105 HB2 PHE 105 22.841 21.600 1.745 588 HB3 PHE 105 HB1 PHE 105 23.210 23.147 0.977 589 HD1 PHE 105 HD2 PHE 105 22.023 21.520 4.069 590 HD2 PHE 105 HD1 PHE 105 23.084 25.230 2.190 591 HE1 PHE 105 HE2 PHE 105 22.057 22.630 6.274 592 HE2 PHE 105 HE1 PHE 105 23.105 26.346 4.401 593 HZ PHE 105 HZ PHE 105 22.593 25.044 6.450 594 H SER 106 HN SER 106 20.457 25.029 0.429 595 HA SER 106 HA SER 106 20.445 24.614 -2.453 596 HB2 SER 106 HB2 SER 106 19.568 26.840 -2.593 597 HB3 SER 106 HB1 SER 106 18.750 26.033 -1.253 598 HG SER 106 HG SER 106 19.613 27.428 0.057 599 H LYS 107 HN LYS 107 21.514 26.420 -3.783 600 HA LYS 107 HA LYS 107 24.337 26.311 -3.312 601 HB2 LYS 107 HB2 LYS 107 24.494 27.694 -5.351 602 HB3 LYS 107 HB1 LYS 107 23.469 26.275 -5.580 603 HG2 LYS 107 HG2 LYS 107 21.479 27.707 -5.062 604 HG3 LYS 107 HG1 LYS 107 22.551 29.114 -5.049 605 HD2 LYS 107 HD2 LYS 107 23.148 28.790 -7.357 606 HD3 LYS 107 HD1 LYS 107 22.334 27.227 -7.410 607 HE2 LYS 107 HE2 LYS 107 20.786 28.685 -8.414 608 HE3 LYS 107 HE1 LYS 107 20.203 28.549 -6.758 609 HZ1 LYS 107 HZ1 LYS 107 22.154 30.629 -7.149 610 HZ2 LYS 107 HZ2 LYS 107 20.660 30.679 -6.341 611 HZ3 LYS 107 HZ3 LYS 107 20.725 30.870 -8.029 612 H ALA 108 HN ALA 108 21.833 28.779 -2.986 613 HA ALA 108 HA ALA 108 23.588 30.948 -2.430 614 HB1 ALA 108 HB1 ALA 108 21.190 31.165 -3.145 615 HB2 ALA 108 HB2 ALA 108 21.611 32.137 -1.735 616 HB3 ALA 108 HB3 ALA 108 20.718 30.630 -1.532 617 H GLN 109 HN GLN 109 21.762 28.713 -0.358 618 HA GLN 109 HA GLN 109 22.634 29.864 2.104 619 HB2 GLN 109 HB2 GLN 109 21.556 27.096 1.495 620 HB3 GLN 109 HB1 GLN 109 21.756 27.784 3.113 621 HG2 GLN 109 HG2 GLN 109 20.114 29.451 2.731 622 HG3 GLN 109 HG1 GLN 109 20.127 29.185 0.986 623 HE21 GLN 109 HE21 GLN 109 20.208 26.362 3.051 624 HE22 GLN 109 HE22 GLN 109 18.598 25.890 2.786 625 H ARG 110 HN ARG 110 24.253 28.069 -0.224 626 HA ARG 110 HA ARG 110 26.058 26.717 1.621 627 HB2 ARG 110 HB2 ARG 110 25.338 25.603 -0.476 628 HB3 ARG 110 HB1 ARG 110 26.128 26.879 -1.404 629 HG2 ARG 110 HG2 ARG 110 28.295 26.303 -0.345 630 HG3 ARG 110 HG1 ARG 110 27.496 25.011 0.561 631 HD2 ARG 110 HD2 ARG 110 27.737 25.229 -2.455 632 HD3 ARG 110 HD1 ARG 110 28.556 24.073 -1.417 633 HE ARG 110 HE ARG 110 25.930 23.620 -0.881 634 HH11 ARG 110 HH21 ARG 110 27.836 23.857 -3.760 635 HH12 ARG 110 HH22 ARG 110 26.858 22.747 -4.663 636 HH21 ARG 110 HH11 ARG 110 24.642 22.166 -2.059 637 HH22 ARG 110 HH12 ARG 110 25.051 21.791 -3.699 638 H HIS 111 HN HIS 111 26.028 29.449 -0.617 639 HA HIS 111 HA HIS 111 28.817 30.002 -0.425 640 HB2 HIS 111 HB2 HIS 111 27.409 30.767 -2.312 641 HB3 HIS 111 HB1 HIS 111 26.562 31.859 -1.211 642 HD2 HIS 111 HD2 HIS 111 27.784 34.329 -1.004 643 HE1 HIS 111 HE1 HIS 111 31.594 33.239 -2.457 644 HE2 HIS 111 HE2 HIS 111 30.167 35.177 -1.652 645 H VAL 112 HN VAL 112 25.950 31.323 1.194 646 HA VAL 112 HA