NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
609755 | 2n8f | 25848 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 1 H SER 1 1.807 0.001 0.856 2 HA SER 1 HA SER 1 1.563 -0.608 -1.958 3 HB2 SER 1 HB2 SER 1 2.634 1.391 -2.783 4 HB3 SER 1 HB3 SER 1 1.231 1.875 -1.831 5 HG SER 1 HG SER 1 2.545 2.533 -0.209 6 H ASN 2 H ASN 2 3.189 -1.898 -2.508 7 HA ASN 2 HA ASN 2 5.627 -1.847 -0.857 8 HB2 ASN 2 HB2 ASN 2 4.077 -4.074 -2.107 9 HB3 ASN 2 HB3 ASN 2 5.821 -4.260 -1.937 10 HD21 ASN 2 HD21 ASN 2 2.966 -4.899 -0.509 11 HD22 ASN 2 HD22 ASN 2 3.472 -5.016 1.139 12 H GLU 3 H GLU 3 7.641 -2.429 -1.956 13 HA GLU 3 HA GLU 3 7.773 -1.146 -4.566 14 HB2 GLU 3 HB2 GLU 3 9.839 -1.969 -2.541 15 HB3 GLU 3 HB3 GLU 3 10.295 -1.487 -4.169 16 HG2 GLU 3 HG2 GLU 3 9.716 0.699 -3.838 17 HG3 GLU 3 HG3 GLU 3 8.527 0.311 -2.595 18 H CYS 4 H CYS 4 9.425 -2.142 -6.133 19 HA CYS 4 HA CYS 4 8.880 -5.031 -6.327 20 HB2 CYS 4 HB2 CYS 4 9.050 -4.766 -8.768 21 HB3 CYS 4 HB3 CYS 4 7.780 -3.750 -8.095 22 H ILE 5 H ILE 5 10.552 -6.110 -7.870 23 HA ILE 5 HA ILE 5 13.075 -5.958 -6.601 24 HB ILE 5 HB ILE 5 12.337 -7.313 -9.198 25 HG12 ILE 5 HG12 ILE 5 12.673 -8.615 -6.503 26 HG13 ILE 5 HG13 ILE 5 11.122 -7.964 -7.021 27 HG21 ILE 5 HG21 ILE 5 14.659 -7.190 -9.236 28 HG22 ILE 5 HG22 ILE 5 14.796 -7.394 -7.490 29 HG23 ILE 5 HG23 ILE 5 14.349 -8.765 -8.506 30 HD11 ILE 5 HD11 ILE 5 10.700 -9.813 -8.148 31 HD12 ILE 5 HD12 ILE 5 12.176 -9.612 -9.092 32 HD13 ILE 5 HD13 ILE 5 12.218 -10.492 -7.564 33 H ARG 6 H ARG 6 14.976 -5.032 -7.200 34 HA ARG 6 HA ARG 6 14.850 -2.839 -9.044 35 HB2 ARG 6 HB2 ARG 6 17.158 -3.990 -7.466 36 HB3 ARG 6 HB3 ARG 6 17.238 -2.511 -8.414 37 HG2 ARG 6 HG2 ARG 6 16.783 -1.560 -6.427 38 HG3 ARG 6 HG3 ARG 6 15.119 -1.936 -6.881 39 HD2 ARG 6 HD2 ARG 6 15.002 -3.751 -5.450 40 HD3 ARG 6 HD3 ARG 6 16.753 -3.955 -5.404 41 HE ARG 6 HE ARG 6 16.254 -1.510 -4.242 42 HH11 ARG 6 HH11 ARG 6 15.349 -4.820 -3.654 43 HH12 ARG 6 HH12 ARG 6 15.207 -4.613 -1.940 44 HH21 ARG 6 HH21 ARG 6 16.071 -1.225 -1.987 45 HH22 ARG 6 HH22 ARG 6 15.617 -2.568 -0.992 46 H LYS 7 H LYS 7 15.910 -2.594 -10.992 47 HA LYS 7 HA LYS 7 16.106 -4.798 -12.676 48 HB2 LYS 7 HB2 LYS 7 15.894 -2.349 -13.317 49 HB3 LYS 7 HB3 LYS 7 17.630 -2.223 -13.065 50 HG2 LYS 7 HG2 LYS 7 18.129 -3.358 -14.956 51 HG3 LYS 7 HG3 LYS 7 16.703 -4.392 -14.845 52 HD2 LYS 7 HD2 LYS 7 16.244 -3.057 -16.693 53 HD3 LYS 7 HD3 LYS 7 15.382 -2.239 -15.387 54 HE2 LYS 7 HE2 LYS 7 16.929 -0.513 -15.278 55 HE3 LYS 7 HE3 LYS 7 18.194 -1.465 -16.055 56 HZ1 LYS 7 HZ1 LYS 7 15.788 -0.867 -17.606 57 HZ2 LYS 7 HZ2 LYS 7 17.392 -1.020 -18.119 58 HZ3 LYS 7 HZ3 LYS 7 16.884 0.395 -17.343 59 H TRP 8 H TRP 8 17.721 -6.149 -13.288 60 HA TRP 8 HA TRP 8 19.661 -7.328 -13.162 61 HB2 TRP 8 HB2 TRP 8 20.702 -4.523 -12.781 62 HB3 TRP 8 HB3 TRP 8 21.771 -5.920 -12.868 63 HD1 TRP 8 HD1 TRP 8 20.205 -3.390 -15.021 64 HE1 TRP 8 HE1 TRP 8 20.400 -4.048 -17.501 65 HE3 TRP 8 HE3 TRP 8 21.604 -8.275 -14.457 66 HZ2 TRP 8 HZ2 TRP 8 21.059 -6.335 -19.019 67 HZ3 TRP 8 HZ3 TRP 8 21.996 -9.630 -16.474 68 HH2 TRP 8 HH2 TRP 8 21.729 -8.678 -18.706 69 H LEU 9 H LEU 9 18.239 -7.656 -10.948 70 HA LEU 9 HA LEU 9 20.208 -7.462 -8.765 71 HB2 LEU 9 HB2 LEU 9 18.263 -6.047 -8.356 72 HB3 LEU 9 HB3 LEU 9 17.199 -7.434 -8.577 73 HG LEU 9 HG LEU 9 18.071 -8.459 -6.556 74 HD11 LEU 9 HD11 LEU 9 20.302 -7.848 -6.398 75 HD12 LEU 9 HD12 LEU 9 19.547 -6.923 -5.101 76 HD13 LEU 9 HD13 LEU 9 19.954 -6.134 -6.624 77 HD21 LEU 9 HD21 LEU 9 17.590 -5.783 -5.482 78 HD22 LEU 9 HD22 LEU 9 16.689 -7.281 -5.247 79 HD23 LEU 9 HD23 LEU 9 16.405 -6.296 -6.683 80 H SER 10 H SER 10 17.187 -9.270 -9.311 81 HA SER 10 HA SER 10 18.421 -11.787 -9.621 82 HB2 SER 10 HB2 SER 10 17.802 -12.791 -7.434 83 HB3 SER 10 HB3 SER 10 19.037 -11.541 -7.278 84 HG SER 10 HG SER 10 17.587 -11.043 -5.737 85 H CYS 11 H CYS 11 16.999 -12.921 -10.749 86 HA CYS 11 HA CYS 11 14.154 -12.258 -10.521 87 HB2 CYS 11 HB2 CYS 11 15.247 -12.179 -12.763 88 HB3 CYS 11 HB3 CYS 11 15.552 -13.909 -12.635 89 H VAL 12 H VAL 12 16.417 -14.692 -9.726 90 HA VAL 12 HA VAL 12 14.982 -17.042 -9.838 91 HB VAL 12 HB VAL 12 16.328 -17.825 -7.921 92 HG11 VAL 12 HG11 VAL 12 18.475 -17.641 -8.983 93 HG12 VAL 12 HG12 VAL 12 17.236 -17.755 -10.235 94 HG13 VAL 12 HG13 VAL 12 17.967 -16.195 -9.856 95 HG21 VAL 12 HG21 VAL 12 17.139 -14.928 -7.762 96 HG22 VAL 12 HG22 VAL 12 16.354 -15.896 -6.514 97 HG23 VAL 12 HG23 VAL 12 18.021 -16.239 -6.976 98 H ASP 13 H ASP 13 14.676 -14.388 -7.581 99 HA ASP 13 HA ASP 13 13.160 -15.687 -5.599 100 HB2 ASP 13 HB2 ASP 13 13.161 -12.778 -6.431 101 HB3 ASP 13 HB3 ASP 13 12.438 -13.403 -4.952 102 H ARG 14 H ARG 14 11.890 -13.288 -7.907 103 HA ARG 14 HA ARG 14 9.652 -15.029 -8.541 104 HB2 ARG 14 HB2 ARG 14 8.064 -13.064 -8.036 105 HB3 ARG 14 HB3 ARG 14 8.641 -14.030 -6.685 106 HG2 ARG 14 HG2 ARG 14 10.213 -11.627 -7.410 107 HG3 ARG 14 HG3 ARG 14 8.641 -11.381 -6.646 108 HD2 ARG 14 HD2 ARG 14 10.485 -13.381 -5.449 109 HD3 ARG 14 HD3 ARG 14 10.861 -11.673 -5.230 110 HE ARG 14 HE ARG 14 8.270 -11.796 -4.516 111 HH11 ARG 14 HH11 ARG 14 11.056 -13.672 -3.602 112 HH12 ARG 14 HH12 ARG 14 10.464 -14.020 -2.012 113 HH21 ARG 14 HH21 ARG 14 7.478 -12.246 -2.424 114 HH22 ARG 14 HH22 ARG 14 8.428 -13.209 -1.343 115 H LYS 15 H LYS 15 9.472 -14.950 -10.671 116 HA LYS 15 HA LYS 15 10.533 -12.723 -12.175 117 HB2 LYS 15 HB2 LYS 15 9.947 -14.078 -14.151 118 HB3 LYS 15 HB3 LYS 15 10.913 -14.981 -12.992 119 HG2 LYS 15 HG2 LYS 15 8.985 -16.173 -12.218 120 HG3 LYS 15 HG3 LYS 15 7.916 -15.168 -13.200 121 HD2 LYS 15 HD2 LYS 15 8.283 -17.329 -14.261 122 HD3 LYS 15 HD3 LYS 15 8.981 -16.032 -15.233 123 HE2 LYS 15 HE2 LYS 15 11.166 -16.603 -14.632 124 HE3 LYS 15 HE3 LYS 15 10.634 -17.546 -13.240 125 HZ1 LYS 15 HZ1 LYS 15 11.405 -18.823 -15.266 126 HZ2 LYS 15 HZ2 LYS 15 9.967 -18.335 -16.012 127 HZ3 LYS 15 HZ3 LYS 15 9.914 -19.281 -14.610 128 H ASN 16 H ASN 16 7.396 -14.010 -11.296 129 HA ASN 16 HA ASN 16 5.901 -12.384 -13.107 130 HB2 ASN 16 HB2 ASN 16 4.981 -13.767 -10.577 131 HB3 ASN 16 HB3 ASN 16 3.942 -13.140 -11.854 132 HD21 ASN 16 HD21 ASN 16 3.893 -14.197 -13.858 133 HD22 ASN 16 HD22 ASN 16 4.420 -15.834 -14.026 134 H ASP 17 H ASP 17 7.518 -11.756 -10.210 135 HA ASP 17 HA ASP 17 6.008 -9.249 -9.868 136 HB2 ASP 17 HB2 ASP 17 7.042 -11.176 -7.821 137 HB3 ASP 17 HB3 ASP 17 6.932 -9.465 -7.420 138 H CYS 18 H CYS 18 8.309 -9.713 -11.545 139 HA CYS 18 HA CYS 18 10.707 -8.875 -10.330 140 HB2 CYS 18 HB2 CYS 18 9.694 -9.194 -13.082 141 HB3 CYS 18 HB3 CYS 18 10.984 -8.010 -12.898 142 H CYS 19 H CYS 19 8.770 -6.950 -12.621 143 HA CYS 19 HA CYS 19 8.398 -4.721 -10.984 144 HB2 CYS 19 HB2 CYS 19 11.060 -4.929 -11.637 145 HB3 CYS 19 HB3 CYS 19 10.455 -3.839 -12.881 146 H GLU 20 H GLU 20 8.458 -2.616 -12.688 147 HA GLU 20 HA GLU 20 6.401 -3.356 -14.595 148 HB2 GLU 20 HB2 GLU 20 6.016 -1.394 -13.227 149 HB3 GLU 20 HB3 GLU 20 7.521 -0.671 -13.778 150 HG2 GLU 20 HG2 GLU 20 6.663 -0.384 -15.983 151 HG3 GLU 20 HG3 GLU 20 5.221 -1.323 -15.601 152 H GLY 21 H GLY 21 6.968 -4.024 -16.555 153 HA2 GLY 21 HA2 GLY 21 7.834 -3.792 -18.704 154 HA3 GLY 21 HA3 GLY 21 8.788 -2.427 -18.145 155 H LEU 22 H LEU 22 8.981 -5.278 -16.254 156 HA LEU 22 HA LEU 22 11.596 -5.898 -17.465 157 HB2 LEU 22 HB2 LEU 22 10.726 -6.057 -14.586 158 HB3 LEU 22 HB3 LEU 22 12.247 -6.704 -15.195 159 HG LEU 22 HG LEU 22 11.417 -3.808 -15.080 160 HD11 LEU 22 HD11 LEU 22 12.521 -3.719 -13.159 161 HD12 LEU 22 HD12 LEU 22 13.934 -4.494 -13.875 162 HD13 LEU 22 HD13 LEU 22 12.637 -5.479 -13.199 163 HD21 LEU 22 HD21 LEU 22 12.703 -3.599 -16.908 164 HD22 LEU 22 HD22 LEU 22 13.441 -5.187 -16.697 165 HD23 LEU 22 HD23 LEU 22 14.041 -3.806 -15.777 166 H GLU 23 H GLU 23 12.269 -8.105 -17.447 167 HA GLU 23 HA GLU 23 10.244 -10.111 -16.831 168 HB2 GLU 23 HB2 GLU 23 10.231 -11.098 -18.995 169 HB3 GLU 23 HB3 GLU 23 9.932 -9.380 -19.223 170 HG2 GLU 23 HG2 GLU 23 12.253 -9.046 -19.867 171 HG3 GLU 23 HG3 GLU 23 12.581 -10.758 -19.605 172 H CYS 24 H CYS 24 11.094 -12.305 -16.853 173 HA CYS 24 HA CYS 24 13.720 -12.416 -15.731 174 HB2 CYS 24 HB2 CYS 24 11.540 -13.912 -15.347 175 HB3 CYS 24 HB3 CYS 24 12.329 -14.912 -16.562 176 H TYR 25 H TYR 25 15.588 -13.244 -16.573 177 HA TYR 25 HA TYR 25 15.579 -13.719 -19.477 178 HB2 TYR 25 HB2 TYR 25 16.955 -11.810 -18.332 179 HB3 TYR 25 HB3 TYR 25 18.065 -13.110 -17.915 180 HD1 TYR 25 HD1 TYR 25 16.107 -12.228 -20.982 181 HD2 TYR 25 HD2 TYR 25 19.907 -13.129 -19.294 182 HE1 TYR 25 HE1 TYR 25 17.130 -12.060 -23.212 183 HE2 TYR 25 HE2 TYR 25 20.941 -12.963 -21.519 184 HH TYR 25 HH TYR 25 18.986 -12.370 -24.415 185 H LYS 26 H LYS 26 17.417 -15.177 -20.216 186 HA LYS 26 HA LYS 26 17.653 -17.475 -18.386 187 HB2 LYS 26 HB2 LYS 26 17.760 -18.851 -20.536 188 HB3 LYS 26 HB3 LYS 26 16.191 -18.199 -20.083 189 HG2 LYS 26 HG2 LYS 26 16.308 -16.513 -21.734 190 HG3 LYS 26 HG3 LYS 26 18.019 -16.828 -22.034 191 HD2 LYS 26 HD2 LYS 26 17.474 -19.020 -22.941 192 HD3 LYS 26 HD3 LYS 26 15.764 -18.758 -22.589 193 HE2 LYS 26 HE2 LYS 26 16.036 -18.289 -24.887 194 HE3 LYS 26 HE3 LYS 26 15.903 -16.724 -24.086 195 HZ1 LYS 26 HZ1 LYS 26 17.885 -17.490 -25.792 196 HZ2 LYS 26 HZ2 LYS 26 18.610 -17.628 -24.270 197 HZ3 LYS 26 HZ3 LYS 26 17.932 -16.156 -24.752 198 H ARG 27 H ARG 27 19.670 -17.901 -17.806 199 HA ARG 27 HA ARG 27 21.853 -17.077 -19.605 200 HB2 ARG 27 HB2 ARG 27 21.595 -17.068 -16.623 201 HB3 ARG 27 HB3 ARG 27 23.187 -17.246 -17.350 202 HG2 ARG 27 HG2 ARG 27 21.341 -14.995 -18.079 203 HG3 ARG 27 HG3 ARG 27 22.459 -14.902 -16.716 204 HD2 ARG 27 HD2 ARG 27 23.509 -15.749 -19.370 205 HD3 ARG 27 HD3 ARG 27 23.138 -14.044 -19.116 206 HE ARG 27 HE ARG 27 24.652 -14.765 -16.953 207 HH11 ARG 27 HH11 ARG 27 25.060 -14.846 -20.410 208 HH12 ARG 27 HH12 ARG 27 26.780 -14.646 -20.342 209 HH21 ARG 27 HH21 ARG 27 26.915 -14.501 -16.851 210 HH22 ARG 27 HH22 ARG 27 27.834 -14.450 -18.318 211 H ARG 28 H ARG 28 23.894 -18.396 -19.273 212 HA ARG 28 HA ARG 28 23.240 -21.163 -19.671 213 HB2 ARG 28 HB2 ARG 28 25.706 -19.496 -19.852 214 HB3 ARG 28 HB3 ARG 28 25.894 -21.236 -19.683 215 HG2 ARG 28 HG2 ARG 28 24.345 -21.469 -21.664 216 HG3 ARG 28 HG3 ARG 28 24.528 -19.728 -21.891 217 HD2 ARG 28 HD2 ARG 28 26.661 -21.848 -22.011 218 HD3 ARG 28 HD3 ARG 28 26.111 -20.792 -23.311 219 HE ARG 28 HE ARG 28 28.071 -20.190 -21.337 220 HH11 ARG 28 HH11 ARG 28 25.557 -18.783 -23.291 221 HH12 ARG 28 HH12 ARG 28 26.264 -17.201 -23.294 222 HH21 ARG 28 HH21 ARG 28 29.012 -18.112 -21.333 223 HH22 ARG 28 HH22 ARG 28 28.229 -16.821 -22.180 224 H HIS 29 H HIS 29 25.654 -19.672 -17.509 225 HA HIS 29 HA HIS 29 24.968 -21.717 -15.500 226 HB2 HIS 29 HB2 HIS 29 27.193 -22.102 -16.485 227 HB3 HIS 29 HB3 HIS 29 27.679 -20.475 -16.017 228 HD1 HIS 29 HD1 HIS 29 27.292 -23.913 -14.716 229 HD2 HIS 29 HD2 HIS 29 28.053 -20.116 -13.211 230 HE1 HIS 29 HE1 HIS 29 28.131 -24.274 -12.373 231 H SER 30 H SER 30 25.855 -18.382 -16.118 232 HA SER 30 HA SER 30 25.983 -17.545 -13.415 233 HB2 SER 30 HB2 SER 30 25.744 -16.161 -16.056 234 HB3 SER 30 HB3 SER 30 25.438 -15.239 -14.584 235 HG SER 30 HG SER 30 27.565 -16.262 -13.914 236 H PHE 31 H PHE 31 24.467 -16.563 -12.107 237 HA PHE 31 HA PHE 31 21.823 -17.460 -12.281 238 HB2 PHE 31 HB2 PHE 31 21.369 -16.029 -10.380 239 HB3 PHE 31 HB3 PHE 31 22.953 -16.770 -10.176 240 HD1 PHE 31 HD1 PHE 31 25.001 -15.419 -10.597 241 HD2 PHE 31 HD2 PHE 31 21.113 -13.689 -10.496 242 HE1 PHE 31 HE1 PHE 31 26.003 -13.193 -10.286 243 HE2 PHE 31 HE2 PHE 31 22.109 -11.461 -10.186 244 HZ PHE 31 HZ PHE 31 24.557 -11.210 -10.081 245 H GLU 32 H GLU 32 20.063 -16.716 -13.283 246 HA GLU 32 HA GLU 32 20.305 -14.389 -14.985 247 HB2 GLU 32 HB2 GLU 32 18.283 -15.095 -16.002 248 HB3 GLU 32 HB3 GLU 32 19.200 -16.559 -15.675 249 HG2 GLU 32 HG2 GLU 32 17.782 -16.490 -13.436 250 HG3 GLU 32 HG3 GLU 32 16.676 -15.590 -14.472 251 H VAL 33 H VAL 33 18.937 -12.575 -14.938 252 HA VAL 33 HA VAL 33 17.315 -12.197 -12.526 253 HB VAL 33 HB VAL 33 18.258 -10.041 -12.043 254 HG11 VAL 33 HG11 VAL 33 19.440 -12.298 -11.391 255 HG12 VAL 33 HG12 VAL 33 20.729 -11.662 -12.414 256 HG13 VAL 33 HG13 VAL 33 20.180 -10.743 -11.012 257 HG21 VAL 33 HG21 VAL 33 20.335 -9.312 -13.314 258 HG22 VAL 33 HG22 VAL 33 19.879 -10.501 -14.534 259 HG23 VAL 33 HG23 VAL 33 18.796 -9.159 -14.162 260 H CYS 34 H CYS 34 16.222 -9.906 -12.711 261 HA CYS 34 HA CYS 34 14.585 -9.992 -15.027 262 HB2 CYS 34 HB2 CYS 34 14.810 -7.702 -13.070 263 HB3 CYS 34 HB3 CYS 34 13.434 -8.109 -14.089 264 H VAL 35 H VAL 35 14.556 -8.746 -16.841 265 HA VAL 35 HA VAL 35 16.637 -6.689 -17.128 266 HB VAL 35 HB VAL 35 16.860 -7.500 -19.549 267 HG11 VAL 35 HG11 VAL 35 17.973 -9.583 -17.761 268 HG12 VAL 35 HG12 VAL 35 18.772 -8.587 -18.979 269 HG13 VAL 35 HG13 VAL 35 18.381 -7.906 -17.399 270 HG21 VAL 35 HG21 VAL 35 15.859 -10.083 -18.370 271 HG22 VAL 35 HG22 VAL 35 14.867 -9.023 -19.371 272 HG23 VAL 35 HG23 VAL 35 16.320 -9.764 -20.042 273 HA PRO 36 HA PRO 36 13.519 -4.168 -18.915 274 HB2 PRO 36 HB2 PRO 36 14.951 -2.739 -20.725 275 HB3 PRO 36 HB3 PRO 36 15.080 -2.483 -18.981 276 HG2 PRO 36 HG2 PRO 36 16.873 -4.037 -20.805 277 HG3 PRO 36 HG3 PRO 36 17.305 -2.928 -19.491 278 HD2 PRO 36 HD2 PRO 36 17.342 -5.619 -19.196 279 HD3 PRO 36 HD3 PRO 36 16.946 -4.518 -17.862 280 H ILE 37 H ILE 37 11.960 -4.751 -20.276 281 HA ILE 37 HA ILE 37 12.441 -6.492 -22.491 282 HB ILE 37 HB ILE 37 9.930 -5.006 -21.712 283 HG12 ILE 37 HG12 ILE 37 10.277 -7.943 -21.353 284 HG13 ILE 37 HG13 ILE 37 11.108 -6.880 -20.222 285 HG21 ILE 37 HG21 ILE 37 8.757 -6.575 -23.156 286 HG22 ILE 37 HG22 ILE 37 9.943 -5.649 -24.074 287 HG23 ILE 37 HG23 ILE 37 10.289 -7.316 -23.616 288 HD11 ILE 37 HD11 ILE 37 8.151 -6.992 -20.756 289 HD12 ILE 37 HD12 ILE 37 8.995 -7.522 -19.300 290 HD13 ILE 37 HD13 ILE 37 8.939 -5.808 -19.713 291 HA PRO 38 HA PRO 38 13.294 -3.391 -25.531 292 HB2 PRO 38 HB2 PRO 38 13.060 -4.986 -27.716 293 HB3 PRO 38 HB3 PRO 38 14.461 -5.031 -26.639 294 HG2 PRO 38 HG2 PRO 38 12.081 -6.846 -26.731 295 HG3 PRO 38 HG3 PRO 38 13.795 -7.257 -26.533 296 HD2 PRO 38 HD2 PRO 38 12.072 -7.150 -24.447 297 HD3 PRO 38 HD3 PRO 38 13.791 -6.735 -24.288 298 H GLY 39 H GLY 39 12.016 -1.913 -26.461 299 HA2 GLY 39 HA2 GLY 39 10.245 -0.998 -27.631 300 HA3 GLY 39 HA3 GLY 39 9.673 -2.628 -27.958 301 H PHE 40 H PHE 40 10.174 -2.383 -24.697 302 HA PHE 40 HA PHE 40 7.491 -2.637 -24.002 303 HB2 PHE 40 HB2 PHE 40 9.023 -3.400 -22.402 304 HB3 PHE 40 HB3 PHE 40 9.950 -1.904 -22.440 305 HD1 PHE 40 HD1 PHE 40 6.637 -3.271 -21.457 306 HD2 PHE 40 HD2 PHE 40 9.597 -0.277 -20.829 307 HE1 PHE 40 HE1 PHE 40 5.395 -2.460 -19.494 308 HE2 PHE 40 HE2 PHE 40 8.361 0.538 -18.864 309 HZ PHE 40 HZ PHE 40 6.257 -0.554 -18.194 310 H CYS 41 H CYS 41 5.964 -1.237 -23.148 311 HA CYS 41 HA CYS 41 6.541 1.579 -22.868 312 HB2 CYS 41 HB2 CYS 41 4.971 2.356 -24.539 313 HB3 CYS 41 HB3 CYS 41 6.166 1.319 -25.312 314 H LEU 42 H LEU 42 4.044 2.633 -22.832 315 HA LEU 42 HA LEU 42 2.576 0.972 -20.892 316 HB2 LEU 42 HB2 LEU 42 2.757 3.967 -20.746 317 HB3 LEU 42 HB3 LEU 42 2.147 2.852 -19.526 318 HG LEU 42 HG LEU 42 5.037 3.095 -20.358 319 HD11 LEU 42 HD11 LEU 42 4.783 3.848 -17.711 320 HD12 LEU 42 HD12 LEU 42 3.417 4.628 -18.507 321 HD13 LEU 42 HD13 LEU 42 5.057 4.919 -19.085 322 HD21 LEU 42 HD21 LEU 42 4.983 0.987 -19.514 323 HD22 LEU 42 HD22 LEU 42 3.539 1.290 -18.546 324 HD23 LEU 42 HD23 LEU 42 5.110 1.874 -17.995 325 H VAL 43 H VAL 43 0.304 2.026 -20.511 326 HA VAL 43 HA VAL 43 -0.826 2.648 -23.162 327 HB VAL 43 HB VAL 43 -2.942 1.630 -22.329 328 HG11 VAL 43 HG11 VAL 43 -1.770 0.224 -23.748 329 HG12 VAL 43 HG12 VAL 43 -0.429 0.031 -22.617 330 HG13 VAL 43 HG13 VAL 43 -1.968 -0.773 -22.308 331 HG21 VAL 43 HG21 VAL 43 -1.729 1.789 -19.858 332 HG22 VAL 43 HG22 VAL 43 -3.211 0.908 -20.231 333 HG23 VAL 43 HG23 VAL 43 -1.660 0.068 -20.236 334 H LYS 44 H LYS 44 -3.271 3.488 -22.649 335 HA LYS 44 HA LYS 44 -2.841 6.047 -21.378 336 HB2 LYS 44 HB2 LYS 44 -5.059 6.612 -22.229 337 HB3 LYS 44 HB3 LYS 44 -4.072 5.900 -23.498 338 HG2 LYS 44 HG2 LYS 44 -5.632 3.915 -22.066 339 HG3 LYS 44 HG3 LYS 44 -6.634 5.163 -22.810 340 HD2 LYS 44 HD2 LYS 44 -5.191 4.756 -24.910 341 HD3 LYS 44 HD3 LYS 44 -4.721 3.254 -24.110 342 HE2 LYS 44 HE2 LYS 44 -7.204 2.792 -23.850 343 HE3 LYS 44 HE3 LYS 44 -7.468 4.128 -24.970 344 HZ1 LYS 44 HZ1 LYS 44 -5.908 1.663 -25.529 345 HZ2 LYS 44 HZ2 LYS 44 -6.102 2.955 -26.602 346 HZ3 LYS 44 HZ3 LYS 44 -7.442 2.032 -26.140 347 H TRP 45 H TRP 45 -3.492 3.138 -20.135 348 HA TRP 45 HA TRP 45 -5.183 4.259 -17.999 349 HB2 TRP 45 HB2 TRP 45 -5.199 1.424 -19.056 350 HB3 TRP 45 HB3 TRP 45 -6.124 1.995 -17.670 351 HD1 TRP 45 HD1 TRP 45 -6.481 1.416 -21.266 352 HE1 TRP 45 HE1 TRP 45 -8.573 2.595 -22.191 353 HE3 TRP 45 HE3 TRP 45 -7.496 4.488 -17.308 354 HZ2 TRP 45 HZ2 TRP 45 -10.411 4.567 -21.353 355 HZ3 TRP 45 HZ3 TRP 45 -9.439 5.991 -17.450 356 HH2 TRP 45 HH2 TRP 45 -10.865 6.029 -19.432 357 H LYS 46 H LYS 46 -2.173 3.769 -18.504 358 HA LYS 46 HA LYS 46 -1.650 2.263 -16.026 359 HB2 LYS 46 HB2 LYS 46 -0.117 2.530 -18.584 360 HB3 LYS 46 HB3 LYS 46 0.749 2.200 -17.089 361 HG2 LYS 46 HG2 LYS 46 -1.567 0.473 -17.509 362 HG3 LYS 46 HG3 LYS 46 -0.322 0.320 -18.750 363 HD2 LYS 46 HD2 LYS 46 1.220 0.320 -16.546 364 HD3 LYS 46 HD3 LYS 46 -0.251 -0.396 -15.884 365 HE2 LYS 46 HE2 LYS 46 -0.216 -2.043 -17.744 366 HE3 LYS 46 HE3 LYS 46 1.329 -1.370 -18.262 367 HZ1 LYS 46 HZ1 LYS 46 0.717 -2.842 -15.771 368 HZ2 LYS 46 HZ2 LYS 46 2.111 -1.895 -15.925 369 HZ3 LYS 46 HZ3 LYS 46 1.866 -3.214 -16.956 370 H GLN 47 H GLN 47 -0.141 3.082 -14.544 371 HA GLN 47 HA GLN 47 -0.208 5.823 -14.082 372 HB2 GLN 47 HB2 GLN 47 1.223 3.514 -12.955 373 HB3 GLN 47 HB3 GLN 47 2.044 5.053 -12.738 374 HG2 GLN 47 HG2 GLN 47 0.415 5.894 -11.375 375 HG3 GLN 47 HG3 GLN 47 -0.847 4.881 -12.075 376 HE21 GLN 47 HE21 GLN 47 -1.123 4.823 -9.587 377 HE22 GLN 47 HE22 GLN 47 -0.397 3.465 -8.803 378 H CYS 48 H CYS 48 1.142 7.513 -14.511 379 HA CYS 48 HA CYS 48 3.203 7.018 -16.544 380 HB2 CYS 48 HB2 CYS 48 2.873 9.216 -17.317 381 HB3 CYS 48 HB3 CYS 48 1.253 8.636 -16.946 382 H ASP 49 H ASP 49 2.747 7.979 -13.291 383 HA ASP 49 HA ASP 49 4.858 9.669 -12.768 384 HB2 ASP 49 HB2 ASP 49 3.291 9.137 -11.030 385 HB3 ASP 49 HB3 ASP 49 3.724 7.431 -11.086 386 H GLY 50 H GLY 50 6.949 9.501 -13.206 387 HA2 GLY 50 HA2 GLY 50 9.087 8.553 -12.988 388 HA3 GLY 50 HA3 GLY 50 8.340 6.999 -12.646 389 H ARG 51 H ARG 51 6.573 7.137 -14.977 390 HA ARG 51 HA ARG 51 8.586 6.565 -17.048 391 HB2 ARG 51 HB2 ARG 51 5.866 5.364 -16.538 392 HB3 ARG 51 HB3 ARG 51 6.752 5.114 -18.036 393 HG2 ARG 51 HG2 ARG 51 7.242 3.231 -16.764 394 HG3 ARG 51 HG3 ARG 51 8.655 4.267 -16.551 395 HD2 ARG 51 HD2 ARG 51 7.950 4.937 -14.391 396 HD3 ARG 51 HD3 ARG 51 6.344 4.249 -14.627 397 HE ARG 51 HE ARG 51 7.168 2.199 -14.023 398 HH11 ARG 51 HH11 ARG 51 9.820 4.346 -14.712 399 HH12 ARG 51 HH12 ARG 51 11.029 3.250 -14.129 400 HH21 ARG 51 HH21 ARG 51 8.750 0.748 -13.252 401 HH22 ARG 51 HH22 ARG 51 10.420 1.204 -13.300 402 H GLU 52 H GLU 52 7.664 9.194 -16.633 403 HA GLU 52 HA GLU 52 5.509 9.936 -18.272 404 HB2 GLU 52 HB2 GLU 52 6.356 12.182 -18.123 405 HB3 GLU 52 HB3 GLU 52 6.585 11.398 -16.567 406 HG2 GLU 52 HG2 GLU 52 8.957 10.869 -17.472 407 HG3 GLU 52 HG3 GLU 52 8.615 12.171 -18.611 408 H ARG 53 H ARG 53 8.630 8.821 -19.061 409 HA ARG 53 HA ARG 53 8.216 9.620 -21.866 410 HB2 ARG 53 HB2 ARG 53 10.902 9.307 -20.519 411 HB3 ARG 53 HB3 ARG 53 10.599 9.866 -22.159 412 HG2 ARG 53 HG2 ARG 53 9.232 11.739 -20.971 413 HG3 ARG 53 HG3 ARG 53 10.206 11.289 -19.570 414 HD2 ARG 53 HD2 ARG 53 11.266 12.120 -22.269 415 HD3 ARG 53 HD3 ARG 53 11.224 13.128 -20.823 416 HE ARG 53 HE ARG 53 12.615 10.844 -20.133 417 HH11 ARG 53 HH11 ARG 53 12.948 13.440 -22.429 418 HH12 ARG 53 HH12 ARG 53 14.679 13.373 -22.451 419 HH21 ARG 53 HH21 ARG 53 14.893 10.746 -20.153 420 HH22 ARG 53 HH22 ARG 53 15.785 11.839 -21.157 421 H ASP 54 H ASP 54 7.522 7.164 -20.319 422 HA ASP 54 HA ASP 54 9.116 5.216 -21.852 423 HB2 ASP 54 HB2 ASP 54 8.719 5.296 -19.124 424 HB3 ASP 54 HB3 ASP 54 7.510 4.131 -19.658 425 H CYS 55 H CYS 55 5.973 6.477 -21.214 426 HA CYS 55 HA CYS 55 4.284 4.428 -21.949 427 HB2 CYS 55 HB2 CYS 55 3.972 7.342 -22.702 428 HB3 CYS 55 HB3 CYS 55 2.682 6.148 -22.604 429 H CYS 56 H CYS 56 3.008 4.294 -24.031 430 HA CYS 56 HA CYS 56 4.769 3.665 -26.155 431 HB2 CYS 56 HB2 CYS 56 1.854 3.562 -25.678 432 HB3 CYS 56 HB3 CYS 56 2.342 3.689 -27.365 433 H ALA 57 H ALA 57 3.966 4.469 -28.483 434 HA ALA 57 HA ALA 57 4.741 7.213 -28.615 435 HB1 ALA 57 HB1 ALA 57 4.177 5.051 -30.537 436 HB2 ALA 57 HB2 ALA 57 3.916 6.694 -31.125 437 HB3 ALA 57 HB3 ALA 57 5.495 6.223 -30.496 438 H GLY 58 H GLY 58 3.500 8.970 -28.556 439 HA2 GLY 58 HA2 GLY 58 1.606 10.239 -29.282 440 HA3 GLY 58 HA3 GLY 58 0.681 8.747 -29.359 441 H LEU 59 H LEU 59 1.959 8.048 -26.657 442 HA LEU 59 HA LEU 59 -0.178 9.165 -25.076 443 HB2 LEU 59 HB2 LEU 59 2.005 7.177 -24.566 444 HB3 LEU 59 HB3 LEU 59 1.031 7.812 -23.242 445 HG LEU 59 HG LEU 59 -0.004 6.261 -25.615 446 HD11 LEU 59 HD11 LEU 59 0.559 5.521 -22.761 447 HD12 LEU 59 HD12 LEU 59 1.118 4.732 -24.235 448 HD13 LEU 59 HD13 LEU 59 -0.577 4.615 -23.762 449 HD21 LEU 59 HD21 LEU 59 -2.067 6.206 -24.050 450 HD22 LEU 59 HD22 LEU 59 -1.774 7.638 -25.038 451 HD23 LEU 59 HD23 LEU 59 -1.346 7.644 -23.326 452 H GLU 60 H GLU 60 0.450 9.868 -22.752 453 HA GLU 60 HA GLU 60 2.937 11.257 -22.451 454 HB2 GLU 60 HB2 GLU 60 2.106 13.512 -22.410 455 HB3 GLU 60 HB3 GLU 60 1.674 12.792 -23.954 456 HG2 GLU 60 HG2 GLU 60 -0.549 12.223 -22.599 457 HG3 GLU 60 HG3 GLU 60 -0.046 13.664 -21.718 458 H CYS 61 H CYS 61 3.156 12.258 -20.354 459 HA CYS 61 HA CYS 61 1.901 10.767 -18.300 460 HB2 CYS 61 HB2 CYS 61 4.226 11.942 -18.341 461 HB3 CYS 61 HB3 CYS 61 3.333 13.357 -17.792 462 H TRP 62 H TRP 62 -0.306 11.055 -18.322 463 HA TRP 62 HA TRP 62 -1.501 13.663 -18.326 464 HB2 TRP 62 HB2 TRP 62 -2.503 11.421 -19.169 465 HB3 TRP 62 HB3 TRP 62 -2.925 11.156 -17.480 466 HD1 TRP 62 HD1 TRP 62 -3.203 14.755 -18.200 467 HE1 TRP 62 HE1 TRP 62 -5.658 15.419 -18.595 468 HE3 TRP 62 HE3 TRP 62 -5.230 10.091 -18.731 469 HZ2 TRP 62 HZ2 TRP 62 -8.128 14.135 -19.068 470 HZ3 TRP 62 HZ3 TRP 62 -7.647 9.897 -19.152 471 HH2 TRP 62 HH2 TRP 62 -9.064 11.878 -19.316 472 H LYS 63 H LYS 63 -2.045 14.912 -16.645 473 HA LYS 63 HA LYS 63 -1.433 13.919 -13.957 474 HB2 LYS 63 HB2 LYS 63 -0.589 16.176 -15.095 475 HB3 LYS 63 HB3 LYS 63 -2.115 16.775 -14.458 476 HG2 LYS 63 HG2 LYS 63 -0.380 15.241 -12.612 477 HG3 LYS 63 HG3 LYS 63 0.144 16.862 -13.072 478 HD2 LYS 63 HD2 LYS 63 -2.629 16.285 -12.057 479 HD3 LYS 63 HD3 LYS 63 -1.286 16.675 -10.979 480 HE2 LYS 63 HE2 LYS 63 -0.960 18.746 -12.453 481 HE3 LYS 63 HE3 LYS 63 -2.565 18.389 -13.088 482 HZ1 LYS 63 HZ1 LYS 63 -2.771 19.944 -11.308 483 HZ2 LYS 63 HZ2 LYS 63 -1.858 18.974 -10.266 484 HZ3 LYS 63 HZ3 LYS 63 -3.389 18.463 -10.772 485 H ARG 64 H ARG 64 -3.219 12.859 -13.245 486 HA ARG 64 HA ARG 64 -5.737 14.391 -13.192 487 HB2 ARG 64 HB2 ARG 64 -5.173 11.629 -13.975 488 HB3 ARG 64 HB3 ARG 64 -6.470 11.762 -12.795 489 HG2 ARG 64 HG2 ARG 64 -7.834 12.947 -14.224 490 HG3 ARG 64 HG3 ARG 64 -6.483 13.516 -15.207 491 HD2 ARG 64 HD2 ARG 64 -7.019 11.896 -16.643 492 HD3 ARG 64 HD3 ARG 64 -6.355 10.771 -15.459 493 HE ARG 64 HE ARG 64 -8.476 10.043 -15.033 494 HH11 ARG 64 HH11 ARG 64 -8.650 13.138 -16.616 495 HH12 ARG 64 HH12 ARG 64 -10.374 13.102 -16.784 496 HH21 ARG 64 HH21 ARG 64 -10.746 9.983 -15.247 497 HH22 ARG 64 HH22 ARG 64 -11.565 11.307 -16.004 498 H SER 65 H SER 65 -6.454 14.925 -11.242 499 HA SER 65 HA SER 65 -5.664 13.279 -8.936 500 HB2 SER 65 HB2 SER 65 -5.347 15.343 -7.605 501 HB3 SER 65 HB3 SER 65 -4.212 15.243 -8.952 502 HG SER 65 HG SER 65 -5.476 17.303 -8.522 503 H GLY 66 H GLY 66 -7.216 12.958 -7.407 504 HA2 GLY 66 HA2 GLY 66 -9.213 13.748 -6.246 505 HA3 GLY 66 HA3 GLY 66 -9.776 14.380 -7.787 506 H ASN 67 H ASN 67 -8.849 11.919 -9.188 507 HA ASN 67 HA ASN 67 -11.059 10.164 -8.341 508 HB2 ASN 67 HB2 ASN 67 -9.959 10.828 -11.062 509 HB3 ASN 67 HB3 ASN 67 -10.891 9.358 -10.793 510 HD21 ASN 67 HD21 ASN 67 -11.099 12.454 -11.789 511 HD22 ASN 67 HD22 ASN 67 -12.768 12.762 -11.466 512 H LYS 68 H LYS 68 -7.853 10.114 -9.887 513 HA LYS 68 HA LYS 68 -7.155 7.750 -8.353 514 HB2 LYS 68 HB2 LYS 68 -7.238 7.766 -11.372 515 HB3 LYS 68 HB3 LYS 68 -6.352 6.571 -10.434 516 HG2 LYS 68 HG2 LYS 68 -9.312 7.055 -10.183 517 HG3 LYS 68 HG3 LYS 68 -8.587 5.817 -11.212 518 HD2 LYS 68 HD2 LYS 68 -7.652 5.821 -8.425 519 HD3 LYS 68 HD3 LYS 68 -9.359 5.425 -8.637 520 HE2 LYS 68 HE2 LYS 68 -8.380 3.348 -8.813 521 HE3 LYS 68 HE3 LYS 68 -8.468 3.838 -10.504 522 HZ1 LYS 68 HZ1 LYS 68 -6.256 2.925 -9.387 523 HZ2 LYS 68 HZ2 LYS 68 -6.048 4.571 -9.060 524 HZ3 LYS 68 HZ3 LYS 68 -6.239 4.044 -10.656 525 H SER 69 H SER 69 -4.809 7.038 -9.340 526 HA SER 69 HA SER 69 -3.122 9.255 -8.707 527 HB2 SER 69 HB2 SER 69 -2.691 6.376 -9.394 528 HB3 SER 69 HB3 SER 69 -1.320 7.483 -9.476 529 HG SER 69 HG SER 69 -2.827 6.664 -7.262 530 H SER 70 H SER 70 -1.031 9.422 -10.200 531 HA SER 70 HA SER 70 -1.899 10.697 -12.575 532 HB2 SER 70 HB2 SER 70 0.348 11.313 -12.898 533 HB3 SER 70 HB3 SER 70 0.197 11.185 -11.146 534 HG SER 70 HG SER 70 1.175 9.164 -11.244 535 H VAL 71 H VAL 71 -2.458 9.772 -14.420 536 HA VAL 71 HA VAL 71 -1.187 7.216 -15.161 537 HB VAL 71 HB VAL 71 -3.270 6.773 -16.497 538 HG11 VAL 71 HG11 VAL 71 -4.031 7.054 -13.624 539 HG12 VAL 71 HG12 VAL 71 -4.314 5.713 -14.736 540 HG13 VAL 71 HG13 VAL 71 -2.702 5.987 -14.075 541 HG21 VAL 71 HG21 VAL 71 -3.857 9.427 -15.731 542 HG22 VAL 71 HG22 VAL 71 -4.839 8.331 -16.704 543 HG23 VAL 71 HG23 VAL 71 -5.048 8.383 -14.953 544 H CYS 72 H CYS 72 -1.612 6.852 -17.666 545 HA CYS 72 HA CYS 72 -0.532 9.240 -18.996 546 HB2 CYS 72 HB2 CYS 72 0.090 6.411 -19.125 547 HB3 CYS 72 HB3 CYS 72 -0.256 7.060 -20.725 548 H ALA 73 H ALA 73 -1.249 9.769 -21.130 549 HA ALA 73 HA ALA 73 -3.734 8.551 -22.046 550 HB1 ALA 73 HB1 ALA 73 -5.110 10.253 -21.602 551 HB2 ALA 73 HB2 ALA 73 -3.868 10.797 -20.473 552 HB3 ALA 73 HB3 ALA 73 -3.924 11.458 -22.106 553 HA PRO 74 HA PRO 74 -2.108 9.325 -26.049 554 HB2 PRO 74 HB2 PRO 74 -4.370 9.736 -27.492 555 HB3 PRO 74 HB3 PRO 74 -3.895 8.147 -26.882 556 HG2 PRO 74 HG2 PRO 74 -5.872 10.094 -25.758 557 HG3 PRO 74 HG3 PRO 74 -6.007 8.333 -25.926 558 HD2 PRO 74 HD2 PRO 74 -5.373 9.529 -23.580 559 HD3 PRO 74 HD3 PRO 74 -4.749 7.930 -24.036 560 H ILE 75 H ILE 75 -2.139 10.906 -27.889 561 HA ILE 75 HA ILE 75 -1.623 13.494 -27.013 562 HB ILE 75 HB ILE 75 -1.838 14.133 -29.458 563 HG12 ILE 75 HG12 ILE 75 -2.080 11.175 -29.947 564 HG13 ILE 75 HG13 ILE 75 -3.511 12.195 -29.837 565 HG21 ILE 75 HG21 ILE 75 -0.087 11.731 -29.200 566 HG22 ILE 75 HG22 ILE 75 0.256 13.299 -29.929 567 HG23 ILE 75 HG23 ILE 75 0.204 13.135 -28.174 568 HD11 ILE 75 HD11 ILE 75 -1.721 13.459 -31.610 569 HD12 ILE 75 HD12 ILE 75 -1.797 11.754 -32.056 570 HD13 ILE 75 HD13 ILE 75 -3.276 12.710 -31.968 571 H THR 76 H THR 76 -2.730 15.473 -27.324 572 HA THR 76 HA THR 76 -5.630 15.248 -27.765 573 HB THR 76 HB THR 76 -6.099 16.761 -25.932 574 HG1 THR 76 HG1 THR 76 -3.311 16.659 -25.339 575 HG21 THR 76 HG21 THR 76 -4.466 15.060 -24.295 576 HG22 THR 76 HG22 THR 76 -5.136 14.133 -25.637 577 HG23 THR 76 HG23 THR 76 -6.209 15.016 -24.552 Start of MODEL 2 1 H1 SER 1 H SER 1 1.926 -0.920 1.415 2 HA SER 1 HA SER 1 2.798 -0.341 -1.330 3 HB2 SER 1 HB2 SER 1 4.312 1.307 -0.329 4 HB3 SER 1 HB3 SER 1 2.655 1.588 0.205 5 HG SER 1 HG SER 1 4.845 1.040 1.674 6 H ASN 2 H ASN 2 4.600 -1.221 -2.172 7 HA ASN 2 HA ASN 2 6.632 -2.418 -0.520 8 HB2 ASN 2 HB2 ASN 2 5.002 -4.233 -0.540 9 HB3 ASN 2 HB3 ASN 2 4.919 -4.167 -2.297 10 HD21 ASN 2 HD21 ASN 2 6.000 -5.717 -3.250 11 HD22 ASN 2 HD22 ASN 2 7.452 -6.455 -2.676 12 H GLU 3 H GLU 3 8.568 -2.609 -1.573 13 HA GLU 3 HA GLU 3 8.784 -1.275 -4.112 14 HB2 GLU 3 HB2 GLU 3 10.670 -2.283 -2.048 15 HB3 GLU 3 HB3 GLU 3 11.287 -2.127 -3.687 16 HG2 GLU 3 HG2 GLU 3 9.815 0.159 -2.481 17 HG3 GLU 3 HG3 GLU 3 11.474 -0.157 -1.976 18 H CYS 4 H CYS 4 10.297 -2.263 -5.802 19 HA CYS 4 HA CYS 4 9.467 -5.051 -6.262 20 HB2 CYS 4 HB2 CYS 4 9.580 -4.609 -8.630 21 HB3 CYS 4 HB3 CYS 4 8.598 -3.358 -7.877 22 H ILE 5 H ILE 5 11.035 -6.159 -7.892 23 HA ILE 5 HA ILE 5 13.599 -6.254 -6.608 24 HB ILE 5 HB ILE 5 12.611 -7.702 -9.068 25 HG12 ILE 5 HG12 ILE 5 12.991 -8.920 -6.353 26 HG13 ILE 5 HG13 ILE 5 11.506 -8.053 -6.728 27 HG21 ILE 5 HG21 ILE 5 15.139 -7.894 -7.477 28 HG22 ILE 5 HG22 ILE 5 14.514 -9.291 -8.350 29 HG23 ILE 5 HG23 ILE 5 14.926 -7.817 -9.225 30 HD11 ILE 5 HD11 ILE 5 10.716 -9.722 -7.976 31 HD12 ILE 5 HD12 ILE 5 12.275 -10.013 -8.749 32 HD13 ILE 5 HD13 ILE 5 11.936 -10.701 -7.161 33 H ARG 6 H ARG 6 15.499 -5.426 -7.266 34 HA ARG 6 HA ARG 6 15.545 -3.359 -9.194 35 HB2 ARG 6 HB2 ARG 6 17.791 -4.832 -7.808 36 HB3 ARG 6 HB3 ARG 6 18.023 -3.413 -8.821 37 HG2 ARG 6 HG2 ARG 6 17.962 -2.428 -6.772 38 HG3 ARG 6 HG3 ARG 6 16.246 -2.369 -7.183 39 HD2 ARG 6 HD2 ARG 6 15.709 -4.103 -5.743 40 HD3 ARG 6 HD3 ARG 6 17.359 -4.727 -5.720 41 HE ARG 6 HE ARG 6 17.315 -2.153 -4.583 42 HH11 ARG 6 HH11 ARG 6 16.289 -5.415 -3.922 43 HH12 ARG 6 HH12 ARG 6 16.384 -5.234 -2.201 44 HH21 ARG 6 HH21 ARG 6 17.443 -1.905 -2.319 45 HH22 ARG 6 HH22 ARG 6 17.039 -3.237 -1.291 46 H LYS 7 H LYS 7 16.507 -3.255 -11.223 47 HA LYS 7 HA LYS 7 16.262 -5.562 -12.838 48 HB2 LYS 7 HB2 LYS 7 16.038 -3.112 -13.536 49 HB3 LYS 7 HB3 LYS 7 17.794 -3.078 -13.591 50 HG2 LYS 7 HG2 LYS 7 17.782 -4.851 -15.267 51 HG3 LYS 7 HG3 LYS 7 16.018 -4.899 -15.205 52 HD2 LYS 7 HD2 LYS 7 16.595 -3.588 -17.097 53 HD3 LYS 7 HD3 LYS 7 16.047 -2.461 -15.854 54 HE2 LYS 7 HE2 LYS 7 18.665 -2.497 -15.291 55 HE3 LYS 7 HE3 LYS 7 18.740 -2.857 -17.014 56 HZ1 LYS 7 HZ1 LYS 7 18.153 -0.389 -15.703 57 HZ2 LYS 7 HZ2 LYS 7 16.959 -0.797 -16.829 58 HZ3 LYS 7 HZ3 LYS 7 18.575 -0.676 -17.316 59 H TRP 8 H TRP 8 17.771 -6.920 -13.721 60 HA TRP 8 HA TRP 8 19.685 -8.142 -13.842 61 HB2 TRP 8 HB2 TRP 8 20.809 -5.358 -13.572 62 HB3 TRP 8 HB3 TRP 8 21.848 -6.767 -13.763 63 HD1 TRP 8 HD1 TRP 8 19.821 -4.326 -15.728 64 HE1 TRP 8 HE1 TRP 8 19.854 -4.961 -18.222 65 HE3 TRP 8 HE3 TRP 8 21.867 -8.996 -15.350 66 HZ2 TRP 8 HZ2 TRP 8 20.642 -7.150 -19.818 67 HZ3 TRP 8 HZ3 TRP 8 22.228 -10.295 -17.408 68 HH2 TRP 8 HH2 TRP 8 21.627 -9.390 -19.595 69 H LEU 9 H LEU 9 18.531 -8.477 -11.480 70 HA LEU 9 HA LEU 9 20.787 -8.472 -9.588 71 HB2 LEU 9 HB2 LEU 9 18.699 -6.887 -9.202 72 HB3 LEU 9 HB3 LEU 9 18.002 -8.370 -8.555 73 HG LEU 9 HG LEU 9 20.438 -6.905 -7.554 74 HD11 LEU 9 HD11 LEU 9 19.020 -5.913 -6.172 75 HD12 LEU 9 HD12 LEU 9 18.504 -7.485 -5.563 76 HD13 LEU 9 HD13 LEU 9 17.672 -6.754 -6.936 77 HD21 LEU 9 HD21 LEU 9 19.411 -9.655 -6.980 78 HD22 LEU 9 HD22 LEU 9 20.240 -8.732 -5.727 79 HD23 LEU 9 HD23 LEU 9 21.068 -9.110 -7.238 80 H SER 10 H SER 10 17.509 -9.863 -9.843 81 HA SER 10 HA SER 10 18.268 -12.502 -10.258 82 HB2 SER 10 HB2 SER 10 17.774 -13.365 -7.881 83 HB3 SER 10 HB3 SER 10 19.355 -12.639 -8.171 84 HG SER 10 HG SER 10 18.635 -11.679 -6.350 85 H CYS 11 H CYS 11 16.489 -13.196 -11.222 86 HA CYS 11 HA CYS 11 13.877 -12.294 -10.233 87 HB2 CYS 11 HB2 CYS 11 12.999 -12.769 -12.389 88 HB3 CYS 11 HB3 CYS 11 14.540 -11.962 -12.660 89 H VAL 12 H VAL 12 15.928 -14.921 -10.059 90 HA VAL 12 HA VAL 12 14.412 -17.183 -10.364 91 HB VAL 12 HB VAL 12 16.368 -16.657 -8.121 92 HG11 VAL 12 HG11 VAL 12 15.338 -19.241 -9.287 93 HG12 VAL 12 HG12 VAL 12 16.659 -19.109 -8.125 94 HG13 VAL 12 HG13 VAL 12 15.028 -18.619 -7.666 95 HG21 VAL 12 HG21 VAL 12 17.889 -17.961 -9.737 96 HG22 VAL 12 HG22 VAL 12 16.711 -17.520 -10.972 97 HG23 VAL 12 HG23 VAL 12 17.567 -16.262 -10.081 98 H ASP 13 H ASP 13 14.339 -14.873 -7.715 99 HA ASP 13 HA ASP 13 12.646 -16.424 -6.025 100 HB2 ASP 13 HB2 ASP 13 14.053 -14.676 -5.087 101 HB3 ASP 13 HB3 ASP 13 13.229 -13.456 -6.054 102 H ARG 14 H ARG 14 12.012 -13.517 -7.995 103 HA ARG 14 HA ARG 14 9.281 -14.492 -8.426 104 HB2 ARG 14 HB2 ARG 14 9.843 -11.600 -7.792 105 HB3 ARG 14 HB3 ARG 14 8.283 -12.404 -7.890 106 HG2 ARG 14 HG2 ARG 14 8.938 -13.755 -5.897 107 HG3 ARG 14 HG3 ARG 14 10.380 -12.747 -5.762 108 HD2 ARG 14 HD2 ARG 14 8.931 -11.681 -4.321 109 HD3 ARG 14 HD3 ARG 14 8.675 -10.780 -5.815 110 HE ARG 14 HE ARG 14 6.852 -12.930 -5.656 111 HH11 ARG 14 HH11 ARG 14 7.511 -9.805 -4.267 112 HH12 ARG 14 HH12 ARG 14 5.854 -9.483 -3.879 113 HH21 ARG 14 HH21 ARG 14 4.666 -12.517 -5.150 114 HH22 ARG 14 HH22 ARG 14 4.236 -11.026 -4.381 115 H LYS 15 H LYS 15 9.380 -14.883 -10.558 116 HA LYS 15 HA LYS 15 10.805 -13.123 -12.353 117 HB2 LYS 15 HB2 LYS 15 9.991 -14.704 -14.110 118 HB3 LYS 15 HB3 LYS 15 10.913 -15.474 -12.825 119 HG2 LYS 15 HG2 LYS 15 8.983 -16.415 -11.863 120 HG3 LYS 15 HG3 LYS 15 7.913 -15.386 -12.817 121 HD2 LYS 15 HD2 LYS 15 8.696 -16.530 -14.863 122 HD3 LYS 15 HD3 LYS 15 9.683 -17.597 -13.862 123 HE2 LYS 15 HE2 LYS 15 7.555 -18.638 -14.512 124 HE3 LYS 15 HE3 LYS 15 7.696 -18.449 -12.764 125 HZ1 LYS 15 HZ1 LYS 15 6.446 -16.206 -14.048 126 HZ2 LYS 15 HZ2 LYS 15 5.938 -17.104 -12.707 127 HZ3 LYS 15 HZ3 LYS 15 5.590 -17.648 -14.271 128 H ASN 16 H ASN 16 7.542 -13.626 -11.291 129 HA ASN 16 HA ASN 16 6.459 -11.966 -13.435 130 HB2 ASN 16 HB2 ASN 16 5.406 -14.149 -12.316 131 HB3 ASN 16 HB3 ASN 16 4.740 -12.949 -11.213 132 HD21 ASN 16 HD21 ASN 16 3.688 -14.727 -13.477 133 HD22 ASN 16 HD22 ASN 16 2.711 -13.647 -14.409 134 H ASP 17 H ASP 17 7.845 -11.521 -10.459 135 HA ASP 17 HA ASP 17 6.399 -8.984 -10.066 136 HB2 ASP 17 HB2 ASP 17 7.739 -10.461 -7.814 137 HB3 ASP 17 HB3 ASP 17 6.511 -9.202 -7.728 138 H CYS 18 H CYS 18 8.741 -9.451 -11.687 139 HA CYS 18 HA CYS 18 11.115 -8.716 -10.353 140 HB2 CYS 18 HB2 CYS 18 10.210 -8.973 -13.142 141 HB3 CYS 18 HB3 CYS 18 11.491 -7.789 -12.899 142 H CYS 19 H CYS 19 9.323 -6.688 -12.672 143 HA CYS 19 HA CYS 19 8.963 -4.486 -10.983 144 HB2 CYS 19 HB2 CYS 19 11.629 -4.749 -11.604 145 HB3 CYS 19 HB3 CYS 19 11.069 -3.618 -12.833 146 H GLU 20 H GLU 20 9.125 -2.351 -12.660 147 HA GLU 20 HA GLU 20 7.017 -2.943 -14.540 148 HB2 GLU 20 HB2 GLU 20 7.009 -0.893 -13.132 149 HB3 GLU 20 HB3 GLU 20 8.425 -0.321 -14.003 150 HG2 GLU 20 HG2 GLU 20 7.229 -0.000 -15.979 151 HG3 GLU 20 HG3 GLU 20 5.890 -1.010 -15.439 152 H GLY 21 H GLY 21 7.471 -3.727 -16.487 153 HA2 GLY 21 HA2 GLY 21 8.334 -3.758 -18.633 154 HA3 GLY 21 HA3 GLY 21 9.300 -2.348 -18.225 155 H LEU 22 H LEU 22 9.362 -5.321 -16.375 156 HA LEU 22 HA LEU 22 12.033 -5.903 -17.468 157 HB2 LEU 22 HB2 LEU 22 11.147 -5.932 -14.590 158 HB3 LEU 22 HB3 LEU 22 12.646 -6.666 -15.157 159 HG LEU 22 HG LEU 22 11.928 -3.739 -15.164 160 HD11 LEU 22 HD11 LEU 22 13.112 -5.387 -13.233 161 HD12 LEU 22 HD12 LEU 22 13.037 -3.627 -13.247 162 HD13 LEU 22 HD13 LEU 22 14.427 -4.454 -13.949 163 HD21 LEU 22 HD21 LEU 22 14.285 -5.173 -16.373 164 HD22 LEU 22 HD22 LEU 22 14.250 -3.440 -16.049 165 HD23 LEU 22 HD23 LEU 22 13.110 -4.146 -17.195 166 H GLU 23 H GLU 23 12.601 -8.062 -17.658 167 HA GLU 23 HA GLU 23 10.459 -10.005 -17.095 168 HB2 GLU 23 HB2 GLU 23 11.482 -9.262 -19.608 169 HB3 GLU 23 HB3 GLU 23 12.160 -10.848 -19.265 170 HG2 GLU 23 HG2 GLU 23 9.247 -10.397 -18.851 171 HG3 GLU 23 HG3 GLU 23 9.866 -10.604 -20.488 172 H CYS 24 H CYS 24 11.327 -12.310 -17.114 173 HA CYS 24 HA CYS 24 13.697 -12.370 -15.409 174 HB2 CYS 24 HB2 CYS 24 11.724 -13.515 -14.568 175 HB3 CYS 24 HB3 CYS 24 11.627 -14.485 -16.034 176 H TYR 25 H TYR 25 15.600 -12.699 -16.334 177 HA TYR 25 HA TYR 25 15.753 -14.119 -18.881 178 HB2 TYR 25 HB2 TYR 25 16.895 -11.906 -18.563 179 HB3 TYR 25 HB3 TYR 25 17.963 -12.683 -17.399 180 HD1 TYR 25 HD1 TYR 25 16.907 -12.734 -20.956 181 HD2 TYR 25 HD2 TYR 25 19.862 -13.875 -18.115 182 HE1 TYR 25 HE1 TYR 25 18.399 -13.414 -22.789 183 HE2 TYR 25 HE2 TYR 25 21.362 -14.557 -19.942 184 HH TYR 25 HH TYR 25 21.032 -13.638 -23.031 185 H LYS 26 H LYS 26 16.671 -16.073 -19.139 186 HA LYS 26 HA LYS 26 17.567 -17.459 -16.715 187 HB2 LYS 26 HB2 LYS 26 16.719 -18.536 -19.410 188 HB3 LYS 26 HB3 LYS 26 17.240 -19.527 -18.054 189 HG2 LYS 26 HG2 LYS 26 15.295 -19.253 -16.924 190 HG3 LYS 26 HG3 LYS 26 15.026 -17.628 -17.558 191 HD2 LYS 26 HD2 LYS 26 13.364 -19.154 -18.445 192 HD3 LYS 26 HD3 LYS 26 14.429 -18.601 -19.739 193 HE2 LYS 26 HE2 LYS 26 15.326 -20.656 -20.061 194 HE3 LYS 26 HE3 LYS 26 15.234 -21.080 -18.352 195 HZ1 LYS 26 HZ1 LYS 26 12.650 -20.817 -19.545 196 HZ2 LYS 26 HZ2 LYS 26 13.302 -22.105 -18.662 197 HZ3 LYS 26 HZ3 LYS 26 13.587 -21.990 -20.325 198 H ARG 27 H ARG 27 19.532 -18.507 -16.588 199 HA ARG 27 HA ARG 27 21.403 -18.075 -18.819 200 HB2 ARG 27 HB2 ARG 27 21.697 -17.354 -15.937 201 HB3 ARG 27 HB3 ARG 27 23.123 -17.893 -16.813 202 HG2 ARG 27 HG2 ARG 27 21.435 -15.769 -18.027 203 HG3 ARG 27 HG3 ARG 27 22.479 -15.352 -16.667 204 HD2 ARG 27 HD2 ARG 27 23.933 -14.975 -18.382 205 HD3 ARG 27 HD3 ARG 27 24.261 -16.683 -18.094 206 HE ARG 27 HE ARG 27 22.254 -16.646 -19.960 207 HH11 ARG 27 HH11 ARG 27 25.476 -15.348 -19.735 208 HH12 ARG 27 HH12 ARG 27 25.768 -15.427 -21.441 209 HH21 ARG 27 HH21 ARG 27 22.626 -16.754 -22.208 210 HH22 ARG 27 HH22 ARG 27 24.146 -16.226 -22.847 211 H ARG 28 H ARG 28 23.375 -19.478 -18.629 212 HA ARG 28 HA ARG 28 22.536 -22.191 -18.169 213 HB2 ARG 28 HB2 ARG 28 25.207 -21.075 -19.046 214 HB3 ARG 28 HB3 ARG 28 24.773 -22.780 -19.040 215 HG2 ARG 28 HG2 ARG 28 23.359 -20.666 -20.650 216 HG3 ARG 28 HG3 ARG 28 24.628 -21.726 -21.270 217 HD2 ARG 28 HD2 ARG 28 23.221 -23.677 -20.652 218 HD3 ARG 28 HD3 ARG 28 21.940 -22.559 -20.186 219 HE ARG 28 HE ARG 28 22.868 -22.168 -22.874 220 HH11 ARG 28 HH11 ARG 28 20.712 -23.995 -20.839 221 HH12 ARG 28 HH12 ARG 28 19.610 -24.371 -22.122 222 HH21 ARG 28 HH21 ARG 28 21.424 -22.657 -24.571 223 HH22 ARG 28 HH22 ARG 28 20.016 -23.610 -24.244 224 H HIS 29 H HIS 29 25.585 -20.642 -17.187 225 HA HIS 29 HA HIS 29 25.659 -22.309 -14.812 226 HB2 HIS 29 HB2 HIS 29 27.674 -20.221 -15.645 227 HB3 HIS 29 HB3 HIS 29 27.919 -21.575 -14.546 228 HD1 HIS 29 HD1 HIS 29 28.830 -23.663 -15.551 229 HD2 HIS 29 HD2 HIS 29 27.280 -21.087 -18.419 230 HE1 HIS 29 HE1 HIS 29 29.415 -24.695 -17.768 231 H SER 30 H SER 30 25.610 -18.849 -15.604 232 HA SER 30 HA SER 30 25.667 -17.883 -12.970 233 HB2 SER 30 HB2 SER 30 24.274 -16.552 -15.300 234 HB3 SER 30 HB3 SER 30 24.969 -15.774 -13.878 235 HG SER 30 HG SER 30 26.166 -16.107 -16.121 236 H PHE 31 H PHE 31 23.529 -16.253 -12.577 237 HA PHE 31 HA PHE 31 21.339 -18.176 -12.164 238 HB2 PHE 31 HB2 PHE 31 20.653 -16.501 -10.342 239 HB3 PHE 31 HB3 PHE 31 22.079 -17.487 -10.039 240 HD1 PHE 31 HD1 PHE 31 24.314 -16.501 -10.131 241 HD2 PHE 31 HD2 PHE 31 20.813 -14.134 -10.631 242 HE1 PHE 31 HE1 PHE 31 25.638 -14.466 -9.731 243 HE2 PHE 31 HE2 PHE 31 22.132 -12.095 -10.233 244 HZ PHE 31 HZ PHE 31 24.547 -12.259 -9.784 245 H GLU 32 H GLU 32 19.135 -17.202 -12.094 246 HA GLU 32 HA GLU 32 18.737 -15.598 -14.454 247 HB2 GLU 32 HB2 GLU 32 16.529 -16.348 -12.574 248 HB3 GLU 32 HB3 GLU 32 16.491 -16.190 -14.324 249 HG2 GLU 32 HG2 GLU 32 18.263 -18.228 -14.002 250 HG3 GLU 32 HG3 GLU 32 17.159 -18.495 -12.654 251 H VAL 33 H VAL 33 18.474 -13.468 -14.534 252 HA VAL 33 HA VAL 33 17.652 -12.047 -12.090 253 HB VAL 33 HB VAL 33 19.269 -10.366 -12.344 254 HG11 VAL 33 HG11 VAL 33 21.419 -11.554 -12.361 255 HG12 VAL 33 HG12 VAL 33 20.201 -12.405 -11.407 256 HG13 VAL 33 HG13 VAL 33 20.616 -12.978 -13.022 257 HG21 VAL 33 HG21 VAL 33 19.732 -11.502 -15.091 258 HG22 VAL 33 HG22 VAL 33 19.169 -9.888 -14.657 259 HG23 VAL 33 HG23 VAL 33 20.838 -10.356 -14.332 260 H CYS 34 H CYS 34 16.801 -9.864 -12.514 261 HA CYS 34 HA CYS 34 14.866 -9.916 -14.587 262 HB2 CYS 34 HB2 CYS 34 15.747 -7.716 -12.711 263 HB3 CYS 34 HB3 CYS 34 14.400 -7.556 -13.833 264 H VAL 35 H VAL 35 14.712 -8.736 -16.474 265 HA VAL 35 HA VAL 35 17.036 -7.137 -17.280 266 HB VAL 35 HB VAL 35 16.942 -8.190 -19.552 267 HG11 VAL 35 HG11 VAL 35 18.650 -8.764 -17.852 268 HG12 VAL 35 HG12 VAL 35 17.628 -10.101 -17.323 269 HG13 VAL 35 HG13 VAL 35 18.294 -10.092 -18.956 270 HG21 VAL 35 HG21 VAL 35 14.613 -9.178 -19.045 271 HG22 VAL 35 HG22 VAL 35 15.754 -10.148 -19.978 272 HG23 VAL 35 HG23 VAL 35 15.505 -10.485 -18.266 273 HA PRO 36 HA PRO 36 14.070 -4.344 -18.921 274 HB2 PRO 36 HB2 PRO 36 15.468 -3.259 -20.979 275 HB3 PRO 36 HB3 PRO 36 15.818 -2.897 -19.285 276 HG2 PRO 36 HG2 PRO 36 17.188 -4.811 -21.136 277 HG3 PRO 36 HG3 PRO 36 17.897 -3.678 -19.970 278 HD2 PRO 36 HD2 PRO 36 17.621 -6.320 -19.450 279 HD3 PRO 36 HD3 PRO 36 17.517 -5.082 -18.183 280 H ILE 37 H ILE 37 12.405 -4.377 -20.331 281 HA ILE 37 HA ILE 37 12.407 -6.447 -22.380 282 HB ILE 37 HB ILE 37 10.174 -4.682 -21.371 283 HG12 ILE 37 HG12 ILE 37 10.296 -7.647 -21.005 284 HG13 ILE 37 HG13 ILE 37 11.277 -6.626 -19.957 285 HG21 ILE 37 HG21 ILE 37 10.378 -6.251 -23.753 286 HG22 ILE 37 HG22 ILE 37 9.165 -6.955 -22.685 287 HG23 ILE 37 HG23 ILE 37 9.032 -5.268 -23.181 288 HD11 ILE 37 HD11 ILE 37 9.398 -6.772 -18.697 289 HD12 ILE 37 HD12 ILE 37 8.978 -5.356 -19.662 290 HD13 ILE 37 HD13 ILE 37 8.337 -6.941 -20.096 291 HA PRO 38 HA PRO 38 13.301 -3.462 -25.549 292 HB2 PRO 38 HB2 PRO 38 12.979 -5.153 -27.646 293 HB3 PRO 38 HB3 PRO 38 14.413 -5.165 -26.615 294 HG2 PRO 38 HG2 PRO 38 12.014 -6.953 -26.543 295 HG3 PRO 38 HG3 PRO 38 13.729 -7.375 -26.383 296 HD2 PRO 38 HD2 PRO 38 12.078 -7.151 -24.248 297 HD3 PRO 38 HD3 PRO 38 13.805 -6.748 -24.167 298 H GLY 39 H GLY 39 11.890 -1.958 -26.177 299 HA2 GLY 39 HA2 GLY 39 10.122 -1.085 -27.423 300 HA3 GLY 39 HA3 GLY 39 9.533 -2.720 -27.687 301 H PHE 40 H PHE 40 10.234 -2.105 -24.439 302 HA PHE 40 HA PHE 40 7.580 -2.466 -23.598 303 HB2 PHE 40 HB2 PHE 40 9.243 -3.057 -22.040 304 HB3 PHE 40 HB3 PHE 40 10.069 -1.510 -22.204 305 HD1 PHE 40 HD1 PHE 40 7.016 -3.125 -20.880 306 HD2 PHE 40 HD2 PHE 40 9.552 0.292 -20.797 307 HE1 PHE 40 HE1 PHE 40 5.803 -2.276 -18.913 308 HE2 PHE 40 HE2 PHE 40 8.345 1.145 -18.831 309 HZ PHE 40 HZ PHE 40 6.468 -0.139 -17.887 310 H CYS 41 H CYS 41 6.053 -1.052 -22.754 311 HA CYS 41 HA CYS 41 6.524 1.781 -22.652 312 HB2 CYS 41 HB2 CYS 41 4.966 2.445 -24.372 313 HB3 CYS 41 HB3 CYS 41 6.176 1.386 -25.089 314 H LEU 42 H LEU 42 4.018 2.776 -22.655 315 HA LEU 42 HA LEU 42 2.562 1.144 -20.682 316 HB2 LEU 42 HB2 LEU 42 2.677 4.144 -20.610 317 HB3 LEU 42 HB3 LEU 42 2.102 3.043 -19.361 318 HG LEU 42 HG LEU 42 4.983 3.319 -20.209 319 HD11 LEU 42 HD11 LEU 42 5.066 5.146 -18.958 320 HD12 LEU 42 HD12 LEU 42 4.609 4.170 -17.563 321 HD13 LEU 42 HD13 LEU 42 3.365 4.975 -18.520 322 HD21 LEU 42 HD21 LEU 42 5.494 1.674 -18.766 323 HD22 LEU 42 HD22 LEU 42 3.814 1.192 -19.007 324 HD23 LEU 42 HD23 LEU 42 4.261 2.166 -17.605 325 H VAL 43 H VAL 43 0.269 2.161 -20.347 326 HA VAL 43 HA VAL 43 -0.846 2.714 -23.022 327 HB VAL 43 HB VAL 43 -2.947 1.657 -22.198 328 HG11 VAL 43 HG11 VAL 43 -1.811 -0.727 -22.049 329 HG12 VAL 43 HG12 VAL 43 -1.837 0.194 -23.554 330 HG13 VAL 43 HG13 VAL 43 -0.388 0.187 -22.548 331 HG21 VAL 43 HG21 VAL 43 -3.220 0.921 -20.103 332 HG22 VAL 43 HG22 VAL 43 -1.623 0.174 -20.061 333 HG23 VAL 43 HG23 VAL 43 -1.800 1.894 -19.714 334 H LYS 44 H LYS 44 -3.313 3.507 -22.549 335 HA LYS 44 HA LYS 44 -2.959 6.091 -21.311 336 HB2 LYS 44 HB2 LYS 44 -5.158 6.608 -22.203 337 HB3 LYS 44 HB3 LYS 44 -4.172 5.848 -23.446 338 HG2 LYS 44 HG2 LYS 44 -5.716 3.908 -21.946 339 HG3 LYS 44 HG3 LYS 44 -6.734 5.135 -22.706 340 HD2 LYS 44 HD2 LYS 44 -5.277 4.671 -24.807 341 HD3 LYS 44 HD3 LYS 44 -4.865 3.169 -23.974 342 HE2 LYS 44 HE2 LYS 44 -7.210 2.569 -23.841 343 HE3 LYS 44 HE3 LYS 44 -7.670 4.104 -24.577 344 HZ1 LYS 44 HZ1 LYS 44 -5.903 2.176 -25.957 345 HZ2 LYS 44 HZ2 LYS 44 -6.770 3.466 -26.623 346 HZ3 LYS 44 HZ3 LYS 44 -7.588 2.088 -26.081 347 H TRP 45 H TRP 45 -3.554 3.184 -20.032 348 HA TRP 45 HA TRP 45 -5.293 4.294 -17.928 349 HB2 TRP 45 HB2 TRP 45 -5.220 1.457 -18.975 350 HB3 TRP 45 HB3 TRP 45 -6.133 1.978 -17.561 351 HD1 TRP 45 HD1 TRP 45 -6.534 1.450 -21.168 352 HE1 TRP 45 HE1 TRP 45 -8.698 2.550 -22.025 353 HE3 TRP 45 HE3 TRP 45 -7.613 4.381 -17.120 354 HZ2 TRP 45 HZ2 TRP 45 -10.608 4.415 -21.108 355 HZ3 TRP 45 HZ3 TRP 45 -9.626 5.794 -17.192 356 HH2 TRP 45 HH2 TRP 45 -11.090 5.810 -19.145 357 H LYS 46 H LYS 46 -2.274 3.948 -18.361 358 HA LYS 46 HA LYS 46 -1.731 2.500 -15.852 359 HB2 LYS 46 HB2 LYS 46 -0.156 2.740 -18.393 360 HB3 LYS 46 HB3 LYS 46 0.668 2.419 -16.873 361 HG2 LYS 46 HG2 LYS 46 -1.636 0.689 -17.359 362 HG3 LYS 46 HG3 LYS 46 -0.343 0.526 -18.549 363 HD2 LYS 46 HD2 LYS 46 1.112 0.543 -16.287 364 HD3 LYS 46 HD3 LYS 46 -0.383 -0.167 -15.677 365 HE2 LYS 46 HE2 LYS 46 -0.256 -1.777 -17.624 366 HE3 LYS 46 HE3 LYS 46 1.375 -1.169 -17.906 367 HZ1 LYS 46 HZ1 LYS 46 0.661 -2.107 -15.219 368 HZ2 LYS 46 HZ2 LYS 46 2.162 -2.121 -15.999 369 HZ3 LYS 46 HZ3 LYS 46 0.978 -3.255 -16.421 370 H GLN 47 H GLN 47 -0.253 3.402 -14.387 371 HA GLN 47 HA GLN 47 -0.387 6.146 -14.001 372 HB2 GLN 47 HB2 GLN 47 1.077 3.906 -12.810 373 HB3 GLN 47 HB3 GLN 47 1.923 5.441 -12.682 374 HG2 GLN 47 HG2 GLN 47 0.396 6.330 -11.267 375 HG3 GLN 47 HG3 GLN 47 -0.945 5.423 -11.965 376 HE21 GLN 47 HE21 GLN 47 -1.314 5.293 -9.540 377 HE22 GLN 47 HE22 GLN 47 -0.655 3.910 -8.740 378 H CYS 48 H CYS 48 0.962 7.861 -14.416 379 HA CYS 48 HA CYS 48 3.008 7.380 -16.472 380 HB2 CYS 48 HB2 CYS 48 2.589 9.521 -17.327 381 HB3 CYS 48 HB3 CYS 48 0.990 8.931 -16.886 382 H ASP 49 H ASP 49 2.494 8.517 -13.264 383 HA ASP 49 HA ASP 49 4.597 10.241 -12.826 384 HB2 ASP 49 HB2 ASP 49 2.738 9.219 -11.224 385 HB3 ASP 49 HB3 ASP 49 4.065 8.159 -10.758 386 H GLY 50 H GLY 50 6.693 10.045 -13.221 387 HA2 GLY 50 HA2 GLY 50 8.829 9.117 -12.912 388 HA3 GLY 50 HA3 GLY 50 8.078 7.592 -12.465 389 H ARG 51 H ARG 51 6.339 7.553 -14.819 390 HA ARG 51 HA ARG 51 8.378 6.840 -16.821 391 HB2 ARG 51 HB2 ARG 51 5.593 5.706 -16.505 392 HB3 ARG 51 HB3 ARG 51 6.804 5.180 -17.666 393 HG2 ARG 51 HG2 ARG 51 7.054 4.977 -14.671 394 HG3 ARG 51 HG3 ARG 51 6.626 3.657 -15.762 395 HD2 ARG 51 HD2 ARG 51 8.768 3.728 -16.808 396 HD3 ARG 51 HD3 ARG 51 9.187 5.226 -15.978 397 HE ARG 51 HE ARG 51 8.722 3.447 -13.966 398 HH11 ARG 51 HH11 ARG 51 10.798 3.504 -16.760 399 HH12 ARG 51 HH12 ARG 51 12.032 2.534 -16.025 400 HH21 ARG 51 HH21 ARG 51 10.339 2.170 -12.987 401 HH22 ARG 51 HH22 ARG 51 11.769 1.775 -13.879 402 H GLU 52 H GLU 52 7.356 9.485 -16.567 403 HA GLU 52 HA GLU 52 5.244 10.035 -18.343 404 HB2 GLU 52 HB2 GLU 52 6.006 12.333 -18.288 405 HB3 GLU 52 HB3 GLU 52 6.102 11.642 -16.674 406 HG2 GLU 52 HG2 GLU 52 8.579 11.131 -17.414 407 HG3 GLU 52 HG3 GLU 52 8.274 12.472 -18.517 408 H ARG 53 H ARG 53 8.460 9.057 -18.905 409 HA ARG 53 HA ARG 53 8.199 9.767 -21.753 410 HB2 ARG 53 HB2 ARG 53 10.810 9.409 -20.282 411 HB3 ARG 53 HB3 ARG 53 10.573 10.031 -21.909 412 HG2 ARG 53 HG2 ARG 53 9.320 11.951 -20.883 413 HG3 ARG 53 HG3 ARG 53 9.864 11.363 -19.311 414 HD2 ARG 53 HD2 ARG 53 11.410 13.028 -19.948 415 HD3 ARG 53 HD3 ARG 53 12.218 11.486 -20.225 416 HE ARG 53 HE ARG 53 11.115 12.045 -22.630 417 HH11 ARG 53 HH11 ARG 53 13.150 13.846 -20.453 418 HH12 ARG 53 HH12 ARG 53 13.923 14.747 -21.715 419 HH21 ARG 53 HH21 ARG 53 12.127 13.225 -24.300 420 HH22 ARG 53 HH22 ARG 53 13.340 14.394 -23.902 421 H ASP 54 H ASP 54 7.363 7.345 -20.242 422 HA ASP 54 HA ASP 54 9.005 5.361 -21.675 423 HB2 ASP 54 HB2 ASP 54 8.645 5.465 -18.978 424 HB3 ASP 54 HB3 ASP 54 7.326 4.397 -19.449 425 H CYS 55 H CYS 55 5.862 6.656 -21.133 426 HA CYS 55 HA CYS 55 4.167 4.610 -21.860 427 HB2 CYS 55 HB2 CYS 55 3.905 7.507 -22.693 428 HB3 CYS 55 HB3 CYS 55 2.600 6.329 -22.591 429 H CYS 56 H CYS 56 2.974 4.359 -23.948 430 HA CYS 56 HA CYS 56 4.788 3.725 -26.025 431 HB2 CYS 56 HB2 CYS 56 1.874 3.535 -25.584 432 HB3 CYS 56 HB3 CYS 56 2.375 3.643 -27.268 433 H ALA 57 H ALA 57 3.997 4.433 -28.388 434 HA ALA 57 HA ALA 57 4.701 7.186 -28.601 435 HB1 ALA 57 HB1 ALA 57 3.911 5.083 -30.588 436 HB2 ALA 57 HB2 ALA 57 4.162 6.761 -31.071 437 HB3 ALA 57 HB3 ALA 57 5.483 5.847 -30.345 438 H GLY 58 H GLY 58 3.416 8.907 -28.534 439 HA2 GLY 58 HA2 GLY 58 1.500 10.122 -29.314 440 HA3 GLY 58 HA3 GLY 58 0.607 8.610 -29.360 441 H LEU 59 H LEU 59 1.870 7.983 -26.644 442 HA LEU 59 HA LEU 59 -0.286 9.108 -25.094 443 HB2 LEU 59 HB2 LEU 59 1.929 7.169 -24.512 444 HB3 LEU 59 HB3 LEU 59 0.896 7.797 -23.229 445 HG LEU 59 HG LEU 59 -0.007 6.172 -25.606 446 HD11 LEU 59 HD11 LEU 59 0.472 5.524 -22.718 447 HD12 LEU 59 HD12 LEU 59 1.065 4.690 -24.154 448 HD13 LEU 59 HD13 LEU 59 -0.637 4.578 -23.709 449 HD21 LEU 59 HD21 LEU 59 -1.472 7.637 -23.461 450 HD22 LEU 59 HD22 LEU 59 -2.124 6.114 -24.065 451 HD23 LEU 59 HD23 LEU 59 -1.858 7.461 -25.173 452 H GLU 60 H GLU 60 0.308 9.877 -22.790 453 HA GLU 60 HA GLU 60 2.783 11.304 -22.517 454 HB2 GLU 60 HB2 GLU 60 1.963 13.530 -22.564 455 HB3 GLU 60 HB3 GLU 60 1.379 12.763 -24.033 456 HG2 GLU 60 HG2 GLU 60 -0.729 12.273 -22.533 457 HG3 GLU 60 HG3 GLU 60 -0.120 13.662 -21.635 458 H CYS 61 H CYS 61 2.818 12.590 -20.460 459 HA CYS 61 HA CYS 61 1.680 11.008 -18.357 460 HB2 CYS 61 HB2 CYS 61 3.973 12.217 -18.411 461 HB3 CYS 61 HB3 CYS 61 3.060 13.646 -17.940 462 H TRP 62 H TRP 62 -0.511 11.220 -18.260 463 HA TRP 62 HA TRP 62 -1.759 13.828 -18.314 464 HB2 TRP 62 HB2 TRP 62 -2.708 11.590 -19.238 465 HB3 TRP 62 HB3 TRP 62 -3.173 11.286 -17.566 466 HD1 TRP 62 HD1 TRP 62 -3.465 14.897 -18.239 467 HE1 TRP 62 HE1 TRP 62 -5.917 15.545 -18.678 468 HE3 TRP 62 HE3 TRP 62 -5.438 10.224 -18.874 469 HZ2 TRP 62 HZ2 TRP 62 -8.364 14.246 -19.220 470 HZ3 TRP 62 HZ3 TRP 62 -7.842 10.013 -19.349 471 HH2 TRP 62 HH2 TRP 62 -9.274 11.984 -19.518 472 H LYS 63 H LYS 63 -2.190 15.057 -16.604 473 HA LYS 63 HA LYS 63 -1.795 13.911 -13.931 474 HB2 LYS 63 HB2 LYS 63 -0.494 15.962 -14.745 475 HB3 LYS 63 HB3 LYS 63 -2.009 16.842 -14.595 476 HG2 LYS 63 HG2 LYS 63 -0.632 17.158 -12.629 477 HG3 LYS 63 HG3 LYS 63 -2.103 16.274 -12.219 478 HD2 LYS 63 HD2 LYS 63 0.022 14.466 -12.964 479 HD3 LYS 63 HD3 LYS 63 0.528 15.532 -11.650 480 HE2 LYS 63 HE2 LYS 63 -2.007 13.895 -11.675 481 HE3 LYS 63 HE3 LYS 63 -0.515 13.431 -10.859 482 HZ1 LYS 63 HZ1 LYS 63 -2.268 14.543 -9.453 483 HZ2 LYS 63 HZ2 LYS 63 -1.907 15.977 -10.275 484 HZ3 LYS 63 HZ3 LYS 63 -0.713 15.204 -9.357 485 H ARG 64 H ARG 64 -3.719 13.062 -13.320 486 HA ARG 64 HA ARG 64 -6.052 14.862 -13.375 487 HB2 ARG 64 HB2 ARG 64 -5.758 11.993 -14.008 488 HB3 ARG 64 HB3 ARG 64 -7.160 12.408 -13.031 489 HG2 ARG 64 HG2 ARG 64 -8.126 13.659 -14.703 490 HG3 ARG 64 HG3 ARG 64 -6.586 13.967 -15.506 491 HD2 ARG 64 HD2 ARG 64 -8.074 12.388 -16.729 492 HD3 ARG 64 HD3 ARG 64 -6.491 11.722 -16.329 493 HE ARG 64 HE ARG 64 -7.534 10.149 -15.045 494 HH11 ARG 64 HH11 ARG 64 -9.735 12.793 -15.583 495 HH12 ARG 64 HH12 ARG 64 -11.080 11.997 -14.837 496 HH21 ARG 64 HH21 ARG 64 -9.297 9.090 -14.060 497 HH22 ARG 64 HH22 ARG 64 -10.830 9.892 -13.969 498 H SER 65 H SER 65 -7.121 15.247 -11.506 499 HA SER 65 HA SER 65 -6.326 13.720 -9.122 500 HB2 SER 65 HB2 SER 65 -6.664 16.089 -7.968 501 HB3 SER 65 HB3 SER 65 -5.112 15.623 -8.664 502 HG SER 65 HG SER 65 -5.937 17.745 -9.288 503 H GLY 66 H GLY 66 -7.944 13.211 -7.732 504 HA2 GLY 66 HA2 GLY 66 -10.078 13.779 -6.698 505 HA3 GLY 66 HA3 GLY 66 -10.595 14.398 -8.260 506 H ASN 67 H ASN 67 -9.248 11.994 -9.537 507 HA ASN 67 HA ASN 67 -11.423 10.088 -8.978 508 HB2 ASN 67 HB2 ASN 67 -9.900 10.614 -11.538 509 HB3 ASN 67 HB3 ASN 67 -11.035 9.284 -11.323 510 HD21 ASN 67 HD21 ASN 67 -10.650 12.629 -11.918 511 HD22 ASN 67 HD22 ASN 67 -12.322 13.021 -12.098 512 H LYS 68 H LYS 68 -8.025 10.263 -10.020 513 HA LYS 68 HA LYS 68 -7.271 8.139 -8.259 514 HB2 LYS 68 HB2 LYS 68 -7.782 7.580 -11.125 515 HB3 LYS 68 HB3 LYS 68 -6.305 6.906 -10.451 516 HG2 LYS 68 HG2 LYS 68 -7.911 6.080 -8.555 517 HG3 LYS 68 HG3 LYS 68 -9.143 6.288 -9.802 518 HD2 LYS 68 HD2 LYS 68 -8.558 4.140 -10.263 519 HD3 LYS 68 HD3 LYS 68 -7.333 4.956 -11.238 520 HE2 LYS 68 HE2 LYS 68 -6.302 3.201 -9.935 521 HE3 LYS 68 HE3 LYS 68 -5.753 4.773 -9.353 522 HZ1 LYS 68 HZ1 LYS 68 -6.466 2.999 -7.657 523 HZ2 LYS 68 HZ2 LYS 68 -8.046 3.430 -8.077 524 HZ3 LYS 68 HZ3 LYS 68 -6.998 4.590 -7.432 525 H SER 69 H SER 69 -4.893 7.411 -8.960 526 HA SER 69 HA SER 69 -3.275 9.683 -8.681 527 HB2 SER 69 HB2 SER 69 -2.770 6.793 -9.244 528 HB3 SER 69 HB3 SER 69 -1.445 7.936 -9.467 529 HG SER 69 HG SER 69 -2.808 7.216 -7.125 530 H SER 70 H SER 70 -1.268 9.894 -10.259 531 HA SER 70 HA SER 70 -2.294 10.993 -12.663 532 HB2 SER 70 HB2 SER 70 0.497 10.694 -12.949 533 HB3 SER 70 HB3 SER 70 -0.381 12.139 -12.447 534 HG SER 70 HG SER 70 -0.123 11.546 -10.325 535 H VAL 71 H VAL 71 -2.750 10.007 -14.507 536 HA VAL 71 HA VAL 71 -1.408 7.450 -15.106 537 HB VAL 71 HB VAL 71 -3.467 6.929 -16.479 538 HG11 VAL 71 HG11 VAL 71 -4.255 5.720 -14.756 539 HG12 VAL 71 HG12 VAL 71 -2.879 6.400 -13.882 540 HG13 VAL 71 HG13 VAL 71 -4.474 7.138 -13.729 541 HG21 VAL 71 HG21 VAL 71 -4.166 9.451 -16.262 542 HG22 VAL 71 HG22 VAL 71 -5.387 8.182 -16.345 543 HG23 VAL 71 HG23 VAL 71 -4.949 8.885 -14.787 544 H CYS 72 H CYS 72 -1.785 6.963 -17.600 545 HA CYS 72 HA CYS 72 -0.686 9.289 -19.012 546 HB2 CYS 72 HB2 CYS 72 -0.220 6.397 -19.125 547 HB3 CYS 72 HB3 CYS 72 -0.390 7.143 -20.711 548 H ALA 73 H ALA 73 -1.395 9.783 -21.152 549 HA ALA 73 HA ALA 73 -3.901 8.591 -22.043 550 HB1 ALA 73 HB1 ALA 73 -4.015 10.855 -20.518 551 HB2 ALA 73 HB2 ALA 73 -4.007 11.509 -22.157 552 HB3 ALA 73 HB3 ALA 73 -5.242 10.345 -21.677 553 HA PRO 74 HA PRO 74 -2.227 9.214 -26.052 554 HB2 PRO 74 HB2 PRO 74 -4.480 9.566 -27.526 555 HB3 PRO 74 HB3 PRO 74 -4.004 8.001 -26.857 556 HG2 PRO 74 HG2 PRO 74 -5.995 9.980 -25.816 557 HG3 PRO 74 HG3 PRO 74 -6.123 8.214 -25.923 558 HD2 PRO 74 HD2 PRO 74 -5.510 9.494 -23.617 559 HD3 PRO 74 HD3 PRO 74 -4.878 7.882 -24.011 560 H ILE 75 H ILE 75 -2.249 10.728 -27.948 561 HA ILE 75 HA ILE 75 -1.748 13.348 -27.160 562 HB ILE 75 HB ILE 75 -1.948 13.899 -29.629 563 HG12 ILE 75 HG12 ILE 75 -2.161 10.925 -30.018 564 HG13 ILE 75 HG13 ILE 75 -3.604 11.930 -29.945 565 HG21 ILE 75 HG21 ILE 75 0.156 13.068 -30.048 566 HG22 ILE 75 HG22 ILE 75 0.087 12.958 -28.289 567 HG23 ILE 75 HG23 ILE 75 -0.183 11.521 -29.274 568 HD11 ILE 75 HD11 ILE 75 -1.477 11.812 -32.018 569 HD12 ILE 75 HD12 ILE 75 -3.230 11.846 -32.196 570 HD13 ILE 75 HD13 ILE 75 -2.360 13.320 -31.773 571 H THR 76 H THR 76 -2.864 15.305 -27.501 572 HA THR 76 HA THR 76 -5.422 15.582 -28.574 573 HB THR 76 HB THR 76 -6.357 14.229 -26.874 574 HG1 THR 76 HG1 THR 76 -7.609 15.778 -25.705 575 HG21 THR 76 HG21 THR 76 -5.121 13.859 -25.046 576 HG22 THR 76 HG22 THR 76 -5.784 15.366 -24.413 577 HG23 THR 76 HG23 THR 76 -4.233 15.367 -25.252 Start of MODEL 3 1 H1 SER 1 H SER 1 0.528 -4.462 -0.091 2 HA SER 1 HA SER 1 1.704 -2.189 -1.030 3 HB2 SER 1 HB2 SER 1 0.356 -2.072 0.942 4 HB3 SER 1 HB3 SER 1 1.437 -3.151 1.822 5 HG SER 1 HG SER 1 1.872 -1.048 2.440 6 H ASN 2 H ASN 2 3.606 -3.053 -2.148 7 HA ASN 2 HA ASN 2 5.988 -2.489 -0.707 8 HB2 ASN 2 HB2 ASN 2 5.506 -4.822 0.080 9 HB3 ASN 2 HB3 ASN 2 5.663 -5.364 -1.588 10 HD21 ASN 2 HD21 ASN 2 7.355 -6.727 -0.741 11 HD22 ASN 2 HD22 ASN 2 8.944 -6.082 -0.533 12 H GLU 3 H GLU 3 7.695 -2.066 -2.064 13 HA GLU 3 HA GLU 3 7.134 -1.501 -4.753 14 HB2 GLU 3 HB2 GLU 3 9.477 -0.952 -4.972 15 HB3 GLU 3 HB3 GLU 3 8.892 -0.375 -3.418 16 HG2 GLU 3 HG2 GLU 3 9.916 -2.258 -2.297 17 HG3 GLU 3 HG3 GLU 3 10.436 -2.924 -3.844 18 H CYS 4 H CYS 4 8.767 -2.331 -6.519 19 HA CYS 4 HA CYS 4 8.502 -5.255 -6.541 20 HB2 CYS 4 HB2 CYS 4 8.708 -5.060 -8.994 21 HB3 CYS 4 HB3 CYS 4 7.363 -4.112 -8.366 22 H ILE 5 H ILE 5 10.236 -6.320 -8.018 23 HA ILE 5 HA ILE 5 12.743 -5.974 -6.740 24 HB ILE 5 HB ILE 5 12.065 -7.545 -9.229 25 HG12 ILE 5 HG12 ILE 5 12.565 -8.762 -6.544 26 HG13 ILE 5 HG13 ILE 5 10.996 -8.029 -6.859 27 HG21 ILE 5 HG21 ILE 5 14.577 -7.056 -7.827 28 HG22 ILE 5 HG22 ILE 5 14.212 -8.767 -8.044 29 HG23 ILE 5 HG23 ILE 5 14.286 -7.697 -9.444 30 HD11 ILE 5 HD11 ILE 5 10.344 -9.717 -8.163 31 HD12 ILE 5 HD12 ILE 5 11.911 -9.834 -8.965 32 HD13 ILE 5 HD13 ILE 5 11.662 -10.605 -7.398 33 H ARG 6 H ARG 6 14.467 -4.787 -7.277 34 HA ARG 6 HA ARG 6 14.278 -2.835 -9.339 35 HB2 ARG 6 HB2 ARG 6 16.617 -3.670 -7.616 36 HB3 ARG 6 HB3 ARG 6 16.610 -2.270 -8.679 37 HG2 ARG 6 HG2 ARG 6 16.016 -1.196 -6.797 38 HG3 ARG 6 HG3 ARG 6 14.403 -1.756 -7.243 39 HD2 ARG 6 HD2 ARG 6 14.396 -3.421 -5.648 40 HD3 ARG 6 HD3 ARG 6 16.155 -3.513 -5.587 41 HE ARG 6 HE ARG 6 14.457 -1.791 -4.042 42 HH11 ARG 6 HH11 ARG 6 17.646 -2.205 -5.376 43 HH12 ARG 6 HH12 ARG 6 18.411 -1.180 -4.207 44 HH21 ARG 6 HH21 ARG 6 15.452 -0.439 -2.497 45 HH22 ARG 6 HH22 ARG 6 17.162 -0.177 -2.569 46 H LYS 7 H LYS 7 15.369 -2.672 -11.276 47 HA LYS 7 HA LYS 7 15.781 -4.980 -12.766 48 HB2 LYS 7 HB2 LYS 7 15.422 -2.608 -13.610 49 HB3 LYS 7 HB3 LYS 7 17.137 -2.342 -13.321 50 HG2 LYS 7 HG2 LYS 7 17.754 -3.941 -14.954 51 HG3 LYS 7 HG3 LYS 7 16.099 -4.541 -15.088 52 HD2 LYS 7 HD2 LYS 7 16.384 -3.184 -16.977 53 HD3 LYS 7 HD3 LYS 7 15.494 -2.170 -15.838 54 HE2 LYS 7 HE2 LYS 7 17.127 -0.718 -16.565 55 HE3 LYS 7 HE3 LYS 7 17.876 -1.387 -15.116 56 HZ1 LYS 7 HZ1 LYS 7 19.573 -1.974 -16.390 57 HZ2 LYS 7 HZ2 LYS 7 18.762 -1.516 -17.803 58 HZ3 LYS 7 HZ3 LYS 7 18.567 -3.078 -17.185 59 H TRP 8 H TRP 8 17.527 -6.221 -13.278 60 HA TRP 8 HA TRP 8 19.542 -7.242 -13.013 61 HB2 TRP 8 HB2 TRP 8 20.361 -4.352 -12.728 62 HB3 TRP 8 HB3 TRP 8 21.528 -5.671 -12.722 63 HD1 TRP 8 HD1 TRP 8 20.004 -3.304 -15.026 64 HE1 TRP 8 HE1 TRP 8 20.276 -4.064 -17.471 65 HE3 TRP 8 HE3 TRP 8 21.387 -8.159 -14.217 66 HZ2 TRP 8 HZ2 TRP 8 20.982 -6.412 -18.870 67 HZ3 TRP 8 HZ3 TRP 8 21.841 -9.595 -16.163 68 HH2 TRP 8 HH2 TRP 8 21.642 -8.738 -18.440 69 H LEU 9 H LEU 9 18.054 -7.567 -10.842 70 HA LEU 9 HA LEU 9 19.952 -7.204 -8.619 71 HB2 LEU 9 HB2 LEU 9 17.942 -5.745 -8.434 72 HB3 LEU 9 HB3 LEU 9 16.946 -7.198 -8.393 73 HG LEU 9 HG LEU 9 18.095 -7.868 -6.298 74 HD11 LEU 9 HD11 LEU 9 19.184 -5.668 -5.224 75 HD12 LEU 9 HD12 LEU 9 19.631 -5.425 -6.912 76 HD13 LEU 9 HD13 LEU 9 20.120 -6.898 -6.075 77 HD21 LEU 9 HD21 LEU 9 16.189 -6.954 -5.568 78 HD22 LEU 9 HD22 LEU 9 16.322 -5.577 -6.662 79 HD23 LEU 9 HD23 LEU 9 17.186 -5.568 -5.123 80 H SER 10 H SER 10 16.947 -9.014 -9.277 81 HA SER 10 HA SER 10 18.145 -11.552 -9.327 82 HB2 SER 10 HB2 SER 10 17.162 -12.332 -7.073 83 HB3 SER 10 HB3 SER 10 18.665 -11.409 -7.034 84 HG SER 10 HG SER 10 16.646 -10.844 -5.640 85 H CYS 11 H CYS 11 16.764 -12.808 -10.385 86 HA CYS 11 HA CYS 11 13.935 -12.052 -10.434 87 HB2 CYS 11 HB2 CYS 11 15.109 -12.226 -12.596 88 HB3 CYS 11 HB3 CYS 11 15.475 -13.914 -12.254 89 H VAL 12 H VAL 12 16.068 -14.483 -9.286 90 HA VAL 12 HA VAL 12 14.524 -16.765 -9.219 91 HB VAL 12 HB VAL 12 16.310 -15.825 -6.972 92 HG11 VAL 12 HG11 VAL 12 16.641 -18.478 -7.061 93 HG12 VAL 12 HG12 VAL 12 15.406 -17.698 -6.070 94 HG13 VAL 12 HG13 VAL 12 14.978 -18.379 -7.641 95 HG21 VAL 12 HG21 VAL 12 16.905 -16.940 -9.666 96 HG22 VAL 12 HG22 VAL 12 17.770 -15.717 -8.734 97 HG23 VAL 12 HG23 VAL 12 17.923 -17.422 -8.309 98 H ASP 13 H ASP 13 14.351 -13.929 -7.149 99 HA ASP 13 HA ASP 13 12.705 -14.922 -5.129 100 HB2 ASP 13 HB2 ASP 13 13.238 -12.208 -6.256 101 HB3 ASP 13 HB3 ASP 13 11.878 -12.404 -5.153 102 H ARG 14 H ARG 14 11.828 -13.379 -8.208 103 HA ARG 14 HA ARG 14 9.531 -14.937 -8.599 104 HB2 ARG 14 HB2 ARG 14 7.797 -13.169 -8.239 105 HB3 ARG 14 HB3 ARG 14 8.527 -13.778 -6.759 106 HG2 ARG 14 HG2 ARG 14 10.097 -11.757 -6.937 107 HG3 ARG 14 HG3 ARG 14 8.923 -11.129 -8.095 108 HD2 ARG 14 HD2 ARG 14 8.232 -10.221 -6.064 109 HD3 ARG 14 HD3 ARG 14 7.177 -11.618 -6.273 110 HE ARG 14 HE ARG 14 9.434 -12.404 -4.809 111 HH11 ARG 14 HH11 ARG 14 6.605 -10.402 -4.480 112 HH12 ARG 14 HH12 ARG 14 6.504 -10.601 -2.762 113 HH21 ARG 14 HH21 ARG 14 9.312 -12.674 -2.548 114 HH22 ARG 14 HH22 ARG 14 8.045 -11.893 -1.664 115 H LYS 15 H LYS 15 9.412 -14.981 -10.734 116 HA LYS 15 HA LYS 15 10.511 -12.833 -12.324 117 HB2 LYS 15 HB2 LYS 15 10.145 -14.295 -14.220 118 HB3 LYS 15 HB3 LYS 15 10.890 -15.207 -12.914 119 HG2 LYS 15 HG2 LYS 15 8.654 -16.081 -12.309 120 HG3 LYS 15 HG3 LYS 15 7.989 -15.250 -13.718 121 HD2 LYS 15 HD2 LYS 15 8.351 -17.362 -14.566 122 HD3 LYS 15 HD3 LYS 15 9.858 -16.554 -15.002 123 HE2 LYS 15 HE2 LYS 15 10.601 -17.451 -12.628 124 HE3 LYS 15 HE3 LYS 15 9.335 -18.636 -12.941 125 HZ1 LYS 15 HZ1 LYS 15 11.047 -18.249 -15.198 126 HZ2 LYS 15 HZ2 LYS 15 10.610 -19.681 -14.412 127 HZ3 LYS 15 HZ3 LYS 15 11.907 -18.762 -13.834 128 H ASN 16 H ASN 16 7.347 -14.173 -11.581 129 HA ASN 16 HA ASN 16 5.932 -12.618 -13.512 130 HB2 ASN 16 HB2 ASN 16 5.191 -14.804 -12.343 131 HB3 ASN 16 HB3 ASN 16 4.694 -13.755 -11.018 132 HD21 ASN 16 HD21 ASN 16 2.705 -13.007 -11.086 133 HD22 ASN 16 HD22 ASN 16 1.703 -12.907 -12.490 134 H ASP 17 H ASP 17 7.414 -11.837 -10.611 135 HA ASP 17 HA ASP 17 5.829 -9.364 -10.414 136 HB2 ASP 17 HB2 ASP 17 6.713 -11.222 -8.232 137 HB3 ASP 17 HB3 ASP 17 6.530 -9.502 -7.896 138 H CYS 18 H CYS 18 8.267 -9.861 -11.880 139 HA CYS 18 HA CYS 18 10.568 -9.020 -10.526 140 HB2 CYS 18 HB2 CYS 18 9.714 -9.262 -13.340 141 HB3 CYS 18 HB3 CYS 18 11.000 -8.096 -13.049 142 H CYS 19 H CYS 19 8.772 -7.033 -12.877 143 HA CYS 19 HA CYS 19 8.313 -4.842 -11.209 144 HB2 CYS 19 HB2 CYS 19 11.004 -5.042 -11.714 145 HB3 CYS 19 HB3 CYS 19 10.476 -3.930 -12.971 146 H GLU 20 H GLU 20 8.424 -2.697 -12.828 147 HA GLU 20 HA GLU 20 6.499 -3.394 -14.881 148 HB2 GLU 20 HB2 GLU 20 6.084 -1.469 -13.412 149 HB3 GLU 20 HB3 GLU 20 7.548 -0.698 -14.005 150 HG2 GLU 20 HG2 GLU 20 6.629 -0.396 -16.162 151 HG3 GLU 20 HG3 GLU 20 5.260 -1.447 -15.799 152 H GLY 21 H GLY 21 7.188 -3.991 -16.825 153 HA2 GLY 21 HA2 GLY 21 8.180 -3.693 -18.909 154 HA3 GLY 21 HA3 GLY 21 9.068 -2.322 -18.260 155 H LEU 22 H LEU 22 9.033 -5.535 -16.837 156 HA LEU 22 HA LEU 22 11.800 -5.938 -17.750 157 HB2 LEU 22 HB2 LEU 22 10.734 -6.306 -14.956 158 HB3 LEU 22 HB3 LEU 22 12.304 -6.890 -15.500 159 HG LEU 22 HG LEU 22 11.419 -4.021 -15.236 160 HD11 LEU 22 HD11 LEU 22 12.463 -5.763 -13.367 161 HD12 LEU 22 HD12 LEU 22 12.476 -4.002 -13.278 162 HD13 LEU 22 HD13 LEU 22 13.870 -4.861 -13.931 163 HD21 LEU 22 HD21 LEU 22 14.108 -3.990 -15.756 164 HD22 LEU 22 HD22 LEU 22 12.835 -3.614 -16.918 165 HD23 LEU 22 HD23 LEU 22 13.522 -5.238 -16.856 166 H GLU 23 H GLU 23 12.528 -8.199 -17.574 167 HA GLU 23 HA GLU 23 10.393 -10.187 -17.455 168 HB2 GLU 23 HB2 GLU 23 11.822 -9.356 -19.897 169 HB3 GLU 23 HB3 GLU 23 11.740 -11.093 -19.638 170 HG2 GLU 23 HG2 GLU 23 9.304 -9.350 -19.507 171 HG3 GLU 23 HG3 GLU 23 9.898 -10.026 -21.023 172 H CYS 24 H CYS 24 11.295 -12.438 -17.585 173 HA CYS 24 HA CYS 24 13.681 -12.569 -15.926 174 HB2 CYS 24 HB2 CYS 24 11.359 -13.919 -15.762 175 HB3 CYS 24 HB3 CYS 24 12.279 -15.053 -16.746 176 H TYR 25 H TYR 25 15.632 -13.023 -16.692 177 HA TYR 25 HA TYR 25 15.890 -13.933 -19.455 178 HB2 TYR 25 HB2 TYR 25 17.154 -11.932 -18.707 179 HB3 TYR 25 HB3 TYR 25 18.022 -12.937 -17.553 180 HD1 TYR 25 HD1 TYR 25 17.447 -12.367 -21.167 181 HD2 TYR 25 HD2 TYR 25 19.897 -14.214 -18.219 182 HE1 TYR 25 HE1 TYR 25 19.115 -12.899 -22.895 183 HE2 TYR 25 HE2 TYR 25 21.573 -14.748 -19.938 184 HH TYR 25 HH TYR 25 21.429 -15.105 -22.601 185 H LYS 26 H LYS 26 17.370 -15.627 -20.024 186 HA LYS 26 HA LYS 26 17.365 -17.779 -18.050 187 HB2 LYS 26 HB2 LYS 26 16.583 -17.932 -20.548 188 HB3 LYS 26 HB3 LYS 26 18.302 -18.108 -20.877 189 HG2 LYS 26 HG2 LYS 26 18.314 -20.013 -19.240 190 HG3 LYS 26 HG3 LYS 26 16.552 -19.902 -19.216 191 HD2 LYS 26 HD2 LYS 26 17.947 -20.091 -21.844 192 HD3 LYS 26 HD3 LYS 26 17.790 -21.547 -20.857 193 HE2 LYS 26 HE2 LYS 26 15.365 -21.216 -20.767 194 HE3 LYS 26 HE3 LYS 26 15.527 -19.765 -21.754 195 HZ1 LYS 26 HZ1 LYS 26 16.809 -21.921 -23.035 196 HZ2 LYS 26 HZ2 LYS 26 15.491 -21.006 -23.570 197 HZ3 LYS 26 HZ3 LYS 26 15.235 -22.385 -22.625 198 H ARG 27 H ARG 27 19.087 -17.851 -16.762 199 HA ARG 27 HA ARG 27 21.747 -17.583 -17.994 200 HB2 ARG 27 HB2 ARG 27 20.875 -15.638 -16.457 201 HB3 ARG 27 HB3 ARG 27 21.294 -16.745 -15.157 202 HG2 ARG 27 HG2 ARG 27 23.168 -15.367 -15.441 203 HG3 ARG 27 HG3 ARG 27 23.591 -16.896 -16.214 204 HD2 ARG 27 HD2 ARG 27 24.295 -15.295 -17.750 205 HD3 ARG 27 HD3 ARG 27 22.728 -15.806 -18.374 206 HE ARG 27 HE ARG 27 22.181 -13.649 -16.783 207 HH11 ARG 27 HH11 ARG 27 24.225 -14.247 -19.537 208 HH12 ARG 27 HH12 ARG 27 24.116 -12.625 -20.136 209 HH21 ARG 27 HH21 ARG 27 22.029 -11.509 -17.562 210 HH22 ARG 27 HH22 ARG 27 22.866 -11.068 -19.011 211 H ARG 28 H ARG 28 23.026 -19.281 -17.676 212 HA ARG 28 HA ARG 28 22.252 -21.236 -15.622 213 HB2 ARG 28 HB2 ARG 28 23.765 -21.532 -18.213 214 HB3 ARG 28 HB3 ARG 28 23.708 -22.803 -17.000 215 HG2 ARG 28 HG2 ARG 28 21.172 -22.636 -17.184 216 HG3 ARG 28 HG3 ARG 28 21.463 -21.689 -18.646 217 HD2 ARG 28 HD2 ARG 28 22.658 -23.521 -19.653 218 HD3 ARG 28 HD3 ARG 28 22.562 -24.454 -18.160 219 HE ARG 28 HE ARG 28 19.990 -23.720 -19.188 220 HH11 ARG 28 HH11 ARG 28 22.589 -26.024 -19.424 221 HH12 ARG 28 HH12 ARG 28 21.583 -27.294 -20.038 222 HH21 ARG 28 HH21 ARG 28 18.654 -25.383 -19.995 223 HH22 ARG 28 HH22 ARG 28 19.345 -26.927 -20.362 224 H HIS 29 H HIS 29 25.082 -19.665 -17.080 225 HA HIS 29 HA HIS 29 27.029 -20.732 -15.382 226 HB2 HIS 29 HB2 HIS 29 26.846 -18.277 -17.078 227 HB3 HIS 29 HB3 HIS 29 28.187 -18.426 -15.947 228 HD1 HIS 29 HD1 HIS 29 29.461 -18.393 -18.401 229 HD2 HIS 29 HD2 HIS 29 27.440 -21.855 -17.310 230 HE1 HIS 29 HE1 HIS 29 30.401 -20.209 -19.864 231 H SER 30 H SER 30 25.169 -17.715 -15.105 232 HA SER 30 HA SER 30 25.838 -17.678 -12.236 233 HB2 SER 30 HB2 SER 30 25.943 -15.461 -14.247 234 HB3 SER 30 HB3 SER 30 25.535 -15.084 -12.573 235 HG SER 30 HG SER 30 27.934 -15.508 -13.614 236 H PHE 31 H PHE 31 24.269 -16.344 -10.952 237 HA PHE 31 HA PHE 31 21.675 -17.317 -11.255 238 HB2 PHE 31 HB2 PHE 31 21.048 -15.777 -9.477 239 HB3 PHE 31 HB3 PHE 31 22.615 -16.495 -9.119 240 HD1 PHE 31 HD1 PHE 31 24.680 -15.154 -9.430 241 HD2 PHE 31 HD2 PHE 31 20.796 -13.447 -9.760 242 HE1 PHE 31 HE1 PHE 31 25.648 -12.909 -9.163 243 HE2 PHE 31 HE2 PHE 31 21.757 -11.198 -9.493 244 HZ PHE 31 HZ PHE 31 24.187 -10.927 -9.195 245 H GLU 32 H GLU 32 19.984 -16.709 -12.444 246 HA GLU 32 HA GLU 32 20.250 -14.528 -14.293 247 HB2 GLU 32 HB2 GLU 32 18.038 -15.237 -15.106 248 HB3 GLU 32 HB3 GLU 32 19.158 -16.588 -14.991 249 HG2 GLU 32 HG2 GLU 32 17.459 -16.095 -12.631 250 HG3 GLU 32 HG3 GLU 32 16.643 -16.666 -14.086 251 H VAL 33 H VAL 33 18.886 -12.707 -14.459 252 HA VAL 33 HA VAL 33 17.238 -12.065 -12.124 253 HB VAL 33 HB VAL 33 18.209 -9.882 -11.840 254 HG11 VAL 33 HG11 VAL 33 19.307 -12.056 -10.893 255 HG12 VAL 33 HG12 VAL 33 20.631 -11.621 -11.975 256 HG13 VAL 33 HG13 VAL 33 20.119 -10.501 -10.713 257 HG21 VAL 33 HG21 VAL 33 20.509 -9.635 -13.199 258 HG22 VAL 33 HG22 VAL 33 19.571 -10.555 -14.376 259 HG23 VAL 33 HG23 VAL 33 18.968 -9.006 -13.786 260 H CYS 34 H CYS 34 16.189 -9.786 -12.553 261 HA CYS 34 HA CYS 34 14.602 -10.069 -14.888 262 HB2 CYS 34 HB2 CYS 34 14.843 -7.671 -13.058 263 HB3 CYS 34 HB3 CYS 34 13.528 -7.998 -14.182 264 H VAL 35 H VAL 35 14.506 -8.808 -16.745 265 HA VAL 35 HA VAL 35 16.729 -6.943 -17.204 266 HB VAL 35 HB VAL 35 17.012 -7.849 -19.495 267 HG11 VAL 35 HG11 VAL 35 18.381 -9.705 -18.872 268 HG12 VAL 35 HG12 VAL 35 18.455 -8.522 -17.566 269 HG13 VAL 35 HG13 VAL 35 17.454 -9.964 -17.395 270 HG21 VAL 35 HG21 VAL 35 15.883 -9.651 -20.316 271 HG22 VAL 35 HG22 VAL 35 15.648 -10.371 -18.723 272 HG23 VAL 35 HG23 VAL 35 14.641 -9.017 -19.236 273 HA PRO 36 HA PRO 36 13.700 -4.305 -18.981 274 HB2 PRO 36 HB2 PRO 36 15.199 -2.963 -20.805 275 HB3 PRO 36 HB3 PRO 36 15.335 -2.692 -19.063 276 HG2 PRO 36 HG2 PRO 36 17.061 -4.348 -20.864 277 HG3 PRO 36 HG3 PRO 36 17.539 -3.243 -19.562 278 HD2 PRO 36 HD2 PRO 36 17.455 -5.930 -19.235 279 HD3 PRO 36 HD3 PRO 36 17.105 -4.796 -17.914 280 H ILE 37 H ILE 37 12.135 -4.662 -20.420 281 HA ILE 37 HA ILE 37 12.559 -6.488 -22.612 282 HB ILE 37 HB ILE 37 10.082 -4.962 -21.802 283 HG12 ILE 37 HG12 ILE 37 10.434 -7.909 -21.458 284 HG13 ILE 37 HG13 ILE 37 11.203 -6.828 -20.300 285 HG21 ILE 37 HG21 ILE 37 10.083 -5.596 -24.174 286 HG22 ILE 37 HG22 ILE 37 10.376 -7.273 -23.715 287 HG23 ILE 37 HG23 ILE 37 8.868 -6.483 -23.254 288 HD11 ILE 37 HD11 ILE 37 9.293 -6.637 -19.213 289 HD12 ILE 37 HD12 ILE 37 8.520 -5.982 -20.658 290 HD13 ILE 37 HD13 ILE 37 8.526 -7.722 -20.372 291 HA PRO 38 HA PRO 38 13.446 -3.375 -25.629 292 HB2 PRO 38 HB2 PRO 38 13.150 -4.938 -27.829 293 HB3 PRO 38 HB3 PRO 38 14.562 -5.030 -26.768 294 HG2 PRO 38 HG2 PRO 38 12.139 -6.786 -26.853 295 HG3 PRO 38 HG3 PRO 38 13.844 -7.239 -26.680 296 HD2 PRO 38 HD2 PRO 38 12.148 -7.117 -24.573 297 HD3 PRO 38 HD3 PRO 38 13.877 -6.743 -24.429 298 H GLY 39 H GLY 39 12.224 -1.876 -26.615 299 HA2 GLY 39 HA2 GLY 39 10.445 -0.883 -27.689 300 HA3 GLY 39 HA3 GLY 39 9.862 -2.492 -28.089 301 H PHE 40 H PHE 40 10.385 -2.236 -24.792 302 HA PHE 40 HA PHE 40 7.692 -2.573 -24.114 303 HB2 PHE 40 HB2 PHE 40 9.210 -3.340 -22.511 304 HB3 PHE 40 HB3 PHE 40 10.148 -1.851 -22.545 305 HD1 PHE 40 HD1 PHE 40 6.844 -3.215 -21.537 306 HD2 PHE 40 HD2 PHE 40 9.798 -0.209 -20.944 307 HE1 PHE 40 HE1 PHE 40 5.617 -2.403 -19.566 308 HE2 PHE 40 HE2 PHE 40 8.576 0.607 -18.970 309 HZ PHE 40 HZ PHE 40 6.482 -0.489 -18.280 310 H CYS 41 H CYS 41 6.148 -1.204 -23.238 311 HA CYS 41 HA CYS 41 6.699 1.625 -22.956 312 HB2 CYS 41 HB2 CYS 41 5.157 2.402 -24.602 313 HB3 CYS 41 HB3 CYS 41 6.216 1.249 -25.407 314 H LEU 42 H LEU 42 4.183 2.634 -22.845 315 HA LEU 42 HA LEU 42 2.826 0.968 -20.831 316 HB2 LEU 42 HB2 LEU 42 2.917 3.969 -20.752 317 HB3 LEU 42 HB3 LEU 42 2.392 2.860 -19.487 318 HG LEU 42 HG LEU 42 5.239 3.168 -20.437 319 HD11 LEU 42 HD11 LEU 42 5.446 4.908 -19.081 320 HD12 LEU 42 HD12 LEU 42 4.810 3.967 -17.732 321 HD13 LEU 42 HD13 LEU 42 3.708 4.862 -18.780 322 HD21 LEU 42 HD21 LEU 42 5.821 1.513 -19.029 323 HD22 LEU 42 HD22 LEU 42 4.142 1.010 -19.229 324 HD23 LEU 42 HD23 LEU 42 4.616 1.968 -17.825 325 H VAL 43 H VAL 43 0.562 2.174 -20.363 326 HA VAL 43 HA VAL 43 -0.683 2.654 -22.993 327 HB VAL 43 HB VAL 43 -2.742 1.583 -22.087 328 HG11 VAL 43 HG11 VAL 43 -1.768 0.076 -23.463 329 HG12 VAL 43 HG12 VAL 43 -0.207 0.176 -22.647 330 HG13 VAL 43 HG13 VAL 43 -1.506 -0.796 -21.954 331 HG21 VAL 43 HG21 VAL 43 -1.465 0.010 -20.051 332 HG22 VAL 43 HG22 VAL 43 -1.348 1.725 -19.661 333 HG23 VAL 43 HG23 VAL 43 -2.925 0.993 -19.951 334 H LYS 44 H LYS 44 -3.129 3.433 -22.404 335 HA LYS 44 HA LYS 44 -2.725 6.007 -21.156 336 HB2 LYS 44 HB2 LYS 44 -4.918 6.561 -21.985 337 HB3 LYS 44 HB3 LYS 44 -4.034 5.728 -23.257 338 HG2 LYS 44 HG2 LYS 44 -5.363 3.704 -21.901 339 HG3 LYS 44 HG3 LYS 44 -6.526 5.030 -21.979 340 HD2 LYS 44 HD2 LYS 44 -6.235 5.172 -24.388 341 HD3 LYS 44 HD3 LYS 44 -5.006 3.906 -24.333 342 HE2 LYS 44 HE2 LYS 44 -6.574 2.254 -23.782 343 HE3 LYS 44 HE3 LYS 44 -7.784 3.440 -23.298 344 HZ1 LYS 44 HZ1 LYS 44 -7.218 2.362 -25.898 345 HZ2 LYS 44 HZ2 LYS 44 -7.323 4.050 -25.895 346 HZ3 LYS 44 HZ3 LYS 44 -8.617 3.122 -25.326 347 H TRP 45 H TRP 45 -3.259 3.090 -19.882 348 HA TRP 45 HA TRP 45 -4.910 4.176 -17.697 349 HB2 TRP 45 HB2 TRP 45 -4.932 1.401 -18.887 350 HB3 TRP 45 HB3 TRP 45 -5.654 1.779 -17.326 351 HD1 TRP 45 HD1 TRP 45 -6.313 1.963 -21.025 352 HE1 TRP 45 HE1 TRP 45 -8.657 2.946 -21.434 353 HE3 TRP 45 HE3 TRP 45 -7.364 3.560 -16.282 354 HZ2 TRP 45 HZ2 TRP 45 -10.682 4.229 -19.944 355 HZ3 TRP 45 HZ3 TRP 45 -9.526 4.656 -15.858 356 HH2 TRP 45 HH2 TRP 45 -11.149 4.983 -17.653 357 H LYS 46 H LYS 46 -1.907 3.776 -18.289 358 HA LYS 46 HA LYS 46 -1.269 2.313 -15.812 359 HB2 LYS 46 HB2 LYS 46 0.176 2.547 -18.426 360 HB3 LYS 46 HB3 LYS 46 1.085 2.237 -16.953 361 HG2 LYS 46 HG2 LYS 46 -1.240 0.500 -17.293 362 HG3 LYS 46 HG3 LYS 46 -0.020 0.333 -18.558 363 HD2 LYS 46 HD2 LYS 46 1.565 0.368 -16.380 364 HD3 LYS 46 HD3 LYS 46 0.109 -0.350 -15.687 365 HE2 LYS 46 HE2 LYS 46 0.119 -2.043 -17.472 366 HE3 LYS 46 HE3 LYS 46 1.601 -1.337 -18.116 367 HZ1 LYS 46 HZ1 LYS 46 1.331 -3.243 -16.085 368 HZ2 LYS 46 HZ2 LYS 46 1.986 -1.845 -15.394 369 HZ3 LYS 46 HZ3 LYS 46 2.754 -2.575 -16.712 370 H GLN 47 H GLN 47 0.255 3.194 -14.393 371 HA GLN 47 HA GLN 47 0.170 5.913 -13.941 372 HB2 GLN 47 HB2 GLN 47 1.742 3.657 -12.932 373 HB3 GLN 47 HB3 GLN 47 2.581 5.200 -12.825 374 HG2 GLN 47 HG2 GLN 47 1.169 6.021 -11.261 375 HG3 GLN 47 HG3 GLN 47 -0.221 5.139 -11.894 376 HE21 GLN 47 HE21 GLN 47 -0.637 4.703 -9.626 377 HE22 GLN 47 HE22 GLN 47 0.163 3.375 -8.863 378 H CYS 48 H CYS 48 1.514 7.647 -14.363 379 HA CYS 48 HA CYS 48 3.403 7.243 -16.584 380 HB2 CYS 48 HB2 CYS 48 2.890 9.393 -17.374 381 HB3 CYS 48 HB3 CYS 48 1.334 8.748 -16.862 382 H ASP 49 H ASP 49 3.091 8.254 -13.323 383 HA ASP 49 HA ASP 49 5.137 10.057 -12.963 384 HB2 ASP 49 HB2 ASP 49 3.660 9.420 -11.145 385 HB3 ASP 49 HB3 ASP 49 4.308 7.782 -11.151 386 H GLY 50 H GLY 50 7.193 9.984 -13.562 387 HA2 GLY 50 HA2 GLY 50 9.389 9.180 -13.525 388 HA3 GLY 50 HA3 GLY 50 8.785 7.622 -12.979 389 H ARG 51 H ARG 51 6.799 7.452 -15.130 390 HA ARG 51 HA ARG 51 8.646 6.805 -17.331 391 HB2 ARG 51 HB2 ARG 51 5.961 5.550 -16.736 392 HB3 ARG 51 HB3 ARG 51 7.102 5.046 -17.975 393 HG2 ARG 51 HG2 ARG 51 7.673 4.982 -15.022 394 HG3 ARG 51 HG3 ARG 51 7.094 3.605 -15.960 395 HD2 ARG 51 HD2 ARG 51 9.086 3.324 -17.038 396 HD3 ARG 51 HD3 ARG 51 9.500 5.034 -16.945 397 HE ARG 51 HE ARG 51 9.502 3.815 -14.375 398 HH11 ARG 51 HH11 ARG 51 11.362 4.165 -17.297 399 HH12 ARG 51 HH12 ARG 51 12.885 3.906 -16.514 400 HH21 ARG 51 HH21 ARG 51 11.502 3.472 -13.332 401 HH22 ARG 51 HH22 ARG 51 12.964 3.512 -14.258 402 H GLU 52 H GLU 52 7.773 9.391 -17.211 403 HA GLU 52 HA GLU 52 5.372 9.856 -18.657 404 HB2 GLU 52 HB2 GLU 52 6.189 12.167 -18.864 405 HB3 GLU 52 HB3 GLU 52 6.327 11.570 -17.216 406 HG2 GLU 52 HG2 GLU 52 8.760 10.950 -17.996 407 HG3 GLU 52 HG3 GLU 52 8.454 12.213 -19.187 408 H ARG 53 H ARG 53 8.492 8.864 -19.592 409 HA ARG 53 HA ARG 53 7.962 9.609 -22.392 410 HB2 ARG 53 HB2 ARG 53 10.647 8.673 -21.467 411 HB3 ARG 53 HB3 ARG 53 10.238 9.765 -22.784 412 HG2 ARG 53 HG2 ARG 53 11.010 11.328 -21.370 413 HG3 ARG 53 HG3 ARG 53 9.385 11.220 -20.688 414 HD2 ARG 53 HD2 ARG 53 10.619 10.963 -18.784 415 HD3 ARG 53 HD3 ARG 53 10.489 9.277 -19.281 416 HE ARG 53 HE ARG 53 12.743 9.255 -19.693 417 HH11 ARG 53 HH11 ARG 53 11.668 12.546 -19.335 418 HH12 ARG 53 HH12 ARG 53 13.271 13.205 -19.318 419 HH21 ARG 53 HH21 ARG 53 14.858 10.110 -19.673 420 HH22 ARG 53 HH22 ARG 53 15.084 11.819 -19.511 421 H ASP 54 H ASP 54 8.455 6.998 -20.183 422 HA ASP 54 HA ASP 54 9.166 4.961 -21.984 423 HB2 ASP 54 HB2 ASP 54 8.847 5.106 -19.282 424 HB3 ASP 54 HB3 ASP 54 7.429 4.166 -19.740 425 H CYS 55 H CYS 55 6.133 6.493 -21.290 426 HA CYS 55 HA CYS 55 4.276 4.619 -22.062 427 HB2 CYS 55 HB2 CYS 55 4.230 7.571 -22.723 428 HB3 CYS 55 HB3 CYS 55 2.835 6.498 -22.709 429 H CYS 56 H CYS 56 3.081 4.381 -24.086 430 HA CYS 56 HA CYS 56 4.807 3.844 -26.262 431 HB2 CYS 56 HB2 CYS 56 1.905 3.624 -25.718 432 HB3 CYS 56 HB3 CYS 56 2.364 3.743 -27.414 433 H ALA 57 H ALA 57 3.926 4.617 -28.563 434 HA ALA 57 HA ALA 57 4.579 7.384 -28.718 435 HB1 ALA 57 HB1 ALA 57 3.331 6.196 -31.088 436 HB2 ALA 57 HB2 ALA 57 4.894 6.990 -30.903 437 HB3 ALA 57 HB3 ALA 57 4.708 5.294 -30.457 438 H GLY 58 H GLY 58 3.290 9.108 -28.634 439 HA2 GLY 58 HA2 GLY 58 1.330 10.320 -29.246 440 HA3 GLY 58 HA3 GLY 58 0.449 8.801 -29.310 441 H LEU 59 H LEU 59 1.901 8.158 -26.656 442 HA LEU 59 HA LEU 59 -0.234 9.133 -24.981 443 HB2 LEU 59 HB2 LEU 59 2.103 7.304 -24.558 444 HB3 LEU 59 HB3 LEU 59 1.126 7.864 -23.202 445 HG LEU 59 HG LEU 59 0.197 6.188 -25.533 446 HD11 LEU 59 HD11 LEU 59 -0.399 4.763 -23.365 447 HD12 LEU 59 HD12 LEU 59 0.999 5.635 -22.737 448 HD13 LEU 59 HD13 LEU 59 1.159 4.640 -24.185 449 HD21 LEU 59 HD21 LEU 59 -1.289 7.623 -23.374 450 HD22 LEU 59 HD22 LEU 59 -1.899 6.087 -23.990 451 HD23 LEU 59 HD23 LEU 59 -1.681 7.454 -25.084 452 H GLU 60 H GLU 60 0.446 9.879 -22.685 453 HA GLU 60 HA GLU 60 2.847 11.414 -22.468 454 HB2 GLU 60 HB2 GLU 60 1.951 13.617 -22.495 455 HB3 GLU 60 HB3 GLU 60 1.394 12.833 -23.967 456 HG2 GLU 60 HG2 GLU 60 -0.697 12.266 -22.479 457 HG3 GLU 60 HG3 GLU 60 -0.137 13.661 -21.560 458 H CYS 61 H CYS 61 3.077 12.430 -20.387 459 HA CYS 61 HA CYS 61 1.927 10.909 -18.291 460 HB2 CYS 61 HB2 CYS 61 4.209 12.088 -18.344 461 HB3 CYS 61 HB3 CYS 61 3.326 13.551 -17.919 462 H TRP 62 H TRP 62 -0.268 11.103 -18.165 463 HA TRP 62 HA TRP 62 -1.558 13.679 -18.180 464 HB2 TRP 62 HB2 TRP 62 -2.495 11.386 -18.994 465 HB3 TRP 62 HB3 TRP 62 -2.895 11.140 -17.296 466 HD1 TRP 62 HD1 TRP 62 -3.269 14.718 -18.095 467 HE1 TRP 62 HE1 TRP 62 -5.746 15.312 -18.473 468 HE3 TRP 62 HE3 TRP 62 -5.187 9.994 -18.483 469 HZ2 TRP 62 HZ2 TRP 62 -8.188 13.957 -18.879 470 HZ3 TRP 62 HZ3 TRP 62 -7.604 9.730 -18.865 471 HH2 TRP 62 HH2 TRP 62 -9.072 11.673 -19.058 472 H LYS 63 H LYS 63 -2.210 14.870 -16.478 473 HA LYS 63 HA LYS 63 -1.502 13.877 -13.804 474 HB2 LYS 63 HB2 LYS 63 -0.667 16.144 -14.941 475 HB3 LYS 63 HB3 LYS 63 -2.178 16.739 -14.265 476 HG2 LYS 63 HG2 LYS 63 -0.322 15.195 -12.520 477 HG3 LYS 63 HG3 LYS 63 0.047 16.878 -12.902 478 HD2 LYS 63 HD2 LYS 63 -2.648 16.041 -11.872 479 HD3 LYS 63 HD3 LYS 63 -1.310 16.410 -10.782 480 HE2 LYS 63 HE2 LYS 63 -1.124 18.639 -11.768 481 HE3 LYS 63 HE3 LYS 63 -2.449 18.268 -12.868 482 HZ1 LYS 63 HZ1 LYS 63 -2.529 19.058 -10.105 483 HZ2 LYS 63 HZ2 LYS 63 -3.502 17.715 -10.440 484 HZ3 LYS 63 HZ3 LYS 63 -3.730 19.159 -11.292 485 H ARG 64 H ARG 64 -3.299 12.803 -13.120 486 HA ARG 64 HA ARG 64 -5.815 14.337 -13.055 487 HB2 ARG 64 HB2 ARG 64 -5.235 11.576 -13.801 488 HB3 ARG 64 HB3 ARG 64 -6.503 11.697 -12.588 489 HG2 ARG 64 HG2 ARG 64 -7.915 12.877 -13.991 490 HG3 ARG 64 HG3 ARG 64 -6.596 13.400 -15.040 491 HD2 ARG 64 HD2 ARG 64 -7.318 11.758 -16.391 492 HD3 ARG 64 HD3 ARG 64 -6.429 10.704 -15.292 493 HE ARG 64 HE ARG 64 -9.153 11.199 -14.502 494 HH11 ARG 64 HH11 ARG 64 -7.024 9.194 -16.391 495 HH12 ARG 64 HH12 ARG 64 -8.102 7.838 -16.406 496 HH21 ARG 64 HH21 ARG 64 -10.581 9.420 -14.514 497 HH22 ARG 64 HH22 ARG 64 -10.125 7.967 -15.338 498 H SER 65 H SER 65 -6.737 14.723 -11.129 499 HA SER 65 HA SER 65 -5.730 13.272 -8.777 500 HB2 SER 65 HB2 SER 65 -5.935 15.506 -7.540 501 HB3 SER 65 HB3 SER 65 -4.566 15.329 -8.637 502 HG SER 65 HG SER 65 -6.952 16.405 -9.628 503 H GLY 66 H GLY 66 -7.245 12.670 -7.322 504 HA2 GLY 66 HA2 GLY 66 -9.331 13.113 -6.155 505 HA3 GLY 66 HA3 GLY 66 -9.966 13.762 -7.659 506 H ASN 67 H ASN 67 -8.553 11.405 -9.031 507 HA ASN 67 HA ASN 67 -10.671 9.440 -8.460 508 HB2 ASN 67 HB2 ASN 67 -10.629 10.585 -10.743 509 HB3 ASN 67 HB3 ASN 67 -9.157 9.672 -11.059 510 HD21 ASN 67 HD21 ASN 67 -11.352 9.381 -12.654 511 HD22 ASN 67 HD22 ASN 67 -12.039 7.813 -12.422 512 H LYS 68 H LYS 68 -7.302 9.717 -9.569 513 HA LYS 68 HA LYS 68 -6.442 7.607 -7.851 514 HB2 LYS 68 HB2 LYS 68 -7.100 7.009 -10.666 515 HB3 LYS 68 HB3 LYS 68 -5.537 6.418 -10.118 516 HG2 LYS 68 HG2 LYS 68 -6.899 5.484 -8.108 517 HG3 LYS 68 HG3 LYS 68 -8.274 5.667 -9.200 518 HD2 LYS 68 HD2 LYS 68 -6.878 4.370 -10.898 519 HD3 LYS 68 HD3 LYS 68 -5.821 3.962 -9.545 520 HE2 LYS 68 HE2 LYS 68 -7.798 3.036 -8.357 521 HE3 LYS 68 HE3 LYS 68 -8.758 3.332 -9.807 522 HZ1 LYS 68 HZ1 LYS 68 -6.821 1.941 -10.886 523 HZ2 LYS 68 HZ2 LYS 68 -8.158 1.189 -10.174 524 HZ3 LYS 68 HZ3 LYS 68 -6.703 1.312 -9.319 525 H SER 69 H SER 69 -4.079 6.920 -8.649 526 HA SER 69 HA SER 69 -2.481 9.198 -8.404 527 HB2 SER 69 HB2 SER 69 -1.975 6.337 -9.088 528 HB3 SER 69 HB3 SER 69 -0.680 7.500 -9.376 529 HG SER 69 HG SER 69 -1.687 6.529 -7.009 530 H SER 70 H SER 70 -0.574 9.519 -10.076 531 HA SER 70 HA SER 70 -1.753 10.679 -12.381 532 HB2 SER 70 HB2 SER 70 0.356 11.557 -12.843 533 HB3 SER 70 HB3 SER 70 0.429 11.328 -11.095 534 HG SER 70 HG SER 70 1.475 9.304 -11.530 535 H VAL 71 H VAL 71 -2.261 9.759 -14.245 536 HA VAL 71 HA VAL 71 -0.893 7.256 -15.000 537 HB VAL 71 HB VAL 71 -2.990 6.712 -16.282 538 HG11 VAL 71 HG11 VAL 71 -3.694 5.471 -14.547 539 HG12 VAL 71 HG12 VAL 71 -2.311 6.176 -13.707 540 HG13 VAL 71 HG13 VAL 71 -3.920 6.874 -13.504 541 HG21 VAL 71 HG21 VAL 71 -4.030 9.057 -14.703 542 HG22 VAL 71 HG22 VAL 71 -4.016 8.860 -16.455 543 HG23 VAL 71 HG23 VAL 71 -5.068 7.851 -15.463 544 H CYS 72 H CYS 72 -1.369 6.853 -17.491 545 HA CYS 72 HA CYS 72 -0.425 9.273 -18.864 546 HB2 CYS 72 HB2 CYS 72 0.310 6.477 -18.989 547 HB3 CYS 72 HB3 CYS 72 -0.137 7.075 -20.583 548 H ALA 73 H ALA 73 -1.215 9.748 -20.992 549 HA ALA 73 HA ALA 73 -3.690 8.449 -21.816 550 HB1 ALA 73 HB1 ALA 73 -3.951 11.357 -21.884 551 HB2 ALA 73 HB2 ALA 73 -5.103 10.124 -21.371 552 HB3 ALA 73 HB3 ALA 73 -3.860 10.689 -20.254 553 HA PRO 74 HA PRO 74 -2.192 9.217 -25.870 554 HB2 PRO 74 HB2 PRO 74 -4.509 9.493 -27.257 555 HB3 PRO 74 HB3 PRO 74 -3.942 7.939 -26.635 556 HG2 PRO 74 HG2 PRO 74 -5.980 9.810 -25.490 557 HG3 PRO 74 HG3 PRO 74 -6.034 8.043 -25.624 558 HD2 PRO 74 HD2 PRO 74 -5.397 9.309 -23.316 559 HD3 PRO 74 HD3 PRO 74 -4.709 7.734 -23.763 560 H ILE 75 H ILE 75 -2.519 10.746 -27.798 561 HA ILE 75 HA ILE 75 -1.998 13.367 -27.007 562 HB ILE 75 HB ILE 75 -2.456 13.957 -29.427 563 HG12 ILE 75 HG12 ILE 75 -2.671 10.986 -29.848 564 HG13 ILE 75 HG13 ILE 75 -4.107 11.979 -29.628 565 HG21 ILE 75 HG21 ILE 75 -0.255 13.188 -28.427 566 HG22 ILE 75 HG22 ILE 75 -0.608 11.607 -29.123 567 HG23 ILE 75 HG23 ILE 75 -0.430 13.013 -30.172 568 HD11 ILE 75 HD11 ILE 75 -2.846 13.380 -31.547 569 HD12 ILE 75 HD12 ILE 75 -2.300 11.746 -31.929 570 HD13 ILE 75 HD13 ILE 75 -4.025 12.107 -31.863 571 H THR 76 H THR 76 -3.200 15.302 -27.239 572 HA THR 76 HA THR 76 -6.118 14.965 -27.392 573 HB THR 76 HB THR 76 -6.473 16.479 -25.548 574 HG1 THR 76 HG1 THR 76 -4.930 17.767 -24.897 575 HG21 THR 76 HG21 THR 76 -6.273 14.830 -24.053 576 HG22 THR 76 HG22 THR 76 -4.511 14.892 -24.123 577 HG23 THR 76 HG23 THR 76 -5.406 13.923 -25.292 Start of MODEL 4 1 H1 SER 1 H SER 1 -0.952 -3.803 -3.113 2 HA SER 1 HA SER 1 0.373 -1.484 -3.745 3 HB2 SER 1 HB2 SER 1 -0.718 -2.296 -1.040 4 HB3 SER 1 HB3 SER 1 -0.312 -0.647 -1.512 5 HG SER 1 HG SER 1 -2.579 -1.946 -1.924 6 H ASN 2 H ASN 2 2.391 -3.351 -3.785 7 HA ASN 2 HA ASN 2 4.170 -2.324 -1.682 8 HB2 ASN 2 HB2 ASN 2 3.792 -5.177 -2.562 9 HB3 ASN 2 HB3 ASN 2 5.308 -4.642 -1.842 10 HD21 ASN 2 HD21 ASN 2 4.905 -3.266 0.216 11 HD22 ASN 2 HD22 ASN 2 3.805 -3.965 1.350 12 H GLU 3 H GLU 3 6.504 -2.592 -2.260 13 HA GLU 3 HA GLU 3 6.969 -1.517 -4.854 14 HB2 GLU 3 HB2 GLU 3 8.874 -2.498 -2.725 15 HB3 GLU 3 HB3 GLU 3 9.384 -1.700 -4.205 16 HG2 GLU 3 HG2 GLU 3 9.377 0.047 -2.730 17 HG3 GLU 3 HG3 GLU 3 7.763 0.180 -3.427 18 H CYS 4 H CYS 4 8.794 -2.458 -6.244 19 HA CYS 4 HA CYS 4 8.346 -5.355 -6.552 20 HB2 CYS 4 HB2 CYS 4 8.654 -5.053 -8.960 21 HB3 CYS 4 HB3 CYS 4 7.337 -4.043 -8.372 22 H ILE 5 H ILE 5 10.171 -6.348 -7.963 23 HA ILE 5 HA ILE 5 12.582 -6.115 -6.508 24 HB ILE 5 HB ILE 5 12.092 -7.459 -9.169 25 HG12 ILE 5 HG12 ILE 5 12.331 -8.839 -6.511 26 HG13 ILE 5 HG13 ILE 5 10.787 -8.166 -7.028 27 HG21 ILE 5 HG21 ILE 5 14.118 -8.841 -8.144 28 HG22 ILE 5 HG22 ILE 5 14.364 -7.416 -9.151 29 HG23 ILE 5 HG23 ILE 5 14.460 -7.282 -7.395 30 HD11 ILE 5 HD11 ILE 5 11.709 -10.680 -7.578 31 HD12 ILE 5 HD12 ILE 5 10.415 -9.846 -8.436 32 HD13 ILE 5 HD13 ILE 5 12.061 -9.804 -9.066 33 H ARG 6 H ARG 6 14.512 -5.152 -6.982 34 HA ARG 6 HA ARG 6 14.431 -2.921 -8.793 35 HB2 ARG 6 HB2 ARG 6 16.692 -4.000 -7.098 36 HB3 ARG 6 HB3 ARG 6 16.716 -2.471 -7.968 37 HG2 ARG 6 HG2 ARG 6 16.006 -1.582 -6.052 38 HG3 ARG 6 HG3 ARG 6 14.431 -2.250 -6.489 39 HD2 ARG 6 HD2 ARG 6 14.648 -3.136 -4.399 40 HD3 ARG 6 HD3 ARG 6 15.432 -4.408 -5.334 41 HE ARG 6 HE ARG 6 17.475 -2.750 -4.696 42 HH11 ARG 6 HH11 ARG 6 14.993 -4.331 -2.837 43 HH12 ARG 6 HH12 ARG 6 15.967 -4.468 -1.410 44 HH21 ARG 6 HH21 ARG 6 18.767 -2.922 -2.824 45 HH22 ARG 6 HH22 ARG 6 18.112 -3.665 -1.403 46 H LYS 7 H LYS 7 15.563 -2.632 -10.678 47 HA LYS 7 HA LYS 7 15.978 -4.784 -12.364 48 HB2 LYS 7 HB2 LYS 7 15.777 -2.306 -12.950 49 HB3 LYS 7 HB3 LYS 7 17.496 -2.190 -12.601 50 HG2 LYS 7 HG2 LYS 7 18.078 -3.155 -14.532 51 HG3 LYS 7 HG3 LYS 7 16.791 -4.359 -14.434 52 HD2 LYS 7 HD2 LYS 7 16.175 -3.105 -16.287 53 HD3 LYS 7 HD3 LYS 7 15.225 -2.372 -14.993 54 HE2 LYS 7 HE2 LYS 7 16.449 -0.447 -14.998 55 HE3 LYS 7 HE3 LYS 7 17.926 -1.260 -15.518 56 HZ1 LYS 7 HZ1 LYS 7 15.590 -0.820 -17.292 57 HZ2 LYS 7 HZ2 LYS 7 17.132 -1.353 -17.738 58 HZ3 LYS 7 HZ3 LYS 7 16.908 0.237 -17.205 59 H TRP 8 H TRP 8 17.682 -6.064 -12.907 60 HA TRP 8 HA TRP 8 19.634 -7.203 -12.659 61 HB2 TRP 8 HB2 TRP 8 20.601 -4.413 -12.018 62 HB3 TRP 8 HB3 TRP 8 21.679 -5.797 -12.180 63 HD1 TRP 8 HD1 TRP 8 20.243 -3.072 -14.165 64 HE1 TRP 8 HE1 TRP 8 20.547 -3.506 -16.683 65 HE3 TRP 8 HE3 TRP 8 21.552 -8.010 -13.986 66 HZ2 TRP 8 HZ2 TRP 8 21.249 -5.656 -18.371 67 HZ3 TRP 8 HZ3 TRP 8 22.022 -9.183 -16.098 68 HH2 TRP 8 HH2 TRP 8 21.873 -8.028 -18.243 69 H LEU 9 H LEU 9 18.032 -7.656 -10.595 70 HA LEU 9 HA LEU 9 19.778 -7.478 -8.227 71 HB2 LEU 9 HB2 LEU 9 17.722 -6.204 -7.947 72 HB3 LEU 9 HB3 LEU 9 16.769 -7.631 -8.351 73 HG LEU 9 HG LEU 9 17.423 -8.714 -6.306 74 HD11 LEU 9 HD11 LEU 9 19.649 -8.100 -5.955 75 HD12 LEU 9 HD12 LEU 9 18.773 -7.325 -4.635 76 HD13 LEU 9 HD13 LEU 9 19.283 -6.376 -6.032 77 HD21 LEU 9 HD21 LEU 9 15.585 -7.552 -5.698 78 HD22 LEU 9 HD22 LEU 9 16.234 -6.013 -6.264 79 HD23 LEU 9 HD23 LEU 9 16.741 -6.665 -4.705 80 H SER 10 H SER 10 16.931 -9.433 -9.089 81 HA SER 10 HA SER 10 18.299 -11.854 -9.466 82 HB2 SER 10 HB2 SER 10 17.632 -12.990 -7.321 83 HB3 SER 10 HB3 SER 10 18.898 -11.777 -7.138 84 HG SER 10 HG SER 10 16.253 -11.744 -6.263 85 H CYS 11 H CYS 11 16.952 -12.926 -10.734 86 HA CYS 11 HA CYS 11 14.068 -12.493 -10.445 87 HB2 CYS 11 HB2 CYS 11 15.174 -12.120 -12.666 88 HB3 CYS 11 HB3 CYS 11 15.541 -13.841 -12.715 89 H VAL 12 H VAL 12 16.436 -14.726 -9.636 90 HA VAL 12 HA VAL 12 15.353 -17.215 -10.084 91 HB VAL 12 HB VAL 12 16.764 -16.329 -7.563 92 HG11 VAL 12 HG11 VAL 12 16.084 -18.404 -6.950 93 HG12 VAL 12 HG12 VAL 12 15.910 -18.962 -8.615 94 HG13 VAL 12 HG13 VAL 12 17.509 -18.872 -7.877 95 HG21 VAL 12 HG21 VAL 12 18.648 -17.597 -8.998 96 HG22 VAL 12 HG22 VAL 12 17.696 -16.897 -10.308 97 HG23 VAL 12 HG23 VAL 12 18.388 -15.854 -9.066 98 H ASP 13 H ASP 13 14.371 -14.792 -7.768 99 HA ASP 13 HA ASP 13 12.135 -16.536 -6.976 100 HB2 ASP 13 HB2 ASP 13 14.008 -16.129 -5.215 101 HB3 ASP 13 HB3 ASP 13 13.296 -14.525 -5.074 102 H ARG 14 H ARG 14 10.145 -15.625 -6.980 103 HA ARG 14 HA ARG 14 8.483 -14.124 -7.381 104 HB2 ARG 14 HB2 ARG 14 9.625 -12.947 -5.457 105 HB3 ARG 14 HB3 ARG 14 10.479 -11.980 -6.652 106 HG2 ARG 14 HG2 ARG 14 8.598 -10.817 -7.259 107 HG3 ARG 14 HG3 ARG 14 7.506 -12.110 -6.757 108 HD2 ARG 14 HD2 ARG 14 9.164 -10.647 -4.740 109 HD3 ARG 14 HD3 ARG 14 7.660 -9.947 -5.336 110 HE ARG 14 HE ARG 14 7.272 -12.626 -4.482 111 HH11 ARG 14 HH11 ARG 14 7.710 -9.381 -3.298 112 HH12 ARG 14 HH12 ARG 14 6.851 -9.665 -1.820 113 HH21 ARG 14 HH21 ARG 14 6.140 -13.012 -2.540 114 HH22 ARG 14 HH22 ARG 14 5.960 -11.731 -1.390 115 H LYS 15 H LYS 15 9.656 -15.005 -9.609 116 HA LYS 15 HA LYS 15 10.665 -12.919 -11.285 117 HB2 LYS 15 HB2 LYS 15 10.427 -14.589 -13.100 118 HB3 LYS 15 HB3 LYS 15 11.309 -15.212 -11.712 119 HG2 LYS 15 HG2 LYS 15 8.432 -15.716 -11.614 120 HG3 LYS 15 HG3 LYS 15 9.258 -16.482 -12.973 121 HD2 LYS 15 HD2 LYS 15 10.986 -17.101 -11.035 122 HD3 LYS 15 HD3 LYS 15 9.522 -16.969 -10.058 123 HE2 LYS 15 HE2 LYS 15 8.404 -18.600 -11.446 124 HE3 LYS 15 HE3 LYS 15 9.786 -18.666 -12.538 125 HZ1 LYS 15 HZ1 LYS 15 10.768 -19.191 -10.007 126 HZ2 LYS 15 HZ2 LYS 15 10.582 -20.288 -11.281 127 HZ3 LYS 15 HZ3 LYS 15 9.348 -20.100 -10.141 128 H ASN 16 H ASN 16 7.548 -13.901 -10.318 129 HA ASN 16 HA ASN 16 6.203 -12.839 -12.658 130 HB2 ASN 16 HB2 ASN 16 5.442 -14.838 -11.174 131 HB3 ASN 16 HB3 ASN 16 4.821 -13.590 -10.098 132 HD21 ASN 16 HD21 ASN 16 4.834 -14.365 -13.562 133 HD22 ASN 16 HD22 ASN 16 3.168 -13.991 -13.824 134 H ASP 17 H ASP 17 7.620 -11.530 -9.975 135 HA ASP 17 HA ASP 17 5.915 -9.139 -10.145 136 HB2 ASP 17 HB2 ASP 17 6.195 -10.788 -7.887 137 HB3 ASP 17 HB3 ASP 17 7.174 -9.362 -7.555 138 H CYS 18 H CYS 18 8.385 -9.793 -11.523 139 HA CYS 18 HA CYS 18 10.689 -8.739 -10.441 140 HB2 CYS 18 HB2 CYS 18 9.626 -8.919 -13.232 141 HB3 CYS 18 HB3 CYS 18 11.102 -8.004 -12.939 142 H CYS 19 H CYS 19 8.686 -6.904 -12.746 143 HA CYS 19 HA CYS 19 8.275 -4.649 -11.158 144 HB2 CYS 19 HB2 CYS 19 10.942 -4.818 -11.815 145 HB3 CYS 19 HB3 CYS 19 10.310 -3.756 -13.069 146 H GLU 20 H GLU 20 8.317 -2.578 -12.919 147 HA GLU 20 HA GLU 20 6.298 -3.420 -14.839 148 HB2 GLU 20 HB2 GLU 20 5.747 -1.499 -13.494 149 HB3 GLU 20 HB3 GLU 20 7.242 -0.693 -13.949 150 HG2 GLU 20 HG2 GLU 20 6.488 -0.417 -16.199 151 HG3 GLU 20 HG3 GLU 20 5.062 -1.408 -15.893 152 H GLY 21 H GLY 21 6.939 -4.044 -16.790 153 HA2 GLY 21 HA2 GLY 21 7.812 -3.695 -18.932 154 HA3 GLY 21 HA3 GLY 21 8.744 -2.343 -18.307 155 H LEU 22 H LEU 22 8.965 -5.201 -16.462 156 HA LEU 22 HA LEU 22 11.602 -5.763 -17.652 157 HB2 LEU 22 HB2 LEU 22 10.648 -6.069 -14.810 158 HB3 LEU 22 HB3 LEU 22 12.197 -6.666 -15.403 159 HG LEU 22 HG LEU 22 11.315 -3.793 -15.157 160 HD11 LEU 22 HD11 LEU 22 12.497 -5.516 -13.331 161 HD12 LEU 22 HD12 LEU 22 12.437 -3.757 -13.240 162 HD13 LEU 22 HD13 LEU 22 13.834 -4.555 -13.963 163 HD21 LEU 22 HD21 LEU 22 13.789 -3.451 -15.872 164 HD22 LEU 22 HD22 LEU 22 12.556 -3.713 -17.106 165 HD23 LEU 22 HD23 LEU 22 13.609 -5.040 -16.614 166 H GLU 23 H GLU 23 12.335 -7.997 -17.552 167 HA GLU 23 HA GLU 23 10.271 -10.023 -17.195 168 HB2 GLU 23 HB2 GLU 23 10.526 -10.974 -19.382 169 HB3 GLU 23 HB3 GLU 23 10.136 -9.270 -19.573 170 HG2 GLU 23 HG2 GLU 23 12.500 -8.779 -19.970 171 HG3 GLU 23 HG3 GLU 23 12.877 -10.493 -19.803 172 H CYS 24 H CYS 24 11.096 -12.162 -17.008 173 HA CYS 24 HA CYS 24 13.668 -12.274 -15.772 174 HB2 CYS 24 HB2 CYS 24 11.512 -13.681 -15.300 175 HB3 CYS 24 HB3 CYS 24 12.133 -14.721 -16.576 176 H TYR 25 H TYR 25 15.576 -12.956 -16.560 177 HA TYR 25 HA TYR 25 15.713 -13.520 -19.423 178 HB2 TYR 25 HB2 TYR 25 17.157 -11.757 -18.271 179 HB3 TYR 25 HB3 TYR 25 18.048 -13.100 -17.562 180 HD1 TYR 25 HD1 TYR 25 17.107 -11.513 -20.774 181 HD2 TYR 25 HD2 TYR 25 19.691 -14.259 -18.802 182 HE1 TYR 25 HE1 TYR 25 18.496 -11.653 -22.800 183 HE2 TYR 25 HE2 TYR 25 21.087 -14.406 -20.823 184 HH TYR 25 HH TYR 25 20.130 -12.871 -23.831 185 H LYS 26 H LYS 26 17.297 -15.170 -20.158 186 HA LYS 26 HA LYS 26 17.116 -17.558 -18.449 187 HB2 LYS 26 HB2 LYS 26 17.353 -18.855 -20.532 188 HB3 LYS 26 HB3 LYS 26 15.953 -17.792 -20.570 189 HG2 LYS 26 HG2 LYS 26 17.351 -16.155 -21.856 190 HG3 LYS 26 HG3 LYS 26 18.587 -17.411 -21.970 191 HD2 LYS 26 HD2 LYS 26 17.438 -17.716 -23.946 192 HD3 LYS 26 HD3 LYS 26 16.618 -18.864 -22.884 193 HE2 LYS 26 HE2 LYS 26 14.709 -17.614 -22.780 194 HE3 LYS 26 HE3 LYS 26 15.566 -16.089 -23.002 195 HZ1 LYS 26 HZ1 LYS 26 15.633 -17.895 -25.268 196 HZ2 LYS 26 HZ2 LYS 26 15.400 -16.220 -25.223 197 HZ3 LYS 26 HZ3 LYS 26 14.108 -17.262 -24.899 198 H ARG 27 H ARG 27 18.924 -18.281 -17.555 199 HA ARG 27 HA ARG 27 21.427 -18.248 -18.987 200 HB2 ARG 27 HB2 ARG 27 21.049 -15.973 -17.711 201 HB3 ARG 27 HB3 ARG 27 21.525 -16.923 -16.309 202 HG2 ARG 27 HG2 ARG 27 23.663 -17.341 -17.183 203 HG3 ARG 27 HG3 ARG 27 23.192 -16.817 -18.800 204 HD2 ARG 27 HD2 ARG 27 22.705 -14.547 -17.582 205 HD3 ARG 27 HD3 ARG 27 23.824 -15.191 -16.380 206 HE ARG 27 HE ARG 27 24.978 -15.451 -18.923 207 HH11 ARG 27 HH11 ARG 27 24.074 -12.983 -16.641 208 HH12 ARG 27 HH12 ARG 27 25.298 -11.872 -17.159 209 HH21 ARG 27 HH21 ARG 27 26.594 -13.998 -19.615 210 HH22 ARG 27 HH22 ARG 27 26.730 -12.450 -18.852 211 H ARG 28 H ARG 28 22.710 -19.904 -18.378 212 HA ARG 28 HA ARG 28 21.839 -21.473 -16.046 213 HB2 ARG 28 HB2 ARG 28 23.158 -22.277 -18.632 214 HB3 ARG 28 HB3 ARG 28 23.116 -23.344 -17.235 215 