VAL 112 27.018 33.423 2.578 647 HB VAL 112 HB VAL 112 25.307 32.963 4.316 648 HG11 VAL 112 HG11 VAL 112 23.342 32.793 2.638 649 HG12 VAL 112 HG12 VAL 112 24.588 32.714 1.391 650 HG13 VAL 112 HG13 VAL 112 24.473 34.132 2.433 651 HG21 VAL 112 HG21 VAL 112 23.819 30.941 3.842 652 HG22 VAL 112 HG22 VAL 112 25.410 30.578 4.511 653 HG23 VAL 112 HG23 VAL 112 25.109 30.365 2.791 654 H LEU 113 HN LEU 113 28.111 33.717 4.493 655 HA LEU 113 HA LEU 113 30.010 31.758 5.193 656 HB2 LEU 113 HB2 LEU 113 30.380 34.191 5.505 657 HB3 LEU 113 HB1 LEU 113 29.150 34.200 6.773 658 HG LEU 113 HG LEU 113 30.502 32.578 8.079 659 HD11 LEU 113 HD11 LEU 113 33.000 32.456 7.136 660 HD12 LEU 113 HD12 LEU 113 32.182 32.672 5.591 661 HD13 LEU 113 HD13 LEU 113 31.775 31.300 6.623 662 HD21 LEU 113 HD21 LEU 113 31.853 35.120 7.178 663 HD22 LEU 113 HD22 LEU 113 32.470 34.124 8.496 664 HD23 LEU 113 HD23 LEU 113 30.876 34.865 8.624 665 H ASP 114 HN ASP 114 26.786 32.378 6.246 666 HA ASP 114 HA ASP 114 27.103 30.395 8.453 667 HB2 ASP 114 HB2 ASP 114 26.568 32.677 9.234 668 HB3 ASP 114 HB1 ASP 114 25.084 32.628 8.281 669 HA PRO 115 HA PRO 115 24.525 28.454 5.139 670 HB2 PRO 115 HB2 PRO 115 25.348 26.083 6.781 671 HB3 PRO 115 HB1 PRO 115 25.361 26.295 5.016 672 HG2 PRO 115 HG2 PRO 115 27.617 26.371 6.442 673 HG3 PRO 115 HG1 PRO 115 27.374 27.432 5.037 674 HD2 PRO 115 HD2 PRO 115 27.246 28.102 7.954 675 HD3 PRO 115 HD1 PRO 115 27.819 29.085 6.587 676 H ARG 116 HN ARG 116 22.395 27.939 5.270 677 HA ARG 116 HA ARG 116 21.252 27.214 7.907 678 HB2 ARG 116 HB2 ARG 116 20.268 29.368 6.030 679 HB3 ARG 116 HB1 ARG 116 19.335 28.726 7.390 680 HG2 ARG 116 HG2 ARG 116 21.025 29.458 8.958 681 HG3 ARG 116 HG1 ARG 116 22.085 29.965 7.647 682 HD2 ARG 116 HD2 ARG 116 20.947 31.917 8.563 683 HD3 ARG 116 HD1 ARG 116 20.352 31.602 6.931 684 HE ARG 116 HE ARG 116 18.276 31.004 7.838 685 HH11 ARG 116 HH21 ARG 116 20.693 31.419 10.278 686 HH12 ARG 116 HH22 ARG 116 19.568 31.396 11.594 687 HH21 ARG 116 HH11 ARG 116 16.792 30.972 9.559 688 HH22 ARG 116 HH12 ARG 116 17.360 31.141 11.186 689 H CYS 117 HN CYS 117 20.397 25.271 7.664 690 HA CYS 117 HA CYS 117 19.781 23.979 5.287 691 HB2 CYS 117 HB2 CYS 117 18.078 23.408 7.696 692 HB3 CYS 117 HB1 CYS 117 18.914 22.285 6.616 693 H GLN 118 HN GLN 118 17.809 23.535 4.230 694 HA GLN 118 HA GLN 118 16.194 25.670 3.579 695 HB2 GLN 118 HB2 GLN 118 15.528 22.725 3.556 696 HB3 GLN 118 HB1 GLN 118 14.531 23.971 2.794 697 HG2 GLN 118 HG2 GLN 118 17.467 23.560 2.172 698 HG3 GLN 118 HG1 GLN 118 16.161 22.851 1.226 699 HE21 GLN 118 HE21 GLN 118 18.234 25.418 1.165 700 HE22 GLN 118 HE22 GLN 118 17.271 26.548 0.342 701 H ILE 119 HN ILE 119 16.252 24.033 6.524 702 HA ILE 119 HA ILE 119 13.460 24.555 7.192 703 HB ILE 119 HB ILE 119 15.767 23.313 8.704 704 HG12 ILE 119 HG12 ILE 119 14.300 21.306 8.565 705 HG13 ILE 119 HG11 ILE 119 13.131 22.246 