HG2 ARG 28 HG2 ARG 28 20.599 -23.058 -17.269 216 HG3 ARG 28 HG3 ARG 28 20.811 -22.316 -18.857 217 HD2 ARG 28 HD2 ARG 28 21.452 -24.283 -19.841 218 HD3 ARG 28 HD3 ARG 28 22.103 -24.945 -18.343 219 HE ARG 28 HE ARG 28 19.408 -25.178 -19.315 220 HH11 ARG 28 HH11 ARG 28 21.457 -25.243 -16.501 221 HH12 ARG 28 HH12 ARG 28 20.365 -26.212 -15.568 222 HH21 ARG 28 HH21 ARG 28 17.962 -26.455 -18.097 223 HH22 ARG 28 HH22 ARG 28 18.378 -26.903 -16.477 224 H HIS 29 H HIS 29 24.743 -20.481 -17.842 225 HA HIS 29 HA HIS 29 26.642 -21.438 -16.029 226 HB2 HIS 29 HB2 HIS 29 26.708 -19.171 -18.015 227 HB3 HIS 29 HB3 HIS 29 28.111 -19.600 -17.040 228 HD1 HIS 29 HD1 HIS 29 26.274 -20.540 -20.074 229 HD2 HIS 29 HD2 HIS 29 29.144 -22.239 -17.596 230 HE1 HIS 29 HE1 HIS 29 27.245 -22.454 -21.384 231 H SER 30 H SER 30 25.161 -18.214 -16.274 232 HA SER 30 HA SER 30 26.068 -17.693 -13.517 233 HB2 SER 30 HB2 SER 30 26.002 -15.952 -15.938 234 HB3 SER 30 HB3 SER 30 25.670 -15.202 -14.377 235 HG SER 30 HG SER 30 27.707 -16.456 -13.765 236 H PHE 31 H PHE 31 24.659 -16.372 -12.203 237 HA PHE 31 HA PHE 31 21.990 -17.221 -12.248 238 HB2 PHE 31 HB2 PHE 31 21.641 -15.782 -10.378 239 HB3 PHE 31 HB3 PHE 31 23.289 -16.386 -10.245 240 HD1 PHE 31 HD1 PHE 31 25.175 -14.886 -11.041 241 HD2 PHE 31 HD2 PHE 31 21.201 -13.496 -10.414 242 HE1 PHE 31 HE1 PHE 31 26.009 -12.575 -10.906 243 HE2 PHE 31 HE2 PHE 31 22.029 -11.182 -10.279 244 HZ PHE 31 HZ PHE 31 24.435 -10.720 -10.523 245 H GLU 32 H GLU 32 20.158 -16.403 -13.095 246 HA GLU 32 HA GLU 32 20.431 -14.096 -14.874 247 HB2 GLU 32 HB2 GLU 32 18.465 -14.873 -15.989 248 HB3 GLU 32 HB3 GLU 32 19.511 -16.263 -15.735 249 HG2 GLU 32 HG2 GLU 32 18.074 -16.549 -13.560 250 HG3 GLU 32 HG3 GLU 32 16.906 -15.594 -14.469 251 H VAL 33 H VAL 33 19.059 -12.321 -14.790 252 HA VAL 33 HA VAL 33 17.256 -12.133 -12.478 253 HB VAL 33 HB VAL 33 18.050 -9.942 -11.887 254 HG11 VAL 33 HG11 VAL 33 19.380 -12.220 -11.355 255 HG12 VAL 33 HG12 VAL 33 20.668 -11.281 -12.114 256 HG13 VAL 33 HG13 VAL 33 19.833 -10.649 -10.694 257 HG21 VAL 33 HG21 VAL 33 19.457 -10.155 -14.463 258 HG22 VAL 33 HG22 VAL 33 18.801 -8.739 -13.640 259 HG23 VAL 33 HG23 VAL 33 20.370 -9.390 -13.162 260 H CYS 34 H CYS 34 16.051 -9.895 -12.649 261 HA CYS 34 HA CYS 34 14.531 -9.997 -15.041 262 HB2 CYS 34 HB2 CYS 34 14.564 -7.801 -12.962 263 HB3 CYS 34 HB3 CYS 34 13.279 -8.138 -14.117 264 H VAL 35 H VAL 35 14.649 -8.839 -16.877 265 HA VAL 35 HA VAL 35 16.604 -6.638 -16.998 266 HB VAL 35 HB VAL 35 16.942 -7.374 -19.432 267 HG11 VAL 35 HG11 VAL 35 18.032 -9.389 -17.512 268 HG12 VAL 35 HG12 VAL 35 18.838 -8.561 -18.846 269 HG13 VAL 35 HG13 VAL 35 18.476 -7.690 -17.355 270 HG21 VAL 35 HG21 VAL 35 16.435 -9.571 -20.062 271 HG22 VAL 35 HG22 VAL 35 16.102 -10.067 -18.403 272 HG23 VAL 35 HG23 VAL 35 14.977 -9.006 -19.248 273 HA PRO 36 HA PRO 36 13.476 -4.171 -18.841 274 HB2 PRO 36 HB2 PRO 36 14.925 -2.652 -20.563 275 HB3 PRO 36 HB3 PRO 36 14.983 -2.437 -18.809 276 HG2 PRO 36 HG2 PRO 36 16.891 -3.889 -20.602 277 HG3 PRO 36 HG3 PRO 36 17.238 -2.799 -19.247 278 HD2 PRO 36 HD2 PRO 36 17.351 -5.495 -19.016 279 HD3 PRO 36 HD3 PRO 36 16.872 -4.440 -17.671 280 H ILE 37 H ILE 37 11.995 -4.552 -20.364 281 HA ILE 37 HA ILE 37 12.593 -6.303 -22.567 282 HB ILE 37 HB ILE 37 10.032 -4.864 -21.866 283 HG12 ILE 37 HG12 ILE 37 10.421 -7.806 -21.563 284 HG13 ILE 37 HG13 ILE 37 11.146 -6.748 -20.358 285 HG21 ILE 37 HG21 ILE 37 10.506 -7.120 -23.811 286 HG22 ILE 37 HG22 ILE 37 8.946 -6.408 -23.403 287 HG23 ILE 37 HG23 ILE 37 10.161 -5.445 -24.242 288 HD11 ILE 37 HD11 ILE 37 8.804 -5.704 -20.187 289 HD12 ILE 37 HD12 ILE 37 8.262 -7.172 -21.000 290 HD13 ILE 37 HD13 ILE 37 9.091 -7.279 -19.448 291 HA PRO 38 HA PRO 38 13.549 -3.112 -25.481 292 HB2 PRO 38 HB2 PRO 38 13.438 -4.649 -27.716 293 HB3 PRO 38 HB3 PRO 38 14.787 -4.708 -26.576 294 HG2 PRO 38 HG2 PRO 38 12.436 -6.546 -26.826 295 HG3 PRO 38 HG3 PRO 38 14.144 -6.944 -26.560 296 HD2 PRO 38 HD2 PRO 38 12.325 -6.912 -24.555 297 HD3 PRO 38 HD3 PRO 38 14.029 -6.482 -24.304 298 H GLY 39 H GLY 39 12.308 -1.627 -26.451 299 HA2 GLY 39 HA2 GLY 39 10.577 -0.695 -27.663 300 HA3 GLY 39 HA3 GLY 39 10.049 -2.321 -28.074 301 H PHE 40 H PHE 40 10.389 -2.146 -24.779 302 HA PHE 40 HA PHE 40 7.680 -2.484 -24.225 303 HB2 PHE 40 HB2 PHE 40 9.141 -3.252 -22.566 304 HB3 PHE 40 HB3 PHE 40 10.045 -1.741 -22.529 305 HD1 PHE 40 HD1 PHE 40 6.700 -3.162 -21.745 306 HD2 PHE 40 HD2 PHE 40 9.602 -0.168 -20.892 307 HE1 PHE 40 HE1 PHE 40 5.355 -2.410 -19.827 308 HE2 PHE 40 HE2 PHE 40 8.262 0.589 -18.972 309 HZ PHE 40 HZ PHE 40 6.136 -0.534 -18.436 310 H CYS 41 H CYS 41 6.079 -1.140 -23.418 311 HA CYS 41 HA CYS 41 6.603 1.705 -23.142 312 HB2 CYS 41 HB2 CYS 41 4.977 2.406 -24.772 313 HB3 CYS 41 HB3 CYS 41 6.122 1.332 -25.570 314 H LEU 42 H LEU 42 4.079 2.683 -23.022 315 HA LEU 42 HA LEU 42 2.734 1.018 -20.999 316 HB2 LEU 42 HB2 LEU 42 2.858 4.015 -20.872 317 HB3 LEU 42 HB3 LEU 42 2.342 2.889 -19.618 318 HG LEU 42 HG LEU 42 5.178 3.194 -20.602 319 HD11 LEU 42 HD11 LEU 42 3.620 4.697 -18.664 320 HD12 LEU 42 HD12 LEU 42 5.201 5.044 -19.363 321 HD13 LEU 42 HD13 LEU 42 5.072 3.978 -17.964 322 HD21 LEU 42 HD21 LEU 42 5.810 1.673 -18.965 323 HD22 LEU 42 HD22 LEU 42 4.329 0.966 -19.611 324 HD23 LEU 42 HD23 LEU 42 4.294 1.841 -18.080 325 H VAL 43 H VAL 43 0.456 1.967 -20.541 326 HA VAL 43 HA VAL 43 -0.791 2.595 -23.138 327 HB VAL 43 HB VAL 43 -2.846 1.517 -22.232 328 HG11 VAL 43 HG11 VAL 43 -0.302 0.028 -22.686 329 HG12 VAL 43 HG12 VAL 43 -1.753 -0.866 -22.222 330 HG13 VAL 43 HG13 VAL 43 -1.751 0.116 -23.688 331 HG21 VAL 43 HG21 VAL 43 -3.016 0.891 -20.106 332 HG22 VAL 43 HG22 VAL 43 -1.548 -0.080 -20.221 333 HG23 VAL 43 HG23 VAL 43 -1.442 1.632 -19.813 334 H LYS 44 H LYS 44 -3.235 3.367 -22.520 335 HA LYS 44 HA LYS 44 -2.823 5.930 -21.256 336 HB2 LYS 44 HB2 LYS 44 -5.073 6.450 -22.017 337 HB3 LYS 44 HB3 LYS 44 -4.147 5.727 -23.325 338 HG2 LYS 44 HG2 LYS 44 -5.611 3.752 -21.782 339 HG3 LYS 44 HG3 LYS 44 -6.662 4.978 -22.494 340 HD2 LYS 44 HD2 LYS 44 -5.311 4.544 -24.655 341 HD3 LYS 44 HD3 LYS 44 -4.807 3.054 -23.854 342 HE2 LYS 44 HE2 LYS 44 -7.243 2.550 -23.495 343 HE3 LYS 44 HE3 LYS 44 -7.610 3.923 -24.539 344 HZ1 LYS 44 HZ1 LYS 44 -7.224 1.382 -25.376 345 HZ2 LYS 44 HZ2 LYS 44 -5.714 2.082 -25.675 346 HZ3 LYS 44 HZ3 LYS 44 -7.108 2.755 -26.357 347 H TRP 45 H TRP 45 -3.338 2.999 -20.000 348 HA TRP 45 HA TRP 45 -4.964 4.063 -17.786 349 HB2 TRP 45 HB2 TRP 45 -4.939 1.239 -18.868 350 HB3 TRP 45 HB3 TRP 45 -5.799 1.754 -17.420 351 HD1 TRP 45 HD1 TRP 45 -6.370 1.192 -20.982 352 HE1 TRP 45 HE1 TRP 45 -8.548 2.318 -21.765 353 HE3 TRP 45 HE3 TRP 45 -7.208 4.228 -16.954 354 HZ2 TRP 45 HZ2 TRP 45 -10.378 4.240 -20.803 355 HZ3 TRP 45 HZ3 TRP 45 -9.194 5.680 -16.966 356 HH2 TRP 45 HH2 TRP 45 -10.744 5.685 -18.851 357 H LYS 46 H LYS 46 -1.980 3.767 -18.365 358 HA LYS 46 HA LYS 46 -1.297 2.261 -15.925 359 HB2 LYS 46 HB2 LYS 46 0.148 2.562 -18.537 360 HB3 LYS 46 HB3 LYS 46 1.043 2.201 -17.067 361 HG2 LYS 46 HG2 LYS 46 -1.283 0.484 -17.483 362 HG3 LYS 46 HG3 LYS 46 -0.054 0.354 -18.743 363 HD2 LYS 46 HD2 LYS 46 1.490 0.332 -16.514 364 HD3 LYS 46 HD3 LYS 46 0.031 -0.461 -15.915 365 HE2 LYS 46 HE2 LYS 46 0.150 -2.027 -17.827 366 HE3 LYS 46 HE3 LYS 46 1.661 -1.267 -18.323 367 HZ1 LYS 46 HZ1 LYS 46 1.981 -1.909 -15.663 368 HZ2 LYS 46 HZ2 LYS 46 2.684 -2.690 -16.988 369 HZ3 LYS 46 HZ3 LYS 46 1.224 -3.257 -16.350 370 H GLN 47 H GLN 47 0.215 3.151 -14.503 371 HA GLN 47 HA GLN 47 0.111 5.900 -14.104 372 HB2 GLN 47 HB2 GLN 47 1.604 3.642 -12.960 373 HB3 GLN 47 HB3 GLN 47 2.417 5.194 -12.810 374 HG2 GLN 47 HG2 GLN 47 0.831 6.052 -11.413 375 HG3 GLN 47 HG3 GLN 47 -0.450 5.028 -12.057 376 HE21 GLN 47 HE21 GLN 47 -0.753 4.926 -9.623 377 HE22 GLN 47 HE22 GLN 47 0.031 3.619 -8.809 378 H CYS 48 H CYS 48 1.389 7.604 -14.646 379 HA CYS 48 HA CYS 48 3.406 7.099 -16.714 380 HB2 CYS 48 HB2 CYS 48 3.019 9.277 -17.518 381 HB3 CYS 48 HB3 CYS 48 1.420 8.680 -17.084 382 H ASP 49 H ASP 49 3.056 8.075 -13.463 383 HA ASP 49 HA ASP 49 5.138 9.823 -13.028 384 HB2 ASP 49 HB2 ASP 49 3.592 9.180 -11.259 385 HB3 ASP 49 HB3 ASP 49 4.228 7.537 -11.267 386 H GLY 50 H GLY 50 7.214 9.711 -13.548 387 HA2 GLY 50 HA2 GLY 50 9.385 8.824 -13.418 388 HA3 GLY 50 HA3 GLY 50 8.696 7.254 -13.032 389 H ARG 51 H ARG 51 6.830 7.317 -15.285 390 HA ARG 51 HA ARG 51 8.769 6.785 -17.436 391 HB2 ARG 51 HB2 ARG 51 6.114 5.505 -16.798 392 HB3 ARG 51 HB3 ARG 51 6.940 5.267 -18.331 393 HG2 ARG 51 HG2 ARG 51 7.547 3.415 -17.067 394 HG3 ARG 51 HG3 ARG 51 8.933 4.496 -16.921 395 HD2 ARG 51 HD2 ARG 51 8.299 5.162 -14.739 396 HD3 ARG 51 HD3 ARG 51 6.706 4.424 -14.902 397 HE ARG 51 HE ARG 51 8.547 2.383 -15.197 398 HH11 ARG 51 HH11 ARG 51 7.642 4.681 -12.744 399 HH12 ARG 51 HH12 ARG 51 8.086 3.647 -11.426 400 HH21 ARG 51 HH21 ARG 51 9.135 1.012 -13.473 401 HH22 ARG 51 HH22 ARG 51 8.936 1.560 -11.842 402 H GLU 52 H GLU 52 7.814 9.389 -17.028 403 HA GLU 52 HA GLU 52 5.558 10.042 -18.577 404 HB2 GLU 52 HB2 GLU 52 6.315 12.315 -18.460 405 HB3 GLU 52 HB3 GLU 52 6.666 11.547 -16.918 406 HG2 GLU 52 HG2 GLU 52 9.005 11.150 -17.824 407 HG3 GLU 52 HG3 GLU 52 8.575 12.273 -19.112 408 H ARG 53 H ARG 53 8.661 8.994 -19.481 409 HA ARG 53 HA ARG 53 8.134 9.786 -22.269 410 HB2 ARG 53 HB2 ARG 53 10.826 9.496 -22.266 411 HB3 ARG 53 HB3 ARG 53 10.005 11.035 -22.042 412 HG2 ARG 53 HG2 ARG 53 10.426 11.089 -19.781 413 HG3 ARG 53 HG3 ARG 53 10.611 9.337 -19.668 414 HD2 ARG 53 HD2 ARG 53 12.538 11.159 -21.100 415 HD3 ARG 53 HD3 ARG 53 12.740 10.615 -19.435 416 HE ARG 53 HE ARG 53 12.402 8.340 -20.970 417 HH11 ARG 53 HH11 ARG 53 14.663 10.979 -20.756 418 HH12 ARG 53 HH12 ARG 53 16.010 10.042 -21.315 419 HH21 ARG 53 HH21 ARG 53 14.166 7.097 -21.707 420 HH22 ARG 53 HH22 ARG 53 15.726 7.835 -21.857 421 H ASP 54 H ASP 54 7.595 7.312 -20.631 422 HA ASP 54 HA ASP 54 9.136 5.390 -22.248 423 HB2 ASP 54 HB2 ASP 54 8.816 5.477 -19.497 424 HB3 ASP 54 HB3 ASP 54 7.653 4.255 -20.005 425 H CYS 55 H CYS 55 6.000 6.597 -21.484 426 HA CYS 55 HA CYS 55 4.317 4.517 -22.139 427 HB2 CYS 55 HB2 CYS 55 3.922 7.419 -22.895 428 HB3 CYS 55 HB3 CYS 55 2.659 6.204 -22.730 429 H CYS 56 H CYS 56 2.973 4.317 -24.158 430 HA CYS 56 HA CYS 56 4.659 3.734 -26.355 431 HB2 CYS 56 HB2 CYS 56 1.775 3.530 -25.744 432 HB3 CYS 56 HB3 CYS 56 2.176 3.673 -27.453 433 H ALA 57 H ALA 57 3.724 4.493 -28.650 434 HA ALA 57 HA ALA 57 4.406 7.257 -28.838 435 HB1 ALA 57 HB1 ALA 57 3.521 6.745 -31.299 436 HB2 ALA 57 HB2 ALA 57 5.101 6.207 -30.726 437 HB3 ALA 57 HB3 ALA 57 3.740 5.087 -30.739 438 H GLY 58 H GLY 58 3.124 8.983 -28.748 439 HA2 GLY 58 HA2 GLY 58 1.161 10.194 -29.370 440 HA3 GLY 58 HA3 GLY 58 0.274 8.677 -29.399 441 H LEU 59 H LEU 59 1.697 8.020 -26.761 442 HA LEU 59 HA LEU 59 -0.389 9.087 -25.080 443 HB2 LEU 59 HB2 LEU 59 1.871 7.161 -24.667 444 HB3 LEU 59 HB3 LEU 59 0.934 7.770 -23.304 445 HG LEU 59 HG LEU 59 -0.144 6.177 -25.629 446 HD11 LEU 59 HD11 LEU 59 1.064 4.690 -24.280 447 HD12 LEU 59 HD12 LEU 59 -0.607 4.534 -23.741 448 HD13 LEU 59 HD13 LEU 59 0.541 5.478 -22.791 449 HD21 LEU 59 HD21 LEU 59 -1.443 7.558 -23.319 450 HD22 LEU 59 HD22 LEU 59 -2.145 6.078 -23.972 451 HD23 LEU 59 HD23 LEU 59 -1.941 7.490 -25.010 452 H GLU 60 H GLU 60 0.319 9.825 -22.798 453 HA GLU 60 HA GLU 60 2.784 11.283 -22.628 454 HB2 GLU 60 HB2 GLU 60 1.940 13.500 -22.605 455 HB3 GLU 60 HB3 GLU 60 1.298 12.746 -24.056 456 HG2 GLU 60 HG2 GLU 60 -0.800 12.277 -22.742 457 HG3 GLU 60 HG3 GLU 60 -0.143 13.326 -21.488 458 H CYS 61 H CYS 61 2.993 12.432 -20.550 459 HA CYS 61 HA CYS 61 1.941 10.848 -18.424 460 HB2 CYS 61 HB2 CYS 61 4.218 12.118 -18.603 461 HB3 CYS 61 HB3 CYS 61 3.301 13.487 -17.985 462 H TRP 62 H TRP 62 -0.264 11.055 -18.291 463 HA TRP 62 HA TRP 62 -1.519 13.651 -18.205 464 HB2 TRP 62 HB2 TRP 62 -2.496 11.414 -19.116 465 HB3 TRP 62 HB3 TRP 62 -2.886 11.092 -17.429 466 HD1 TRP 62 HD1 TRP 62 -3.219 14.709 -18.058 467 HE1 TRP 62 HE1 TRP 62 -5.690 15.351 -18.383 468 HE3 TRP 62 HE3 TRP 62 -5.204 10.034 -18.640 469 HZ2 TRP 62 HZ2 TRP 62 -8.155 14.049 -18.826 470 HZ3 TRP 62 HZ3 TRP 62 -7.627 9.819 -19.009 471 HH2 TRP 62 HH2 TRP 62 -9.070 11.785 -19.100 472 H LYS 63 H LYS 63 -1.872 14.848 -16.456 473 HA LYS 63 HA LYS 63 -1.322 13.670 -13.826 474 HB2 LYS 63 HB2 LYS 63 -0.127 15.771 -14.681 475 HB3 LYS 63 HB3 LYS 63 -1.655 16.604 -14.424 476 HG2 LYS 63 HG2 LYS 63 -0.242 16.958 -12.524 477 HG3 LYS 63 HG3 LYS 63 -1.583 15.912 -12.050 478 HD2 LYS 63 HD2 LYS 63 0.524 15.110 -11.116 479 HD3 LYS 63 HD3 LYS 63 -0.132 13.952 -12.276 480 HE2 LYS 63 HE2 LYS 63 1.678 15.949 -13.434 481 HE3 LYS 63 HE3 LYS 63 2.433 14.870 -12.262 482 HZ1 LYS 63 HZ1 LYS 63 1.669 14.338 -14.931 483 HZ2 LYS 63 HZ2 LYS 63 0.860 13.281 -13.889 484 HZ3 LYS 63 HZ3 LYS 63 2.550 13.364 -13.863 485 H ARG 64 H ARG 64 -3.181 12.765 -13.110 486 HA ARG 64 HA ARG 64 -5.564 14.496 -13.019 487 HB2 ARG 64 HB2 ARG 64 -5.222 11.677 -13.769 488 HB3 ARG 64 HB3 ARG 64 -6.533 11.961 -12.632 489 HG2 ARG 64 HG2 ARG 64 -7.706 13.301 -14.124 490 HG3 ARG 64 HG3 ARG 64 -6.279 13.609 -15.117 491 HD2 ARG 64 HD2 ARG 64 -7.308 12.072 -16.442 492 HD3 ARG 64 HD3 ARG 64 -6.388 10.975 -15.413 493 HE ARG 64 HE ARG 64 -8.356 10.211 -14.531 494 HH11 ARG 64 HH11 ARG 64 -8.942 13.213 -16.195 495 HH12 ARG 64 HH12 ARG 64 -10.665 13.109 -16.046 496 HH21 ARG 64 HH21 ARG 64 -10.624 10.063 -14.330 497 HH22 ARG 64 HH22 ARG 64 -11.620 11.318 -14.984 498 H SER 65 H SER 65 -6.512 14.854 -11.087 499 HA SER 65 HA SER 65 -5.577 13.298 -8.773 500 HB2 SER 65 HB2 SER 65 -5.747 15.559 -7.506 501 HB3 SER 65 HB3 SER 65 -4.320 15.254 -8.496 502 HG SER 65 HG SER 65 -5.216 17.333 -8.871 503 H GLY 66 H GLY 66 -7.101 12.819 -7.256 504 HA2 GLY 66 HA2 GLY 66 -9.182 13.387 -6.117 505 HA3 GLY 66 HA3 GLY 66 -9.792 13.964 -7.661 506 H ASN 67 H ASN 67 -8.500 11.555 -8.970 507 HA ASN 67 HA ASN 67 -10.602 9.629 -8.233 508 HB2 ASN 67 HB2 ASN 67 -10.803 10.611 -10.512 509 HB3 ASN 67 HB3 ASN 67 -9.228 9.934 -10.910 510 HD21 ASN 67 HD21 ASN 67 -9.001 7.619 -10.869 511 HD22 ASN 67 HD22 ASN 67 -10.368 6.621 -11.212 512 H LYS 68 H LYS 68 -7.289 9.840 -9.514 513 HA LYS 68 HA LYS 68 -6.376 7.761 -7.780 514 HB2 LYS 68 HB2 LYS 68 -7.118 7.129 -10.572 515 HB3 LYS 68 HB3 LYS 68 -5.555 6.520 -10.043 516 HG2 LYS 68 HG2 LYS 68 -6.871 5.625 -8.000 517 HG3 LYS 68 HG3 LYS 68 -8.285 5.850 -9.031 518 HD2 LYS 68 HD2 LYS 68 -5.850 4.285 -9.870 519 HD3 LYS 68 HD3 LYS 68 -7.258 3.553 -9.095 520 HE2 LYS 68 HE2 LYS 68 -7.676 5.271 -11.490 521 HE3 LYS 68 HE3 LYS 68 -7.027 3.648 -11.720 522 HZ1 LYS 68 HZ1 LYS 68 -9.584 4.069 -11.722 523 HZ2 LYS 68 HZ2 LYS 68 -9.408 3.992 -10.042 524 HZ3 LYS 68 HZ3 LYS 68 -8.949 2.676 -11.001 525 H SER 69 H SER 69 -4.046 7.047 -8.661 526 HA SER 69 HA SER 69 -2.430 9.321 -8.506 527 HB2 SER 69 HB2 SER 69 -1.929 6.458 -9.240 528 HB3 SER 69 HB3 SER 69 -0.641 7.645 -9.446 529 HG SER 69 HG SER 69 -1.590 6.503 -7.173 530 H SER 70 H SER 70 -0.572 9.579 -10.258 531 HA SER 70 HA SER 70 -1.843 10.693 -12.549 532 HB2 SER 70 HB2 SER 70 0.170 11.702 -12.975 533 HB3 SER 70 HB3 SER 70 0.441 11.284 -11.283 534 HG SER 70 HG SER 70 1.360 9.263 -12.177 535 H VAL 71 H VAL 71 -2.338 9.752 -14.410 536 HA VAL 71 HA VAL 71 -0.977 7.231 -15.113 537 HB VAL 71 HB VAL 71 -3.074 6.663 -16.379 538 HG11 VAL 71 HG11 VAL 71 -3.857 6.963 -13.531 539 HG12 VAL 71 HG12 VAL 71 -3.940 5.551 -14.587 540 HG13 VAL 71 HG13 VAL 71 -2.396 6.047 -13.895 541 HG21 VAL 71 HG21 VAL 71 -4.800 8.065 -16.505 542 HG22 VAL 71 HG22 VAL 71 -4.800 8.329 -14.762 543 HG23 VAL 71 HG23 VAL 71 -3.751 9.295 -15.799 544 H CYS 72 H CYS 72 -1.476 6.781 -17.598 545 HA CYS 72 HA CYS 72 -0.481 9.150 -19.017 546 HB2 CYS 72 HB2 CYS 72 0.088 6.297 -19.158 547 HB3 CYS 72 HB3 CYS 72 -0.267 6.979 -20.742 548 H ALA 73 H ALA 73 -1.301 9.673 -21.108 549 HA ALA 73 HA ALA 73 -3.820 8.442 -21.908 550 HB1 ALA 73 HB1 ALA 73 -5.174 10.130 -21.375 551 HB2 ALA 73 HB2 ALA 73 -3.862 10.726 -20.357 552 HB3 ALA 73 HB3 ALA 73 -4.049 11.336 -22.001 553 HA PRO 74 HA PRO 74 -2.354 9.185 -25.978 554 HB2 PRO 74 HB2 PRO 74 -4.679 9.533 -27.334 555 HB3 PRO 74 HB3 PRO 74 -4.148 7.961 -26.725 556 HG2 PRO 74 HG2 PRO 74 -6.117 9.883 -25.546 557 HG3 PRO 74 HG3 PRO 74 -6.224 8.119 -25.687 558 HD2 PRO 74 HD2 PRO 74 -5.521 9.356 -23.383 559 HD3 PRO 74 HD3 PRO 74 -4.884 7.765 -23.845 560 H ILE 75 H ILE 75 -2.554 10.737 -27.859 561 HA ILE 75 HA ILE 75 -1.980 13.332 -27.078 562 HB ILE 75 HB ILE 75 -2.463 13.951 -29.489 563 HG12 ILE 75 HG12 ILE 75 -2.768 10.987 -29.918 564 HG13 ILE 75 HG13 ILE 75 -4.171 12.021 -29.674 565 HG21 ILE 75 HG21 ILE 75 -0.682 11.546 -29.259 566 HG22 ILE 75 HG22 ILE 75 -0.469 12.983 -30.256 567 HG23 ILE 75 HG23 ILE 75 -0.272 13.087 -28.507 568 HD11 ILE 75 HD11 ILE 75 -3.088 13.420 -31.601 569 HD12 ILE 75 HD12 ILE 75 -2.286 11.891 -31.965 570 HD13 ILE 75 HD13 ILE 75 -4.048 11.981 -31.950 571 H THR 76 H THR 76 -3.120 15.305 -27.268 572 HA THR 76 HA THR 76 -6.030 15.136 -27.534 573 HB THR 76 HB THR 76 -6.276 16.642 -25.524 574 HG1 THR 76 HG1 THR 76 -3.691 15.679 -24.834 575 HG21 THR 76 HG21 THR 76 -6.817 14.238 -25.459 576 HG22 THR 76 HG22 THR 76 -6.200 14.820 -23.912 577 HG23 THR 76 HG23 THR 76 -5.156 13.889 -24.985 Start of MODEL 5 1 H1 SER 1 H SER 1 -0.171 -2.243 -0.257 2 HA SER 1 HA SER 1 0.423 -3.284 -2.868 3 HB2 SER 1 HB2 SER 1 0.674 -0.306 -2.380 4 HB3 SER 1 HB3 SER 1 1.314 -1.161 -3.784 5 HG SER 1 HG SER 1 -1.424 -1.163 -3.044 6 H ASN 2 H ASN 2 2.830 -2.605 -3.417 7 HA ASN 2 HA ASN 2 4.565 -2.047 -1.241 8 HB2 ASN 2 HB2 ASN 2 5.658 -4.331 -1.206 9 HB3 ASN 2 HB3 ASN 2 4.074 -4.239 -0.443 10 HD21 ASN 2 HD21 ASN 2 5.756 -5.177 -3.384 11 HD22 ASN 2 HD22 ASN 2 4.606 -6.367 -3.881 12 H GLU 3 H GLU 3 6.905 -2.542 -1.865 13 HA GLU 3 HA GLU 3 7.386 -1.439 -4.434 14 HB2 GLU 3 HB2 GLU 3 9.122 -2.525 -2.246 15 HB3 GLU 3 HB3 GLU 3 9.824 -2.164 -3.818 16 HG2 GLU 3 HG2 GLU 3 9.392 0.113 -3.629 17 HG3 GLU 3 HG3 GLU 3 8.195 -0.124 -2.356 18 H CYS 4 H CYS 4 9.088 -2.512 -5.909 19 HA CYS 4 HA CYS 4 8.331 -5.332 -6.313 20 HB2 CYS 4 HB2 CYS 4 8.535 -4.973 -8.714 21 HB3 CYS 4 HB3 CYS 4 7.379 -3.834 -8.031 22 H ILE 5 H ILE 5 9.989 -6.430 -7.850 23 HA ILE 5 HA ILE 5 12.496 -6.415 -6.505 24 HB ILE 5 HB ILE 5 11.763 -7.769 -9.104 25 HG12 ILE 5 HG12 ILE 5 11.786 -8.925 -6.311 26 HG13 ILE 5 HG13 ILE 5 10.330 -8.358 -7.121 27 HG21 ILE 5 HG21 ILE 5 13.640 -9.341 -8.026 28 HG22 ILE 5 HG22 ILE 5 14.011 -8.023 -9.136 29 HG23 ILE 5 HG23 ILE 5 14.174 -7.782 -7.397 30 HD11 ILE 5 HD11 ILE 5 11.179 -10.904 -7.159 31 HD12 ILE 5 HD12 ILE 5 10.198 -10.174 -8.431 32 HD13 ILE 5 HD13 ILE 5 11.947 -10.297 -8.626 33 H ARG 6 H ARG 6 14.036 -4.951 -6.784 34 HA ARG 6 HA ARG 6 14.147 -3.035 -8.786 35 HB2 ARG 6 HB2 ARG 6 16.348 -4.167 -7.056 36 HB3 ARG 6 HB3 ARG 6 16.553 -2.761 -8.093 37 HG2 ARG 6 HG2 ARG 6 16.053 -1.693 -6.164 38 HG3 ARG 6 HG3 ARG 6 14.409 -1.946 -6.753 39 HD2 ARG 6 HD2 ARG 6 13.952 -3.549 -5.200 40 HD3 ARG 6 HD3 ARG 6 15.625 -4.101 -5.120 41 HE ARG 6 HE ARG 6 15.457 -1.513 -4.040 42 HH11 ARG 6 HH11 ARG 6 14.495 -4.783 -3.336 43 HH12 ARG 6 HH12 ARG 6 14.522 -4.560 -1.618 44 HH21 ARG 6 HH21 ARG 6 15.496 -1.205 -1.781 45 HH22 ARG 6 HH22 ARG 6 15.091 -2.524 -0.735 46 H LYS 7 H LYS 7 15.351 -2.801 -10.671 47 HA LYS 7 HA LYS 7 15.641 -5.114 -12.262 48 HB2 LYS 7 HB2 LYS 7 15.199 -2.736 -13.046 49 HB3 LYS 7 HB3 LYS 7 16.917 -2.437 -12.814 50 HG2 LYS 7 HG2 LYS 7 17.445 -4.187 -14.434 51 HG3 LYS 7 HG3 LYS 7 15.721 -4.489 -14.667 52 HD2 LYS 7 HD2 LYS 7 16.383 -3.097 -16.457 53 HD3 LYS 7 HD3 LYS 7 15.523 -2.049 -15.325 54 HE2 LYS 7 HE2 LYS 7 17.987 -1.725 -14.374 55 HE3 LYS 7 HE3 LYS 7 18.403 -2.133 -16.038 56 HZ1 LYS 7 HZ1 LYS 7 17.952 0.327 -15.333 57 HZ2 LYS 7 HZ2 LYS 7 16.335 -0.109 -15.568 58 HZ3 LYS 7 HZ3 LYS 7 17.440 -0.244 -16.841 59 H TRP 8 H TRP 8 17.434 -6.237 -12.947 60 HA TRP 8 HA TRP 8 19.488 -7.200 -12.789 61 HB2 TRP 8 HB2 TRP 8 20.228 -4.320 -12.267 62 HB3 TRP 8 HB3 TRP 8 21.426 -5.602 -12.425 63 HD1 TRP 8 HD1 TRP 8 19.633 -3.112 -14.441 64 HE1 TRP 8 HE1 TRP 8 19.894 -3.603 -16.954 65 HE3 TRP 8 HE3 TRP 8 21.485 -7.867 -14.148 66 HZ2 TRP 8 HZ2 TRP 8 20.769 -5.728 -18.595 67 HZ3 TRP 8 HZ3 TRP 8 22.008 -9.060 -16.236 68 HH2 TRP 8 HH2 TRP 8 21.657 -8.010 -18.412 69 H LEU 9 H LEU 9 18.034 -7.730 -10.626 70 HA LEU 9 HA LEU 9 19.963 -7.497 -8.413 71 HB2 LEU 9 HB2 LEU 9 17.908 -6.095 -8.113 72 HB3 LEU 9 HB3 LEU 9 16.967 -7.585 -8.106 73 HG LEU 9 HG LEU 9 18.551 -8.231 -6.127 74 HD11 LEU 9 HD11 LEU 9 18.649 -5.662 -5.034 75 HD12 LEU 9 HD12 LEU 9 19.312 -5.510 -6.661 76 HD13 LEU 9 HD13 LEU 9 20.009 -6.670 -5.530 77 HD21 LEU 9 HD21 LEU 9 16.517 -6.111 -5.538 78 HD22 LEU 9 HD22 LEU 9 16.883 -7.585 -4.640 79 HD23 LEU 9 HD23 LEU 9 16.034 -7.679 -6.184 80 H SER 10 H SER 10 17.000 -9.310 -9.242 81 HA SER 10 HA SER 10 18.222 -11.811 -9.478 82 HB2 SER 10 HB2 SER 10 18.019 -10.962 -6.780 83 HB3 SER 10 HB3 SER 10 16.816 -12.229 -7.014 84 HG SER 10 HG SER 10 18.677 -13.275 -6.517 85 H CYS 11 H CYS 11 16.829 -13.117 -10.483 86 HA CYS 11 HA CYS 11 14.005 -12.334 -10.526 87 HB2 CYS 11 HB2 CYS 11 15.189 -12.520 -12.690 88 HB3 CYS 11 HB3 CYS 11 15.515 -14.217 -12.352 89 H VAL 12 H VAL 12 16.106 -14.750 -9.326 90 HA VAL 12 HA VAL 12 14.574 -17.041 -9.282 91 HB VAL 12 HB VAL 12 16.295 -16.074 -6.996 92 HG11 VAL 12 HG11 VAL 12 15.171 -17.954 -6.218 93 HG12 VAL 12 HG12 VAL 12 15.192 -18.742 -7.796 94 HG13 VAL 12 HG13 VAL 12 16.675 -18.624 -6.849 95 HG21 VAL 12 HG21 VAL 12 17.871 -17.772 -8.383 96 HG22 VAL 12 HG22 VAL 12 16.967 -17.027 -9.701 97 HG23 VAL 12 HG23 VAL 12 17.892 -16.021 -8.587 98 H ASP 13 H ASP 13 14.223 -14.131 -7.390 99 HA ASP 13 HA ASP 13 12.524 -15.171 -5.380 100 HB2 ASP 13 HB2 ASP 13 13.161 -12.432 -6.406 101 HB3 ASP 13 HB3 ASP 13 11.789 -12.644 -5.320 102 H ARG 14 H ARG 14 11.557 -12.883 -7.932 103 HA ARG 14 HA ARG 14 9.225 -14.534 -8.530 104 HB2 ARG 14 HB2 ARG 14 9.063 -11.661 -7.608 105 HB3 ARG 14 HB3 ARG 14 7.732 -12.532 -8.357 106 HG2 ARG 14 HG2 ARG 14 7.517 -13.992 -6.532 107 HG3 ARG 14 HG3 ARG 14 9.085 -13.525 -5.871 108 HD2 ARG 14 HD2 ARG 14 8.288 -11.450 -5.142 109 HD3 ARG 14 HD3 ARG 14 6.867 -11.532 -6.183 110 HE ARG 14 HE ARG 14 5.784 -12.705 -4.547 111 HH11 ARG 14 HH11 ARG 14 9.204 -12.747 -3.898 112 HH12 ARG 14 HH12 ARG 14 9.032 -13.487 -2.342 113 HH21 ARG 14 HH21 ARG 14 5.544 -13.681 -2.499 114 HH22 ARG 14 HH22 ARG 14 6.951 -14.020 -1.548 115 H LYS 15 H LYS 15 9.254 -14.784 -10.655 116 HA LYS 15 HA LYS 15 10.571 -12.866 -12.371 117 HB2 LYS 15 HB2 LYS 15 10.164 -14.467 -14.152 118 HB3 LYS 15 HB3 LYS 15 10.819 -15.293 -12.744 119 HG2 LYS 15 HG2 LYS 15 8.624 -16.110 -12.155 120 HG3 LYS 15 HG3 LYS 15 7.900 -15.201 -13.484 121 HD2 LYS 15 HD2 LYS 15 8.097 -17.403 -14.284 122 HD3 LYS 15 HD3 LYS 15 9.444 -16.528 -15.016 123 HE2 LYS 15 HE2 LYS 15 10.776 -17.358 -12.955 124 HE3 LYS 15 HE3 LYS 15 9.471 -18.532 -12.790 125 HZ1 LYS 15 HZ1 LYS 15 9.920 -19.297 -15.033 126 HZ2 LYS 15 HZ2 LYS 15 11.311 -19.419 -14.081 127 HZ3 LYS 15 HZ3 LYS 15 11.163 -18.162 -15.204 128 H ASN 16 H ASN 16 7.304 -13.837 -11.577 129 HA ASN 16 HA ASN 16 6.101 -12.346 -13.728 130 HB2 ASN 16 HB2 ASN 16 5.069 -13.905 -11.383 131 HB3 ASN 16 HB3 ASN 16 3.989 -12.815 -12.247 132 HD21 ASN 16 HD21 ASN 16 3.115 -15.201 -12.360 133 HD22 ASN 16 HD22 ASN 16 3.482 -16.013 -13.841 134 H ASP 17 H ASP 17 7.024 -11.759 -10.436 135 HA ASP 17 HA ASP 17 5.672 -9.145 -10.505 136 HB2 ASP 17 HB2 ASP 17 6.658 -10.798 -8.174 137 HB3 ASP 17 HB3 ASP 17 6.062 -9.147 -8.019 138 H CYS 18 H CYS 18 8.142 -9.706 -11.892 139 HA CYS 18 HA CYS 18 10.435 -8.905 -10.533 140 HB2 CYS 18 HB2 CYS 18 9.576 -9.027 -13.359 141 HB3 CYS 18 HB3 CYS 18 10.907 -7.925 -13.018 142 H CYS 19 H CYS 19 8.675 -6.819 -12.824 143 HA CYS 19 HA CYS 19 8.261 -4.669 -11.092 144 HB2 CYS 19 HB2 CYS 19 10.953 -4.909 -11.647 145 HB3 CYS 19 HB3 CYS 19 10.418 -3.716 -12.826 146 H GLU 20 H GLU 20 8.470 -2.482 -12.691 147 HA GLU 20 HA GLU 20 6.477 -3.061 -14.713 148 HB2 GLU 20 HB2 GLU 20 6.157 -1.131 -13.253 149 HB3 GLU 20 HB3 GLU 20 7.681 -0.444 -13.798 150 HG2 GLU 20 HG2 GLU 20 6.828 -0.043 -15.970 151 HG3 GLU 20 HG3 GLU 20 5.385 -1.004 -15.651 152 H GLY 21 H GLY 21 7.093 -3.677 -16.676 153 HA2 GLY 21 HA2 GLY 21 8.075 -3.464 -18.767 154 HA3 GLY 21 HA3 GLY 21 8.993 -2.094 -18.161 155 H LEU 22 H LEU 22 9.004 -5.169 -16.517 156 HA LEU 22 HA LEU 22 11.712 -5.689 -17.546 157 HB2 LEU 22 HB2 LEU 22 10.741 -5.884 -14.702 158 HB3 LEU 22 HB3 LEU 22 12.279 -6.536 -15.266 159 HG LEU 22 HG LEU 22 11.467 -3.633 -15.156 160 HD11 LEU 22 HD11 LEU 22 12.449 -3.588 -13.170 161 HD12 LEU 22 HD12 LEU 22 13.912 -4.315 -13.831 162 HD13 LEU 22 HD13 LEU 22 12.605 -5.343 -13.241 163 HD21 LEU 22 HD21 LEU 22 13.896 -3.302 -15.843 164 HD22 LEU 22 HD22 LEU 22 12.770 -3.809 -17.103 165 HD23 LEU 22 HD23 LEU 22 13.860 -4.986 -16.369 166 H GLU 23 H GLU 23 12.377 -7.896 -17.548 167 HA GLU 23 HA GLU 23 10.333 -9.908 -17.026 168 HB2 GLU 23 HB2 GLU 23 10.419 -10.872 -19.214 169 HB3 GLU 23 HB3 GLU 23 10.060 -9.161 -19.402 170 HG2 GLU 23 HG2 GLU 23 12.339 -8.705 -20.032 171 HG3 GLU 23 HG3 GLU 23 12.792 -10.380 -19.722 172 H CYS 24 H CYS 24 11.148 -12.024 -16.796 173 HA CYS 24 HA CYS 24 13.676 -12.220 -15.614 174 HB2 CYS 24 HB2 CYS 24 11.551 -13.783 -15.511 175 HB3 CYS 24 HB3 CYS 24 12.384 -14.639 -16.805 176 H TYR 25 H TYR 25 15.603 -13.204 -16.294 177 HA TYR 25 HA TYR 25 15.963 -13.222 -19.214 178 HB2 TYR 25 HB2 TYR 25 17.303 -11.539 -18.033 179 HB3 TYR 25 HB3 TYR 25 18.014 -12.798 -17.030 180 HD1 TYR 25 HD1 TYR 25 17.800 -11.501 -20.490 181 HD2 TYR 25 HD2 TYR 25 19.854 -14.078 -17.797 182 HE1 TYR 25 HE1 TYR 25 19.583 -11.813 -22.156 183 HE2 TYR 25 HE2 TYR 25 21.642 -14.396 -19.455 184 HH TYR 25 HH TYR 25 21.336 -13.599 -22.664 185 H LYS 26 H LYS 26 17.289 -14.837 -20.163 186 HA LYS 26 HA LYS 26 17.219 -17.367 -18.688 187 HB2 LYS 26 HB2 LYS 26 16.181 -17.052 -21.020 188 HB3 LYS 26 HB3 LYS 26 17.836 -17.048 -21.617 189 HG2 LYS 26 HG2 LYS 26 18.197 -19.274 -20.778 190 HG3 LYS 26 HG3 LYS 26 16.606 -19.281 -20.015 191 HD2 LYS 26 HD2 LYS 26 16.753 -18.744 -22.936 192 HD3 LYS 26 HD3 LYS 26 17.029 -20.398 -22.382 193 HE2 LYS 26 HE2 LYS 26 14.887 -20.620 -21.559 194 HE3 LYS 26 HE3 LYS 26 14.674 -18.882 -21.353 195 HZ1 LYS 26 HZ1 LYS 26 13.594 -18.895 -23.272 196 HZ2 LYS 26 HZ2 LYS 26 13.987 -20.514 -23.567 197 HZ3 LYS 26 HZ3 LYS 26 15.041 -19.285 -24.056 198 H ARG 27 H ARG 27 19.040 -17.540 -17.499 199 HA ARG 27 HA ARG 27 21.614 -16.983 -18.803 200 HB2 ARG 27 HB2 ARG 27 20.884 -15.969 -16.510 201 HB3 ARG 27 HB3 ARG 27 21.313 -17.552 -15.876 202 HG2 ARG 27 HG2 ARG 27 23.174 -16.064 -15.618 203 HG3 ARG 27 HG3 ARG 27 23.574 -17.282 -16.830 204 HD2 ARG 27 HD2 ARG 27 23.166 -15.727 -18.611 205 HD3 ARG 27 HD3 ARG 27 22.542 -14.526 -17.480 206 HE ARG 27 HE ARG 27 25.224 -15.284 -16.871 207 HH11 ARG 27 HH11 ARG 27 23.276 -13.285 -18.952 208 HH12 ARG 27 HH12 ARG 27 24.531 -12.123 -19.228 209 HH21 ARG 27 HH21 ARG 27 26.885 -13.761 -17.228 210 HH22 ARG 27 HH22 ARG 27 26.584 -12.396 -18.248 211 H ARG 28 H ARG 28 23.327 -18.493 -18.654 212 HA ARG 28 HA ARG 28 22.536 -21.189 -19.012 213 HB2 ARG 28 HB2 ARG 28 24.518 -20.119 -20.093 214 HB3 ARG 28 HB3 ARG 28 25.324 -20.130 -18.530 215 HG2 ARG 28 HG2 ARG 28 26.182 -22.024 -19.487 216 HG3 ARG 28 HG3 ARG 28 24.804 -22.687 -18.606 217 HD2 ARG 28 HD2 ARG 28 23.580 -23.045 -20.519 218 HD3 ARG 28 HD3 ARG 28 24.420 -21.783 -21.418 219 HE ARG 28 HE ARG 28 26.251 -23.815 -20.839 220 HH11 ARG 28 HH11 ARG 28 23.388 -23.296 -22.751 221 HH12 ARG 28 HH12 ARG 28 23.827 -24.457 -23.959 222 HH21 ARG 28 HH21 ARG 28 26.840 -25.346 -22.424 223 HH22 ARG 28 HH22 ARG 28 25.790 -25.624 -23.772 224 H HIS 29 H HIS 29 24.891 -19.964 -16.634 225 HA HIS 29 HA HIS 29 23.797 -21.900 -14.700 226 HB2 HIS 29 HB2 HIS 29 26.172 -21.903 -13.746 227 HB3 HIS 29 HB3 HIS 29 25.925 -22.747 -15.272 228 HD1 HIS 29 HD1 HIS 29 27.986 -20.205 -13.706 229 HD2 HIS 29 HD2 HIS 29 26.806 -21.147 -17.577 230 HE1 HIS 29 HE1 HIS 29 29.597 -18.998 -15.214 231 H SER 30 H SER 30 25.602 -18.851 -15.009 232 HA SER 30 HA SER 30 25.502 -17.994 -12.387 233 HB2 SER 30 HB2 SER 30 26.618 -16.910 -14.468 234 HB3 SER 30 HB3 SER 30 25.086 -16.057 -14.650 235 HG SER 30 HG SER 30 25.505 -14.900 -12.919 236 H PHE 31 H PHE 31 24.075 -16.793 -11.154 237 HA PHE 31 HA PHE 31 21.379 -17.352 -11.324 238 HB2 PHE 31 HB2 PHE 31 21.044 -15.775 -9.580 239 HB3 PHE 31 HB3 PHE 31 22.662 -16.425 -9.336 240 HD1 PHE 31 HD1 PHE 31 24.587 -15.048 -10.477 241 HD2 PHE 31 HD2 PHE 31 20.744 -13.499 -9.504 242 HE1 PHE 31 HE1 PHE 31 25.508 -12.767 -10.490 243 HE2 PHE 31 HE2 PHE 31 21.658 -11.215 -9.516 244 HZ PHE 31 HZ PHE 31 24.043 -10.845 -10.010 245 H GLU 32 H GLU 32 19.644 -16.483 -12.315 246 HA GLU 32 HA GLU 32 20.154 -14.390 -14.289 247 HB2 GLU 32 HB2 GLU 32 17.890 -15.036 -15.153 248 HB3 GLU 32 HB3 GLU 32 19.084 -16.327 -15.189 249 HG2 GLU 32 HG2 GLU 32 17.515 -16.257 -12.732 250 HG3 GLU 32 HG3 GLU 32 16.553 -16.523 -14.185 251 H VAL 33 H VAL 33 19.029 -12.469 -14.381 252 HA VAL 33 HA VAL 33 17.245 -11.866 -12.120 253 HB VAL 33 HB VAL 33 18.211 -9.684 -11.843 254 HG11 VAL 33 HG11 VAL 33 19.958 -10.370 -10.598 255 HG12 VAL 33 HG12 VAL 33 19.418 -11.980 -11.079 256 HG13 VAL 33 HG13 VAL 33 20.733 -11.194 -11.952 257 HG21 VAL 33 HG21 VAL 33 19.763 -10.410 -14.296 258 HG22 VAL 33 HG22 VAL 33 18.842 -8.946 -13.949 259 HG23 VAL 33 HG23 VAL 33 20.395 -9.219 -13.158 260 H CYS 34 H CYS 34 16.183 -9.600 -12.564 261 HA CYS 34 HA CYS 34 14.631 -9.904 -14.932 262 HB2 CYS 34 HB2 CYS 34 14.766 -7.572 -13.008 263 HB3 CYS 34 HB3 CYS 34 13.510 -7.841 -14.211 264 H VAL 35 H VAL 35 14.490 -8.535 -16.732 265 HA VAL 35 HA VAL 35 16.674 -6.615 -17.112 266 HB VAL 35 HB VAL 35 16.860 -7.499 -19.509 267 HG11 VAL 35 HG11 VAL 35 17.963 -9.654 -17.900 268 HG12 VAL 35 HG12 VAL 35 18.785 -8.410 -18.843 269 HG13 VAL 35 HG13 VAL 35 18.254 -8.063 -17.197 270 HG21 VAL 35 HG21 VAL 35 15.908 -10.088 -18.341 271 HG22 VAL 35 HG22 VAL 35 14.776 -8.977 -19.115 272 HG23 VAL 35 HG23 VAL 35 16.126 -9.642 -20.034 273 HA PRO 36 HA PRO 36 13.632 -4.040 -18.952 274 HB2 PRO 36 HB2 PRO 36 15.100 -2.708 -20.806 275 HB3 PRO 36 HB3 PRO 36 15.247 -2.410 -19.070 276 HG2 PRO 36 HG2 PRO 36 16.978 -4.072 -20.860 277 HG3 PRO 36 HG3 PRO 36 17.453 -2.943 -19.578 278 HD2 PRO 36 HD2 PRO 36 17.403 -5.625 -19.211 279 HD3 PRO 36 HD3 PRO 36 17.050 -4.475 -17.904 280 H ILE 37 H ILE 37 12.054 -4.489 -20.346 281 HA ILE 37 HA ILE 37 12.473 -6.335 -22.510 282 HB ILE 37 HB ILE 37 10.001 -4.780 -21.735 283 HG12 ILE 37 HG12 ILE 37 10.223 -7.712 -21.327 284 HG13 ILE 37 HG13 ILE 37 11.181 -6.696 -20.255 285 HG21 ILE 37 HG21 ILE 37 9.995 -5.474 -24.089 286 HG22 ILE 37 HG22 ILE 37 10.285 -7.140 -23.590 287 HG23 ILE 37 HG23 ILE 37 8.780 -6.336 -23.144 288 HD11 ILE 37 HD11 ILE 37 8.417 -7.323 -20.124 289 HD12 ILE 37 HD12 ILE 37 9.391 -6.363 -19.009 290 HD13 ILE 37 HD13 ILE 37 8.590 -5.586 -20.375 291 HA PRO 38 HA PRO 38 13.363 -3.302 -25.607 292 HB2 PRO 38 HB2 PRO 38 13.060 -4.921 -27.765 293 HB3 PRO 38 HB3 PRO 38 14.472 -4.988 -26.705 294 HG2 PRO 38 HG2 PRO 38 12.045 -6.740 -26.741 295 HG3 PRO 38 HG3 PRO 38 13.749 -7.194 -26.559 296 HD2 PRO 38 HD2 PRO 38 12.056 -7.012 -24.453 297 HD3 PRO 38 HD3 PRO 38 13.788 -6.640 -24.322 298 H GLY 39 H GLY 39 12.150 -1.832 -26.647 299 HA2 GLY 39 HA2 GLY 39 10.368 -0.856 -27.731 300 HA3 GLY 39 HA3 GLY 39 9.786 -2.473 -28.100 301 H PHE 40 H PHE 40 10.310 -2.120 -24.804 302 HA PHE 40 HA PHE 40 7.612 -2.450 -24.126 303 HB2 PHE 40 HB2 PHE 40 9.154 -3.192 -22.521 304 HB3 PHE 40 HB3 PHE 40 10.055 -1.679 -22.553 305 HD1 PHE 40 HD1 PHE 40 6.765 -3.109 -21.583 306 HD2 PHE 40 HD2 PHE 40 9.659 -0.053 -20.951 307 HE1 PHE 40 HE1 PHE 40 5.498 -2.320 -19.629 308 HE2 PHE 40 HE2 PHE 40 8.396 0.741 -18.993 309 HZ PHE 40 HZ PHE 40 6.312 -0.392 -18.331 310 H CYS 41 H CYS 41 6.071 -1.060 -23.278 311 HA CYS 41 HA CYS 41 6.637 1.776 -23.076 312 HB2 CYS 41 HB2 CYS 41 4.933 2.460 -24.671 313 HB3 CYS 41 HB3 CYS 41 6.135 1.458 -25.477 314 H LEU 42 H LEU 42 4.137 2.802 -22.928 315 HA LEU 42 HA LEU 42 2.793 1.184 -20.866 316 HB2 LEU 42 HB2 LEU 42 2.974 4.182 -20.793 317 HB3 LEU 42 HB3 LEU 42 2.433 3.093 -19.519 318 HG LEU 42 HG LEU 42 5.274 3.305 -20.513 319 HD11 LEU 42 HD11 LEU 42 3.782 4.969 -18.717 320 HD12 LEU 42 HD12 LEU 42 5.457 5.117 -19.249 321 HD13 LEU 42 HD13 LEU 42 5.063 4.130 -17.842 322 HD21 LEU 42 HD21 LEU 42 5.010 1.154 -19.637 323 HD22 LEU 42 HD22 LEU 42 3.934 1.708 -18.354 324 HD23 LEU 42 HD23 LEU 42 5.655 2.094 -18.291 325 H VAL 43 H VAL 43 0.514 1.824 -20.495 326 HA VAL 43 HA VAL 43 -0.747 2.575 -23.045 327 HB VAL 43 HB VAL 43 -2.781 1.453 -22.142 328 HG11 VAL 43 HG11 VAL 43 -1.235 0.288 -23.645 329 HG12 VAL 43 HG12 VAL 43 -0.318 -0.287 -22.252 330 HG13 VAL 43 HG13 VAL 43 -1.982 -0.819 -22.494 331 HG21 VAL 43 HG21 VAL 43 -2.928 0.667 -20.055 332 HG22 VAL 43 HG22 VAL 43 -1.328 -0.072 -20.126 333 HG23 VAL 43 HG23 VAL 43 -1.494 1.636 -19.718 334 H LYS 44 H LYS 44 -3.191 3.316 -22.431 335 HA LYS 44 HA LYS 44 -2.830 5.881 -21.185 336 HB2 LYS 44 HB2 LYS 44 -5.085 6.349 -21.892 337 HB3 LYS 44 HB3 LYS 44 -4.244 5.536 -23.205 338 HG2 LYS 44 HG2 LYS 44 -5.566 3.619 -21.519 339 HG3 LYS 44 HG3 LYS 44 -6.700 4.851 -22.076 340 HD2 LYS 44 HD2 LYS 44 -5.677 4.446 -24.400 341 HD3 LYS 44 HD3 LYS 44 -5.016 2.967 -23.698 342 HE2 LYS 44 HE2 LYS 44 -7.280 2.259 -23.081 343 HE3 LYS 44 HE3 LYS 44 -7.934 3.734 -23.791 344 HZ1 LYS 44 HZ1 LYS 44 -6.380 2.596 -25.755 345 HZ2 LYS 44 HZ2 LYS 44 -8.069 2.620 -25.687 346 HZ3 LYS 44 HZ3 LYS 44 -7.216 1.300 -25.063 347 H TRP 45 H TRP 45 -3.280 2.917 -19.905 348 HA TRP 45 HA TRP 45 -4.793 3.988 -17.613 349 HB2 TRP 45 HB2 TRP 45 -4.795 1.162 -18.694 350 HB3 TRP 45 HB3 TRP 45 -5.577 1.664 -17.198 351 HD1 TRP 45 HD1 TRP 45 -6.346 1.101 -20.720 352 HE1 TRP 45 HE1 TRP 45 -8.576 2.209 -21.376 353 HE3 TRP 45 HE3 TRP 45 -6.977 4.128 -16.648 354 HZ2 TRP 45 HZ2 TRP 45 -10.364 4.114 -20.309 355 HZ3 TRP 45 HZ3 TRP 45 -8.974 5.562 -16.543 356 HH2 TRP 45 HH2 TRP 45 -10.631 5.555 -18.336 357 H LYS 46 H LYS 46 -1.823 3.629 -18.384 358 HA LYS 46 HA LYS 46 -1.016 2.153 -15.965 359 HB2 LYS 46 HB2 LYS 46 0.271 2.481 -18.649 360 HB3 LYS 46 HB3 LYS 46 1.279 2.192 -17.237 361 HG2 LYS 46 HG2 LYS 46 -0.986 0.365 -17.448 362 HG3 LYS 46 HG3 LYS 46 0.143 0.265 -18.803 363 HD2 LYS 46 HD2 LYS 46 1.841 0.371 -16.671 364 HD3 LYS 46 HD3 LYS 46 0.481 -0.531 -15.999 365 HE2 LYS 46 HE2 LYS 46 0.622 -1.943 -18.138 366 HE3 LYS 46 HE3 LYS 46 2.210 -1.211 -18.357 367 HZ1 LYS 46 HZ1 LYS 46 2.844 -2.060 -16.172 368 HZ2 LYS 46 HZ2 LYS 46 2.395 -3.315 -17.213 369 HZ3 LYS 46 HZ3 LYS 46 1.330 -2.797 -16.005 370 H GLN 47 H GLN 47 0.469 3.070 -14.561 371 HA GLN 47 HA GLN 47 0.358 5.802 -14.132 372 HB2 GLN 47 HB2 GLN 47 1.883 3.552 -13.058 373 HB3 GLN 47 HB3 GLN 47 2.758 5.075 -12.978 374 HG2 GLN 47 HG2 GLN 47 1.242 6.031 -11.538 375 HG3 GLN 47 HG3 GLN 47 -0.065 4.956 -12.033 376 HE21 GLN 47 HE21 GLN 47 -0.550 4.414 -9.910 377 HE22 GLN 47 HE22 GLN 47 0.461 3.375 -8.970 378 H CYS 48 H CYS 48 1.673 7.533 -14.598 379 HA CYS 48 HA CYS 48 3.609 7.092 -16.768 380 HB2 CYS 48 HB2 CYS 48 3.135 9.261 -17.565 381 HB3 CYS 48 HB3 CYS 48 1.568 8.591 -17.126 382 H ASP 49 H ASP 49 3.266 8.123 -13.522 383 HA ASP 49 HA ASP 49 5.315 9.928 -13.155 384 HB2 ASP 49 HB2 ASP 49 5.432 9.141 -10.845 385 HB3 ASP 49 HB3 ASP 49 3.756 9.235 -11.378 386 H GLY 50 H GLY 50 7.389 9.846 -13.687 387 HA2 GLY 50 HA2 GLY 50 9.578 9.008 -13.554 388 HA3 GLY 50 HA3 GLY 50 8.926 7.434 -13.121 389 H ARG 51 H ARG 51 7.041 7.395 -15.357 390 HA ARG 51 HA ARG 51 8.973 6.860 -17.515 391 HB2 ARG 51 HB2 ARG 51 6.311 5.548 -16.933 392 HB3 ARG 51 HB3 ARG 51 7.307 5.208 -18.342 393 HG2 ARG 51 HG2 ARG 51 8.043 4.711 -15.466 394 HG3 ARG 51 HG3 ARG 51 7.617 3.497 -16.674 395 HD2 ARG 51 HD2 ARG 51 9.583 4.385 -18.025 396 HD3 ARG 51 HD3 ARG 51 10.061 5.242 -16.560 397 HE ARG 51 HE ARG 51 10.388 2.463 -17.100 398 HH11 ARG 51 HH11 ARG 51 9.830 4.773 -14.557 399 HH12 ARG 51 HH12 ARG 51 10.529 3.780 -13.322 400 HH21 ARG 51 HH21 ARG 51 11.312 1.146 -15.483 401 HH22 ARG 51 HH22 ARG 51 11.373 1.716 -13.850 402 H GLU 52 H GLU 52 7.852 9.439 -17.097 403 HA GLU 52 HA GLU 52 5.595 9.958 -18.686 404 HB2 GLU 52 HB2 GLU 52 6.261 12.277 -18.610 405 HB3 GLU 52 HB3 GLU 52 6.555 11.545 -17.038 406 HG2 GLU 52 HG2 GLU 52 8.952 11.222 -17.808 407 HG3 GLU 52 HG3 GLU 52 8.554 12.305 -19.139 408 H ARG 53 H ARG 53 8.780 9.106 -19.540 409 HA ARG 53 HA ARG 53 8.264 9.891 -22.333 410 HB2 ARG 53 HB2 ARG 53 10.988 9.583 -21.065 411 HB3 ARG 53 HB3 ARG 53 10.624 10.202 -22.669 412 HG2 ARG 53 HG2 ARG 53 9.244 11.980 -21.308 413 HG3 ARG 53 HG3 ARG 53 10.360 11.519 -20.022 414 HD2 ARG 53 HD2 ARG 53 11.448 12.138 -22.726 415 HD3 ARG 53 HD3 ARG 53 10.935 13.470 -21.690 416 HE ARG 53 HE ARG 53 12.525 11.995 -20.070 417 HH11 ARG 53 HH11 ARG 53 12.937 13.363 -23.245 418 HH12 ARG 53 HH12 ARG 53 14.647 13.586 -23.069 419 HH21 ARG 53 HH21 ARG 53 14.775 12.283 -19.827 420 HH22 ARG 53 HH22 ARG 53 15.691 12.971 -21.125 421 H ASP 54 H ASP 54 7.679 7.390 -20.772 422 HA ASP 54 HA ASP 54 9.212 5.507 -22.442 423 HB2 ASP 54 HB2 ASP 54 9.066 5.546 -19.690 424 HB3 ASP 54 HB3 ASP 54 7.847 4.350 -20.125 425 H CYS 55 H CYS 55 6.114 6.694 -21.558 426 HA CYS 55 HA CYS 55 4.404 4.612 -22.116 427 HB2 CYS 55 HB2 CYS 55 3.992 7.502 -22.912 428 HB3 CYS 55 HB3 CYS 55 2.731 6.295 -22.684 429 H CYS 56 H CYS 56 2.975 4.400 -24.085 430 HA CYS 56 HA CYS 56 4.600 3.794 -26.338 431 HB2 CYS 56 HB2 CYS 56 1.770 3.477 -25.575 432 HB3 CYS 56 HB3 CYS 56 2.054 3.644 -27.305 433 H ALA 57 H ALA 57 3.513 4.474 -28.599 434 HA ALA 57 HA ALA 57 4.125 7.236 -28.898 435 HB1 ALA 57 HB1 ALA 57 4.678 6.090 -30.794 436 HB2 ALA 57 HB2 ALA 57 3.259 5.043 -30.710 437 HB3 ALA 57 HB3 ALA 57 3.096 6.708 -31.270 438 H GLY 58 H GLY 58 2.832 8.985 -29.002 439 HA2 GLY 58 HA2 GLY 58 0.842 10.183 -29.344 440 HA3 GLY 58 HA3 GLY 58 -0.042 8.663 -29.372 441 H LEU 59 H LEU 59 1.592 8.033 -26.803 442 HA LEU 59 HA LEU 59 -0.463 8.955 -25.004 443 HB2 LEU 59 HB2 LEU 59 1.324 6.794 -25.104 444 HB3 LEU 59 HB3 LEU 59 1.769 7.725 -23.675 445 HG LEU 59 HG LEU 59 -0.424 7.453 -22.742 446 HD11 LEU 59 HD11 LEU 59 -2.072 5.966 -23.980 447 HD12 LEU 59 HD12 LEU 59 -1.096 6.268 -25.418 448 HD13 LEU 59 HD13 LEU 59 -1.873 7.612 -24.582 449 HD21 LEU 59 HD21 LEU 59 1.260 5.225 -23.468 450 HD22 LEU 59 HD22 LEU 59 -0.421 4.722 -23.290 451 HD23 LEU 59 HD23 LEU 59 0.400 5.542 -21.961 452 H GLU 60 H GLU 60 0.302 9.745 -22.766 453 HA GLU 60 HA GLU 60 2.687 11.314 -22.658 454 HB2 GLU 60 HB2 GLU 60 1.764 13.505 -22.678 455 HB3 GLU 60 HB3 GLU 60 1.168 12.697 -24.121 456 HG2 GLU 60 HG2 GLU 60 -0.814 12.126 -22.380 457 HG3 GLU 60 HG3 GLU 60 -0.284 13.694 -21.772 458 H CYS 61 H CYS 61 3.032 12.273 -20.595 459 HA CYS 61 HA CYS 61 1.955 10.796 -18.445 460 HB2 CYS 61 HB2 CYS 61 4.220 12.075 -18.659 461 HB3 CYS 61 HB3 CYS 61 3.300 13.449 -18.055 462 H TRP 62 H TRP 62 -0.253 10.987 -18.298 463 HA TRP 62 HA TRP 62 -1.545 13.557 -18.257 464 HB2 TRP 62 HB2 TRP 62 -2.499 11.259 -19.040 465 HB3 TRP 62 HB3 TRP 62 -2.847 11.015 -17.330 466 HD1 TRP 62 HD1 TRP 62 -3.253 14.591 -18.136 467 HE1 TRP 62 HE1 TRP 62 -5.741 15.178 -18.435 468 HE3 TRP 62 HE3 TRP 62 -5.173 9.862 -18.425 469 HZ2 TRP 62 HZ2 TRP 62 -8.193 13.816 -18.749 470 HZ3 TRP 62 HZ3 TRP 62 -7.601 9.591 -18.724 471 HH2 TRP 62 HH2 TRP 62 -9.078 11.529 -18.882 472 H LYS 63 H LYS 63 -2.161 14.742 -16.535 473 HA LYS 63 HA LYS 63 -1.364 13.753 -13.884 474 HB2 LYS 63 HB2 LYS 63 -0.583 16.031 -15.058 475 HB3 LYS 63 HB3 LYS 63 -2.060 16.612 -14.302 476 HG2 LYS 63 HG2 LYS 63 -0.204 15.040 -12.614 477 HG3 LYS 63 HG3 LYS 63 0.296 16.668 -13.079 478 HD2 LYS 63 HD2 LYS 63 -2.413 16.103 -11.902 479 HD3 LYS 63 HD3 LYS 63 -1.000 16.420 -10.892 480 HE2 LYS 63 HE2 LYS 63 -1.648 18.307 -13.107 481 HE3 LYS 63 HE3 LYS 63 -2.610 18.365 -11.631 482 HZ1 LYS 63 HZ1 LYS 63 -0.989 19.742 -10.963 483 HZ2 LYS 63 HZ2 LYS 63 0.140 19.158 -12.078 484 HZ3 LYS 63 HZ3 LYS 63 -0.135 18.319 -10.635 485 H ARG 64 H ARG 64 -3.141 12.674 -13.155 486 HA ARG 64 HA ARG 64 -5.659 14.201 -13.022 487 HB2 ARG 64 HB2 ARG 64 -5.093 11.462 -13.804 488 HB3 ARG 64 HB3 ARG 64 -6.267 11.529 -12.496 489 HG2 ARG 64 HG2 ARG 64 -7.826 12.648 -13.770 490 HG3 ARG 64 HG3 ARG 64 -6.612 13.289 -14.879 491 HD2 ARG 64 HD2 ARG 64 -7.294 11.663 -16.259 492 HD3 ARG 64 HD3 ARG 64 -6.333 10.599 -15.233 493 HE ARG 64 HE ARG 64 -9.044 10.980 -14.337 494 HH11 ARG 64 HH11 ARG 64 -6.907 9.101 -16.340 495 HH12 ARG 64 HH12 ARG 64 -7.936 7.707 -16.359 496 HH21 ARG 64 HH21 ARG 64 -10.409 9.152 -14.352 497 HH22 ARG 64 HH22 ARG 64 -9.929 7.738 -15.228 498 H SER 65 H SER 65 -6.505 14.628 -11.074 499 HA SER 65 HA SER 65 -5.432 13.201 -8.736 500 HB2 SER 65 HB2 SER 65 -5.970 16.177 -8.808 501 HB3 SER 65 HB3 SER 65 -5.250 15.256 -7.488 502 HG SER 65 HG SER 65 -3.771 16.434 -8.942 503 H GLY 66 H GLY 66 -6.920 12.533 -7.303 504 HA2 GLY 66 HA2 GLY 66 -8.965 12.985 -6.051 505 HA3 GLY 66 HA3 GLY 66 -9.642 13.656 -7.527 506 H ASN 67 H ASN 67 -8.297 11.325 -8.989 507 HA ASN 67 HA ASN 67 -10.405 9.360 -8.384 508 HB2 ASN 67 HB2 ASN 67 -9.101 10.188 -10.961 509 HB3 ASN 67 HB3 ASN 67 -9.876 8.614 -10.816 510 HD21 ASN 67 HD21 ASN 67 -10.371 11.536 -11.987 511 HD22 ASN 67 HD22 ASN 67 -12.077 11.700 -11.766 512 H LYS 68 H LYS 68 -7.055 9.628 -9.552 513 HA LYS 68 HA LYS 68 -6.181 7.487 -7.878 514 HB2 LYS 68 HB2 LYS 68 -6.868 6.944 -10.704 515 HB3 LYS 68 HB3 LYS 68 -5.319 6.312 -10.160 516 HG2 LYS 68 HG2 LYS 68 -6.727 5.397 -8.159 517 HG3 LYS 68 HG3 LYS 68 -8.073 5.594 -9.283 518 HD2 LYS 68 HD2 LYS 68 -6.599 4.299 -10.948 519 HD3 LYS 68 HD3 LYS 68 -5.650 3.839 -9.531 520 HE2 LYS 68 HE2 LYS 68 -7.531 2.769 -8.529 521 HE3 LYS 68 HE3 LYS 68 -8.626 3.423 -9.745 522 HZ1 LYS 68 HZ1 LYS 68 -8.301 1.557 -10.870 523 HZ2 LYS 68 HZ2 LYS 68 -7.070 1.049 -9.827 524 HZ3 LYS 68 HZ3 LYS 68 -6.704 2.041 -11.148 525 H SER 69 H SER 69 -3.835 6.799 -8.722 526 HA SER 69 HA SER 69 -2.223 9.070 -8.477 527 HB2 SER 69 HB2 SER 69 -1.755 6.205 -9.143 528 HB3 SER 69 HB3 SER 69 -0.460 7.344 -9.511 529 HG SER 69 HG SER 69 -1.303 6.391 -7.103 530 H SER 70 H SER 70 -0.324 9.362 -10.180 531 HA SER 70 HA SER 70 -1.524 10.557 -12.458 532 HB2 SER 70 HB2 SER 70 0.600 11.391 -12.963 533 HB3 SER 70 HB3 SER 70 0.674 11.189 -11.212 534 HG SER 70 HG SER 70 2.483 10.326 -12.537 535 H VAL 71 H VAL 71 -2.109 9.626 -14.293 536 HA VAL 71 HA VAL 71 -0.755 7.135 -15.107 537 HB VAL 71 HB VAL 71 -2.898 6.593 -16.321 538 HG11 VAL 71 HG11 VAL 71 -3.783 6.667 -13.547 539 HG12 VAL 71 HG12 VAL 71 -3.432 5.286 -14.588 540 HG13 VAL 71 HG13 VAL 71 -2.123 6.099 -13.728 541 HG21 VAL 71 HG21 VAL 71 -3.896 8.898 -14.656 542 HG22 VAL 71 HG22 VAL 71 -3.936 8.745 -16.412 543 HG23 VAL 71 HG23 VAL 71 -4.948 7.702 -15.414 544 H CYS 72 H CYS 72 -1.312 6.739 -17.579 545 HA CYS 72 HA CYS 72 -0.436 9.171 -18.975 546 HB2 CYS 72 HB2 CYS 72 0.341 6.398 -19.119 547 HB3 CYS 72 HB3 CYS 72 -0.210 6.953 -20.698 548 H ALA 73 H ALA 73 -1.299 9.637 -21.082 549 HA ALA 73 HA ALA 73 -3.802 8.329 -21.810 550 HB1 ALA 73 HB1 ALA 73 -5.198 10.005 -21.321 551 HB2 ALA 73 HB2 ALA 73 -3.915 10.579 -20.256 552 HB3 ALA 73 HB3 ALA 73 -4.068 11.236 -21.886 553 HA PRO 74 HA PRO 74 -2.423 9.063 -25.913 554 HB2 PRO 74 HB2 PRO 74 -4.787 9.258 -27.233 555 HB3 PRO 74 HB3 PRO 74 -4.161 7.728 -26.606 556 HG2 PRO 74 HG2 PRO 74 -6.212 9.561 -25.426 557 HG3 PRO 74 HG3 PRO 74 -6.222 7.792 -25.534 558 HD2 PRO 74 HD2 PRO 74 -5.551 9.108 -23.266 559 HD3 PRO 74 HD3 PRO 74 -4.835 7.545 -23.710 560 H ILE 75 H ILE 75 -2.846 10.555 -27.851 561 HA ILE 75 HA ILE 75 -2.349 13.192 -27.135 562 HB ILE 75 HB ILE 75 -2.972 13.739 -29.532 563 HG12 ILE 75 HG12 ILE 75 -3.135 10.757 -29.897 564 HG13 ILE 75 HG13 ILE 75 -4.581 11.716 -29.601 565 HG21 ILE 75 HG21 ILE 75 -0.694 13.081 -28.689 566 HG22 ILE 75 HG22 ILE 75 -1.043 11.447 -29.253 567 HG23 ILE 75 HG23 ILE 75 -0.983 12.783 -30.403 568 HD11 ILE 75 HD11 ILE 75 -4.611 11.737 -31.857 569 HD12 ILE 75 HD12 ILE 75 -3.556 13.129 -31.607 570 HD13 ILE 75 HD13 ILE 75 -2.862 11.555 -31.995 571 H THR 76 H THR 76 -3.595 15.103 -27.314 572 HA THR 76 HA THR 76 -5.421 16.295 -26.566 573 HB THR 76 HB THR 76 -5.666 16.170 -29.051 574 HG1 THR 76 HG1 THR 76 -7.950 16.762 -28.962 575 HG21 THR 76 HG21 THR 76 -7.589 13.944 -28.367 576 HG22 THR 76 HG22 THR 76 -6.106 13.803 -29.312 577 HG23 THR 76 HG23 THR 76 -7.470 14.725 -29.943 Start of MODEL 6 1 H1 SER 1 H SER 1 2.075 -0.351 1.620 2 HA SER 1 HA SER 1 2.881 -0.577 -1.028 3 HB2 SER 1 HB2 SER 1 3.990 1.151 1.193 4 HB3 SER 1 HB3 SER 1 4.419 1.343 -0.507 5 HG SER 1 HG SER 1 2.640 2.689 0.326 6 H ASN 2 H ASN 2 4.170 -2.117 -1.802 7 HA ASN 2 HA ASN 2 6.738 -2.580 -0.439 8 HB2 ASN 2 HB2 ASN 2 6.489 -4.973 -1.450 9 HB3 ASN 2 HB3 ASN 2 5.645 -4.576 0.045 10 HD21 ASN 2 HD21 ASN 2 3.422 -4.368 0.037 11 HD22 ASN 2 HD22 ASN 2 2.444 -4.905 -1.283 12 H GLU 3 H GLU 3 8.306 -1.843 -1.701 13 HA GLU 3 HA GLU 3 8.081 -1.169 -4.387 14 HB2 GLU 3 HB2 GLU 3 10.449 -1.752 -2.629 15 HB3 GLU 3 HB3 GLU 3 10.662 -1.361 -4.329 16 HG2 GLU 3 HG2 GLU 3 9.637 0.784 -4.027 17 HG3 GLU 3 HG3 GLU 3 9.211 0.391 -2.362 18 H CYS 4 H CYS 4 9.568 -2.127 -6.136 19 HA CYS 4 HA CYS 4 9.000 -5.002 -6.273 20 HB2 CYS 4 HB2 CYS 4 9.313 -4.739 -8.710 21 HB3 CYS 4 HB3 CYS 4 8.061 -3.672 -8.084 22 H ILE 5 H ILE 5 10.653 -6.198 -7.747 23 HA ILE 5 HA ILE 5 13.157 -6.136 -6.387 24 HB ILE 5 HB ILE 5 12.363 -7.661 -8.871 25 HG12 ILE 5 HG12 ILE 5 12.586 -8.770 -6.083 26 HG13 ILE 5 HG13 ILE 5 11.093 -8.027 -6.646 27 HG21 ILE 5 HG21 ILE 5 14.696 -7.674 -8.861 28 HG22 ILE 5 HG22 ILE 5 14.781 -7.771 -7.104 29 HG23 ILE 5 HG23 ILE 5 14.263 -9.174 -8.039 30 HD11 ILE 5 HD11 ILE 5 12.406 -10.231 -8.184 31 HD12 ILE 5 HD12 ILE 5 11.326 -10.561 -6.829 32 HD13 ILE 5 HD13 ILE 5 10.731 -9.683 -8.237 33 H ARG 6 H ARG 6 14.909 -4.985 -6.843 34 HA ARG 6 HA ARG 6 15.040 -3.030 -8.805 35 HB2 ARG 6 HB2 ARG 6 17.252 -4.459 -7.327 36 HB3 ARG 6 HB3 ARG 6 17.525 -3.064 -8.363 37 HG2 ARG 6 HG2 ARG 6 17.356 -1.999 -6.372 38 HG3 ARG 6 HG3 ARG 6 15.646 -2.020 -6.811 39 HD2 ARG 6 HD2 ARG 6 15.140 -3.680 -5.297 40 HD3 ARG 6 HD3 ARG 6 16.785 -4.313 -5.283 41 HE ARG 6 HE ARG 6 16.713 -1.701 -4.195 42 HH11 ARG 6 HH11 ARG 6 15.891 -5.003 -3.465 43 HH12 ARG 6 HH12 ARG 6 16.060 -4.803 -1.752 44 HH21 ARG 6 HH21 ARG 6 16.940 -1.425 -1.941 45 HH22 ARG 6 HH22 ARG 6 16.655 -2.768 -0.887 46 H LYS 7 H LYS 7 16.172 -2.862 -10.769 47 HA LYS 7 HA LYS 7 15.996 -5.143 -12.444 48 HB2 LYS 7 HB2 LYS 7 15.749 -2.721 -13.144 49 HB3 LYS 7 HB3 LYS 7 17.500 -2.595 -13.043 50 HG2 LYS 7 HG2 LYS 7 17.786 -4.205 -14.786 51 HG3 LYS 7 HG3 LYS 7 16.060 -4.571 -14.796 52 HD2 LYS 7 HD2 LYS 7 16.501 -3.138 -16.651 53 HD3 LYS 7 HD3 LYS 7 15.648 -2.182 -15.436 54 HE2 LYS 7 HE2 LYS 7 17.305 -0.703 -15.840 55 HE3 LYS 7 HE3 LYS 7 18.192 -1.712 -14.698 56 HZ1 LYS 7 HZ1 LYS 7 18.630 -2.978 -17.025 57 HZ2 LYS 7 HZ2 LYS 7 19.681 -1.841 -16.344 58 HZ3 LYS 7 HZ3 LYS 7 18.580 -1.366 -17.538 59 H TRP 8 H TRP 8 17.638 -6.316 -13.478 60 HA TRP 8 HA TRP 8 19.559 -7.536 -13.517 61 HB2 TRP 8 HB2 TRP 8 20.591 -4.755 -13.001 62 HB3 TRP 8 HB3 TRP 8 21.686 -6.123 -13.177 63 HD1 TRP 8 HD1 TRP 8 19.872 -3.583 -15.173 64 HE1 TRP 8 HE1 TRP 8 20.073 -4.105 -17.686 65 HE3 TRP 8 HE3 TRP 8 21.726 -8.337 -14.870 66 HZ2 TRP 8 HZ2 TRP 8 20.907 -6.248 -19.322 67 HZ3 TRP 8 HZ3 TRP 8 22.198 -9.555 -16.954 68 HH2 TRP 8 HH2 TRP 8 21.796 -8.530 -19.134 69 H LEU 9 H LEU 9 18.266 -8.053 -11.260 70 HA LEU 9 HA LEU 9 20.389 -8.122 -9.221 71 HB2 LEU 9 HB2 LEU 9 18.637 -6.585 -8.531 72 HB3 LEU 9 HB3 LEU 9 17.420 -7.836 -8.779 73 HG LEU 9 HG LEU 9 18.285 -9.106 -6.918 74 HD11 LEU 9 HD11 LEU 9 20.099 -8.169 -5.509 75 HD12 LEU 9 HD12 LEU 9 20.391 -6.957 -6.756 76 HD13 LEU 9 HD13 LEU 9 20.636 -8.666 -7.114 77 HD21 LEU 9 HD21 LEU 9 16.799 -7.803 -5.867 78 HD22 LEU 9 HD22 LEU 9 17.389 -6.335 -6.648 79 HD23 LEU 9 HD23 LEU 9 18.211 -6.967 -5.221 80 H SER 10 H SER 10 17.198 -9.630 -9.742 81 HA SER 10 HA SER 10 18.124 -12.197 -10.326 82 HB2 SER 10 HB2 SER 10 18.594 -11.587 -7.650 83 HB3 SER 10 HB3 SER 10 17.112 -12.542 -7.617 84 HG SER 10 HG SER 10 19.468 -13.512 -7.734 85 H CYS 11 H CYS 11 16.463 -13.162 -11.279 86 HA CYS 11 HA CYS 11 13.752 -12.249 -10.643 87 HB2 CYS 11 HB2 CYS 11 13.099 -13.043 -12.799 88 HB3 CYS 11 HB3 CYS 11 14.613 -12.171 -13.013 89 H VAL 12 H VAL 12 15.836 -14.825 -10.057 90 HA VAL 12 HA VAL 12 14.290 -17.102 -10.182 91 HB VAL 12 HB VAL 12 16.197 -16.439 -7.935 92 HG11 VAL 12 HG11 VAL 12 16.533 -18.873 -7.853 93 HG12 VAL 12 HG12 VAL 12 14.863 -18.421 -7.509 94 HG13 VAL 12 HG13 VAL 12 15.293 -19.075 -9.089 95 HG21 VAL 12 HG21 VAL 12 17.638 -16.158 -9.656 96 HG22 VAL 12 HG22 VAL 12 17.666 -17.921 -9.624 97 HG23 VAL 12 HG23 VAL 12 16.641 -17.077 -10.785 98 H ASP 13 H ASP 13 14.127 -14.470 -7.896 99 HA ASP 13 HA ASP 13 12.027 -15.897 -6.406 100 HB2 ASP 13 HB2 ASP 13 12.451 -13.944 -4.736 101 HB3 ASP 13 HB3 ASP 13 13.605 -15.272 -4.814 102 H ARG 14 H ARG 14 10.054 -15.399 -7.082 103 HA ARG 14 HA ARG 14 8.222 -14.211 -7.719 104 HB2 ARG 14 HB2 ARG 14 9.690 -11.718 -6.872 105 HB3 ARG 14 HB3 ARG 14 7.953 -11.985 -6.926 106 HG2 ARG 14 HG2 ARG 14 8.076 -13.506 -5.068 107 HG3 ARG 14 HG3 ARG 14 9.838 -13.418 -5.068 108 HD2 ARG 14 HD2 ARG 14 9.527 -11.842 -3.496 109 HD3 ARG 14 HD3 ARG 14 9.187 -10.794 -4.873 110 HE ARG 14 HE ARG 14 6.858 -12.160 -3.938 111 HH11 ARG 14 HH11 ARG 14 8.939 -9.426 -3.379 112 HH12 ARG 14 HH12 ARG 14 7.712 -8.486 -2.598 113 HH21 ARG 14 HH21 ARG 14 5.233 -10.931 -2.913 114 HH22 ARG 14 HH22 ARG 14 5.604 -9.343 -2.334 115 H LYS 15 H LYS 15 9.675 -14.911 -9.794 116 HA LYS 15 HA LYS 15 10.786 -12.934 -11.420 117 HB2 LYS 15 HB2 LYS 15 10.453 -14.493 -13.271 118 HB3 LYS 15 HB3 LYS 15 11.049 -15.336 -11.847 119 HG2 LYS 15 HG2 LYS 15 9.418 -16.786 -12.415 120 HG3 LYS 15 HG3 LYS 15 8.432 -15.675 -11.462 121 HD2 LYS 15 HD2 LYS 15 7.430 -14.761 -13.317 122 HD3 LYS 15 HD3 LYS 15 8.797 -15.132 -14.370 123 HE2 LYS 15 HE2 LYS 15 6.989 -16.559 -14.994 124 HE3 LYS 15 HE3 LYS 15 8.193 -17.548 -14.170 125 HZ1 LYS 15 HZ1 LYS 15 5.562 -17.496 -13.581 126 HZ2 LYS 15 HZ2 LYS 15 6.194 -16.446 -12.416 127 HZ3 LYS 15 HZ3 LYS 15 6.777 -18.030 -12.533 128 H ASN 16 H ASN 16 7.478 -13.708 -10.741 129 HA ASN 16 HA ASN 16 6.389 -12.330 -13.014 130 HB2 ASN 16 HB2 ASN 16 5.285 -14.233 -11.700 131 HB3 ASN 16 HB3 ASN 16 4.895 -13.016 -10.488 132 HD21 ASN 16 HD21 ASN 16 2.708 -13.110 -10.752 133 HD22 ASN 16 HD22 ASN 16 1.901 -12.576 -12.183 134 H ASP 17 H ASP 17 7.244 -11.526 -9.733 135 HA ASP 17 HA ASP 17 6.057 -8.858 -10.038 136 HB2 ASP 17 HB2 ASP 17 7.087 -10.313 -7.596 137 HB3 ASP 17 HB3 ASP 17 6.519 -8.644 -7.583 138 H CYS 18 H CYS 18 8.452 -9.637 -11.452 139 HA CYS 18 HA CYS 18 10.836 -8.853 -10.293 140 HB2 CYS 18 HB2 CYS 18 9.791 -9.005 -13.059 141 HB3 CYS 18 HB3 CYS 18 11.208 -7.985 -12.826 142 H CYS 19 H CYS 19 9.021 -6.765 -12.539 143 HA CYS 19 HA CYS 19 8.817 -4.542 -10.858 144 HB2 CYS 19 HB2 CYS 19 11.459 -4.943 -11.768 145 HB3 CYS 19 HB3 CYS 19 10.818 -3.592 -12.697 146 H GLU 20 H GLU 20 8.966 -2.416 -12.513 147 HA GLU 20 HA GLU 20 6.828 -2.969 -14.380 148 HB2 GLU 20 HB2 GLU 20 6.729 -0.974 -12.959 149 HB3 GLU 20 HB3 GLU 20 8.217 -0.377 -13.681 150 HG2 GLU 20 HG2 GLU 20 7.196 0.136 -15.687 151 HG3 GLU 20 HG3 GLU 20 5.855 -0.973 -15.405 152 H GLY 21 H GLY 21 7.267 -3.679 -16.357 153 HA2 GLY 21 HA2 GLY 21 8.108 -3.604 -18.516 154 HA3 GLY 21 HA3 GLY 21 9.111 -2.241 -18.042 155 H LEU 22 H LEU 22 9.105 -5.300 -16.337 156 HA LEU 22 HA LEU 22 11.732 -5.929 -17.502 157 HB2 LEU 22 HB2 LEU 22 10.953 -6.042 -14.593 158 HB3 LEU 22 HB3 LEU 22 12.445 -6.707 -15.254 159 HG LEU 22 HG LEU 22 11.648 -3.802 -15.111 160 HD11 LEU 22 HD11 LEU 22 12.830 -3.723 -13.237 161 HD12 LEU 22 HD12 LEU 22 14.206 -4.511 -14.010 162 HD13 LEU 22 HD13 LEU 22 12.929 -5.484 -13.281 163 HD21 LEU 22 HD21 LEU 22 12.866 -3.594 -16.983 164 HD22 LEU 22 HD22 LEU 22 13.582 -5.197 -16.817 165 HD23 LEU 22 HD23 LEU 22 14.247 -3.835 -15.913 166 H GLU 23 H GLU 23 12.321 -8.160 -17.467 167 HA GLU 23 HA GLU 23 10.256 -10.082 -16.744 168 HB2 GLU 23 HB2 GLU 23 10.098 -11.090 -18.890 169 HB3 GLU 23 HB3 GLU 23 9.862 -9.364 -19.131 170 HG2 GLU 23 HG2 GLU 23 12.156 -9.134 -19.892 171 HG3 GLU 23 HG3 GLU 23 12.434 -10.851 -19.606 172 H CYS 24 H CYS 24 11.023 -12.297 -16.750 173 HA CYS 24 HA CYS 24 13.645 -12.521 -15.694 174 HB2 CYS 24 HB2 CYS 24 11.485 -13.987 -15.321 175 HB3 CYS 24 HB3 CYS 24 12.142 -14.919 -16.663 176 H TYR 25 H TYR 25 15.510 -13.313 -16.566 177 HA TYR 25 HA TYR 25 15.518 -13.656 -19.487 178 HB2 TYR 25 HB2 TYR 25 16.904 -11.816 -18.291 179 HB3 TYR 25 HB3 TYR 25 17.975 -13.137 -17.835 180 HD1 TYR 25 HD1 TYR 25 16.210 -12.019 -20.944 181 HD2 TYR 25 HD2 TYR 25 19.835 -13.360 -19.166 182 HE1 TYR 25 HE1 TYR 25 17.333 -11.853 -23.125 183 HE2 TYR 25 HE2 TYR 25 20.969 -13.196 -21.343 184 HH TYR 25 HH TYR 25 19.199 -12.477 -24.287 185 H LYS 26 H LYS 26 17.270 -15.133 -20.312 186 HA LYS 26 HA LYS 26 17.372 -17.552 -18.635 187 HB2 LYS 26 HB2 LYS 26 16.092 -17.575 -20.862 188 HB3 LYS 26 HB3 LYS 26 17.672 -17.504 -21.631 189 HG2 LYS 26 HG2 LYS 26 17.068 -19.775 -21.588 190 HG3 LYS 26 HG3 LYS 26 18.271 -19.571 -20.312 191 HD2 LYS 26 HD2 LYS 26 16.659 -20.834 -19.244 192 HD3 LYS 26 HD3 LYS 26 16.189 -19.194 -18.790 193 HE2 LYS 26 HE2 LYS 26 14.221 -20.392 -19.447 194 HE3 LYS 26 HE3 LYS 26 14.584 -19.195 -20.689 195 HZ1 LYS 26 HZ1 LYS 26 15.822 -21.732 -21.188 196 HZ2 LYS 26 HZ2 LYS 26 14.872 -20.775 -22.210 197 HZ3 LYS 26 HZ3 LYS 26 14.134 -21.837 -21.119 198 H ARG 27 H ARG 27 19.300 -18.211 -17.957 199 HA ARG 27 HA ARG 27 21.688 -17.297 -19.420 200 HB2 ARG 27 HB2 ARG 27 21.044 -17.238 -16.519 201 HB3 ARG 27 HB3 ARG 27 22.696 -17.640 -16.964 202 HG2 ARG 27 HG2 ARG 27 21.303 -15.199 -18.014 203 HG3 ARG 27 HG3 ARG 27 22.195 -15.205 -16.492 204 HD2 ARG 27 HD2 ARG 27 23.872 -14.546 -17.880 205 HD3 ARG 27 HD3 ARG 27 24.062 -16.292 -18.030 206 HE ARG 27 HE ARG 27 22.268 -15.209 -19.977 207 HH11 ARG 27 HH11 ARG 27 25.624 -15.727 -19.206 208 HH12 ARG 27 HH12 ARG 27 26.140 -15.720 -20.860 209 HH21 ARG 27 HH21 ARG 27 22.935 -15.199 -22.158 210 HH22 ARG 27 HH22 ARG 27 24.610 -15.420 -22.538 211 H ARG 28 H ARG 28 23.670 -18.680 -18.535 212 HA ARG 28 HA ARG 28 22.898 -21.476 -18.970 213 HB2 ARG 28 HB2 ARG 28 25.331 -19.866 -19.567 214 HB3 ARG 28 HB3 ARG 28 25.546 -21.580 -19.234 215 HG2 ARG 28 HG2 ARG 28 23.632 -21.848 -21.002 216 HG3 ARG 28 HG3 ARG 28 24.171 -20.246 -21.510 217 HD2 ARG 28 HD2 ARG 28 26.428 -21.076 -21.824 218 HD3 ARG 28 HD3 ARG 28 25.951 -22.664 -21.225 219 HE ARG 28 HE ARG 28 25.561 -21.634 -23.861 220 HH11 ARG 28 HH11 ARG 28 24.261 -23.790 -21.458 221 HH12 ARG 28 HH12 ARG 28 23.465 -24.808 -22.612 222 HH21 ARG 28 HH21 ARG 28 24.518 -22.965 -25.391 223 HH22 ARG 28 HH22 ARG 28 23.613 -24.338 -24.850 224 H HIS 29 H HIS 29 25.526 -19.835 -17.202 225 HA HIS 29 HA HIS 29 25.156 -21.792 -15.034 226 HB2 HIS 29 HB2 HIS 29 27.601 -20.306 -15.987 227 HB3 HIS 29 HB3 HIS 29 27.543 -21.116 -14.423 228 HD1 HIS 29 HD1 HIS 29 29.115 -21.764 -17.317 229 HD2 HIS 29 HD2 HIS 29 26.208 -23.943 -15.302 230 HE1 HIS 29 HE1 HIS 29 29.371 -24.132 -18.123 231 H SER 30 H SER 30 25.974 -18.391 -15.664 232 HA SER 30 HA SER 30 25.844 -17.544 -12.979 233 HB2 SER 30 HB2 SER 30 25.687 -16.127 -15.623 234 HB3 SER 30 HB3 SER 30 25.407 -15.244 -14.123 235 HG SER 30 HG SER 30 27.557 -15.084 -14.477 236 H PHE 31 H PHE 31 24.198 -16.939 -11.699 237 HA PHE 31 HA PHE 31 21.603 -17.769 -12.134 238 HB2 PHE 31 HB2 PHE 31 20.972 -16.347 -10.236 239 HB3 PHE 31 HB3 PHE 31 22.482 -17.193 -9.916 240 HD1 PHE 31 HD1 PHE 31 24.634 -15.961 -10.053 241 HD2 PHE 31 HD2 PHE 31 20.868 -13.990 -10.282 242 HE1 PHE 31 HE1 PHE 31 25.728 -13.818 -9.539 243 HE2 PHE 31 HE2 PHE 31 21.957 -11.843 -9.769 244 HZ PHE 31 HZ PHE 31 24.389 -11.756 -9.398 245 H GLU 32 H GLU 32 19.995 -17.072 -13.372 246 HA GLU 32 HA GLU 32 20.271 -14.761 -15.010 247 HB2 GLU 32 HB2 GLU 32 17.957 -15.306 -15.747 248 HB3 GLU 32 HB3 GLU 32 19.065 -16.666 -15.855 249 HG2 GLU 32 HG2 GLU 32 18.165 -17.589 -13.797 250 HG3 GLU 32 HG3 GLU 32 17.080 -16.209 -13.639 251 H VAL 33 H VAL 33 19.169 -12.815 -14.956 252 HA VAL 33 HA VAL 33 17.605 -12.245 -12.530 253 HB VAL 33 HB VAL 33 18.665 -10.117 -12.234 254 HG11 VAL 33 HG11 VAL 33 19.785 -12.289 -11.430 255 HG12 VAL 33 HG12 VAL 33 20.974 -11.973 -12.696 256 HG13 VAL 33 HG13 VAL 33 20.730 -10.801 -11.400 257 HG21 VAL 33 HG21 VAL 33 20.730 -9.628 -13.712 258 HG22 VAL 33 HG22 VAL 33 19.985 -10.755 -14.846 259 HG23 VAL 33 HG23 VAL 33 19.123 -9.295 -14.359 260 H CYS 34 H CYS 34 16.544 -9.974 -12.788 261 HA CYS 34 HA CYS 34 14.815 -10.123 -15.035 262 HB2 CYS 34 HB2 CYS 34 15.193 -7.893 -13.024 263 HB3 CYS 34 HB3 CYS 34 13.853 -8.023 -14.159 264 H VAL 35 H VAL 35 14.625 -8.774 -16.816 265 HA VAL 35 HA VAL 35 16.781 -6.842 -17.288 266 HB VAL 35 HB VAL 35 16.840 -7.706 -19.701 267 HG11 VAL 35 HG11 VAL 35 17.973 -9.660 -17.729 268 HG12 VAL 35 HG12 VAL 35 18.677 -9.065 -19.234 269 HG13 VAL 35 HG13 VAL 35 18.573 -8.004 -17.828 270 HG21 VAL 35 HG21 VAL 35 14.850 -9.154 -19.482 271 HG22 VAL 35 HG22 VAL 35 16.271 -10.030 -20.048 272 HG23 VAL 35 HG23 VAL 35 15.751 -10.184 -18.370 273 HA PRO 36 HA PRO 36 13.645 -4.260 -18.949 274 HB2 PRO 36 HB2 PRO 36 15.013 -2.913 -20.869 275 HB3 PRO 36 HB3 PRO 36 15.249 -2.627 -19.141 276 HG2 PRO 36 HG2 PRO 36 16.887 -4.273 -21.031 277 HG3 PRO 36 HG3 PRO 36 17.427 -3.151 -19.767 278 HD2 PRO 36 HD2 PRO 36 17.399 -5.836 -19.417 279 HD3 PRO 36 HD3 PRO 36 17.114 -4.697 -18.086 280 H ILE 37 H ILE 37 11.993 -4.794 -20.220 281 HA ILE 37 HA ILE 37 12.285 -6.608 -22.410 282 HB ILE 37 HB ILE 37 9.880 -5.001 -21.540 283 HG12 ILE 37 HG12 ILE 37 10.089 -7.935 -21.118 284 HG13 ILE 37 HG13 ILE 37 11.078 -6.910 -20.084 285 HG21 ILE 37 HG21 ILE 37 8.571 -6.553 -22.877 286 HG22 ILE 37 HG22 ILE 37 9.747 -5.708 -23.882 287 HG23 ILE 37 HG23 ILE 37 10.043 -7.376 -23.391 288 HD11 ILE 37 HD11 ILE 37 9.008 -7.382 -18.981 289 HD12 ILE 37 HD12 ILE 37 9.033 -5.678 -19.438 290 HD13 ILE 37 HD13 ILE 37 8.087 -6.830 -20.381 291 HA PRO 38 HA PRO 38 13.095 -3.619 -25.570 292 HB2 PRO 38 HB2 PRO 38 12.677 -5.251 -27.698 293 HB3 PRO 38 HB3 PRO 38 14.132 -5.332 -26.696 294 HG2 PRO 38 HG2 PRO 38 11.678 -7.044 -26.614 295 HG3 PRO 38 HG3 PRO 38 13.381 -7.524 -26.498 296 HD2 PRO 38 HD2 PRO 38 11.781 -7.295 -24.325 297 HD3 PRO 38 HD3 PRO 38 13.521 -6.950 -24.271 298 H GLY 39 H GLY 39 11.834 -2.110 -26.474 299 HA2 GLY 39 HA2 GLY 39 10.040 -1.147 -27.567 300 HA3 GLY 39 HA3 GLY 39 9.384 -2.757 -27.823 301 H PHE 40 H PHE 40 10.073 -2.455 -24.599 302 HA PHE 40 HA PHE 40 7.425 -2.586 -23.754 303 HB2 PHE 40 HB2 PHE 40 8.996 -3.365 -22.208 304 HB3 PHE 40 HB3 PHE 40 9.997 -1.924 -22.355 305 HD1 PHE 40 HD1 PHE 40 6.707 -3.102 -21.102 306 HD2 PHE 40 HD2 PHE 40 9.802 -0.193 -20.819 307 HE1 PHE 40 HE1 PHE 40 5.630 -2.157 -19.102 308 HE2 PHE 40 HE2 PHE 40 8.731 0.756 -18.817 309 HZ PHE 40 HZ PHE 40 6.643 -0.226 -17.956 310 H CYS 41 H CYS 41 6.001 -1.105 -22.856 311 HA CYS 41 HA CYS 41 6.674 1.677 -22.613 312 HB2 CYS 41 HB2 CYS 41 5.150 2.525 -24.299 313 HB3 CYS 41 HB3 CYS 41 6.328 1.461 -25.060 314 H LEU 42 H LEU 42 4.248 2.852 -22.579 315 HA LEU 42 HA LEU 42 2.705 1.257 -20.639 316 HB2 LEU 42 HB2 LEU 42 2.946 4.253 -20.601 317 HB3 LEU 42 HB3 LEU 42 2.276 3.202 -19.355 318 HG LEU 42 HG LEU 42 5.191 3.341 -20.125 319 HD11 LEU 42 HD11 LEU 42 4.876 4.184 -17.506 320 HD12 LEU 42 HD12 LEU 42 3.571 4.984 -18.380 321 HD13 LEU 42 HD13 LEU 42 5.242 5.197 -18.903 322 HD21 LEU 42 HD21 LEU 42 5.476 2.065 -18.003 323 HD22 LEU 42 HD22 LEU 42 4.650 1.168 -19.278 324 HD23 LEU 42 HD23 LEU 42 3.724 1.863 -17.946 325 H VAL 43 H VAL 43 0.418 1.910 -20.439 326 HA VAL 43 HA VAL 43 -0.659 2.662 -23.071 327 HB VAL 43 HB VAL 43 -2.759 1.559 -22.306 328 HG11 VAL 43 HG11 VAL 43 -1.411 0.263 -23.723 329 HG12 VAL 43 HG12 VAL 43 -0.202 -0.008 -22.466 330 HG13 VAL 43 HG13 VAL 43 -1.777 -0.795 -22.361 331 HG21 VAL 43 HG21 VAL 43 -1.424 0.052 -20.185 332 HG22 VAL 43 HG22 VAL 43 -1.677 1.755 -19.803 333 HG23 VAL 43 HG23 VAL 43 -3.049 0.736 -20.241 334 H LYS 44 H LYS 44 -3.133 3.426 -22.630 335 HA LYS 44 HA LYS 44 -2.839 5.991 -21.368 336 HB2 LYS 44 HB2 LYS 44 -5.040 6.470 -22.225 337 HB3 LYS 44 HB3 LYS 44 -4.111 5.658 -23.478 338 HG2 LYS 44 HG2 LYS 44 -5.573 3.756 -21.877 339 HG3 LYS 44 HG3 LYS 44 -6.645 4.983 -22.557 340 HD2 LYS 44 HD2 LYS 44 -5.427 4.533 -24.772 341 HD3 LYS 44 HD3 LYS 44 -4.825 3.069 -23.989 342 HE2 LYS 44 HE2 LYS 44 -7.219 2.488 -23.479 343 HE3 LYS 44 HE3 LYS 44 -7.692 3.835 -24.514 344 HZ1 LYS 44 HZ1 LYS 44 -6.430 2.758 -26.327 345 HZ2 LYS 44 HZ2 LYS 44 -7.739 1.833 -25.788 346 HZ3 LYS 44 HZ3 LYS 44 -6.166 1.421 -25.324 347 H TRP 45 H TRP 45 -3.397 3.035 -20.114 348 HA TRP 45 HA TRP 45 -5.060 4.122 -17.936 349 HB2 TRP 45 HB2 TRP 45 -4.998 1.288 -18.994 350 HB3 TRP 45 HB3 TRP 45 -5.890 1.811 -17.568 351 HD1 TRP 45 HD1 TRP 45 -6.385 1.216 -21.136 352 HE1 TRP 45 HE1 TRP 45 -8.550 2.329 -21.975 353 HE3 TRP 45 HE3 TRP 45 -7.316 4.285 -17.155 354 HZ2 TRP 45 HZ2 TRP 45 -10.406 4.253 -21.068 355 HZ3 TRP 45 HZ3 TRP 45 -9.306 