7.633 706 HG21 ILE 119 HG21 ILE 119 13.887 22.744 10.379 707 HG22 ILE 119 HG22 ILE 119 12.984 24.056 9.616 708 HG23 ILE 119 HG23 ILE 119 14.522 24.390 10.410 709 HD11 ILE 119 HD11 ILE 119 15.983 22.148 6.681 710 HD12 ILE 119 HD12 ILE 119 14.493 22.336 5.755 711 HD13 ILE 119 HD13 ILE 119 14.936 20.757 6.396 712 H CYS 120 HN CYS 120 16.579 25.385 8.706 713 HA CYS 120 HA CYS 120 15.551 27.340 10.418 714 HB2 CYS 120 HB2 CYS 120 18.027 28.226 10.291 715 HB3 CYS 120 HB1 CYS 120 17.708 26.633 10.984 716 H VAL 121 HN VAL 121 16.740 27.589 7.117 717 HA VAL 121 HA VAL 121 16.671 30.449 7.019 718 HB VAL 121 HB VAL 121 18.042 29.019 5.499 719 HG11 VAL 121 HG11 VAL 121 16.072 27.391 5.160 720 HG12 VAL 121 HG12 VAL 121 17.086 27.770 3.774 721 HG13 VAL 121 HG13 VAL 121 15.511 28.540 3.947 722 HG21 VAL 121 HG21 VAL 121 16.049 30.809 4.090 723 HG22 VAL 121 HG22 VAL 121 17.666 30.397 3.522 724 HG23 VAL 121 HG23 VAL 121 17.465 31.386 4.968 725 H HIS 122 HN HIS 122 14.500 27.903 5.799 726 HA HIS 122 HA HIS 122 12.569 29.645 4.711 727 HB2 HIS 122 HB2 HIS 122 12.723 27.254 4.124 728 HB3 HIS 122 HB1 HIS 122 12.196 26.829 5.759 729 HD2 HIS 122 HD2 HIS 122 10.679 28.756 2.626 730 HE1 HIS 122 HE1 HIS 122 7.519 27.336 5.038 731 HE2 HIS 122 HE2 HIS 122 8.087 28.518 2.865 732 H SER 123 HN SER 123 13.523 29.677 7.753 733 HA SER 123 HA SER 123 10.810 29.990 8.909 734 HB2 SER 123 HB2 SER 123 12.432 28.300 9.927 735 HB3 SER 123 HB1 SER 123 13.383 29.686 10.453 736 HG SER 123 HG SER 123 12.022 29.798 12.043 737 H GLN 124 HN GLN 124 14.047 31.279 9.670 738 HA GLN 124 HA GLN 124 12.847 33.887 10.239 739 HB2 GLN 124 HB2 GLN 124 15.700 32.911 10.542 740 HB3 GLN 124 HB1 GLN 124 15.067 34.451 11.124 741 HG2 GLN 124 HG2 GLN 124 14.049 31.725 11.980 742 HG3 GLN 124 HG1 GLN 124 15.145 32.732 12.921 743 HE21 GLN 124 HE21 GLN 124 12.008 31.881 12.921 744 HE22 GLN 124 HE22 GLN 124 11.288 33.325 13.444 745 H ARG 125 HN ARG 125 14.074 32.348 7.566 746 HA ARG 125 HA ARG 125 14.853 33.067 5.518 747 HB2 ARG 125 HB2 ARG 125 13.442 35.565 6.466 748 HB3 ARG 125 HB1 ARG 125 14.063 35.339 4.826 749 HG2 ARG 125 HG2 ARG 125 12.651 33.318 4.581 750 HG3 ARG 125 HG1 ARG 125 12.007 33.583 6.202 751 HD2 ARG 125 HD2 ARG 125 11.798 35.560 3.914 752 HD3 ARG 125 HD1 ARG 125 10.506 34.478 4.429 753 HE ARG 125 HE ARG 125 11.386 36.889 5.781 754 HH11 ARG 125 HH21 ARG 125 9.768 33.841 6.004 755 HH12 ARG 125 HH22 ARG 125 8.822 34.288 7.384 756 HH21 ARG 125 HH11 ARG 125 10.150 37.485 7.587 757 HH22 ARG 125 HH12 ARG 125 9.038 36.352 8.281 758 H ASN 126 HN ASN 126 16.062 35.085 4.459 759 HA ASN 126 HA ASN 126 18.439 35.493 6.143 760 HB2 ASN 126 HB2 ASN 126 18.658 34.614 3.813 761 HB3 ASN 126 HB1 ASN 126 18.032 36.152 3.220 762 HD21 ASN 126 HD21 ASN 126 20.719 35.159 2.656 763 HD22 ASN 126 HD22 ASN 126 21.812 36.243 3.372
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