5.730 -17.219 356 HH2 TRP 45 HH2 TRP 45 -10.818 5.713 -19.137 357 H LYS 46 H LYS 46 -2.040 3.710 -18.517 358 HA LYS 46 HA LYS 46 -1.411 2.244 -16.041 359 HB2 LYS 46 HB2 LYS 46 0.059 2.576 -18.628 360 HB3 LYS 46 HB3 LYS 46 0.970 2.290 -17.151 361 HG2 LYS 46 HG2 LYS 46 -1.277 0.460 -17.533 362 HG3 LYS 46 HG3 LYS 46 -0.036 0.356 -18.783 363 HD2 LYS 46 HD2 LYS 46 1.519 0.436 -16.587 364 HD3 LYS 46 HD3 LYS 46 0.086 -0.347 -15.917 365 HE2 LYS 46 HE2 LYS 46 0.205 -1.932 -17.892 366 HE3 LYS 46 HE3 LYS 46 1.802 -1.258 -18.214 367 HZ1 LYS 46 HZ1 LYS 46 1.021 -3.185 -16.271 368 HZ2 LYS 46 HZ2 LYS 46 1.817 -1.882 -15.544 369 HZ3 LYS 46 HZ3 LYS 46 2.573 -2.750 -16.785 370 H GLN 47 H GLN 47 0.058 3.131 -14.568 371 HA GLN 47 HA GLN 47 -0.102 5.876 -14.132 372 HB2 GLN 47 HB2 GLN 47 1.314 3.612 -12.945 373 HB3 GLN 47 HB3 GLN 47 2.199 5.125 -12.802 374 HG2 GLN 47 HG2 GLN 47 0.652 6.066 -11.422 375 HG3 GLN 47 HG3 GLN 47 -0.681 5.128 -12.094 376 HE21 GLN 47 HE21 GLN 47 -1.433 4.498 -10.089 377 HE22 GLN 47 HE22 GLN 47 -0.601 3.353 -9.100 378 H CYS 48 H CYS 48 1.231 7.598 -14.535 379 HA CYS 48 HA CYS 48 3.326 7.135 -16.545 380 HB2 CYS 48 HB2 CYS 48 2.933 9.311 -17.371 381 HB3 CYS 48 HB3 CYS 48 1.331 8.656 -17.046 382 H ASP 49 H ASP 49 2.781 8.120 -13.323 383 HA ASP 49 HA ASP 49 4.792 9.926 -12.794 384 HB2 ASP 49 HB2 ASP 49 2.997 8.699 -11.250 385 HB3 ASP 49 HB3 ASP 49 4.398 7.715 -10.837 386 H GLY 50 H GLY 50 6.896 9.863 -13.200 387 HA2 GLY 50 HA2 GLY 50 9.077 9.031 -12.942 388 HA3 GLY 50 HA3 GLY 50 8.406 7.444 -12.592 389 H ARG 51 H ARG 51 6.668 7.457 -14.945 390 HA ARG 51 HA ARG 51 8.738 6.974 -16.985 391 HB2 ARG 51 HB2 ARG 51 6.085 5.625 -16.490 392 HB3 ARG 51 HB3 ARG 51 7.002 5.407 -17.975 393 HG2 ARG 51 HG2 ARG 51 7.584 3.572 -16.673 394 HG3 ARG 51 HG3 ARG 51 8.932 4.691 -16.456 395 HD2 ARG 51 HD2 ARG 51 8.165 5.344 -14.314 396 HD3 ARG 51 HD3 ARG 51 6.602 4.564 -14.559 397 HE ARG 51 HE ARG 51 7.530 2.585 -13.888 398 HH11 ARG 51 HH11 ARG 51 10.078 4.817 -14.691 399 HH12 ARG 51 HH12 ARG 51 11.342 3.786 -14.107 400 HH21 ARG 51 HH21 ARG 51 9.185 1.219 -13.117 401 HH22 ARG 51 HH22 ARG 51 10.833 1.739 -13.213 402 H GLU 52 H GLU 52 7.680 9.551 -16.629 403 HA GLU 52 HA GLU 52 5.498 10.148 -18.296 404 HB2 GLU 52 HB2 GLU 52 6.228 12.443 -18.179 405 HB3 GLU 52 HB3 GLU 52 6.458 11.696 -16.604 406 HG2 GLU 52 HG2 GLU 52 8.876 11.265 -17.490 407 HG3 GLU 52 HG3 GLU 52 8.484 12.579 -18.598 408 H ARG 53 H ARG 53 8.676 9.185 -19.039 409 HA ARG 53 HA ARG 53 8.266 9.952 -21.853 410 HB2 ARG 53 HB2 ARG 53 10.913 9.772 -20.403 411 HB3 ARG 53 HB3 ARG 53 10.687 10.188 -22.097 412 HG2 ARG 53 HG2 ARG 53 9.185 12.094 -21.100 413 HG3 ARG 53 HG3 ARG 53 10.159 11.805 -19.658 414 HD2 ARG 53 HD2 ARG 53 11.407 13.417 -20.719 415 HD3 ARG 53 HD3 ARG 53 12.156 11.946 -21.336 416 HE ARG 53 HE ARG 53 11.420 12.502 -23.426 417 HH11 ARG 53 HH11 ARG 53 9.626 14.338 -21.075 418 HH12 ARG 53 HH12 ARG 53 8.822 15.314 -22.259 419 HH21 ARG 53 HH21 ARG 53 10.367 13.780 -24.994 420 HH22 ARG 53 HH22 ARG 53 9.243 14.995 -24.488 421 H ASP 54 H ASP 54 7.649 7.475 -20.281 422 HA ASP 54 HA ASP 54 9.287 5.578 -21.833 423 HB2 ASP 54 HB2 ASP 54 8.836 5.667 -19.069 424 HB3 ASP 54 HB3 ASP 54 7.827 4.347 -19.657 425 H CYS 55 H CYS 55 6.131 6.758 -21.169 426 HA CYS 55 HA CYS 55 4.475 4.652 -21.806 427 HB2 CYS 55 HB2 CYS 55 4.095 7.532 -22.650 428 HB3 CYS 55 HB3 CYS 55 2.829 6.317 -22.505 429 H CYS 56 H CYS 56 3.155 4.451 -23.869 430 HA CYS 56 HA CYS 56 4.913 3.792 -26.001 431 HB2 CYS 56 HB2 CYS 56 2.154 3.343 -25.314 432 HB3 CYS 56 HB3 CYS 56 2.274 3.850 -26.995 433 H ALA 57 H ALA 57 3.850 4.476 -28.333 434 HA ALA 57 HA ALA 57 4.603 7.219 -28.620 435 HB1 ALA 57 HB1 ALA 57 3.721 5.063 -30.488 436 HB2 ALA 57 HB2 ALA 57 3.772 6.737 -31.043 437 HB3 ALA 57 HB3 ALA 57 5.238 5.961 -30.444 438 H GLY 58 H GLY 58 3.361 8.997 -28.800 439 HA2 GLY 58 HA2 GLY 58 1.428 10.244 -29.259 440 HA3 GLY 58 HA3 GLY 58 0.512 8.747 -29.354 441 H LEU 59 H LEU 59 1.973 8.082 -26.682 442 HA LEU 59 HA LEU 59 -0.181 9.033 -25.017 443 HB2 LEU 59 HB2 LEU 59 1.574 6.844 -25.007 444 HB3 LEU 59 HB3 LEU 59 1.944 7.768 -23.552 445 HG LEU 59 HG LEU 59 -0.308 7.532 -22.758 446 HD11 LEU 59 HD11 LEU 59 -0.829 6.353 -25.469 447 HD12 LEU 59 HD12 LEU 59 -1.636 7.711 -24.685 448 HD13 LEU 59 HD13 LEU 59 -1.898 6.069 -24.095 449 HD21 LEU 59 HD21 LEU 59 0.434 5.610 -21.926 450 HD22 LEU 59 HD22 LEU 59 1.386 5.280 -23.374 451 HD23 LEU 59 HD23 LEU 59 -0.311 4.801 -23.304 452 H GLU 60 H GLU 60 0.422 9.836 -22.750 453 HA GLU 60 HA GLU 60 2.827 11.361 -22.480 454 HB2 GLU 60 HB2 GLU 60 1.911 13.569 -22.527 455 HB3 GLU 60 HB3 GLU 60 1.462 12.779 -24.032 456 HG2 GLU 60 HG2 GLU 60 -0.703 12.180 -22.610 457 HG3 GLU 60 HG3 GLU 60 -0.226 13.654 -21.768 458 H CYS 61 H CYS 61 3.043 12.328 -20.399 459 HA CYS 61 HA CYS 61 1.814 10.861 -18.323 460 HB2 CYS 61 HB2 CYS 61 4.102 12.139 -18.404 461 HB3 CYS 61 HB3 CYS 61 3.147 13.499 -17.823 462 H TRP 62 H TRP 62 -0.396 11.079 -18.326 463 HA TRP 62 HA TRP 62 -1.667 13.655 -18.380 464 HB2 TRP 62 HB2 TRP 62 -2.597 11.363 -19.192 465 HB3 TRP 62 HB3 TRP 62 -3.032 11.128 -17.501 466 HD1 TRP 62 HD1 TRP 62 -3.387 14.701 -18.310 467 HE1 TRP 62 HE1 TRP 62 -5.853 15.296 -18.749 468 HE3 TRP 62 HE3 TRP 62 -5.296 9.979 -18.753 469 HZ2 TRP 62 HZ2 TRP 62 -8.285 13.943 -19.220 470 HZ3 TRP 62 HZ3 TRP 62 -7.702 9.717 -19.197 471 HH2 TRP 62 HH2 TRP 62 -9.164 11.659 -19.424 472 H LYS 63 H LYS 63 -2.292 14.895 -16.715 473 HA LYS 63 HA LYS 63 -1.676 13.936 -14.010 474 HB2 LYS 63 HB2 LYS 63 -0.794 16.171 -15.139 475 HB3 LYS 63 HB3 LYS 63 -2.338 16.790 -14.571 476 HG2 LYS 63 HG2 LYS 63 -0.651 15.289 -12.646 477 HG3 LYS 63 HG3 LYS 63 -0.153 16.920 -13.099 478 HD2 LYS 63 HD2 LYS 63 -2.963 16.331 -12.224 479 HD3 LYS 63 HD3 LYS 63 -1.682 16.642 -11.050 480 HE2 LYS 63 HE2 LYS 63 -2.112 18.532 -13.327 481 HE3 LYS 63 HE3 LYS 63 -3.171 18.601 -11.918 482 HZ1 LYS 63 HZ1 LYS 63 -0.874 19.928 -12.102 483 HZ2 LYS 63 HZ2 LYS 63 -0.325 18.514 -11.353 484 HZ3 LYS 63 HZ3 LYS 63 -1.546 19.436 -10.630 485 H ARG 64 H ARG 64 -3.477 12.879 -13.328 486 HA ARG 64 HA ARG 64 -5.993 14.414 -13.326 487 HB2 ARG 64 HB2 ARG 64 -5.415 11.626 -14.030 488 HB3 ARG 64 HB3 ARG 64 -6.752 11.807 -12.903 489 HG2 ARG 64 HG2 ARG 64 -8.038 12.993 -14.415 490 HG3 ARG 64 HG3 ARG 64 -6.641 13.469 -15.384 491 HD2 ARG 64 HD2 ARG 64 -7.327 11.825 -16.755 492 HD3 ARG 64 HD3 ARG 64 -6.520 10.770 -15.595 493 HE ARG 64 HE ARG 64 -8.563 9.945 -15.005 494 HH11 ARG 64 HH11 ARG 64 -9.014 13.004 -16.602 495 HH12 ARG 64 HH12 ARG 64 -10.743 12.885 -16.627 496 HH21 ARG 64 HH21 ARG 64 -10.838 9.775 -15.031 497 HH22 ARG 64 HH22 ARG 64 -11.779 11.047 -15.733 498 H SER 65 H SER 65 -6.892 14.849 -11.410 499 HA SER 65 HA SER 65 -5.987 13.337 -9.055 500 HB2 SER 65 HB2 SER 65 -6.378 16.338 -9.108 501 HB3 SER 65 HB3 SER 65 -5.792 15.369 -7.756 502 HG SER 65 HG SER 65 -3.898 15.764 -8.567 503 H GLY 66 H GLY 66 -7.551 12.776 -7.639 504 HA2 GLY 66 HA2 GLY 66 -9.636 13.297 -6.497 505 HA3 GLY 66 HA3 GLY 66 -10.218 13.988 -8.004 506 H ASN 67 H ASN 67 -8.945 11.636 -9.446 507 HA ASN 67 HA ASN 67 -11.131 9.740 -8.907 508 HB2 ASN 67 HB2 ASN 67 -9.744 10.579 -11.428 509 HB3 ASN 67 HB3 ASN 67 -10.486 8.985 -11.336 510 HD21 ASN 67 HD21 ASN 67 -11.002 11.969 -12.409 511 HD22 ASN 67 HD22 ASN 67 -12.721 12.068 -12.271 512 H LYS 68 H LYS 68 -7.734 9.891 -9.953 513 HA LYS 68 HA LYS 68 -7.016 7.691 -8.274 514 HB2 LYS 68 HB2 LYS 68 -7.541 7.246 -11.156 515 HB3 LYS 68 HB3 LYS 68 -6.071 6.526 -10.514 516 HG2 LYS 68 HG2 LYS 68 -7.674 5.646 -8.644 517 HG3 LYS 68 HG3 LYS 68 -8.915 5.928 -9.867 518 HD2 LYS 68 HD2 LYS 68 -6.422 4.358 -10.461 519 HD3 LYS 68 HD3 LYS 68 -7.861 3.602 -9.774 520 HE2 LYS 68 HE2 LYS 68 -9.086 4.766 -11.752 521 HE3 LYS 68 HE3 LYS 68 -7.476 4.859 -12.461 522 HZ1 LYS 68 HZ1 LYS 68 -8.365 2.280 -11.402 523 HZ2 LYS 68 HZ2 LYS 68 -7.355 2.616 -12.716 524 HZ3 LYS 68 HZ3 LYS 68 -9.030 2.803 -12.868 525 H SER 69 H SER 69 -4.650 6.947 -9.011 526 HA SER 69 HA SER 69 -2.991 9.173 -8.640 527 HB2 SER 69 HB2 SER 69 -2.479 6.324 -9.450 528 HB3 SER 69 HB3 SER 69 -1.160 7.494 -9.413 529 HG SER 69 HG SER 69 -2.142 6.146 -7.392 530 H SER 70 H SER 70 -0.995 9.444 -10.211 531 HA SER 70 HA SER 70 -2.016 10.658 -12.563 532 HB2 SER 70 HB2 SER 70 0.187 11.394 -12.967 533 HB3 SER 70 HB3 SER 70 0.080 11.300 -11.210 534 HG SER 70 HG SER 70 1.307 9.468 -12.986 535 H VAL 71 H VAL 71 -2.506 9.737 -14.430 536 HA VAL 71 HA VAL 71 -1.153 7.220 -15.161 537 HB VAL 71 HB VAL 71 -3.228 6.724 -16.509 538 HG11 VAL 71 HG11 VAL 71 -2.606 6.127 -13.936 539 HG12 VAL 71 HG12 VAL 71 -4.207 6.845 -13.745 540 HG13 VAL 71 HG13 VAL 71 -3.981 5.459 -14.813 541 HG21 VAL 71 HG21 VAL 71 -3.898 9.339 -15.735 542 HG22 VAL 71 HG22 VAL 71 -4.884 8.199 -16.650 543 HG23 VAL 71 HG23 VAL 71 -5.022 8.271 -14.894 544 H CYS 72 H CYS 72 -1.564 6.836 -17.665 545 HA CYS 72 HA CYS 72 -0.564 9.255 -19.000 546 HB2 CYS 72 HB2 CYS 72 0.190 6.472 -19.092 547 HB3 CYS 72 HB3 CYS 72 -0.244 7.035 -20.703 548 H ALA 73 H ALA 73 -1.282 9.726 -21.159 549 HA ALA 73 HA ALA 73 -3.742 8.441 -22.050 550 HB1 ALA 73 HB1 ALA 73 -5.153 10.129 -21.653 551 HB2 ALA 73 HB2 ALA 73 -3.934 10.698 -20.512 552 HB3 ALA 73 HB3 ALA 73 -3.979 11.349 -22.149 553 HA PRO 74 HA PRO 74 -2.089 9.156 -26.054 554 HB2 PRO 74 HB2 PRO 74 -4.358 9.374 -27.528 555 HB3 PRO 74 HB3 PRO 74 -3.789 7.839 -26.861 556 HG2 PRO 74 HG2 PRO 74 -5.896 9.694 -25.819 557 HG3 PRO 74 HG3 PRO 74 -5.918 7.924 -25.927 558 HD2 PRO 74 HD2 PRO 74 -5.384 9.236 -23.619 559 HD3 PRO 74 HD3 PRO 74 -4.656 7.666 -24.015 560 H ILE 75 H ILE 75 -2.358 10.651 -28.014 561 HA ILE 75 HA ILE 75 -1.915 13.293 -27.243 562 HB ILE 75 HB ILE 75 -2.276 13.838 -29.689 563 HG12 ILE 75 HG12 ILE 75 -2.424 10.858 -30.078 564 HG13 ILE 75 HG13 ILE 75 -3.886 11.826 -29.924 565 HG21 ILE 75 HG21 ILE 75 -0.406 11.531 -29.210 566 HG22 ILE 75 HG22 ILE 75 -0.220 12.857 -30.357 567 HG23 ILE 75 HG23 ILE 75 -0.102 13.166 -28.624 568 HD11 ILE 75 HD11 ILE 75 -3.779 12.237 -32.091 569 HD12 ILE 75 HD12 ILE 75 -2.277 13.122 -31.822 570 HD13 ILE 75 HD13 ILE 75 -2.230 11.401 -32.208 571 H THR 76 H THR 76 -3.139 15.201 -27.556 572 HA THR 76 HA THR 76 -6.040 14.819 -27.852 573 HB THR 76 HB THR 76 -6.385 16.545 -26.062 574 HG1 THR 76 HG1 THR 76 -4.668 17.460 -25.250 575 HG21 THR 76 HG21 THR 76 -5.080 14.550 -24.456 576 HG22 THR 76 HG22 THR 76 -5.888 13.789 -25.827 577 HG23 THR 76 HG23 THR 76 -6.803 14.815 -24.721 Start of MODEL 7 1 H1 SER 1 H SER 1 0.460 -0.119 -1.568 2 HA SER 1 HA SER 1 2.705 1.522 -0.607 3 HB2 SER 1 HB2 SER 1 0.775 -0.277 0.869 4 HB3 SER 1 HB3 SER 1 2.216 0.414 1.615 5 HG SER 1 HG SER 1 0.151 1.922 0.382 6 H ASN 2 H ASN 2 3.539 -0.050 -2.541 7 HA ASN 2 HA ASN 2 5.356 -1.829 -1.237 8 HB2 ASN 2 HB2 ASN 2 3.523 -3.380 -1.302 9 HB3 ASN 2 HB3 ASN 2 3.179 -2.989 -2.984 10 HD21 ASN 2 HD21 ASN 2 5.790 -4.209 -0.925 11 HD22 ASN 2 HD22 ASN 2 6.390 -5.356 -2.070 12 H GLU 3 H GLU 3 7.156 -2.216 -2.466 13 HA GLU 3 HA GLU 3 7.204 -0.907 -5.096 14 HB2 GLU 3 HB2 GLU 3 9.348 -1.447 -3.052 15 HB3 GLU 3 HB3 GLU 3 9.742 -1.019 -4.711 16 HG2 GLU 3 HG2 GLU 3 8.952 1.128 -4.491 17 HG3 GLU 3 HG3 GLU 3 7.872 0.709 -3.163 18 H CYS 4 H CYS 4 9.043 -1.896 -6.532 19 HA CYS 4 HA CYS 4 8.611 -4.811 -6.591 20 HB2 CYS 4 HB2 CYS 4 8.838 -4.702 -9.012 21 HB3 CYS 4 HB3 CYS 4 7.576 -3.595 -8.479 22 H ILE 5 H ILE 5 10.402 -5.909 -7.978 23 HA ILE 5 HA ILE 5 12.889 -5.400 -6.634 24 HB ILE 5 HB ILE 5 12.223 -7.387 -8.807 25 HG12 ILE 5 HG12 ILE 5 12.734 -8.123 -5.959 26 HG13 ILE 5 HG13 ILE 5 11.167 -7.439 -6.376 27 HG21 ILE 5 HG21 ILE 5 14.737 -6.578 -7.692 28 HG22 ILE 5 HG22 ILE 5 14.407 -8.262 -7.282 29 HG23 ILE 5 HG23 ILE 5 14.407 -7.749 -8.969 30 HD11 ILE 5 HD11 ILE 5 12.057 -9.592 -8.145 31 HD12 ILE 5 HD12 ILE 5 11.784 -10.072 -6.470 32 HD13 ILE 5 HD13 ILE 5 10.488 -9.308 -7.391 33 H ARG 6 H ARG 6 14.586 -4.277 -7.345 34 HA ARG 6 HA ARG 6 14.489 -2.560 -9.512 35 HB2 ARG 6 HB2 ARG 6 16.868 -3.726 -8.064 36 HB3 ARG 6 HB3 ARG 6 16.999 -2.447 -9.264 37 HG2 ARG 6 HG2 ARG 6 16.906 -1.151 -7.418 38 HG3 ARG 6 HG3 ARG 6 15.170 -1.334 -7.678 39 HD2 ARG 6 HD2 ARG 6 14.920 -2.776 -5.917 40 HD3 ARG 6 HD3 ARG 6 16.571 -3.381 -6.040 41 HE ARG 6 HE ARG 6 15.660 -1.217 -4.429 42 HH11 ARG 6 HH11 ARG 6 18.379 -2.378 -6.267 43 HH12 ARG 6 HH12 ARG 6 19.548 -1.500 -5.337 44 HH21 ARG 6 HH21 ARG 6 17.190 -0.057 -3.198 45 HH22 ARG 6 HH22 ARG 6 18.871 -0.181 -3.591 46 H LYS 7 H LYS 7 16.026 -2.553 -11.400 47 HA LYS 7 HA LYS 7 15.649 -4.999 -12.893 48 HB2 LYS 7 HB2 LYS 7 15.268 -2.739 -13.882 49 HB3 LYS 7 HB3 LYS 7 16.996 -2.434 -13.755 50 HG2 LYS 7 HG2 LYS 7 17.425 -4.333 -15.252 51 HG3 LYS 7 HG3 LYS 7 15.684 -4.582 -15.408 52 HD2 LYS 7 HD2 LYS 7 16.547 -3.330 -17.309 53 HD3 LYS 7 HD3 LYS 7 15.456 -2.328 -16.350 54 HE2 LYS 7 HE2 LYS 7 17.098 -0.909 -15.727 55 HE3 LYS 7 HE3 LYS 7 18.299 -2.194 -15.595 56 HZ1 LYS 7 HZ1 LYS 7 19.017 -1.822 -17.659 57 HZ2 LYS 7 HZ2 LYS 7 18.197 -0.346 -17.565 58 HZ3 LYS 7 HZ3 LYS 7 17.456 -1.680 -18.296 59 H TRP 8 H TRP 8 17.254 -6.297 -13.765 60 HA TRP 8 HA TRP 8 19.209 -7.460 -13.748 61 HB2 TRP 8 HB2 TRP 8 20.164 -4.610 -13.706 62 HB3 TRP 8 HB3 TRP 8 21.310 -5.945 -13.688 63 HD1 TRP 8 HD1 TRP 8 19.348 -3.841 -16.020 64 HE1 TRP 8 HE1 TRP 8 19.510 -4.764 -18.416 65 HE3 TRP 8 HE3 TRP 8 21.398 -8.410 -14.991 66 HZ2 TRP 8 HZ2 TRP 8 20.390 -7.119 -19.701 67 HZ3 TRP 8 HZ3 TRP 8 21.868 -9.939 -16.860 68 HH2 TRP 8 HH2 TRP 8 21.374 -9.306 -19.166 69 H LEU 9 H LEU 9 18.040 -7.684 -11.377 70 HA LEU 9 HA LEU 9 20.259 -7.415 -9.459 71 HB2 LEU 9 HB2 LEU 9 18.173 -5.923 -9.134 72 HB3 LEU 9 HB3 LEU 9 17.383 -7.412 -8.618 73 HG LEU 9 HG LEU 9 19.936 -6.753 -7.280 74 HD11 LEU 9 HD11 LEU 9 17.410 -5.208 -6.714 75 HD12 LEU 9 HD12 LEU 9 18.874 -4.549 -7.443 76 HD13 LEU 9 HD13 LEU 9 18.908 -5.145 -5.784 77 HD21 LEU 9 HD21 LEU 9 18.907 -8.654 -6.447 78 HD22 LEU 9 HD22 LEU 9 17.290 -7.962 -6.581 79 HD23 LEU 9 HD23 LEU 9 18.385 -7.406 -5.315 80 H SER 10 H SER 10 17.108 -9.080 -9.648 81 HA SER 10 HA SER 10 18.113 -11.671 -9.894 82 HB2 SER 10 HB2 SER 10 17.623 -12.443 -7.503 83 HB3 SER 10 HB3 SER 10 19.116 -11.537 -7.751 84 HG SER 10 HG SER 10 17.231 -10.982 -6.049 85 H CYS 11 H CYS 11 16.467 -12.804 -10.668 86 HA CYS 11 HA CYS 11 13.739 -11.911 -10.075 87 HB2 CYS 11 HB2 CYS 11 13.062 -12.996 -12.091 88 HB3 CYS 11 HB3 CYS 11 14.534 -12.103 -12.461 89 H VAL 12 H VAL 12 15.923 -14.255 -9.137 90 HA VAL 12 HA VAL 12 14.538 -16.624 -8.966 91 HB VAL 12 HB VAL 12 16.309 -15.508 -6.788 92 HG11 VAL 12 HG11 VAL 12 15.122 -17.481 -6.074 93 HG12 VAL 12 HG12 VAL 12 15.579 -18.333 -7.550 94 HG13 VAL 12 HG13 VAL 12 16.811 -17.894 -6.367 95 HG21 VAL 12 HG21 VAL 12 17.815 -15.399 -8.463 96 HG22 VAL 12 HG22 VAL 12 17.912 -17.144 -8.217 97 HG23 VAL 12 HG23 VAL 12 16.897 -16.489 -9.502 98 H ASP 13 H ASP 13 14.150 -13.727 -7.041 99 HA ASP 13 HA ASP 13 12.492 -14.929 -5.045 100 HB2 ASP 13 HB2 ASP 13 12.974 -12.048 -5.814 101 HB3 ASP 13 HB3 ASP 13 11.958 -12.536 -4.460 102 H ARG 14 H ARG 14 11.843 -12.837 -7.849 103 HA ARG 14 HA ARG 14 9.197 -14.041 -8.084 104 HB2 ARG 14 HB2 ARG 14 9.734 -11.156 -7.510 105 HB3 ARG 14 HB3 ARG 14 8.371 -11.583 -8.536 106 HG2 ARG 14 HG2 ARG 14 7.140 -12.210 -6.796 107 HG3 ARG 14 HG3 ARG 14 8.451 -13.179 -6.122 108 HD2 ARG 14 HD2 ARG 14 8.819 -10.274 -5.905 109 HD3 ARG 14 HD3 ARG 14 7.455 -10.917 -4.992 110 HE ARG 14 HE ARG 14 10.234 -11.268 -4.412 111 HH11 ARG 14 HH11 ARG 14 7.078 -12.706 -4.107 112 HH12 ARG 14 HH12 ARG 14 7.495 -13.639 -2.708 113 HH21 ARG 14 HH21 ARG 14 10.795 -12.491 -2.570 114 HH22 ARG 14 HH22 ARG 14 9.609 -13.515 -1.834 115 H LYS 15 H LYS 15 9.251 -14.830 -10.082 116 HA LYS 15 HA LYS 15 10.784 -13.551 -12.172 117 HB2 LYS 15 HB2 LYS 15 9.085 -16.044 -12.103 118 HB3 LYS 15 HB3 LYS 15 9.882 -15.468 -13.561 119 HG2 LYS 15 HG2 LYS 15 11.469 -16.914 -12.856 120 HG3 LYS 15 HG3 LYS 15 11.993 -15.495 -11.944 121 HD2 LYS 15 HD2 LYS 15 11.980 -17.225 -10.367 122 HD3 LYS 15 HD3 LYS 15 10.465 -16.365 -10.079 123 HE2 LYS 15 HE2 LYS 15 9.410 -18.076 -11.661 124 HE3 LYS 15 HE3 LYS 15 10.898 -19.000 -11.459 125 HZ1 LYS 15 HZ1 LYS 15 8.980 -18.216 -9.335 126 HZ2 LYS 15 HZ2 LYS 15 10.486 -18.921 -9.029 127 HZ3 LYS 15 HZ3 LYS 15 9.309 -19.781 -9.888 128 H ASN 16 H ASN 16 7.673 -13.249 -10.949 129 HA ASN 16 HA ASN 16 6.679 -12.160 -13.500 130 HB2 ASN 16 HB2 ASN 16 5.272 -13.977 -12.818 131 HB3 ASN 16 HB3 ASN 16 5.179 -13.362 -11.170 132 HD21 ASN 16 HD21 ASN 16 3.815 -11.668 -10.698 133 HD22 ASN 16 HD22 ASN 16 2.605 -11.110 -11.799 134 H ASP 17 H ASP 17 7.153 -11.584 -10.086 135 HA ASP 17 HA ASP 17 5.975 -8.915 -10.297 136 HB2 ASP 17 HB2 ASP 17 6.614 -10.767 -8.075 137 HB3 ASP 17 HB3 ASP 17 6.816 -9.051 -7.734 138 H CYS 18 H CYS 18 8.565 -9.771 -11.543 139 HA CYS 18 HA CYS 18 10.800 -8.814 -10.242 140 HB2 CYS 18 HB2 CYS 18 10.020 -9.281 -13.030 141 HB3 CYS 18 HB3 CYS 18 11.250 -8.035 -12.843 142 H CYS 19 H CYS 19 8.957 -6.941 -12.658 143 HA CYS 19 HA CYS 19 8.662 -4.632 -11.112 144 HB2 CYS 19 HB2 CYS 19 11.303 -4.931 -11.807 145 HB3 CYS 19 HB3 CYS 19 10.699 -3.889 -13.091 146 H GLU 20 H GLU 20 8.709 -2.606 -12.897 147 HA GLU 20 HA GLU 20 6.610 -3.392 -14.737 148 HB2 GLU 20 HB2 GLU 20 6.509 -1.318 -13.302 149 HB3 GLU 20 HB3 GLU 20 7.773 -0.637 -14.317 150 HG2 GLU 20 HG2 GLU 20 6.079 0.203 -15.498 151 HG3 GLU 20 HG3 GLU 20 5.964 -1.417 -16.182 152 H GLY 21 H GLY 21 7.134 -4.147 -16.678 153 HA2 GLY 21 HA2 GLY 21 7.981 -4.063 -18.838 154 HA3 GLY 21 HA3 GLY 21 8.898 -2.632 -18.390 155 H LEU 22 H LEU 22 9.026 -5.677 -16.649 156 HA LEU 22 HA LEU 22 11.714 -6.157 -17.741 157 HB2 LEU 22 HB2 LEU 22 10.864 -6.218 -14.854 158 HB3 LEU 22 HB3 LEU 22 12.377 -6.907 -15.440 159 HG LEU 22 HG LEU 22 11.581 -3.998 -15.469 160 HD11 LEU 22 HD11 LEU 22 12.647 -3.825 -13.533 161 HD12 LEU 22 HD12 LEU 22 14.065 -4.646 -14.184 162 HD13 LEU 22 HD13 LEU 22 12.749 -5.585 -13.482 163 HD21 LEU 22 HD21 LEU 22 12.819 -4.307 -17.445 164 HD22 LEU 22 HD22 LEU 22 13.932 -5.434 -16.670 165 HD23 LEU 22 HD23 LEU 22 13.982 -3.719 -16.257 166 H GLU 23 H GLU 23 12.467 -8.370 -17.517 167 HA GLU 23 HA GLU 23 10.458 -10.383 -16.899 168 HB2 GLU 23 HB2 GLU 23 11.512 -9.833 -19.641 169 HB3 GLU 23 HB3 GLU 23 11.176 -11.495 -19.178 170 HG2 GLU 23 HG2 GLU 23 8.965 -9.859 -18.430 171 HG3 GLU 23 HG3 GLU 23 9.375 -9.546 -20.115 172 H CYS 24 H CYS 24 11.321 -12.485 -16.598 173 HA CYS 24 HA CYS 24 14.006 -12.479 -15.601 174 HB2 CYS 24 HB2 CYS 24 11.954 -13.791 -14.715 175 HB3 CYS 24 HB3 CYS 24 12.343 -14.954 -15.978 176 H TYR 25 H TYR 25 15.814 -13.038 -16.623 177 HA TYR 25 HA TYR 25 15.613 -14.091 -19.340 178 HB2 TYR 25 HB2 TYR 25 16.990 -12.077 -18.944 179 HB3 TYR 25 HB3 TYR 25 18.015 -13.004 -17.853 180 HD1 TYR 25 HD1 TYR 25 16.826 -12.901 -21.381 181 HD2 TYR 25 HD2 TYR 25 19.874 -14.143 -18.684 182 HE1 TYR 25 HE1 TYR 25 18.228 -13.579 -23.286 183 HE2 TYR 25 HE2 TYR 25 21.284 -14.822 -20.580 184 HH TYR 25 HH TYR 25 20.949 -15.512 -22.969 185 H LYS 26 H LYS 26 16.942 -15.842 -20.054 186 HA LYS 26 HA LYS 26 17.134 -17.948 -18.077 187 HB2 LYS 26 HB2 LYS 26 17.874 -18.086 -21.001 188 HB3 LYS 26 HB3 LYS 26 17.501 -19.429 -19.928 189 HG2 LYS 26 HG2 LYS 26 15.186 -18.463 -19.710 190 HG3 LYS 26 HG3 LYS 26 15.616 -17.361 -21.021 191 HD2 LYS 26 HD2 LYS 26 16.064 -19.260 -22.483 192 HD3 LYS 26 HD3 LYS 26 15.684 -20.376 -21.170 193 HE2 LYS 26 HE2 LYS 26 13.703 -20.331 -22.357 194 HE3 LYS 26 HE3 LYS 26 13.412 -19.121 -21.108 195 HZ1 LYS 26 HZ1 LYS 26 12.764 -17.969 -22.939 196 HZ2 LYS 26 HZ2 LYS 26 13.835 -18.761 -23.980 197 HZ3 LYS 26 HZ3 LYS 26 14.403 -17.551 -22.944 198 H ARG 27 H ARG 27 18.879 -17.973 -16.813 199 HA ARG 27 HA ARG 27 21.514 -17.849 -18.096 200 HB2 ARG 27 HB2 ARG 27 20.809 -15.648 -16.944 201 HB3 ARG 27 HB3 ARG 27 21.034 -16.527 -15.438 202 HG2 ARG 27 HG2 ARG 27 23.014 -15.254 -15.964 203 HG3 ARG 27 HG3 ARG 27 23.363 -16.981 -16.067 204 HD2 ARG 27 HD2 ARG 27 23.716 -16.912 -18.300 205 HD3 ARG 27 HD3 ARG 27 22.473 -15.690 -18.564 206 HE ARG 27 HE ARG 27 24.655 -14.537 -17.209 207 HH11 ARG 27 HH11 ARG 27 23.770 -15.792 -20.334 208 HH12 ARG 27 HH12 ARG 27 24.877 -14.779 -21.199 209 HH21 ARG 27 HH21 ARG 27 26.116 -13.197 -18.338 210 HH22 ARG 27 HH22 ARG 27 26.212 -13.303 -20.063 211 H ARG 28 H ARG 28 22.584 -19.648 -17.656 212 HA ARG 28 HA ARG 28 21.884 -21.165 -15.242 213 HB2 ARG 28 HB2 ARG 28 21.964 -22.068 -17.753 214 HB3 ARG 28 HB3 ARG 28 23.654 -22.316 -17.338 215 HG2 ARG 28 HG2 ARG 28 23.202 -24.019 -15.937 216 HG3 ARG 28 HG3 ARG 28 21.699 -23.290 -15.364 217 HD2 ARG 28 HD2 ARG 28 21.726 -24.188 -18.175 218 HD3 ARG 28 HD3 ARG 28 21.800 -25.458 -16.955 219 HE ARG 28 HE ARG 28 19.760 -23.783 -16.172 220 HH11 ARG 28 HH11 ARG 28 20.502 -25.737 -18.955 221 HH12 ARG 28 HH12 ARG 28 18.842 -26.046 -19.344 222 HH21 ARG 28 HH21 ARG 28 17.572 -24.182 -16.673 223 HH22 ARG 28 HH22 ARG 28 17.176 -25.160 -18.046 224 H HIS 29 H HIS 29 24.712 -20.083 -17.106 225 HA HIS 29 HA HIS 29 26.684 -20.962 -15.330 226 HB2 HIS 29 HB2 HIS 29 26.636 -18.685 -17.309 227 HB3 HIS 29 HB3 HIS 29 28.075 -19.102 -16.383 228 HD1 HIS 29 HD1 HIS 29 26.324 -19.900 -19.453 229 HD2 HIS 29 HD2 HIS 29 28.969 -21.858 -16.916 230 HE1 HIS 29 HE1 HIS 29 27.245 -21.820 -20.792 231 H SER 30 H SER 30 24.529 -18.262 -15.170 232 HA SER 30 HA SER 30 25.625 -17.563 -12.555 233 HB2 SER 30 HB2 SER 30 26.741 -15.963 -13.946 234 HB3 SER 30 HB3 SER 30 25.258 -15.608 -14.832 235 HG SER 30 HG SER 30 25.721 -14.011 -13.260 236 H PHE 31 H PHE 31 24.143 -16.447 -11.191 237 HA PHE 31 HA PHE 31 21.539 -17.362 -11.246 238 HB2 PHE 31 HB2 PHE 31 21.056 -15.683 -9.524 239 HB3 PHE 31 HB3 PHE 31 22.611 -16.455 -9.232 240 HD1 PHE 31 HD1 PHE 31 24.708 -15.229 -9.760 241 HD2 PHE 31 HD2 PHE 31 20.886 -13.361 -9.905 242 HE1 PHE 31 HE1 PHE 31 25.789 -13.021 -9.676 243 HE2 PHE 31 HE2 PHE 31 21.961 -11.149 -9.822 244 HZ PHE 31 HZ PHE 31 24.415 -10.976 -9.706 245 H GLU 32 H GLU 32 19.818 -16.883 -12.431 246 HA GLU 32 HA GLU 32 19.874 -14.858 -14.415 247 HB2 GLU 32 HB2 GLU 32 17.453 -15.483 -14.730 248 HB3 GLU 32 HB3 GLU 32 18.594 -16.813 -14.867 249 HG2 GLU 32 HG2 GLU 32 18.026 -17.628 -12.705 250 HG3 GLU 32 HG3 GLU 32 17.064 -16.192 -12.356 251 H VAL 33 H VAL 33 18.720 -12.936 -14.573 252 HA VAL 33 HA VAL 33 17.333 -11.984 -12.174 253 HB VAL 33 HB VAL 33 18.504 -9.905 -12.106 254 HG11 VAL 33 HG11 VAL 33 20.497 -10.609 -11.189 255 HG12 VAL 33 HG12 VAL 33 19.566 -12.108 -11.190 256 HG13 VAL 33 HG13 VAL 33 20.772 -11.816 -12.444 257 HG21 VAL 33 HG21 VAL 33 19.769 -10.855 -14.654 258 HG22 VAL 33 HG22 VAL 33 18.914 -9.345 -14.340 259 HG23 VAL 33 HG23 VAL 33 20.522 -9.607 -13.663 260 H CYS 34 H CYS 34 16.391 -9.698 -12.681 261 HA CYS 34 HA CYS 34 14.621 -10.010 -14.879 262 HB2 CYS 34 HB2 CYS 34 15.117 -7.483 -13.297 263 HB3 CYS 34 HB3 CYS 34 13.667 -7.910 -14.199 264 H VAL 35 H VAL 35 14.436 -8.787 -16.773 265 HA VAL 35 HA VAL 35 16.729 -7.108 -17.502 266 HB VAL 35 HB VAL 35 16.819 -8.158 -19.742 267 HG11 VAL 35 HG11 VAL 35 17.283 -10.113 -17.493 268 HG12 VAL 35 HG12 VAL 35 18.063 -10.123 -19.076 269 HG13 VAL 35 HG13 VAL 35 18.379 -8.808 -17.944 270 HG21 VAL 35 HG21 VAL 35 15.525 -9.907 -20.399 271 HG22 VAL 35 HG22 VAL 35 15.383 -10.560 -18.768 272 HG23 VAL 35 HG23 VAL 35 14.405 -9.176 -19.250 273 HA PRO 36 HA PRO 36 13.712 -4.419 -19.225 274 HB2 PRO 36 HB2 PRO 36 15.156 -3.243 -21.200 275 HB3 PRO 36 HB3 PRO 36 15.409 -2.893 -19.486 276 HG2 PRO 36 HG2 PRO 36 16.947 -4.715 -21.295 277 HG3 PRO 36 HG3 PRO 36 17.551 -3.571 -20.082 278 HD2 PRO 36 HD2 PRO 36 17.368 -6.231 -19.611 279 HD3 PRO 36 HD3 PRO 36 17.150 -5.018 -18.333 280 H ILE 37 H ILE 37 12.031 -4.916 -20.472 281 HA ILE 37 HA ILE 37 12.259 -6.812 -22.616 282 HB ILE 37 HB ILE 37 9.888 -5.171 -21.714 283 HG12 ILE 37 HG12 ILE 37 10.133 -8.109 -21.271 284 HG13 ILE 37 HG13 ILE 37 11.075 -7.040 -20.236 285 HG21 ILE 37 HG21 ILE 37 9.988 -7.561 -23.549 286 HG22 ILE 37 HG22 ILE 37 8.534 -6.725 -23.007 287 HG23 ILE 37 HG23 ILE 37 9.691 -5.896 -24.047 288 HD11 ILE 37 HD11 ILE 37 9.111 -7.395 -19.053 289 HD12 ILE 37 HD12 ILE 37 8.860 -5.825 -19.818 290 HD13 ILE 37 HD13 ILE 37 8.105 -7.267 -20.497 291 HA PRO 38 HA PRO 38 13.029 -3.876 -25.837 292 HB2 PRO 38 HB2 PRO 38 12.558 -5.539 -27.931 293 HB3 PRO 38 HB3 PRO 38 14.031 -5.613 -26.957 294 HG2 PRO 38 HG2 PRO 38 11.568 -7.308 -26.800 295 HG3 PRO 38 HG3 PRO 38 13.271 -7.797 -26.710 296 HD2 PRO 38 HD2 PRO 38 11.715 -7.524 -24.510 297 HD3 PRO 38 HD3 PRO 38 13.458 -7.190 -24.494 298 H GLY 39 H GLY 39 11.761 -2.375 -26.746 299 HA2 GLY 39 HA2 GLY 39 9.950 -1.413 -27.810 300 HA3 GLY 39 HA3 GLY 39 9.285 -3.023 -28.039 301 H PHE 40 H PHE 40 10.037 -2.664 -24.829 302 HA PHE 40 HA PHE 40 7.401 -2.789 -23.937 303 HB2 PHE 40 HB2 PHE 40 9.011 -3.549 -22.415 304 HB3 PHE 40 HB3 PHE 40 9.994 -2.099 -22.586 305 HD1 PHE 40 HD1 PHE 40 6.641 -3.187 -21.384 306 HD2 PHE 40 HD2 PHE 40 9.897 -0.480 -20.951 307 HE1 PHE 40 HE1 PHE 40 5.582 -2.240 -19.375 308 HE2 PHE 40 HE2 PHE 40 8.845 0.470 -18.941 309 HZ PHE 40 HZ PHE 40 6.684 -0.408 -18.150 310 H CYS 41 H CYS 41 5.993 -1.296 -23.038 311 HA CYS 41 HA CYS 41 6.672 1.487 -22.838 312 HB2 CYS 41 HB2 CYS 41 5.236 2.349 -24.539 313 HB3 CYS 41 HB3 CYS 41 6.259 1.138 -25.303 314 H LEU 42 H LEU 42 4.225 2.653 -22.814 315 HA LEU 42 HA LEU 42 2.676 1.068 -20.873 316 HB2 LEU 42 HB2 LEU 42 2.952 4.051 -20.714 317 HB3 LEU 42 HB3 LEU 42 2.367 2.933 -19.483 318 HG LEU 42 HG LEU 42 5.233 3.099 -20.410 319 HD11 LEU 42 HD11 LEU 42 3.725 4.742 -18.559 320 HD12 LEU 42 HD12 LEU 42 5.354 4.961 -19.199 321 HD13 LEU 42 HD13 LEU 42 5.094 3.945 -17.783 322 HD21 LEU 42 HD21 LEU 42 5.676 1.371 -19.061 323 HD22 LEU 42 HD22 LEU 42 3.944 1.043 -19.144 324 HD23 LEU 42 HD23 LEU 42 4.604 1.966 -17.793 325 H VAL 43 H VAL 43 0.417 1.860 -20.608 326 HA VAL 43 HA VAL 43 -0.647 2.727 -23.212 327 HB VAL 43 HB VAL 43 -2.784 1.670 -22.474 328 HG11 VAL 43 HG11 VAL 43 -1.897 -0.710 -22.657 329 HG12 VAL 43 HG12 VAL 43 -1.483 0.401 -23.966 330 HG13 VAL 43 HG13 VAL 43 -0.289 0.013 -22.725 331 HG21 VAL 43 HG21 VAL 43 -3.044 0.585 -20.493 332 HG22 VAL 43 HG22 VAL 43 -1.342 0.133 -20.387 333 HG23 VAL 43 HG23 VAL 43 -1.846 1.774 -19.983 334 H LYS 44 H LYS 44 -3.117 3.522 -22.679 335 HA LYS 44 HA LYS 44 -2.717 6.031 -21.318 336 HB2 LYS 44 HB2 LYS 44 -4.837 6.670 -22.194 337 HB3 LYS 44 HB3 LYS 44 -4.021 5.759 -23.458 338 HG2 LYS 44 HG2 LYS 44 -5.494 3.892 -21.965 339 HG3 LYS 44 HG3 LYS 44 -6.555 5.278 -22.229 340 HD2 LYS 44 HD2 LYS 44 -6.064 5.173 -24.636 341 HD3 LYS 44 HD3 LYS 44 -5.042 3.762 -24.356 342 HE2 LYS 44 HE2 LYS 44 -7.140 2.944 -25.093 343 HE3 LYS 44 HE3 LYS 44 -7.063 2.638 -23.360 344 HZ1 LYS 44 HZ1 LYS 44 -9.176 3.508 -23.707 345 HZ2 LYS 44 HZ2 LYS 44 -8.636 4.686 -24.793 346 HZ3 LYS 44 HZ3 LYS 44 -8.297 4.839 -23.144 347 H TRP 45 H TRP 45 -3.296 3.073 -20.157 348 HA TRP 45 HA TRP 45 -4.963 4.099 -17.952 349 HB2 TRP 45 HB2 TRP 45 -4.981 1.357 -19.221 350 HB3 TRP 45 HB3 TRP 45 -5.740 1.707 -17.670 351 HD1 TRP 45 HD1 TRP 45 -6.447 1.701 -21.301 352 HE1 TRP 45 HE1 TRP 45 -8.714 2.821 -21.779 353 HE3 TRP 45 HE3 TRP 45 -7.261 3.864 -16.741 354 HZ2 TRP 45 HZ2 TRP 45 -10.599 4.412 -20.405 355 HZ3 TRP 45 HZ3 TRP 45 -9.320 5.168 -16.405 356 HH2 TRP 45 HH2 TRP 45 -10.952 5.437 -18.201 357 H LYS 46 H LYS 46 -2.024 3.993 -18.303 358 HA LYS 46 HA LYS 46 -1.390 2.289 -15.984 359 HB2 LYS 46 HB2 LYS 46 0.267 2.906 -18.428 360 HB3 LYS 46 HB3 LYS 46 0.966 2.253 -16.953 361 HG2 LYS 46 HG2 LYS 46 -1.349 0.752 -17.885 362 HG3 LYS 46 HG3 LYS 46 -0.020 0.792 -19.047 363 HD2 LYS 46 HD2 LYS 46 1.399 0.257 -16.871 364 HD3 LYS 46 HD3 LYS 46 -0.144 -0.409 -16.329 365 HE2 LYS 46 HE2 LYS 46 1.491 -1.201 -18.726 366 HE3 LYS 46 HE3 LYS 46 1.028 -2.194 -17.345 367 HZ1 LYS 46 HZ1 LYS 46 -0.585 -2.889 -18.708 368 HZ2 LYS 46 HZ2 LYS 46 -0.462 -1.551 -19.735 369 HZ3 LYS 46 HZ3 LYS 46 -1.359 -1.440 -18.304 370 H GLN 47 H GLN 47 0.439 3.068 -14.670 371 HA GLN 47 HA GLN 47 0.107 5.824 -14.025 372 HB2 GLN 47 HB2 GLN 47 1.465 3.503 -12.888 373 HB3 GLN 47 HB3 GLN 47 2.368 4.995 -12.671 374 HG2 GLN 47 HG2 GLN 47 0.661 5.989 -11.429 375 HG3 GLN 47 HG3 GLN 47 -0.536 4.815 -11.972 376 HE21 GLN 47 HE21 GLN 47 -1.030 4.561 -9.715 377 HE22 GLN 47 HE22 GLN 47 -0.059 3.520 -8.735 378 H CYS 48 H CYS 48 1.227 7.548 -14.675 379 HA CYS 48 HA CYS 48 3.413 7.144 -16.560 380 HB2 CYS 48 HB2 CYS 48 3.062 9.371 -17.263 381 HB3 CYS 48 HB3 CYS 48 1.449 8.732 -16.962 382 H ASP 49 H ASP 49 2.924 7.959 -13.284 383 HA ASP 49 HA ASP 49 4.974 9.695 -12.677 384 HB2 ASP 49 HB2 ASP 49 3.260 8.785 -11.081 385 HB3 ASP 49 HB3 ASP 49 4.206 7.302 -10.998 386 H GLY 50 H GLY 50 7.065 9.616 -13.139 387 HA2 GLY 50 HA2 GLY 50 9.237 8.746 -12.985 388 HA3 GLY 50 HA3 GLY 50 8.555 7.161 -12.652 389 H ARG 51 H ARG 51 6.749 7.268 -14.958 390 HA ARG 51 HA ARG 51 8.753 6.788 -17.061 391 HB2 ARG 51 HB2 ARG 51 6.074 5.500 -16.544 392 HB3 ARG 51 HB3 ARG 51 6.963 5.289 -18.047 393 HG2 ARG 51 HG2 ARG 51 7.518 3.411 -16.798 394 HG3 ARG 51 HG3 ARG 51 8.896 4.491 -16.569 395 HD2 ARG 51 HD2 ARG 51 8.176 5.103 -14.402 396 HD3 ARG 51 HD3 ARG 51 6.584 4.387 -14.649 397 HE ARG 51 HE ARG 51 8.321 2.298 -14.909 398 HH11 ARG 51 HH11 ARG 51 7.684 4.682 -12.453 399 HH12 ARG 51 HH12 ARG 51 8.143 3.645 -11.144 400 HH21 ARG 51 HH21 ARG 51 8.928 0.924 -13.193 401 HH22 ARG 51 HH22 ARG 51 8.851 1.507 -11.565 402 H GLU 52 H GLU 52 7.710 9.380 -16.570 403 HA GLU 52 HA GLU 52 5.527 10.075 -18.179 404 HB2 GLU 52 HB2 GLU 52 6.324 12.349 -18.030 405 HB3 GLU 52 HB3 GLU 52 6.558 11.557 -16.478 406 HG2 GLU 52 HG2 GLU 52 8.949 11.072 -17.466 407 HG3 GLU 52 HG3 GLU 52 8.566 12.477 -18.461 408 H ARG 53 H ARG 53 8.696 9.112 -19.021 409 HA ARG 53 HA ARG 53 8.199 9.911 -21.813 410 HB2 ARG 53 HB2 ARG 53 10.898 9.732 -20.462 411 HB3 ARG 53 HB3 ARG 53 10.595 10.210 -22.128 412 HG2 ARG 53 HG2 ARG 53 9.120 12.060 -21.012 413 HG3 ARG 53 HG3 ARG 53 10.134 11.722 -19.607 414 HD2 ARG 53 HD2 ARG 53 11.189 13.487 -20.769 415 HD3 ARG 53 HD3 ARG 53 12.125 12.037 -21.126 416 HE ARG 53 HE ARG 53 11.501 12.207 -23.329 417 HH11 ARG 53 HH11 ARG 53 9.542 14.337 -21.394 418 HH12 ARG 53 HH12 ARG 53 8.831 15.135 -22.758 419 HH21 ARG 53 HH21 ARG 53 10.572 13.250 -25.133 420 HH22 ARG 53 HH22 ARG 53 9.417 14.515 -24.884 421 H ASP 54 H ASP 54 7.610 7.415 -20.311 422 HA ASP 54 HA ASP 54 9.269 5.552 -21.880 423 HB2 ASP 54 HB2 ASP 54 8.811 5.590 -19.124 424 HB3 ASP 54 HB3 ASP 54 7.781 4.296 -19.730 425 H CYS 55 H CYS 55 6.088 6.675 -21.179 426 HA CYS 55 HA CYS 55 4.469 4.570 -21.907 427 HB2 CYS 55 HB2 CYS 55 4.036 7.475 -22.634 428 HB3 CYS 55 HB3 CYS 55 2.794 6.232 -22.532 429 H CYS 56 H CYS 56 3.153 4.433 -23.979 430 HA CYS 56 HA CYS 56 4.900 3.853 -26.127 431 HB2 CYS 56 HB2 CYS 56 1.994 3.699 -25.617 432 HB3 CYS 56 HB3 CYS 56 2.456 3.857 -27.309 433 H ALA 57 H ALA 57 4.057 4.665 -28.439 434 HA ALA 57 HA ALA 57 4.784 7.426 -28.549 435 HB1 ALA 57 HB1 ALA 57 4.845 7.184 -30.870 436 HB2 ALA 57 HB2 ALA 57 5.292 5.588 -30.264 437 HB3 ALA 57 HB3 ALA 57 3.657 5.880 -30.858 438 H GLY 58 H GLY 58 3.505 9.152 -28.458 439 HA2 GLY 58 HA2 GLY 58 1.582 10.385 -29.181 440 HA3 GLY 58 HA3 GLY 58 0.688 8.874 -29.262 441 H LEU 59 H LEU 59 2.007 8.204 -26.564 442 HA LEU 59 HA LEU 59 -0.149 9.273 -24.971 443 HB2 LEU 59 HB2 LEU 59 2.056 7.304 -24.490 444 HB3 LEU 59 HB3 LEU 59 1.091 7.923 -23.151 445 HG LEU 59 HG LEU 59 0.057 6.364 -25.519 446 HD11 LEU 59 HD11 LEU 59 1.424 5.243 -23.603 447 HD12 LEU 59 HD12 LEU 59 -0.084 4.515 -24.157 448 HD13 LEU 59 HD13 LEU 59 -0.059 5.469 -22.674 449 HD21 LEU 59 HD21 LEU 59 -2.027 6.312 -24.029 450 HD22 LEU 59 HD22 LEU 59 -1.693 7.793 -24.926 451 HD23 LEU 59 HD23 LEU 59 -1.311 7.698 -23.206 452 H GLU 60 H GLU 60 0.510 9.933 -22.626 453 HA GLU 60 HA GLU 60 2.970 11.358 -22.329 454 HB2 GLU 60 HB2 GLU 60 2.144 13.601 -22.297 455 HB3 GLU 60 HB3 GLU 60 1.651 12.880 -23.823 456 HG2 GLU 60 HG2 GLU 60 -0.534 12.328 -22.459 457 HG3 GLU 60 HG3 GLU 60 0.011 13.696 -21.489 458 H CYS 61 H CYS 61 3.091 12.496 -20.236 459 HA CYS 61 HA CYS 61 1.911 10.925 -18.176 460 HB2 CYS 61 HB2 CYS 61 4.195 12.193 -18.225 461 HB3 CYS 61 HB3 CYS 61 3.244 13.564 -17.661 462 H TRP 62 H TRP 62 -0.282 11.117 -18.086 463 HA TRP 62 HA TRP 62 -1.561 13.706 -18.112 464 HB2 TRP 62 HB2 TRP 62 -2.491 11.462 -19.030 465 HB3 TRP 62 HB3 TRP 62 -2.928 11.139 -17.354 466 HD1 TRP 62 HD1 TRP 62 -3.292 14.749 -17.989 467 HE1 TRP 62 HE1 TRP 62 -5.759 15.358 -18.395 468 HE3 TRP 62 HE3 TRP 62 -5.188 10.048 -18.654 469 HZ2 TRP 62 HZ2 TRP 62 -8.188 14.022 -18.928 470 HZ3 TRP 62 HZ3 TRP 62 -7.595 9.801 -19.106 471 HH2 TRP 62 HH2 TRP 62 -9.062 11.748 -19.240 472 H LYS 63 H LYS 63 -2.171 14.889 -16.405 473 HA LYS 63 HA LYS 63 -1.592 13.819 -13.735 474 HB2 LYS 63 HB2 LYS 63 -0.769 16.142 -14.833 475 HB3 LYS 63 HB3 LYS 63 -2.263 16.685 -14.080 476 HG2 LYS 63 HG2 LYS 63 -0.508 17.061 -12.532 477 HG3 LYS 63 HG3 LYS 63 -1.444 15.689 -11.936 478 HD2 LYS 63 HD2 LYS 63 0.911 15.215 -11.697 479 HD3 LYS 63 HD3 LYS 63 0.229 14.164 -12.941 480 HE2 LYS 63 HE2 LYS 63 1.359 15.205 -14.631 481 HE3 LYS 63 HE3 LYS 63 1.390 16.761 -13.800 482 HZ1 LYS 63 HZ1 LYS 63 2.895 14.952 -12.296 483 HZ2 LYS 63 HZ2 LYS 63 3.440 16.313 -13.141 484 HZ3 LYS 63 HZ3 LYS 63 3.396 14.805 -13.905 485 H ARG 64 H ARG 64 -3.400 12.747 -13.099 486 HA ARG 64 HA ARG 64 -5.914 14.285 -13.072 487 HB2 ARG 64 HB2 ARG 64 -5.331 11.529 -13.870 488 HB3 ARG 64 HB3 ARG 64 -6.663 11.657 -12.729 489 HG2 ARG 64 HG2 ARG 64 -7.965 12.898 -14.187 490 HG3 ARG 64 HG3 ARG 64 -6.575 13.407 -15.149 491 HD2 ARG 64 HD2 ARG 64 -7.210 11.799 -16.572 492 HD3 ARG 64 HD3 ARG 64 -6.486 10.689 -15.408 493 HE ARG 64 HE ARG 64 -9.237 11.320 -14.857 494 HH11 ARG 64 HH11 ARG 64 -7.068 9.239 -16.614 495 HH12 ARG 64 HH12 ARG 64 -8.215 7.948 -16.759 496 HH21 ARG 64 HH21 ARG 64 -10.756 9.628 -15.041 497 HH22 ARG 64 HH22 ARG 64 -10.312 8.171 -15.865 498 H SER 65 H SER 65 -6.809 14.684 -11.149 499 HA SER 65 HA SER 65 -5.915 13.106 -8.830 500 HB2 SER 65 HB2 SER 65 -6.201 16.114 -8.999 501 HB3 SER 65 HB3 SER 65 -5.993 15.228 -7.489 502 HG SER 65 HG SER 65 -4.184 15.433 -9.658 503 H GLY 66 H GLY 66 -7.466 12.540 -7.382 504 HA2 GLY 66 HA2 GLY 66 -9.578 13.013 -6.270 505 HA3 GLY 66 HA3 GLY 66 -10.166 13.662 -7.794 506 H ASN 67 H ASN 67 -8.774 11.308 -9.154 507 HA ASN 67 HA ASN 67 -10.903 9.349 -8.602 508 HB2 ASN 67 HB2 ASN 67 -9.502 10.109 -11.158 509 HB3 ASN 67 HB3 ASN 67 -10.372 8.585 -11.002 510 HD21 ASN 67 HD21 ASN 67 -10.671 11.490 -12.260 511 HD22 ASN 67 HD22 ASN 67 -12.367 11.765 -12.079 512 H LYS 68 H LYS 68 -7.527 9.615 -9.691 513 HA LYS 68 HA LYS 68 -6.688 7.491 -7.978 514 HB2 LYS 68 HB2 LYS 68 -7.316 6.918 -10.810 515 HB3 LYS 68 HB3 LYS 68 -5.771 6.302 -10.235 516 HG2 LYS 68 HG2 LYS 68 -7.221 5.405 -8.245 517 HG3 LYS 68 HG3 LYS 68 -8.534 5.562 -9.414 518 HD2 LYS 68 HD2 LYS 68 -7.553 4.023 -10.888 519 HD3 LYS 68 HD3 LYS 68 -5.979 4.137 -10.097 520 HE2 LYS 68 HE2 LYS 68 -8.370 3.116 -8.609 521 HE3 LYS 68 HE3 LYS 68 -7.458 2.052 -9.680 522 HZ1 LYS 68 HZ1 LYS 68 -6.332 1.703 -7.762 523 HZ2 LYS 68 HZ2 LYS 68 -6.676 3.233 -7.127 524 HZ3 LYS 68 HZ3 LYS 68 -5.466 3.057 -8.295 525 H SER 69 H SER 69 -4.321 6.800 -8.761 526 HA SER 69 HA SER 69 -2.714 9.064 -8.488 527 HB2 SER 69 HB2 SER 69 -2.189 6.220 -9.270 528 HB3 SER 69 HB3 SER 69 -0.893 7.408 -9.412 529 HG SER 69 HG SER 69 -0.719 6.622 -7.380 530 H SER 70 H SER 70 -0.790 9.376 -10.153 531 HA SER 70 HA SER 70 -1.958 10.567 -12.453 532 HB2 SER 70 HB2 SER 70 0.103 11.527 -12.815 533 HB3 SER 70 HB3 SER 70 0.263 11.124 -11.106 534 HG SER 70 HG SER 70 1.185 9.065 -11.946 535 H VAL 71 H VAL 71 -2.409 9.688 -14.355 536 HA VAL 71 HA VAL 71 -1.054 7.175 -15.098 537 HB VAL 71 HB VAL 71 -3.121 6.674 -16.444 538 HG11 VAL 71 HG11 VAL 71 -3.781 6.912 -13.527 539 HG12 VAL 71 HG12 VAL 71 -4.208 5.628 -14.660 540 HG13 VAL 71 HG13 VAL 71 -2.542 5.798 -14.106 541 HG21 VAL 71 HG21 VAL 71 -3.796 9.297 -15.676 542 HG22 VAL 71 HG22 VAL 71 -4.763 8.163 -16.618 543 HG23 VAL 71 HG23 VAL 71 -4.935 8.224 -14.864 544 H CYS 72 H CYS 72 -1.470 6.806 -17.606 545 HA CYS 72 HA CYS 72 -0.434 9.217 -18.924 546 HB2 CYS 72 HB2 CYS 72 0.175 6.381 -19.108 547 HB3 CYS 72 HB3 CYS 72 -0.154 7.080 -20.690 548 H ALA 73 H ALA 73 -1.185 9.791 -21.026 549 HA ALA 73 HA ALA 73 -3.661 8.565 -21.952 550 HB1 ALA 73 HB1 ALA 73 -3.893 11.469 -21.942 551 HB2 ALA 73 HB2 ALA 73 -5.054 10.235 -21.448 552 HB3 ALA 73 HB3 ALA 73 -3.807 10.773 -20.323 553 HA PRO 74 HA PRO 74 -2.076 9.460 -25.946 554 HB2 PRO 74 HB2 PRO 74 -4.356 9.872 -27.362 555 HB3 PRO 74 HB3 PRO 74 -3.852 8.275 -26.795 556 HG2 PRO 74 HG2 PRO 74 -5.848 10.164 -25.609 557 HG3 PRO 74 HG3 PRO 74 -5.959 8.406 -25.819 558 HD2 PRO 74 HD2 PRO 74 -5.325 9.554 -23.449 559 HD3 PRO 74 HD3 PRO 74 -4.681 7.976 -23.949 560 H ILE 75 H ILE 75 -2.169 11.083 -27.757 561 HA ILE 75 HA ILE 75 -1.656 13.652 -26.836 562 HB ILE 75 HB ILE 75 -1.955 14.354 -29.253 563 HG12 ILE 75 HG12 ILE 75 -2.206 11.409 -29.814 564 HG13 ILE 75 HG13 ILE 75 -3.634 12.422 -29.630 565 HG21 ILE 75 HG21 ILE 75 -0.184 11.946 -28.956 566 HG22 ILE 75 HG22 ILE 75 0.092 13.404 -29.908 567 HG23 ILE 75 HG23 ILE 75 0.161 13.475 -28.147 568 HD11 ILE 75 HD11 ILE 75 -2.280 13.886 -31.412 569 HD12 ILE 75 HD12 ILE 75 -1.679 12.280 -31.825 570 HD13 ILE 75 HD13 ILE 75 -3.411 12.610 -31.858 571 H THR 76 H THR 76 -2.790 15.627 -27.050 572 HA THR 76 HA THR 76 -5.702 15.383 -27.389 573 HB THR 76 HB THR 76 -5.993 17.040 -25.537 574 HG1 THR 76 HG1 THR 76 -4.294 17.745 -24.453 575 HG21 THR 76 HG21 THR 76 -5.679 14.293 -25.405 576 HG22 THR 76 HG22 THR 76 -6.384 15.321 -24.157 577 HG23 THR 76 HG23 THR 76 -4.676 14.892 -24.085 Start of MODEL 8 1 H1 SER 1 H SER 1 0.972 -2.340 -3.870 2 HA SER 1 HA SER 1 1.670 0.114 -2.605 3 HB2 SER 1 HB2 SER 1 -0.024 -1.470 -1.699 4 HB3 SER 1 HB3 SER 1 1.273 -2.608 -1.340 5 HG SER 1 HG SER 1 0.429 -0.881 0.294 6 H ASN 2 H ASN 2 3.110 -3.137 -2.285 7 HA ASN 2 HA ASN 2 5.500 -2.080 -1.100 8 HB2 ASN 2 HB2 ASN 2 4.569 -4.811 -1.925 9 HB3 ASN 2 HB3 ASN 2 6.264 -4.546 -1.523 10 HD21 ASN 2 HD21 ASN 2 6.589 -3.335 0.588 11 HD22 ASN 2 HD22 ASN 2 5.604 -3.839 1.914 12 H GLU 3 H GLU 3 7.581 -2.043 -1.977 13 HA GLU 3 HA GLU 3 7.801 -1.210 -4.638 14 HB2 GLU 3 HB2 GLU 3 9.902 -2.205 -2.711 15 HB3 GLU 3 HB3 GLU 3 10.274 -1.500 -4.278 16 HG2 GLU 3 HG2 GLU 3 9.382 0.605 -3.634 17 HG3 GLU 3 HG3 GLU 3 8.702 -0.068 -2.155 18 H CYS 4 H CYS 4 9.525 -2.286 -6.139 19 HA CYS 4 HA CYS 4 8.868 -5.152 -6.350 20 HB2 CYS 4 HB2 CYS 4 8.878 -4.946 -8.754 21 HB3 CYS 4 HB3 CYS 4 7.790 -3.729 -8.093 22 H ILE 5 H ILE 5 10.498 -6.265 -7.913 23 HA ILE 5 HA ILE 5 13.084 -5.998 -6.712 24 HB ILE 5 HB ILE 5 12.205 -7.720 -9.033 25 HG12 ILE 5 HG12 ILE 5 12.707 -8.636 -6.212 26 HG13 ILE 5 HG13 ILE 5 11.132 -8.017 -6.697 27 HG21 ILE 5 HG21 ILE 5 14.515 -7.639 -9.229 28 HG22 ILE 5 HG22 ILE 5 14.759 -7.537 -7.486 29 HG23 ILE 5 HG23 ILE 5 14.261 -9.062 -8.219 30 HD11 ILE 5 HD11 ILE 5 11.073 -9.751 -8.475 31 HD12 ILE 5 HD12 ILE 5 12.561 -10.419 -7.800 32 HD13 ILE 5 HD13 ILE 5 11.087 -10.393 -6.831 33 H ARG 6 H ARG 6 14.553 -4.556 -7.300 34 HA ARG 6 HA ARG 6 14.427 -2.867 -9.487 35 HB2 ARG 6 HB2 ARG 6 16.782 -3.785 -7.841 36 HB3 ARG 6 HB3 ARG 6 16.921 -2.553 -9.089 37 HG2 ARG 6 HG2 ARG 6 16.605 -1.215 -7.286 38 HG3 ARG 6 HG3 ARG 6 14.919 -1.476 -7.737 39 HD2 ARG 6 HD2 ARG 6 14.574 -3.016 -6.020 40 HD3 ARG 6 HD3 ARG 6 16.301 -3.301 -5.805 41 HE ARG 6 HE ARG 6 16.394 -1.490 -4.402 42 HH11 ARG 6 HH11 ARG 6 13.390 -1.431 -6.163 43 HH12 ARG 6 HH12 ARG 6 12.720 -0.132 -5.232 44 HH21 ARG 6 HH21 ARG 6 15.522 0.220 -3.170 45 HH22 ARG 6 HH22 ARG 6 13.935 0.807 -3.531 46 H LYS 7 H LYS 7 15.504 -2.789 -11.481 47 HA LYS 7 HA LYS 7 15.623 -5.228 -12.893 48 HB2 LYS 7 HB2 LYS 7 15.086 -3.254 -14.111 49 HB3 LYS 7 HB3 LYS 7 16.547 -2.439 -13.568 50 HG2 LYS 7 HG2 LYS 7 17.905 -3.980 -14.886 51 HG3 LYS 7 HG3 LYS 7 16.442 -4.808 -15.425 52 HD2 LYS 7 HD2 LYS 7 17.237 -3.237 -17.117 53 HD3 LYS 7 HD3 LYS 7 15.664 -2.746 -16.487 54 HE2 LYS 7 HE2 LYS 7 17.195 -0.844 -16.726 55 HE3 LYS 7 HE3 LYS 7 16.724 -1.106 -15.047 56 HZ1 LYS 7 HZ1 LYS 7 19.069 -0.669 -15.178 57 HZ2 LYS 7 HZ2 LYS 7 19.291 -1.913 -16.303 58 HZ3 LYS 7 HZ3 LYS 7 18.840 -2.280 -14.715 59 H TRP 8 H TRP 8 17.369 -6.374 -13.738 60 HA TRP 8 HA TRP 8 19.395 -7.407 -13.614 61 HB2 TRP 8 HB2 TRP 8 20.089 -4.490 -13.620 62 HB3 TRP 8 HB3 TRP 8 21.365 -5.689 -13.435 63 HD1 TRP 8 HD1 TRP 8 20.039 -3.700 -16.044 64 HE1 TRP 8 HE1 TRP 8 20.245 -4.809 -18.357 65 HE3 TRP 8 HE3 TRP 8 20.923 -8.513 -14.562 66 HZ2 TRP 8 HZ2 TRP 8 20.719 -7.382 -19.414 67 HZ3 TRP 8 HZ3 TRP 8 21.242 -10.238 -16.287 68 HH2 TRP 8 HH2 TRP 8 21.140 -9.683 -18.663 69 H LEU 9 H LEU 9 18.162 -7.714 -11.291 70 HA LEU 9 HA LEU 9 20.277 -7.263 -9.290 71 HB2 LEU 9 HB2 LEU 9 18.377 -5.836 -8.798 72 HB3 LEU 9 HB3 LEU 9 17.291 -7.222 -8.871 73 HG LEU 9 HG LEU 9 19.442 -7.498 -6.902 74 HD11 LEU 9 HD11 LEU 9 18.385 -5.957 -5.290 75 HD12 LEU 9 HD12 LEU 9 17.376 -5.326 -6.591 76 HD13 LEU 9 HD13 LEU 9 19.126 -5.120 -6.655 77 HD21 LEU 9 HD21 LEU 9 16.828 -8.458 -7.398 78 HD22 LEU 9 HD22 LEU 9 16.803 -7.632 -5.841 79 HD23 LEU 9 HD23 LEU 9 17.949 -8.942 -6.126 80 H SER 10 H SER 10 17.239 -9.111 -9.287 81 HA SER 10 HA SER 10 18.481 -11.647 -9.555 82 HB2 SER 10 HB2 SER 10 18.903 -10.633 -7.066 83 HB3 SER 10 HB3 SER 10 17.380 -11.487 -6.818 84 HG SER 10 HG SER 10 19.068 -12.910 -6.455 85 H CYS 11 H CYS 11 16.940 -12.638 -10.666 86 HA CYS 11 HA CYS 11 14.135 -12.065 -10.125 87 HB2 CYS 11 HB2 CYS 11 14.961 -12.090 -12.460 88 HB3 CYS 11 HB3 CYS 11 15.382 -13.789 -12.277 89 H VAL 12 H VAL 12 16.479 -14.394 -9.334 90 HA VAL 12 HA VAL 12 15.117 -16.785 -9.214 91 HB VAL 12 HB VAL 12 16.565 -17.373 -7.283 92 HG11 VAL 12 HG11 VAL 12 18.241 -17.773 -8.706 93 HG12 VAL 12 HG12 VAL 12 17.273 -16.906 -9.900 94 HG13 VAL 12 HG13 VAL 12 18.523 -16.056 -8.991 95 HG21 VAL 12 HG21 VAL 12 18.327 -15.615 -6.709 96 HG22 VAL 12 HG22 VAL 12 17.221 -14.443 -7.425 97 HG23 VAL 12 HG23 VAL 12 16.716 -15.394 -6.028 98 H ASP 13 H ASP 13 14.739 -13.962 -7.219 99 HA ASP 13 HA ASP 13 13.347 -15.213 -5.077 100 HB2 ASP 13 HB2 ASP 13 13.399 -12.335 -6.008 101 HB3 ASP 13 HB3 ASP 13 12.633 -12.880 -4.518 102 H ARG 14 H ARG 14 11.966 -12.795 -7.288 103 HA ARG 14 HA ARG 14 9.672 -14.554 -7.754 104 HB2 ARG 14 HB2 ARG 14 9.338 -11.669 -6.930 105 HB3 ARG 14 HB3 ARG 14 8.071 -12.861 -7.185 106 HG2 ARG 14 HG2 ARG 14 8.695 -14.064 -5.232 107 HG3 ARG 14 HG3 ARG 14 10.165 -13.107 -5.044 108 HD2 ARG 14 HD2 ARG 14 9.015 -11.754 -3.707 109 HD3 ARG 14 HD3 ARG 14 8.097 -11.243 -5.123 110 HE ARG 14 HE ARG 14 6.306 -12.444 -4.351 111 HH11 ARG 14 HH11 ARG 14 9.172 -13.435 -2.641 112 HH12 ARG 14 HH12 ARG 14 8.310 -14.414 -1.501 113 HH21 ARG 14 HH21 ARG 14 5.161 -13.730 -2.855 114 HH22 ARG 14 HH22 ARG 14 6.029 -14.582 -1.623 115 H LYS 15 H LYS 15 9.402 -14.698 -9.871 116 HA LYS 15 HA LYS 15 10.493 -12.694 -11.649 117 HB2 LYS 15 HB2 LYS 15 9.835 -14.228 -13.440 118 HB3 LYS 15 HB3 LYS 15 10.744 -15.068 -12.190 119 HG2 LYS 15 HG2 LYS 15 8.312 -15.558 -11.268 120 HG3 LYS 15 HG3 LYS 15 7.897 -15.329 -12.968 121 HD2 LYS 15 HD2 LYS 15 9.042 -17.189 -13.640 122 HD3 LYS 15 HD3 LYS 15 10.216 -17.074 -12.327 123 HE2 LYS 15 HE2 LYS 15 9.013 -18.902 -11.651 124 HE3 LYS 15 HE3 LYS 15 8.123 -17.615 -10.838 125 HZ1 LYS 15 HZ1 LYS 15 6.460 -17.663 -12.514 126 HZ2 LYS 15 HZ2 LYS 15 6.712 -19.262 -12.025 127 HZ3 LYS 15 HZ3 LYS 15 7.363 -18.713 -13.487 128 H ASN 16 H ASN 16 7.316 -13.887 -10.685 129 HA ASN 16 HA ASN 16 5.821 -12.388 -12.562 130 HB2 ASN 16 HB2 ASN 16 4.924 -14.348 -11.341 131 HB3 ASN 16 HB3 ASN 16 4.953 -13.411 -9.850 132 HD21 ASN 16 HD21 ASN 16 2.951 -12.935 -9.319 133 HD22 ASN 16 HD22 ASN 16 1.732 -12.333 -10.386 134 H ASP 17 H ASP 17 7.560 -11.458 -9.822 135 HA ASP 17 HA ASP 17 6.123 -8.886 -9.732 136 HB2 ASP 17 HB2 ASP 17 7.475 -10.372 -7.472 137 HB3 ASP 17 HB3 ASP 17 6.907 -8.709 -7.355 138 H CYS 18 H CYS 18 8.310 -9.601 -11.469 139 HA CYS 18 HA CYS 18 10.816 -8.779 -10.585 140 HB2 CYS 18 HB2 CYS 18 9.469 -9.009 -13.215 141 HB3 CYS 18 HB3 CYS 18 10.891 -7.973 -13.160 142 H CYS 19 H CYS 19 8.757 -6.779 -12.694 143 HA CYS 19 HA CYS 19 8.600 -4.526 -11.078 144 HB2 CYS 19 HB2 CYS 19 11.222 -4.889 -11.957 145 HB3 CYS 19 HB3 CYS 19 10.568 -3.654 -13.028 146 H GLU 20 H GLU 20 8.721 -2.435 -12.815 147 HA GLU 20 HA GLU 20 6.552 -3.088 -14.639 148 HB2 GLU 20 HB2 GLU 20 6.284 -1.125 -13.237 149 HB3 GLU 20 HB3 GLU 20 7.785 -0.444 -13.849 150 HG2 GLU 20 HG2 GLU 20 6.828 -0.179 -16.040 151 HG3 GLU 20 HG3 GLU 20 5.351 -0.993 -15.529 152 H GLY 21 H GLY 21 7.041 -3.765 -16.618 153 HA2 GLY 21 HA2 GLY 21 7.856 -3.579 -18.787 154 HA3 GLY 21 HA3 GLY 21 8.822 -2.203 -18.275 155 H LEU 22 H LEU 22 8.864 -5.358 -16.729 156 HA LEU 22 HA LEU 22 11.553 -5.817 -17.835 157 HB2 LEU 22 HB2 LEU 22 10.630 -6.091 -14.986 158 HB3 LEU 22 HB3 LEU 22 12.109 -6.835 -15.589 159 HG LEU 22 HG LEU 22 11.505 -3.889 -15.372 160 HD11 LEU 22 HD11 LEU 22 13.938 -4.902 -14.169 161 HD12 LEU 22 HD12 LEU 22 12.498 -5.678 -13.512 162 HD13 LEU 22 HD13 LEU 22 12.651 -3.922 -13.466 163 HD21 LEU 22 HD21 LEU 22 13.863 -3.624 -16.176 164 HD22 LEU 22 HD22 LEU 22 12.718 -4.172 -17.401 165 HD23 LEU 22 HD23 LEU 22 13.825 -5.323 -16.650 166 H GLU 23 H GLU 23 12.271 -8.131 -17.496 167 HA GLU 23 HA GLU 23 10.114 -10.071 -17.331 168 HB2 GLU 23 HB2 GLU 23 11.423 -9.281 -19.853 169 HB3 GLU 23 HB3 GLU 23 11.334 -11.014 -19.574 170 HG2 GLU 23 HG2 GLU 23 9.000 -9.114 -19.544 171 HG3 GLU 23 HG3 GLU 23 9.436 -10.193 -20.870 172 H CYS 24 H CYS 24 10.777 -11.987 -16.526 173 HA CYS 24 HA CYS 24 13.290 -12.222 -15.318 174 HB2 CYS 24 HB2 CYS 24 11.087 -13.467 -14.797 175 HB3 CYS 24 HB3 CYS 24 11.598 -14.602 -16.042 176 H TYR 25 H TYR 25 15.205 -13.012 -15.963 177 HA TYR 25 HA TYR 25 15.346 -14.205 -18.655 178 HB2 TYR 25 HB2 TYR 25 16.374 -11.878 -18.280 179 HB3 TYR 25 HB3 TYR 25 17.609 -12.712 -17.343 180 HD1 TYR 25 HD1 TYR 25 15.899 -13.453 -20.588 181 HD2 TYR 25 HD2 TYR 25 19.577 -12.850 -18.533 182 HE1 TYR 25 HE1 TYR 25 17.130 -13.943 -22.660 183 HE2 TYR 25 HE2 TYR 25 20.817 -13.337 -20.600 184 HH TYR 25 HH TYR 25 19.755 -13.162 -23.470 185 H LYS 26 H LYS 26 17.288 -15.606 -18.986 186 HA LYS 26 HA LYS 26 17.946 -17.096 -16.529 187 HB2 LYS 26 HB2 LYS 26 17.845 -19.164 -17.748 188 HB3 LYS 26 HB3 LYS 26 16.336 -18.298 -18.011 189 HG2 LYS 26 HG2 LYS 26 17.504 -17.425 -20.155 190 HG3 LYS 26 HG3 LYS 26 18.584 -18.799 -19.911 191 HD2 LYS 26 HD2 LYS 26 15.576 -18.979 -20.088 192 HD3 LYS 26 HD3 LYS 26 16.686 -19.303 -21.422 193 HE2 LYS 26 HE2 LYS 26 17.734 -21.085 -20.070 194 HE3 LYS 26 HE3 LYS 26 16.548 -20.788 -18.799 195 HZ1 LYS 26 HZ1 LYS 26 15.285 -21.189 -21.314 196 HZ2 LYS 26 HZ2 LYS 26 15.062 -22.023 -19.859 197 HZ3 LYS 26 HZ3 LYS 26 16.282 -22.502 -20.929 198 H ARG 27 H ARG 27 20.025 -17.947 -16.360 199 HA ARG 27 HA ARG 27 21.932 -17.218 -18.469 200 HB2 ARG 27 HB2 ARG 27 21.959 -16.372 -15.607 201 HB3 ARG 27 HB3 ARG 27 23.496 -16.713 -16.393 202 HG2 ARG 27 HG2 ARG 27 21.503 -14.850 -17.628 203 HG3 ARG 27 HG3 ARG 27 22.635 -14.302 -16.390 204 HD2 ARG 27 HD2 ARG 27 23.671 -15.830 -18.731 205 HD3 ARG 27 HD3 ARG 27 23.234 -14.135 -18.942 206 HE ARG 27 HE ARG 27 25.520 -15.167 -17.564 207 HH11 ARG 27 HH11 ARG 27 23.278 -12.509 -17.737 208 HH12 ARG 27 HH12 ARG 27 24.378 -11.365 -17.043 209 HH21 ARG 27 HH21 ARG 27 26.978 -13.670 -16.648 210 HH22 ARG 27 HH22 ARG 27 26.483 -12.027 -16.424 211 H ARG 28 H ARG 28 24.042 -18.330 -18.214 212 HA ARG 28 HA ARG 28 23.600 -21.109 -17.617 213 HB2 ARG 28 HB2 ARG 28 26.060 -19.635 -18.572 214 HB3 ARG 28 HB3 ARG 28 25.944 -21.383 -18.416 215 HG2 ARG 28 HG2 ARG 28 23.974 -19.893 -20.095 216 HG3 ARG 28 HG3 ARG 28 25.578 -20.274 -20.724 217 HD2 ARG 28 HD2 ARG 28 24.354 -22.103 -21.415 218 HD3 ARG 28 HD3 ARG 28 25.033 -22.679 -19.894 219 HE ARG 28 HE ARG 28 22.574 -21.538 -19.306 220 HH11 ARG 28 HH11 ARG 28 23.812 -24.206 -21.170 221 HH12 ARG 28 HH12 ARG 28 22.387 -25.172 -20.973 222 HH21 ARG 28 HH21 ARG 28 20.694 -22.801 -19.039 223 HH22 ARG 28 HH22 ARG 28 20.615 -24.373 -19.761 224 H HIS 29 H HIS 29 26.392 -19.101 -16.708 225 HA HIS 29 HA HIS 29 26.813 -20.649 -14.326 226 HB2 HIS 29 HB2 HIS 29 28.581 -19.491 -15.834 227 HB3 HIS 29 HB3 HIS 29 28.188 -18.042 -14.912 228 HD1 HIS 29 HD1 HIS 29 29.830 -17.688 -13.115 229 HD2 HIS 29 HD2 HIS 29 29.120 -21.729 -13.762 230 HE1 HIS 29 HE1 HIS 29 31.273 -18.899 -11.450 231 H SER 30 H SER 30 25.787 -17.328 -15.036 232 HA SER 30 HA SER 30 25.488 -16.563 -12.317 233 HB2 SER 30 HB2 SER 30 24.109 -15.351 -14.722 234 HB3 SER 30 HB3 SER 30 24.417 -14.575 -13.168 235 HG SER 30 HG SER 30 26.232 -13.963 -14.009 236 H PHE 31 H PHE 31 23.029 -15.439 -12.057 237 HA PHE 31 HA PHE 31 21.242 -17.780 -12.083 238 HB2 PHE 31 HB2 PHE 31 20.105 -16.593 -10.139 239 HB3 PHE 31 HB3 PHE 31 21.707 -17.250 -9.819 240 HD1 PHE 31 HD1 PHE 31 23.648 -15.746 -9.644 241 HD2 PHE 31 HD2 PHE 31 19.681 -14.257 -10.051 242 HE1 PHE 31 HE1 PHE 31 24.403 -13.534 -8.874 243 HE2 PHE 31 HE2 PHE 31 20.430 -12.043 -9.283 244 HZ PHE 31 HZ PHE 31 22.794 -11.678 -8.694 245 H GLU 32 H GLU 32 18.852 -17.071 -11.910 246 HA GLU 32 HA GLU 32 18.219 -15.629 -14.263 247 HB2 GLU 32 HB2 GLU 32 16.264 -16.213 -12.049 248 HB3 GLU 32 HB3 GLU 32 15.956 -16.097 -13.776 249 HG2 GLU 32 HG2 GLU 32 16.034 -18.313 -13.791 250 HG3 GLU 32 HG3 GLU 32 17.780 -18.142 -13.616 251 H VAL 33 H VAL 33 17.549 -13.568 -14.587 252 HA VAL 33 HA VAL 33 16.943 -11.843 -12.328 253 HB VAL 33 HB VAL 33 19.192 -11.149 -14.222 254 HG11 VAL 33 HG11 VAL 33 18.261 -9.116 -13.645 255 HG12 VAL 33 HG12 VAL 33 17.784 -9.670 -12.039 256 HG13 VAL 33 HG13 VAL 33 19.479 -9.328 -12.389 257 HG21 VAL 33 HG21 VAL 33 20.033 -12.801 -12.752 258 HG22 VAL 33 HG22 VAL 33 20.572 -11.252 -12.104 259 HG23 VAL 33 HG23 VAL 33 19.209 -12.092 -11.364 260 H CYS 34 H CYS 34 15.843 -9.943 -12.899 261 HA CYS 34 HA CYS 34 14.255 -10.136 -15.242 262 HB2 CYS 34 HB2 CYS 34 14.567 -7.687 -13.504 263 HB3 CYS 34 HB3 CYS 34 13.183 -8.135 -14.494 264 H VAL 35 H VAL 35 14.160 -8.744 -17.042 265 HA VAL 35 HA VAL 35 16.491 -7.020 -17.494 266 HB VAL 35 HB VAL 35 16.642 -7.896 -19.841 267 HG11 VAL 35 HG11 VAL 35 17.484 -9.245 -17.384 268 HG12 VAL 35 HG12 VAL 35 17.514 -10.272 -18.818 269 HG13 VAL 35 HG13 VAL 35 18.425 -8.762 -18.795 270 HG21 VAL 35 HG21 VAL 35 15.544 -9.802 -20.543 271 HG22 VAL 35 HG22 VAL 35 15.236 -10.358 -18.898 272 HG23 VAL 35 HG23 VAL 35 14.306 -9.016 -19.563 273 HA PRO 36 HA PRO 36 13.601 -4.192 -19.206 274 HB2 PRO 36 HB2 PRO 36 15.144 -2.920 -21.043 275 HB3 PRO 36 HB3 PRO 36 15.326 -2.677 -19.301 276 HG2 PRO 36 HG2 PRO 36 16.920 -4.411 -21.148 277 HG3 PRO 36 HG3 PRO 36 17.484 -3.349 -19.844 278 HD2 PRO 36 HD2 PRO 36 17.249 -6.030 -19.542 279 HD3 PRO 36 HD3 PRO 36 16.989 -4.892 -18.205 280 H ILE 37 H ILE 37 11.961 -4.724 -20.495 281 HA ILE 37 HA ILE 37 12.255 -6.454 -22.744 282 HB ILE 37 HB ILE 37 9.881 -4.801 -21.873 283 HG12 ILE 37 HG12 ILE 37 10.037 -7.763 -21.569 284 HG13 ILE 37 HG13 ILE 37 10.956 -6.773 -20.441 285 HG21 ILE 37 HG21 ILE 37 10.033 -7.087 -23.836 286 HG22 ILE 37 HG22 ILE 37 8.560 -6.282 -23.298 287 HG23 ILE 37 HG23 ILE 37 9.757 -5.392 -24.238 288 HD11 ILE 37 HD11 ILE 37 8.333 -5.702 -20.651 289 HD12 ILE 37 HD12 ILE 37 8.221 -7.438 -20.362 290 HD13 ILE 37 HD13 ILE 37 9.134 -6.417 -19.252 291 HA PRO 38 HA PRO 38 13.247 -3.384 -25.775 292 HB2 PRO 38 HB2 PRO 38 12.870 -4.942 -27.966 293 HB3 PRO 38 HB3 PRO 38 14.286 -5.083 -26.919 294 HG2 PRO 38 HG2 PRO 38 11.797 -6.745 -26.973 295 HG3 PRO 38 HG3 PRO 38 13.485 -7.264 -26.814 296 HD2 PRO 38 HD2 PRO 38 11.817 -7.068 -24.692 297 HD3 PRO 38 HD3 PRO 38 13.561 -6.761 -24.567 298 H GLY 39 H GLY 39 12.081 -1.846 -26.774 299 HA2 GLY 39 HA2 GLY 39 10.327 -0.783 -27.818 300 HA3 GLY 39 HA3 GLY 39 9.687 -2.369 -28.224 301 H PHE 40 H PHE 40 10.243 -2.109 -24.922 302 HA PHE 40 HA PHE 40 7.550 -2.386 -24.223 303 HB2 PHE 40 HB2 PHE 40 9.110 -3.167 -22.646 304 HB3 PHE 40 HB3 PHE 40 10.009 -1.653 -22.654 305 HD1 PHE 40 HD1 PHE 40 6.717 -3.095 -21.708 306 HD2 PHE 40 HD2 PHE 40 9.625 -0.064 -21.016 307 HE1 PHE 40 HE1 PHE 40 5.456 -2.340 -19.735 308 HE2 PHE 40 HE2 PHE 40 8.368 0.695 -19.041 309 HZ PHE 40 HZ PHE 40 6.281 -0.442 -18.399 310 H CYS 41 H CYS 41 6.039 -0.978 -23.345 311 HA CYS 41 HA CYS 41 6.638 1.832 -23.062 312 HB2 CYS 41 HB2 CYS 41 5.066 2.627 -24.719 313 HB3 CYS 41 HB3 CYS 41 6.235 1.572 -25.506 314 H LEU 42 H LEU 42 4.144 2.899 -23.006 315 HA LEU 42 HA LEU 42 2.667 1.235 -21.077 316 HB2 LEU 42 HB2 LEU 42 2.919 4.220 -20.855 317 HB3 LEU 42 HB3 LEU 42 2.295 3.087 -19.658 318 HG LEU 42 HG LEU 42 5.183 3.271 -20.515 319 HD11 LEU 42 HD11 LEU 42 4.821 3.987 -17.812 320 HD12 LEU 42 HD12 LEU 42 3.667 4.927 -18.758 321 HD13 LEU 42 HD13 LEU 42 5.386 4.997 -19.143 322 HD21 LEU 42 HD21 LEU 42 4.241 1.063 -19.642 323 HD22 LEU 42 HD22 LEU 42 4.065 1.890 -18.094 324 HD23 LEU 42 HD23 LEU 42 5.661 1.719 -18.827 325 H VAL 43 H VAL 43 0.392 1.952 -20.775 326 HA VAL 43 HA VAL 43 -0.723 2.841 -23.349 327 HB VAL 43 HB VAL 43 -2.829 1.742 -22.593 328 HG11 VAL 43 HG11 VAL 43 -1.770 -0.650 -22.676 329 HG12 VAL 43 HG12 VAL 43 -1.679 0.415 -24.080 330 HG13 VAL 43 HG13 VAL 43 -0.286 0.239 -23.012 331 HG21 VAL 43 HG21 VAL 43 -1.483 0.106 -20.579 332 HG22 VAL 43 HG22 VAL 43 -1.690 1.793 -20.107 333 HG23 VAL 43 HG23 VAL 43 -3.094 0.827 -20.565 334 H LYS 44 H LYS 44 -3.171 3.629 -22.820 335 HA LYS 44 HA LYS 44 -2.800 6.123 -21.438 336 HB2 LYS 44 HB2 LYS 44 -5.007 6.687 -22.227 337 HB3 LYS 44 HB3 LYS 44 -4.121 5.918 -23.536 338 HG2 LYS 44 HG2 LYS 44 -5.583 3.964 -22.007 339 HG3 LYS 44 HG3 LYS 44 -6.649 5.247 -22.583 340 HD2 LYS 44 HD2 LYS 44 -6.257 4.763 -24.797 341 HD3 LYS 44 HD3 LYS 44 -4.674 4.055 -24.472 342 HE2 LYS 44 HE2 LYS 44 -7.189 2.756 -23.484 343 HE3 LYS 44 HE3 LYS 44 -6.617 2.494 -25.131 344 HZ1 LYS 44 HZ1 LYS 44 -5.846 0.787 -23.566 345 HZ2 LYS 44 HZ2 LYS 44 -5.016 1.969 -22.686 346 HZ3 LYS 44 HZ3 LYS 44 -4.562 1.625 -24.279 347 H TRP 45 H TRP 45 -3.395 3.119 -20.321 348 HA TRP 45 HA TRP 45 -4.992 4.129 -18.059 349 HB2 TRP 45 HB2 TRP 45 -5.014 1.362 -19.282 350 HB3 TRP 45 HB3 TRP 45 -5.839 1.798 -17.787 351 HD1 TRP 45 HD1 TRP 45 -6.506 1.435 -21.351 352 HE1 TRP 45 HE1 TRP 45 -8.679 2.639 -22.024 353 HE3 TRP 45 HE3 TRP 45 -7.184 4.286 -17.162 354 HZ2 TRP 45 HZ2 TRP 45 -10.447 4.546 -20.925 355 HZ3 TRP 45 HZ3 TRP 45 -9.141 5.774 -17.052 356 HH2 TRP 45 HH2 TRP 45 -10.736 5.901 -18.896 357 H LYS 46 H LYS 46 -1.996 3.707 -18.710 358 HA LYS 46 HA LYS 46 -1.348 2.108 -16.322 359 HB2 LYS 46 HB2 LYS 46 0.079 2.529 -18.920 360 HB3 LYS 46 HB3 LYS 46 1.011 2.154 -17.477 361 HG2 LYS 46 HG2 LYS 46 -1.282 0.391 -17.891 362 HG3 LYS 46 HG3 LYS 46 -0.075 0.323 -19.178 363 HD2 LYS 46 HD2 LYS 46 1.519 0.279 -16.992 364 HD3 LYS 46 HD3 LYS 46 0.092 -0.554 -16.371 365 HE2 LYS 46 HE2 LYS 46 0.296 -1.836 -18.681 366 HE3 LYS 46 HE3 LYS 46 1.984 -1.353 -18.520 367 HZ1 LYS 46 HZ1 LYS 46 1.260 -2.331 -16.053 368 HZ2 LYS 46 HZ2 LYS 46 2.235 -3.100 -17.201 369 HZ3 LYS 46 HZ3 LYS 46 0.573 -3.408 -17.161 370 H GLN 47 H GLN 47 0.116 2.911 -14.817 371 HA GLN 47 HA GLN 47 0.037 5.624 -14.255 372 HB2 GLN 47 HB2 GLN 47 1.461 3.287 -13.223 373 HB3 GLN 47 HB3 GLN 47 2.354 4.788 -13.017 374 HG2 GLN 47 HG2 GLN 47 0.866 5.638 -11.533 375 HG3 GLN 47 HG3 GLN 47 -0.505 4.797 -12.254 376 HE21 GLN 47 HE21 GLN 47 -1.346 3.792 -10.531 377 HE22 GLN 47 HE22 GLN 47 -0.504 2.646 -9.548 378 H CYS 48 H CYS 48 1.414 7.340 -14.571 379 HA CYS 48 HA CYS 48 3.442 6.953 -16.666 380 HB2 CYS 48 HB2 CYS 48 3.059 9.167 -17.379 381 HB3 CYS 48 HB3 CYS 48 1.455 8.526 -17.036 382 H ASP 49 H ASP 49 2.965 7.845 -13.393 383 HA ASP 49 HA ASP 49 5.044 9.568 -12.845 384 HB2 ASP 49 HB2 ASP 49 3.258 8.578 -11.265 385 HB3 ASP 49 HB3 ASP 49 4.403 7.263 -11.020 386 H GLY 50 H GLY 50 7.139 9.440 -13.281 387 HA2 GLY 50 HA2 GLY 50 9.293 8.529 -13.083 388 HA3 GLY 50 HA3 GLY 50 8.574 6.962 -12.740 389 H ARG 51 H ARG 51 6.797 7.065 -15.061 390 HA ARG 51 HA ARG 51 8.812 6.542 -17.144 391 HB2 ARG 51 HB2 ARG 51 6.069 5.318 -16.794 392 HB3 ARG 51 HB3 ARG 51 7.188 4.953 -18.102 393 HG2 ARG 51 HG2 ARG 51 7.621 4.404 -15.173 394 HG3 ARG 51 HG3 ARG 51 7.256 3.217 -16.427 395 HD2 ARG 51 HD2 ARG 51 9.356 3.747 -17.551 396 HD3 ARG 51 HD3 ARG 51 9.714 4.959 -16.323 397 HE ARG 51 HE ARG 51 10.116 2.146 -16.116 398 HH11 ARG 51 HH11 ARG 51 9.327 5.000 -14.284 399 HH12 ARG 51 HH12 ARG 51 9.939 4.370 -12.791 400 HH21 ARG 51 HH21 ARG 51 10.926 1.305 -14.157 401 HH22 ARG 51 HH22 ARG 51 10.850 2.268 -12.720 402 H GLU 52 H GLU 52 7.727 9.140 -16.662 403 HA GLU 52 HA GLU 52 5.580 9.788 -18.350 404 HB2 GLU 52 HB2 GLU 52 6.299 12.081 -18.138 405 HB3 GLU 52 HB3 GLU 52 6.491 11.278 -16.587 406 HG2 GLU 52 HG2 GLU 52 8.919 10.917 -17.260 407 HG3 GLU 52 HG3 GLU 52 8.613 12.082 -18.546 408 H ARG 53 H ARG 53 8.803 8.914 -19.059 409 HA ARG 53 HA ARG 53 8.457 9.822 -21.842 410 HB2 ARG 53 HB2 ARG 53 11.083 9.387 -20.413 411 HB3 ARG 53 HB3 ARG 53 10.857 10.036 -22.032 412 HG2 ARG 53 HG2 ARG 53 9.431 11.836 -20.732 413 HG3 ARG 53 HG3 ARG 53 10.461 11.332 -19.392 414 HD2 ARG 53 HD2 ARG 53 12.434 11.922 -20.581 415 HD3 ARG 53 HD3 ARG 53 11.537 12.146 -22.081 416 HE ARG 53 HE ARG 53 10.651 13.887 -19.991 417 HH11 ARG 53 HH11 ARG 53 13.048 13.439 -22.475 418 HH12 ARG 53 HH12 ARG 53 13.373 15.133 -22.648 419 HH21 ARG 53 HH21 ARG 53 11.069 16.118 -20.210 420 HH22 ARG 53 HH22 ARG 53 12.248 16.655 -21.359 421 H ASP 54 H ASP 54 7.693 7.279 -20.454 422 HA ASP 54 HA ASP 54 9.264 5.421 -22.120 423 HB2 ASP 54 HB2 ASP 54 8.958 5.343 -19.376 424 HB3 ASP 54 HB3 ASP 54 7.748 4.194 -19.941 425 H CYS 55 H CYS 55 6.163 6.675 -21.349 426 HA CYS 55 HA CYS 55 4.420 4.675 -22.088 427 HB2 CYS 55 HB2 CYS 55 4.140 7.610 -22.771 428 HB3 CYS 55 HB3 CYS 55 2.832 6.435 -22.660 429 H CYS 56 H CYS 56 3.082 4.625 -24.141 430 HA CYS 56 HA CYS 56 4.812 4.067 -26.334 431 HB2 CYS 56 HB2 CYS 56 1.936 3.795 -25.735 432 HB3 CYS 56 HB3 CYS 56 2.325 4.015 -27.437 433 H ALA 57 H ALA 57 3.866 4.878 -28.610 434 HA ALA 57 HA ALA 57 4.552 7.632 -28.749 435 HB1 ALA 57 HB1 ALA 57 3.404 7.037 -31.179 436 HB2 ALA 57 HB2 ALA 57 5.107 6.842 -30.760 437 HB3 ALA 57 HB3 ALA 57 4.002 5.474 -30.619 438 H GLY 58 H GLY 58 3.311 9.419 -28.824 439 HA2 GLY 58 HA2 GLY 58 1.370 10.684 -29.205 440 HA3 GLY 58 HA3 GLY 58 0.451 9.192 -29.344 441 H LEU 59 H LEU 59 1.938 8.395 -26.736 442 HA LEU 59 HA LEU 59 -0.172 9.297 -24.991 443 HB2 LEU 59 HB2 LEU 59 1.556 7.089 -25.111 444 HB3 LEU 59 HB3 LEU 59 1.958 7.940 -23.621 445 HG LEU 59 HG LEU 59 -0.284 7.693 -22.803 446 HD11 LEU 59 HD11 LEU 59 -1.640 7.979 -24.697 447 HD12 LEU 59 HD12 LEU 59 -1.912 6.313 -24.187 448 HD13 LEU 59 HD13 LEU 59 -0.861 6.654 -25.562 449 HD21 LEU 59 HD21 LEU 59 -0.333 4.992 -23.479 450 HD22 LEU 59 HD22 LEU 59 0.447 5.723 -22.077 451 HD23 LEU 59 HD23 LEU 59 1.368 5.449 -23.556 452 H GLU 60 H GLU 60 0.504 9.963 -22.688 453 HA GLU 60 HA GLU 60 2.926 11.450 -22.394 454 HB2 GLU 60 HB2 GLU 60 2.049 13.670 -22.331 455 HB3 GLU 60 HB3 GLU 60 1.549 12.955 -23.857 456 HG2 GLU 60 HG2 GLU 60 -0.579 12.331 -22.352 457 HG3 GLU 60 HG3 GLU 60 -0.062 13.809 -21.543 458 H CYS 61 H CYS 61 3.199 12.302 -20.275 459 HA CYS 61 HA CYS 61 1.979 10.762 -18.250 460 HB2 CYS 61 HB2 CYS 61 4.287 11.974 -18.293 461 HB3 CYS 61 HB3 CYS 61 3.382 13.354 -17.682 462 H TRP 62 H TRP 62 -0.226 11.014 -18.202 463 HA TRP 62 HA TRP 62 -1.449 13.615 -18.100 464 HB2 TRP 62 HB2 TRP 62 -2.428 11.385 -19.030 465 HB3 TRP 62 HB3 TRP 62 -2.861 11.073 -17.351 466 HD1 TRP 62 HD1 TRP 62 -3.135 14.692 -18.002 467 HE1 TRP 62 HE1 TRP 62 -5.590 15.363 -18.383 468 HE3 TRP 62 HE3 TRP 62 -5.163 10.038 -18.606 469 HZ2 TRP 62 HZ2 TRP 62 -8.061 14.087 -18.874 470 HZ3 TRP 62 HZ3 TRP 62 -7.580 9.850 -19.028 471 HH2 TRP 62 HH2 TRP 62 -8.997 11.834 -19.158 472 H LYS 63 H LYS 63 -2.099 14.746 -16.357 473 HA LYS 63 HA LYS 63 -1.459 13.620 -13.720 474 HB2 LYS 63 HB2 LYS 63 -0.545 15.909 -14.738 475 HB3 LYS 63 HB3 LYS 63 -2.054 16.516 -14.070 476 HG2 LYS 63 HG2 LYS 63 -0.346 14.838 -12.321 477 HG3 LYS 63 HG3 LYS 63 0.191 16.481 -12.675 478 HD2 LYS 63 HD2 LYS 63 -2.599 15.894 -11.727 479 HD3 LYS 63 HD3 LYS 63 -1.262 16.128 -10.597 480 HE2 LYS 63 HE2 LYS 63 -0.850 18.302 -11.974 481 HE3 LYS 63 HE3 LYS 63 -2.524 18.078 -12.481 482 HZ1 LYS 63 HZ1 LYS 63 -3.265 18.770 -10.517 483 HZ2 LYS 63 HZ2 LYS 63 -1.696 19.318 -10.204 484 HZ3 LYS 63 HZ3 LYS 63 -2.184 17.795 -9.652 485 H ARG 64 H ARG 64 -3.289 12.565 -13.105 486 HA ARG 64 HA ARG 64 -5.771 14.154 -13.018 487 HB2 ARG 64 HB2 ARG 64 -5.242 11.415 -13.867 488 HB3 ARG 64 HB3 ARG 64 -6.516 11.508 -12.659 489 HG2 ARG 64 HG2 ARG 64 -7.901 12.759 -14.022 490 HG3 ARG 64 HG3 ARG 64 -6.567 13.324 -15.029 491 HD2 ARG 64 HD2 ARG 64 -7.270 11.756 -16.471 492 HD3 ARG 64 HD3 ARG 64 -6.429 10.632 -15.403 493 HE ARG 64 HE ARG 64 -8.457 9.795 -14.753 494 HH11 ARG 64 HH11 ARG 64 -8.944 12.862 -16.326 495 HH12 ARG 64 HH12 ARG 64 -10.671 12.724 -16.346 496 HH21 ARG 64 HH21 ARG 64 -10.729 9.602 -14.773 497 HH22 ARG 64 HH22 ARG 64 -11.686 10.870 -15.461 498 H SER 65 H SER 65 -6.712 14.494 -11.093 499 HA SER 65 HA SER 65 -5.779 12.931 -8.784 500 HB2 SER 65 HB2 SER 65 -5.429 14.845 -7.460 501 HB3 SER 65 HB3 SER 65 -4.720 15.273 -9.016 502 HG SER 65 HG SER 65 -7.121 16.155 -7.848 503 H GLY 66 H GLY 66 -7.340 12.277 -7.411 504 HA2 GLY 66 HA2 GLY 66 -9.429 12.719 -6.245 505 HA3 GLY 66 HA3 GLY 66 -10.020 13.475 -7.717 506 H ASN 67 H ASN 67 -8.672 11.169 -9.221 507 HA ASN 67 HA ASN 67 -10.861 9.245 -8.800 508 HB2 ASN 67 HB2 ASN 67 -10.649 10.544 -11.023 509 HB3 ASN 67 HB3 ASN 67 -9.280 9.487 -11.348 510 HD21 ASN 67 HD21 ASN 67 -9.626 7.306 -11.712 511 HD22 ASN 67 HD22 ASN 67 -11.193 6.665 -12.059 512 H LYS 68 H LYS 68 -7.455 9.461 -9.806 513 HA LYS 68 HA LYS 68 -6.715 7.229 -8.189 514 HB2 LYS 68 HB2 LYS 68 -7.306 6.815 -11.057 515 HB3 LYS 68 HB3 LYS 68 -5.793 6.124 -10.486 516 HG2 LYS 68 HG2 LYS 68 -7.272 5.149 -8.579 517 HG3 LYS 68 HG3 LYS 68 -8.593 5.452 -9.710 518 HD2 LYS 68 HD2 LYS 68 -8.062 3.352 -10.389 519 HD3 LYS 68 HD3 LYS 68 -6.889 4.233 -11.370 520 HE2 LYS 68 HE2 LYS 68 -5.678 2.487 -10.359 521 HE3 LYS 68 HE3 LYS 68 -5.271 3.934 -9.440 522 HZ1 LYS 68 HZ1 LYS 68 -6.271 1.554 -8.457 523 HZ2 LYS 68 HZ2 LYS 68 -7.539 2.664 -8.323 524 HZ3 LYS 68 HZ3 LYS 68 -6.046 2.997 -7.604 525 H SER 69 H SER 69 -4.357 6.502 -8.967 526 HA SER 69 HA SER 69 -2.689 8.705 -8.560 527 HB2 SER 69 HB2 SER 69 -2.181 5.903 -9.533 528 HB3 SER 69 HB3 SER 69 -0.870 7.078 -9.423 529 HG SER 69 HG SER 69 -1.022 7.080 -7.280 530 H SER 70 H SER 70 -0.719 9.020 -10.173 531 HA SER 70 HA SER 70 -1.792 10.348 -12.439 532 HB2 SER 70 HB2 SER 70 0.341 11.191 -12.776 533 HB3 SER 70 HB3 SER 70 0.398 10.806 -11.055 534 HG SER 70 HG SER 70 2.221 10.035 -12.309 535 H VAL 71 H VAL 71 -2.300 9.537 -14.354 536 HA VAL 71 HA VAL 71 -0.993 7.038 -15.216 537 HB VAL 71 HB VAL 71 -3.083 6.603 -16.540 538 HG11 VAL 71 HG11 VAL 71 -3.804 5.292 -14.873 539 HG12 VAL 71 HG12 VAL 71 -2.468 5.981 -13.949 540 HG13 VAL 71 HG13 VAL 71 -4.090 6.658 -13.796 541 HG21 VAL 71 HG21 VAL 71 -4.083 8.913 -14.888 542 HG22 VAL 71 HG22 VAL 71 -4.056 8.775 -16.645 543 HG23 VAL 71 HG23 VAL 71 -5.144 7.762 -15.698 544 H CYS 72 H CYS 72 -1.446 6.773 -17.727 545 HA CYS 72 HA CYS 72 -0.432 9.237 -18.966 546 HB2 CYS 72 HB2 CYS 72 0.274 6.451 -19.201 547 HB3 CYS 72 HB3 CYS 72 -0.182 7.093 -20.776 548 H ALA 73 H ALA 73 -1.180 9.824 -21.086 549 HA ALA 73 HA ALA 73 -3.675 8.623 -21.995 550 HB1 ALA 73 HB1 ALA 73 -5.052 10.307 -21.484 551 HB2 ALA 73 HB2 ALA 73 -3.801 10.806 -20.344 552 HB3 ALA 73 HB3 ALA 73 -3.872 11.533 -21.950 553 HA PRO 74 HA PRO 74 -2.080 9.510 -25.988 554 HB2 PRO 74 HB2 PRO 74 -4.371 9.837 -27.408 555 HB3 PRO 74 HB3 PRO 74 -3.816 8.261 -26.827 556 HG2 PRO 74 HG2 PRO 74 -5.874 10.095 -25.657 557 HG3 PRO 74 HG3 PRO 74 -5.926 8.334 -25.852 558 HD2 PRO 74 HD2 PRO 74 -5.331 9.521 -23.492 559 HD3 PRO 74 HD3 PRO 74 -4.637 7.961 -23.978 560 H ILE 75 H ILE 75 -2.365 11.104 -27.867 561 HA ILE 75 HA ILE 75 -1.841 13.691 -26.995 562 HB ILE 75 HB ILE 75 -2.307 14.368 -29.393 563 HG12 ILE 75 HG12 ILE 75 -2.534 11.412 -29.914 564 HG13 ILE 75 HG13 ILE 75 -3.966 12.402 -29.652 565 HG21 ILE 75 HG21 ILE 75 -0.288 13.440 -30.178 566 HG22 ILE 75 HG22 ILE 75 -0.106 13.557 -28.428 567 HG23 ILE 75 HG23 ILE 75 -0.467 12.001 -29.174 568 HD11 ILE 75 HD11 ILE 75 -3.072 13.877 -31.527 569 HD12 ILE 75 HD12 ILE 75 -1.980 12.540 -31.886 570 HD13 ILE 75 HD13 ILE 75 -3.725 12.298 -31.965 571 H THR 76 H THR 76 -3.027 15.640 -27.145 572 HA THR 76 HA THR 76 -5.943 15.359 -27.365 573 HB THR 76 HB THR 76 -6.306 16.762 -25.409 574 HG1 THR 76 HG1 THR 76 -4.429 17.204 -24.053 575 HG21 THR 76 HG21 THR 76 -6.374 14.892 -24.202 576 HG22 THR 76 HG22 THR 76 -4.628 14.964 -23.963 577 HG23 THR 76 HG23 THR 76 -5.292 14.118 -25.360 Start of MODEL 9 1 H1 SER 1 H SER 1 -0.191 -2.260 0.561 2 HA SER 1 HA SER 1 1.042 -3.065 -1.719 3 HB2 SER 1 HB2 SER 1 0.301 -0.711 -1.089 4 HB3 SER 1 HB3 SER 1 1.869 -0.528 -0.303 5 HG SER 1 HG SER 1 2.601 -1.353 -2.544 6 H ASN 2 H ASN 2 3.083 -3.525 -2.430 7 HA ASN 2 HA ASN 2 5.263 -3.498 -0.465 8 HB2 ASN 2 HB2 ASN 2 5.934 -5.769 -1.586 9 HB3 ASN 2 HB3 ASN 2 4.733 -5.749 -0.298 10 HD21 ASN 2 HD21 ASN 2 5.371 -6.443 -3.576 11 HD22 ASN 2 HD22 ASN 2 3.790 -6.992 -4.007 12 H GLU 3 H GLU 3 7.415 -3.851 -1.515 13 HA GLU 3 HA GLU 3 7.574 -2.202 -3.888 14 HB2 GLU 3 HB2 GLU 3 9.934 -2.128 -3.489 15 HB3 GLU 3 HB3 GLU 3 9.123 -1.930 -1.943 16 HG2 GLU 3 HG2 GLU 3 9.459 -4.453 -1.662 17 HG3 GLU 3 HG3 GLU 3 10.613 -4.305 -2.987 18 H CYS 4 H CYS 4 9.418 -2.937 -5.483 19 HA CYS 4 HA CYS 4 8.858 -5.731 -6.236 20 HB2 CYS 4 HB2 CYS 4 8.908 -5.111 -8.545 21 HB3 CYS 4 HB3 CYS 4 7.831 -3.982 -7.729 22 H ILE 5 H ILE 5 10.583 -6.531 -7.867 23 HA ILE 5 HA ILE 5 13.090 -6.484 -6.523 24 HB ILE 5 HB ILE 5 12.387 -7.618 -9.233 25 HG12 ILE 5 HG12 ILE 5 12.802 -9.214 -6.728 26 HG13 ILE 5 HG13 ILE 5 11.242 -8.459 -7.037 27 HG21 ILE 5 HG21 ILE 5 14.674 -7.537 -9.338 28 HG22 ILE 5 HG22 ILE 5 14.869 -7.673 -7.591 29 HG23 ILE 5 HG23 ILE 5 14.447 -9.095 -8.544 30 HD11 ILE 5 HD11 ILE 5 12.272 -9.946 -9.316 31 HD12 ILE 5 HD12 ILE 5 12.015 -10.939 -7.880 32 HD13 ILE 5 HD13 ILE 5 10.685 -9.992 -8.549 33 H ARG 6 H ARG 6 15.027 -5.565 -7.109 34 HA ARG 6 HA ARG 6 14.853 -3.189 -8.732 35 HB2 ARG 6 HB2 ARG 6 17.175 -4.421 -7.238 36 HB3 ARG 6 HB3 ARG 6 17.222 -2.861 -8.049 37 HG2 ARG 6 HG2 ARG 6 16.742 -2.117 -5.976 38 HG3 ARG 6 HG3 ARG 6 15.090 -2.465 -6.489 39 HD2 ARG 6 HD2 ARG 6 15.000 -4.450 -5.273 40 HD3 ARG 6 HD3 ARG 6 16.756 -4.565 -5.155 41 HE ARG 6 HE ARG 6 14.990 -3.100 -3.418 42 HH11 ARG 6 HH11 ARG 6 18.244 -3.396 -4.619 43 HH12 ARG 6 HH12 ARG 6 18.961 -2.621 -3.245 44 HH21 ARG 6 HH21 ARG 6 15.922 -2.078 -1.604 45 HH22 ARG 6 HH22 ARG 6 17.639 -1.872 -1.530 46 H LYS 7 H LYS 7 16.182 -2.714 -10.540 47 HA LYS 7 HA LYS 7 16.332 -4.754 -12.460 48 HB2 LYS 7 HB2 LYS 7 16.164 -2.289 -12.916 49 HB3 LYS 7 HB3 LYS 7 17.866 -2.151 -12.488 50 HG2 LYS 7 HG2 LYS 7 18.329 -2.525 -14.621 51 HG3 LYS 7 HG3 LYS 7 17.791 -4.188 -14.372 52 HD2 LYS 7 HD2 LYS 7 16.458 -3.571 -16.136 53 HD3 LYS 7 HD3 LYS 7 15.416 -3.140 -14.779 54 HE2 LYS 7 HE2 LYS 7 15.444 -1.350 -16.411 55 HE3 LYS 7 HE3 LYS 7 16.223 -0.822 -14.920 56 HZ1 LYS 7 HZ1 LYS 7 18.093 -1.974 -16.736 57 HZ2 LYS 7 HZ2 LYS 7 18.113 -0.453 -15.997 58 HZ3 LYS 7 HZ3 LYS 7 17.271 -0.677 -17.447 59 H TRP 8 H TRP 8 17.975 -6.022 -13.204 60 HA TRP 8 HA TRP 8 19.869 -7.280 -13.093 61 HB2 TRP 8 HB2 TRP 8 21.025 -4.581 -12.368 62 HB3 TRP 8 HB3 TRP 8 21.996 -6.001 -12.748 63 HD1 TRP 8 HD1 TRP 8 20.211 -3.141 -14.358 64 HE1 TRP 8 HE1 TRP 8 20.370 -3.336 -16.920 65 HE3 TRP 8 HE3 TRP 8 22.017 -7.911 -14.697 66 HZ2 TRP 8 HZ2 TRP 8 21.157 -5.258 -18.830 67 HZ3 TRP 8 HZ3 TRP 8 22.446 -8.853 -16.928 68 HH2 TRP 8 HH2 TRP 8 22.024 -7.554 -18.952 69 H LEU 9 H LEU 9 18.396 -7.774 -10.953 70 HA LEU 9 HA LEU 9 20.316 -7.798 -8.717 71 HB2 LEU 9 HB2 LEU 9 18.438 -6.375 -8.180 72 HB3 LEU 9 HB3 LEU 9 17.307 -7.651 -8.624 73 HG LEU 9 HG LEU 9 17.994 -8.973 -6.714 74 HD11 LEU 9 HD11 LEU 9 20.001 -6.772 -6.327 75 HD12 LEU 9 HD12 LEU 9 20.282 -8.507 -6.465 76 HD13 LEU 9 HD13 LEU 9 19.517 -7.850 -5.018 77 HD21 LEU 9 HD21 LEU 9 17.579 -6.892 -4.981 78 HD22 LEU 9 HD22 LEU 9 16.317 -7.801 -5.811 79 HD23 LEU 9 HD23 LEU 9 16.896 -6.278 -6.486 80 H SER 10 H SER 10 17.259 -9.475 -9.452 81 HA SER 10 HA SER 10 18.306 -11.968 -10.074 82 HB2 SER 10 HB2 SER 10 17.746 -13.101 -7.806 83 HB3 SER 10 HB3 SER 10 19.289 -12.264 -7.967 84 HG SER 10 HG SER 10 17.909 -11.819 -6.034 85 H CYS 11 H CYS 11 16.658 -12.725 -11.209 86 HA CYS 11 HA CYS 11 13.921 -12.194 -10.294 87 HB2 CYS 11 HB2 CYS 11 13.206 -12.518 -12.537 88 HB3 CYS 11 HB3 CYS 11 14.665 -11.537 -12.629 89 H VAL 12 H VAL 12 16.219 -14.604 -10.237 90 HA VAL 12 HA VAL 12 14.991 -16.964 -10.878 91 HB VAL 12 HB VAL 12 16.371 -18.068 -9.219 92 HG11 VAL 12 HG11 VAL 12 18.458 -16.266 -9.774 93 HG12 VAL 12 HG12 VAL 12 18.028 -17.731 -10.658 94 HG13 VAL 12 HG13 VAL 12 17.342 -16.176 -11.136 95 HG21 VAL 12 HG21 VAL 12 15.950 -16.602 -7.327 96 HG22 VAL 12 HG22 VAL 12 17.685 -16.782 -7.590 97 HG23 VAL 12 HG23 VAL 12 16.864 -15.308 -8.103 98 H ASP 13 H ASP 13 14.374 -14.902 -8.121 99 HA ASP 13 HA ASP 13 12.692 -16.840 -6.794 100 HB2 ASP 13 HB2 ASP 13 13.510 -14.008 -6.253 101 HB3 ASP 13 HB3 ASP 13 12.121 -14.686 -5.408 102 H ARG 14 H ARG 14 12.044 -13.551 -8.023 103 HA ARG 14 HA ARG 14 9.338 -14.472 -8.746 104 HB2 ARG 14 HB2 ARG 14 10.304 -11.967 -7.453 105 HB3 ARG 14 HB3 ARG 14 8.935 -11.849 -8.550 106 HG2 ARG 14 HG2 ARG 14 7.736 -12.269 -6.706 107 HG3 ARG 14 HG3 ARG 14 8.173 -13.948 -7.027 108 HD2 ARG 14 HD2 ARG 14 10.145 -13.666 -5.554 109 HD3 ARG 14 HD3 ARG 14 9.590 -12.036 -5.175 110 HE ARG 14 HE ARG 14 7.598 -14.022 -4.661 111 HH11 ARG 14 HH11 ARG 14 10.444 -12.480 -3.381 112 HH12 ARG 14 HH12 ARG 14 10.032 -12.799 -1.728 113 HH21 ARG 14 HH21 ARG 14 7.044 -14.448 -2.490 114 HH22 ARG 14 HH22 ARG 14 8.099 -13.919 -1.222 115 H LYS 15 H LYS 15 9.509 -14.888 -10.880 116 HA LYS 15 HA LYS 15 11.017 -13.159 -12.638 117 HB2 LYS 15 HB2 LYS 15 10.305 -14.717 -14.408 118 HB3 LYS 15 HB3 LYS 15 11.028 -15.560 -13.044 119 HG2 LYS 15 HG2 LYS 15 8.769 -16.100 -12.218 120 HG3 LYS 15 HG3 LYS 15 8.088 -15.326 -13.651 121 HD2 LYS 15 HD2 LYS 15 10.036 -17.625 -13.749 122 HD3 LYS 15 HD3 LYS 15 8.283 -17.820 -13.796 123 HE2 LYS 15 HE2 LYS 15 8.191 -16.440 -15.818 124 HE3 LYS 15 HE3 LYS 15 9.944 -16.255 -15.770 125 HZ1 LYS 15 HZ1 LYS 15 8.353 -18.653 -16.397 126 HZ2 LYS 15 HZ2 LYS 15 9.934 -18.814 -15.816 127 HZ3 LYS 15 HZ3 LYS 15 9.643 -17.975 -17.255 128 H ASN 16 H ASN 16 7.645 -13.817 -11.884 129 HA ASN 16 HA ASN 16 6.677 -12.069 -13.976 130 HB2 ASN 16 HB2 ASN 16 4.439 -12.568 -12.997 131 HB3 ASN 16 HB3 ASN 16 5.344 -14.013 -13.440 132 HD21 ASN 16 HD21 ASN 16 3.979 -12.164 -10.877 133 HD22 ASN 16 HD22 ASN 16 4.273 -13.301 -9.610 134 H ASP 17 H ASP 17 7.296 -11.939 -10.541 135 HA ASP 17 HA ASP 17 6.087 -9.281 -10.350 136 HB2 ASP 17 HB2 ASP 17 7.022 -11.305 -8.343 137 HB3 ASP 17 HB3 ASP 17 6.845 -9.617 -7.870 138 H CYS 18 H CYS 18 8.490 -9.685 -11.910 139 HA CYS 18 HA CYS 18 10.827 -8.957 -10.557 140 HB2 CYS 18 HB2 CYS 18 9.930 -9.133 -13.323 141 HB3 CYS 18 HB3 CYS 18 11.060 -7.805 -13.076 142 H CYS 19 H CYS 19 8.988 -6.787 -12.703 143 HA CYS 19 HA CYS 19 8.583 -4.729 -10.861 144 HB2 CYS 19 HB2 CYS 19 11.266 -4.907 -11.473 145 HB3 CYS 19 HB3 CYS 19 10.697 -3.669 -12.587 146 H GLU 20 H GLU 20 8.740 -2.464 -12.357 147 HA GLU 20 HA GLU 20 6.673 -2.926 -14.313 148 HB2 GLU 20 HB2 GLU 20 6.591 -0.993 -12.777 149 HB3 GLU 20 HB3 GLU 20 8.052 -0.355 -13.520 150 HG2 GLU 20 HG2 GLU 20 6.929 -0.007 -15.596 151 HG3 GLU 20 HG3 GLU 20 5.493 -0.852 -15.019 152 H GLY 21 H GLY 21 7.157 -3.555 -16.308 153 HA2 GLY 21 HA2 GLY 21 8.045 -3.400 -18.441 154 HA3 GLY 21 HA3 GLY 21 9.019 -2.042 -17.899 155 H LEU 22 H LEU 22 9.142 -4.984 -16.094 156 HA LEU 22 HA LEU 22 11.761 -5.596 -17.299 157 HB2 LEU 22 HB2 LEU 22 10.927 -5.801 -14.411 158 HB3 LEU 22 HB3 LEU 22 12.454 -6.399 -15.058 159 HG LEU 22 HG LEU 22 11.556 -3.529 -14.843 160 HD11 LEU 22 HD11 LEU 22 14.129 -4.371 -13.744 161 HD12 LEU 22 HD12 LEU 22 12.736 -5.130 -12.975 162 HD13 LEU 22 HD13 LEU 22 12.861 -3.372 -13.035 163 HD21 LEU 22 HD21 LEU 22 14.056 -4.650 -16.106 164 HD22 LEU 22 HD22 LEU 22 13.714 -2.943 -15.829 165 HD23 LEU 22 HD23 LEU 22 12.724 -3.869 -16.958 166 H GLU 23 H GLU 23 12.381 -7.796 -17.379 167 HA GLU 23 HA GLU 23 10.343 -9.785 -16.728 168 HB2 GLU 23 HB2 GLU 23 10.269 -10.738 -18.896 169 HB3 GLU 23 HB3 GLU 23 10.040 -9.010 -19.119 170 HG2 GLU 23 HG2 GLU 23 12.361 -8.765 -19.784 171 HG3 GLU 23 HG3 GLU 23 12.634 -10.484 -19.510 172 H CYS 24 H CYS 24 11.142 -11.850 -16.363 173 HA CYS 24 HA CYS 24 13.875 -11.990 -15.561 174 HB2 CYS 24 HB2 CYS 24 12.110 -13.197 -14.356 175 HB3 CYS 24 HB3 CYS 24 11.797 -14.177 -15.784 176 H TYR 25 H TYR 25 15.601 -12.868 -16.561 177 HA TYR 25 HA TYR 25 15.252 -13.681 -19.344 178 HB2 TYR 25 HB2 TYR 25 16.972 -11.934 -18.489 179 HB3 TYR 25 HB3 TYR 25 17.908 -13.335 -17.981 180 HD1 TYR 25 HD1 TYR 25 16.334 -11.740 -20.944 181 HD2 TYR 25 HD2 TYR 25 19.234 -14.510 -19.522 182 HE1 TYR 25 HE1 TYR 25 17.243 -11.948 -23.220 183 HE2 TYR 25 HE2 TYR 25 20.152 -14.724 -21.794 184 HH TYR 25 HH TYR 25 18.558 -13.350 -24.557 185 H LYS 26 H LYS 26 16.126 -15.598 -20.185 186 HA LYS 26 HA LYS 26 16.346 -17.751 -18.211 187 HB2 LYS 26 HB2 LYS 26 14.699 -17.818 -20.173 188 HB3 LYS 26 HB3 LYS 26 16.106 -18.087 -21.195 189 HG2 LYS 26 HG2 LYS 26 16.531 -20.177 -20.278 190 HG3 LYS 26 HG3 LYS 26 15.585 -19.840 -18.826 191 HD2 LYS 26 HD2 LYS 26 14.181 -19.815 -21.448 192 HD3 LYS 26 HD3 LYS 26 14.658 -21.376 -20.778 193 HE2 LYS 26 HE2 LYS 26 13.285 -21.149 -18.930 194 HE3 LYS 26 HE3 LYS 26 13.233 -19.391 -19.058 195 HZ1 LYS 26 HZ1 LYS 26 11.740 -19.508 -20.849 196 HZ2 LYS 26 HZ2 LYS 26 11.154 -20.619 -19.716 197 HZ3 LYS 26 HZ3 LYS 26 11.995 -21.164 -21.080 198 H ARG 27 H ARG 27 18.207 -18.769 -17.822 199 HA ARG 27 HA ARG 27 20.425 -18.393 -19.724 200 HB2 ARG 27 HB2 ARG 27 20.297 -17.883 -16.814 201 HB3 ARG 27 HB3 ARG 27 21.739 -18.716 -17.380 202 HG2 ARG 27 HG2 ARG 27 22.525 -16.650 -17.712 203 HG3 ARG 27 HG3 ARG 27 21.560 -16.705 -19.188 204 HD2 ARG 27 HD2 ARG 27 19.680 -15.682 -17.955 205 HD3 ARG 27 HD3 ARG 27 20.711 -15.563 -16.529 206 HE ARG 27 HE ARG 27 21.859 -14.301 -18.825 207 HH11 ARG 27 HH11 ARG 27 19.592 -13.894 -16.214 208 HH12 ARG 27 HH12 ARG 27 19.712 -12.166 -16.207 209 HH21 ARG 27 HH21 ARG 27 22.025 -12.027 -18.825 210 HH22 ARG 27 HH22 ARG 27 21.095 -11.105 -17.694 211 H ARG 28 H ARG 28 22.282 -20.019 -19.049 212 HA ARG 28 HA ARG 28 21.061 -22.654 -19.195 213 HB2 ARG 28 HB2 ARG 28 23.927 -21.744 -19.505 214 HB3 ARG 28 HB3 ARG 28 23.391 -23.409 -19.681 215 HG2 ARG 28 HG2 ARG 28 22.076 -21.311 -21.327 216 HG3 ARG 28 HG3 ARG 28 23.699 -21.846 -21.765 217 HD2 ARG 28 HD2 ARG 28 22.770 -24.217 -21.620 218 HD3 ARG 28 HD3 ARG 28 21.175 -23.466 -21.599 219 HE ARG 28 HE ARG 28 22.460 -22.384 -23.771 220 HH11 ARG 28 HH11 ARG 28 21.602 -25.585 -22.702 221 HH12 ARG 28 HH12 ARG 28 21.436 -26.217 -24.306 222 HH21 ARG 28 HH21 ARG 28 22.244 -23.206 -25.888 223 HH22 ARG 28 HH22 ARG 28 21.802 -24.864 -26.117 224 H HIS 29 H HIS 29 24.033 -21.611 -17.543 225 HA HIS 29 HA HIS 29 23.074 -22.982 -15.120 226 HB2 HIS 29 HB2 HIS 29 24.878 -24.203 -16.506 227 HB3 HIS 29 HB3 HIS 29 25.974 -22.954 -15.920 228 HD1 HIS 29 HD1 HIS 29 27.180 -25.103 -14.801 229 HD2 HIS 29 HD2 HIS 29 23.509 -23.989 -13.207 230 HE1 HIS 29 HE1 HIS 29 27.055 -26.223 -12.553 231 H SER 30 H SER 30 23.083 -20.132 -15.932 232 HA SER 30 HA SER 30 24.796 -19.075 -13.779 233 HB2 SER 30 HB2 SER 30 25.162 -18.404 -16.315 234 HB3 SER 30 HB3 SER 30 23.827 -17.300 -15.981 235 HG SER 30 HG SER 30 25.282 -16.071 -15.114 236 H PHE 31 H PHE 31 23.961 -17.236 -12.606 237 HA PHE 31 HA PHE 31 21.318 -17.589 -11.737 238 HB2 PHE 31 HB2 PHE 31 23.498 -16.249 -10.784 239 HB3 PHE 31 HB3 PHE 31 22.468 -14.914 -11.294 240 HD1 PHE 31 HD2 PHE 31 22.406 -18.043 -9.284 241 HD2 PHE 31 HD1 PHE 31 20.798 -14.148 -9.890 242 HE1 PHE 31 HE2 PHE 31 21.110 -18.257 -7.204 243 HE2 PHE 31 HE1 PHE 31 19.499 -14.357 -7.810 244 HZ PHE 31 HZ PHE 31 19.655 -16.413 -6.464 245 H GLU 32 H GLU 32 19.521 -16.110 -11.859 246 HA GLU 32 HA GLU 32 19.448 -14.640 -14.412 247 HB2 GLU 32 HB2 GLU 32 16.996 -15.700 -13.041 248 HB3 GLU 32 HB3 GLU 32 17.216 -15.274 -14.732 249 HG2 GLU 32 HG2 GLU 32 17.440 -17.452 -15.094 250 HG3 GLU 32 HG3 GLU 32 19.040 -17.291 -14.375 251 H VAL 33 H VAL 33 18.845 -12.551 -14.405 252 HA VAL 33 HA VAL 33 17.774 -11.428 -11.901 253 HB VAL 33 HB VAL 33 19.185 -9.558 -11.985 254 HG11 VAL 33 HG11 VAL 33 21.428 -10.464 -11.928 255 HG12 VAL 33 HG12 VAL 33 20.300 -11.622 -11.219 256 HG13 VAL 33 HG13 VAL 33 20.912 -11.872 -12.855 257 HG21 VAL 33 HG21 VAL 33 19.674 -10.380 -14.817 258 HG22 VAL 33 HG22 VAL 33 19.182 -8.813 -14.176 259 HG23 VAL 33 HG23 VAL 33 20.845 -9.363 -13.976 260 H CYS 34 H CYS 34 16.694 -9.319 -12.198 261 HA CYS 34 HA CYS 34 14.812 -9.444 -14.317 262 HB2 CYS 34 HB2 CYS 34 15.409 -7.398 -12.189 263 HB3 CYS 34 HB3 CYS 34 14.180 -7.115 -13.418 264 H VAL 35 H VAL 35 14.870 -8.605 -16.297 265 HA VAL 35 HA VAL 35 16.865 -6.515 -16.879 266 HB VAL 35 HB VAL 35 16.966 -7.550 -19.211 267 HG11 VAL 35 HG11 VAL 35 18.963 -7.940 -18.274 268 HG12 VAL 35 HG12 VAL 35 18.253 -8.410 -16.729 269 HG13 VAL 35 HG13 VAL 35 18.366 -9.583 -18.042 270 HG21 VAL 35 HG21 VAL 35 15.975 -10.002 -17.772 271 HG22 VAL 35 HG22 VAL 35 14.956 -9.008 -18.813 272 HG23 VAL 35 HG23 VAL 35 16.362 -9.834 -19.485 273 HA PRO 36 HA PRO 36 13.640 -4.162 -18.707 274 HB2 PRO 36 HB2 PRO 36 14.964 -2.909 -20.718 275 HB3 PRO 36 HB3 PRO 36 15.189 -2.494 -19.015 276 HG2 PRO 36 HG2 PRO 36 16.884 -4.213 -20.786 277 HG3 PRO 36 HG3 PRO 36 17.384 -2.988 -19.605 278 HD2 PRO 36 HD2 PRO 36 17.446 -5.641 -19.067 279 HD3 PRO 36 HD3 PRO 36 17.121 -4.421 -17.819 280 H ILE 37 H ILE 37 12.067 -4.392 -20.210 281 HA ILE 37 HA ILE 37 12.401 -6.491 -22.194 282 HB ILE 37 HB ILE 37 9.943 -4.916 -21.418 283 HG12 ILE 37 HG12 ILE 37 10.287 -7.821 -20.847 284 HG13 ILE 37 HG13 ILE 37 11.160 -6.678 -19.834 285 HG21 ILE 37 HG21 ILE 37 8.686 -6.551 -22.692 286 HG22 ILE 37 HG22 ILE 37 9.865 -5.750 -23.729 287 HG23 ILE 37 HG23 ILE 37 10.177 -7.381 -23.138 288 HD11 ILE 37 HD11 ILE 37 8.452 -5.820 -20.109 289 HD12 ILE 37 HD12 ILE 37 8.494 -7.509 -19.603 290 HD13 ILE 37 HD13 ILE 37 9.337 -6.283 -18.656 291 HA PRO 38 HA PRO 38 13.143 -3.634 -25.490 292 HB2 PRO 38 HB2 PRO 38 12.770 -5.372 -27.541 293 HB3 PRO 38 HB3 PRO 38 14.223 -5.371 -26.534 294 HG2 PRO 38 HG2 PRO 38 11.810 -7.137 -26.378 295 HG3 PRO 38 HG3 PRO 38 13.523 -7.570 -26.238 296 HD2 PRO 38 HD2 PRO 38 11.912 -7.280 -24.081 297 HD3 PRO 38 HD3 PRO 38 13.644 -6.891 -24.038 298 H GLY 39 H GLY 39 11.877 -2.229 -26.559 299 HA2 GLY 39 HA2 GLY 39 10.048 -1.328 -27.628 300 HA3 GLY 39 HA3 GLY 39 9.465 -2.967 -27.882 301 H PHE 40 H PHE 40 10.112 -2.431 -24.635 302 HA PHE 40 HA PHE 40 7.446 -2.736 -23.834 303 HB2 PHE 40 HB2 PHE 40 9.044 -3.378 -22.246 304 HB3 PHE 40 HB3 PHE 40 9.946 -1.874 -22.407 305 HD1 PHE 40 HD1 PHE 40 6.649 -3.176 -21.272 306 HD2 PHE 40 HD2 PHE 40 9.668 -0.206 -20.838 307 HE1 PHE 40 HE1 PHE 40 5.465 -2.263 -19.318 308 HE2 PHE 40 HE2 PHE 40 8.488 0.711 -18.882 309 HZ PHE 40 HZ PHE 40 6.385 -0.317 -18.121 310 H CYS 41 H CYS 41 5.927 -1.309 -23.007 311 HA CYS 41 HA CYS 41 6.462 1.524 -22.907 312 HB2 CYS 41 HB2 CYS 41 4.927 2.214 -24.602 313 HB3 CYS 41 HB3 CYS 41 6.003 1.031 -25.338 314 H LEU 42 H LEU 42 3.975 2.560 -22.833 315 HA LEU 42 HA LEU 42 2.561 0.972 -20.795 316 HB2 LEU 42 HB2 LEU 42 2.706 3.969 -20.751 317 HB3 LEU 42 HB3 LEU 42 2.193 2.876 -19.466 318 HG LEU 42 HG LEU 42 5.027 3.160 -20.463 319 HD11 LEU 42 HD11 LEU 42 5.209 4.948 -19.170 320 HD12 LEU 42 HD12 LEU 42 4.724 3.984 -17.776 321 HD13 LEU 42 HD13 LEU 42 3.505 4.828 -18.729 322 HD21 LEU 42 HD21 LEU 42 3.680 1.420 -18.464 323 HD22 LEU 42 HD22 LEU 42 5.296 2.022 -18.093 324 HD23 LEU 42 HD23 LEU 42 5.023 1.067 -19.552 325 H VAL 43 H VAL 43 0.297 2.031 -20.393 326 HA VAL 43 HA VAL 43 -0.898 2.585 -23.032 327 HB VAL 43 HB VAL 43 -2.985 1.560 -22.135 328 HG11 VAL 43 HG11 VAL 43 -0.550 -0.219 -22.183 329 HG12 VAL 43 HG12 VAL 43 -2.221 -0.766 -22.346 330 HG13 VAL 43 HG13 VAL 43 -1.509 0.280 -23.576 331 HG21 VAL 43 HG21 VAL 43 -1.635 0.050 -20.046 332 HG22 VAL 43 HG22 VAL 43 -1.726 1.776 -19.693 333 HG23 VAL 43 HG23 VAL 43 -3.199 0.864 -20.022 334 H LYS 44 H LYS 44 -3.339 3.412 -22.479 335 HA LYS 44 HA LYS 44 -2.907 5.995 -21.262 336 HB2 LYS 44 HB2 LYS 44 -5.126 6.541 -22.085 337 HB3 LYS 44 HB3 LYS 44 -4.190 5.765 -23.356 338 HG2 LYS 44 HG2 LYS 44 -5.710 3.846 -21.809 339 HG3 LYS 44 HG3 LYS 44 -6.738 5.087 -22.531 340 HD2 LYS 44 HD2 LYS 44 -5.346 4.605 -24.679 341 HD3 LYS 44 HD3 LYS 44 -4.948 3.091 -23.862 342 HE2 LYS 44 HE2 LYS 44 -6.830 2.562 -25.133 343 HE3 LYS 44 HE3 LYS 44 -7.480 2.844 -23.518 344 HZ1 LYS 44 HZ1 LYS 44 -7.361 5.112 -25.363 345 HZ2 LYS 44 HZ2 LYS 44 -8.496 4.757 -24.160 346 HZ3 LYS 44 HZ3 LYS 44 -8.546 3.936 -25.639 347 H TRP 45 H TRP 45 -3.493 3.104 -19.952 348 HA TRP 45 HA TRP 45 -5.151 4.243 -17.798 349 HB2 TRP 45 HB2 TRP 45 -5.157 1.404 -18.842 350 HB3 TRP 45 HB3 TRP 45 -6.013 1.940 -17.399 351 HD1 TRP 45 HD1 TRP 45 -6.546 1.416 -20.989 352 HE1 TRP 45 HE1 TRP 45 -8.720 2.550 -21.773 353 HE3 TRP 45 HE3 TRP 45 -7.440 4.365 -16.909 354 HZ2 TRP 45 HZ2 TRP 45 -10.568 4.443 -20.791 355 HZ3 TRP 45 HZ3 TRP 45 -9.433 5.808 -16.912 356 HH2 TRP 45 HH2 TRP 45 -10.962 5.846 -18.814 357 H LYS 46 H LYS 46 -2.155 3.856 -18.323 358 HA LYS 46 HA LYS 46 -1.551 2.394 -15.836 359 HB2 LYS 46 HB2 LYS 46 -0.053 2.628 -18.424 360 HB3 LYS 46 HB3 LYS 46 0.816 2.299 -16.931 361 HG2 LYS 46 HG2 LYS 46 -1.514 0.585 -17.339 362 HG3 LYS 46 HG3 LYS 46 -0.269 0.419 -18.579 363 HD2 LYS 46 HD2 LYS 46 1.241 0.444 -16.323 364 HD3 LYS 46 HD3 LYS 46 -0.228 -0.342 -15.740 365 HE2 LYS 46 HE2 LYS 46 -0.068 -1.921 -17.656 366 HE3 LYS 46 HE3 LYS 46 1.478 -1.185 -18.079 367 HZ1 LYS 46 HZ1 LYS 46 2.264 -1.800 -15.825 368 HZ2 LYS 46 HZ2 LYS 46 1.898 -3.132 -16.801 369 HZ3 LYS 46 HZ3 LYS 46 0.823 -2.653 -15.586 370 H GLN 47 H GLN 47 -0.079 3.290 -14.384 371 HA GLN 47 HA GLN 47 -0.150 6.040 -14.023 372 HB2 GLN 47 HB2 GLN 47 1.207 3.775 -12.792 373 HB3 GLN 47 HB3 GLN 47 2.171 5.244 -12.728 374 HG2 GLN 47 HG2 GLN 47 0.715 6.311 -11.342 375 HG3 GLN 47 HG3 GLN 47 -0.683 5.426 -11.947 376 HE21 GLN 47 HE21 GLN 47 -1.304 5.094 -9.764 377 HE22 GLN 47 HE22 GLN 47 -0.552 3.865 -8.809 378 H CYS 48 H CYS 48 1.166 7.727 -14.541 379 HA CYS 48 HA CYS 48 3.205 7.183 -16.581 380 HB2 CYS 48 HB2 CYS 48 2.862 9.371 -17.396 381 HB3 CYS 48 HB3 CYS 48 1.250 8.782 -17.003 382 H ASP 49 H ASP 49 2.797 8.251 -13.350 383 HA ASP 49 HA ASP 49 4.927 9.946 -12.920 384 HB2 ASP 49 HB2 ASP 49 3.171 9.178 -11.248 385 HB3 ASP 49 HB3 ASP 49 4.163 7.742 -11.005 386 H GLY 50 H GLY 50 7.011 9.742 -13.377 387 HA2 GLY 50 HA2 GLY 50 9.143 8.787 -13.160 388 HA3 GLY 50 HA3 GLY 50 8.392 7.258 -12.727 389 H ARG 51 H ARG 51 6.585 7.282 -15.025 390 HA ARG 51 HA ARG 51 8.556 6.610 -17.107 391 HB2 ARG 51 HB2 ARG 51 5.769 5.484 -16.800 392 HB3 ARG 51 HB3 ARG 51 7.016 4.939 -17.915 393 HG2 ARG 51 HG2 ARG 51 7.057 4.712 -14.913 394 HG3 ARG 51 HG3 ARG 51 6.845 3.402 -16.076 395 HD2 ARG 51 HD2 ARG 51 9.131 4.157 -17.002 396 HD3 ARG 51 HD3 ARG 51 9.301 5.008 -15.467 397 HE ARG 51 HE ARG 51 9.587 2.214 -15.906 398 HH11 ARG 51 HH11 ARG 51 8.492 4.563 -13.582 399 HH12 ARG 51 HH12 ARG 51 8.783 3.540 -12.215 400 HH21 ARG 51 HH21 ARG 51 9.975 0.857 -14.114 401 HH22 ARG 51 HH22 ARG 51 9.628 1.432 -12.519 402 H GLU 52 H GLU 52 7.648 9.248 -16.828 403 HA GLU 52 HA GLU 52 5.447 9.850 -18.498 404 HB2 GLU 52 HB2 GLU 52 6.188 12.134 -18.390 405 HB3 GLU 52 HB3 GLU 52 6.424 11.402 -16.809 406 HG2 GLU 52 HG2 GLU 52 8.829 10.983 -17.566 407 HG3 GLU 52 HG3 GLU 52 8.480 12.125 -18.863 408 H ARG 53 H ARG 53 8.574 8.763 -19.202 409 HA ARG 53 HA ARG 53 8.245 9.555 -22.021 410 HB2 ARG 53 HB2 ARG 53 10.895 9.176 -20.620 411 HB3 ARG 53 HB3 ARG 53 10.629 9.775 -22.253 412 HG2 ARG 53 HG2 ARG 53 9.259 11.634 -21.008 413 HG3 ARG 53 HG3 ARG 53 10.270 11.154 -19.644 414 HD2 ARG 53 HD2 ARG 53 12.206 11.870 -20.651 415 HD3 ARG 53 HD3 ARG 53 11.560 11.667 -22.278 416 HE ARG 53 HE ARG 53 10.078 13.687 -21.167 417 HH11 ARG 53 HH11 ARG 53 13.458 13.111 -21.772 418 HH12 ARG 53 HH12 ARG 53 13.841 14.788 -21.975 419 HH21 ARG 53 HH21 ARG 53 10.570 15.898 -21.433 420 HH22 ARG 53 HH22 ARG 53 12.199 16.372 -21.781 421 H ASP 54 H ASP 54 7.451 7.118 -20.502 422 HA ASP 54 HA ASP 54 9.022 5.142 -22.026 423 HB2 ASP 54 HB2 ASP 54 8.803 5.208 -19.325 424 HB3 ASP 54 HB3 ASP 54 7.426 4.187 -19.727 425 H CYS 55 H CYS 55 5.920 6.468 -21.369 426 HA CYS 55 HA CYS 55 4.174 4.441 -22.031 427 HB2 CYS 55 HB2 CYS 55 3.917 7.342 -22.855 428 HB3 CYS 55 HB3 CYS 55 2.602 6.181 -22.704 429 H CYS 56 H CYS 56 2.900 4.211 -24.075 430 HA CYS 56 HA CYS 56 4.629 3.552 -26.216 431 HB2 CYS 56 HB2 CYS 56 1.725 3.414 -25.678 432 HB3 CYS 56 HB3 CYS 56 2.180 3.495 -27.377 433 H ALA 57 H ALA 57 3.765 4.273 -28.548 434 HA ALA 57 HA ALA 57 4.494 7.021 -28.782 435 HB1 ALA 57 HB1 ALA 57 3.971 4.782 -30.600 436 HB2 ALA 57 HB2 ALA 57 3.554 6.370 -31.248 437 HB3 ALA 57 HB3 ALA 57 5.193 6.052 -30.680 438 H GLY 58 H GLY 58 3.224 8.750 -28.662 439 HA2 GLY 58 HA2 GLY 58 1.299 9.985 -29.388 440 HA3 GLY 58 HA3 GLY 58 0.391 8.480 -29.411 441 H LEU 59 H LEU 59 1.784 7.884 -26.723 442 HA LEU 59 HA LEU 59 -0.334 9.008 -25.110 443 HB2 LEU 59 HB2 LEU 59 1.875 7.044 -24.608 444 HB3 LEU 59 HB3 LEU 59 0.908 7.690 -23.284 445 HG LEU 59 HG LEU 59 -0.122 6.079 -25.619 446 HD11 LEU 59 HD11 LEU 59 0.990 4.575 -24.223 447 HD12 LEU 59 HD12 LEU 59 -0.689 4.492 -23.691 448 HD13 LEU 59 HD13 LEU 59 0.486 5.417 -22.757 449 HD21 LEU 59 HD21 LEU 59 -2.174 6.043 -24.011 450 HD22 LEU 59 HD22 LEU 59 -1.923 7.416 -25.089 451 HD23 LEU 59 HD23 LEU 59 -1.471 7.535 -23.388 452 H GLU 60 H GLU 60 0.342 9.768 -22.826 453 HA GLU 60 HA GLU 60 2.837 11.158 -22.606 454 HB2 GLU 60 HB2 GLU 60 2.014 13.416 -22.605 455 HB3 GLU 60 HB3 GLU 60 1.547 12.659 -24.122 456 HG2 GLU 60 HG2 GLU 60 -0.663 12.137 -22.798 457 HG3 GLU 60 HG3 GLU 60 -0.135 13.509 -21.826 458 H CYS 61 H CYS 61 3.028 12.326 -20.550 459 HA CYS 61 HA CYS 61 1.838 10.850 -18.427 460 HB2 CYS 61 HB2 CYS 61 4.159 11.995 -18.519 461 HB3 CYS 61 HB3 CYS 61 3.290 13.455 -18.055 462 H TRP 62 H TRP 62 -0.349 11.116 -18.314 463 HA TRP 62 HA TRP 62 -1.551 13.736 -18.399 464 HB2 TRP 62 HB2 TRP 62 -2.556 11.457 -19.181 465 HB3 TRP 62 HB3 TRP 62 -2.987 11.263 -17.484 466 HD1 TRP 62 HD1 TRP 62 -3.233 14.833 -18.309 467 HE1 TRP 62 HE1 TRP 62 -5.677 15.505 -18.754 468 HE3 TRP 62 HE3 TRP 62 -5.289 10.173 -18.753 469 HZ2 TRP 62 HZ2 TRP 62 -8.150 14.228 -19.230 470 HZ3 TRP 62 HZ3 TRP 62 -7.701 9.985 -19.203 471 HH2 TRP 62 HH2 TRP 62 -9.100 11.972 -19.436 472 H LYS 63 H LYS 63 -2.109 15.000 -16.729 473 HA LYS 63 HA LYS 63 -1.488 14.025 -14.031 474 HB2 LYS 63 HB2 LYS 63 -0.507 16.204 -15.147 475 HB3 LYS 63 HB3 LYS 63 -2.038 16.902 -14.635 476 HG2 LYS 63 HG2 LYS 63 -0.497 15.369 -12.622 477 HG3 LYS 63 HG3 LYS 63 0.128 16.945 -13.110 478 HD2 LYS 63 HD2 LYS 63 -2.734 16.559 -12.285 479 HD3 LYS 63 HD3 LYS 63 -1.458 16.869 -11.105 480 HE2 LYS 63 HE2 LYS 63 -2.014 18.636 -13.481 481 HE3 LYS 63 HE3 LYS 63 -2.705 18.902 -11.881 482 HZ1 LYS 63 HZ1 LYS 63 -0.881 20.082 -11.478 483 HZ2 LYS 63 HZ2 LYS 63 -0.080 19.501 -12.850 484 HZ3 LYS 63 HZ3 LYS 63 -0.039 18.617 -11.408 485 H ARG 64 H ARG 64 -3.314 13.044 -13.309 486 HA ARG 64 HA ARG 64 -5.786 14.652 -13.322 487 HB2 ARG 64 HB2 ARG 64 -5.280 11.836 -13.930 488 HB3 ARG 64 HB3 ARG 64 -6.575 12.069 -12.765 489 HG2 ARG 64 HG2 ARG 64 -7.905 13.210 -14.269 490 HG3 ARG 64 HG3 ARG 64 -6.538 13.658 -15.291 491 HD2 ARG 64 HD2 ARG 64 -6.648 11.754 -16.472 492 HD3 ARG 64 HD3 ARG 64 -6.937 10.772 -15.036 493 HE ARG 64 HE ARG 64 -8.890 11.722 -16.866 494 HH11 ARG 64 HH11 ARG 64 -8.353 11.048 -13.492 495 HH12 ARG 64 HH12 ARG 64 -10.024 10.742 -13.154 496 HH21 ARG 64 HH21 ARG 64 -11.093 11.322 -16.432 497 HH22 ARG 64 HH22 ARG 64 -11.582 10.899 -14.827 498 H SER 65 H SER 65 -6.652 15.193 -11.417 499 HA SER 65 HA SER 65 -5.757 13.766 -9.005 500 HB2 SER 65 HB2 SER 65 -5.962 16.771 -9.327 501 HB3 SER 65 HB3 SER 65 -5.639 15.935 -7.808 502 HG SER 65 HG SER 65 -4.002 15.343 -9.986 503 H GLY 66 H GLY 66 -7.324 13.293 -7.566 504 HA2 GLY 66 HA2 GLY 66 -9.379 13.938 -6.422 505 HA3 GLY 66 HA3 GLY 66 -9.961 14.561 -7.959 506 H ASN 67 H ASN 67 -8.750 12.099 -9.275 507 HA ASN 67 HA ASN 67 -10.961 10.276 -8.594 508 HB2 ASN 67 HB2 ASN 67 -9.701 11.049 -11.188 509 HB3 ASN 67 HB3 ASN 67 -10.335 9.415 -11.026 510 HD21 ASN 67 HD21 ASN 67 -11.058 12.527 -11.875 511 HD22 ASN 67 HD22 ASN 67 -12.782 12.445 -11.789 512 H LYS 68 H LYS 68 -7.605 10.321 -9.780 513 HA LYS 68 HA LYS 68 -6.856 8.188 -8.025 514 HB2 LYS 68 HB2 LYS 68 -7.494 7.626 -10.864 515 HB3 LYS 68 HB3 LYS 68 -6.011 6.911 -10.244 516 HG2 LYS 68 HG2 LYS 68 -7.546 6.131 -8.284 517 HG3 LYS 68 HG3 LYS 68 -8.838 6.396 -9.457 518 HD2 LYS 68 HD2 LYS 68 -6.406 4.737 -10.078 519 HD3 LYS 68 HD3 LYS 68 -7.859 4.053 -9.343 520 HE2 LYS 68 HE2 LYS 68 -9.094 5.170 -11.323 521 HE3 LYS 68 HE3 LYS 68 -7.498 5.249 -12.067 522 HZ1 LYS 68 HZ1 LYS 68 -7.502 3.067 -12.475 523 HZ2 LYS 68 HZ2 LYS 68 -9.173 3.145 -12.222 524 HZ3 LYS 68 HZ3 LYS 68 -8.148 2.669 -10.963 525 H SER 69 H SER 69 -4.530 7.379 -8.800 526 HA SER 69 HA SER 69 -2.822 9.582 -8.584 527 HB2 SER 69 HB2 SER 69 -2.368 6.709 -9.360 528 HB3 SER 69 HB3 SER 69 -1.040 7.870 -9.342 529 HG SER 69 HG SER 69 -1.172 8.019 -7.203 530 H SER 70 H SER 70 -0.880 9.747 -10.250 531 HA SER 70 HA SER 70 -1.991 10.893 -12.603 532 HB2 SER 70 HB2 SER 70 0.933 10.300 -12.393 533 HB3 SER 70 HB3 SER 70 0.123 11.738 -13.014 534 HG SER 70 HG SER 70 1.050 11.249 -10.535 535 H VAL 71 H VAL 71 -2.491 9.931 -14.449 536 HA VAL 71 HA VAL 71 -1.187 7.368 -15.101 537 HB VAL 71 HB VAL 71 -3.275 6.841 -16.401 538 HG11 VAL 71 HG11 VAL 71 -4.116 7.180 -13.576 539 HG12 VAL 71 HG12 VAL 71 -4.186 5.757 -14.618 540 HG13 VAL 71 HG13 VAL 71 -2.655 6.245 -13.889 541 HG21 VAL 71 HG21 VAL 71 -4.882 8.356 -16.636 542 HG22 VAL 71 HG22 VAL 71 -5.059 8.481 -14.886 543 HG23 VAL 71 HG23 VAL 71 -3.902 9.510 -15.730 544 H CYS 72 H CYS 72 -1.629 6.901 -17.585 545 HA CYS 72 HA CYS 72 -0.577 9.240 -19.013 546 HB2 CYS 72 HB2 CYS 72 -0.020 6.381 -19.096 547 HB3 CYS 72 HB3 CYS 72 -0.321 7.047 -20.698 548 H ALA 73 H ALA 73 -1.332 9.718 -21.143 549 HA ALA 73 HA ALA 73 -3.840 8.491 -21.982 550 HB1 ALA 73 HB1 ALA 73 -5.193 10.195 -21.509 551 HB2 ALA 73 HB2 ALA 73 -3.895 10.817 -20.488 552 HB3 ALA 73 HB3 ALA 73 -4.053 11.378 -22.151 553 HA PRO 74 HA PRO 74 -2.276 9.140 -26.031 554 HB2 PRO 74 HB2 PRO 74 -4.562 9.514 -27.447 555 HB3 PRO 74 HB3 PRO 74 -4.080 7.942 -26.799 556 HG2 PRO 74 HG2 PRO 74 -6.034 9.926 -25.699 557 HG3 PRO 74 HG3 PRO 74 -6.174 8.161 -25.812 558 HD2 PRO 74 HD2 PRO 74 -5.499 9.424 -23.514 559 HD3 PRO 74 HD3 PRO 74 -4.886 7.811 -23.934 560 H ILE 75 H ILE 75 -2.464 10.662 -27.966 561 HA ILE 75 HA ILE 75 -1.830 13.259 -27.209 562 HB ILE 75 HB ILE 75 -2.249 13.844 -29.640 563 HG12 ILE 75 HG12 ILE 75 -2.599 10.883 -30.033 564 HG13 ILE 75 HG13 ILE 75 -3.990 11.939 -29.820 565 HG21 ILE 75 HG21 ILE 75 -0.525 11.406 -29.350 566 HG22 ILE 75 HG22 ILE 75 -0.255 12.841 -30.339 567 HG23 ILE 75 HG23 ILE 75 -0.101 12.937 -28.585 568 HD11 ILE 75 HD11 ILE 75 -2.077 11.753 -32.083 569 HD12 ILE 75 HD12 ILE 75 -3.837 11.878 -32.094 570 HD13 ILE 75 HD13 ILE 75 -2.854 13.300 -31.745 571 H THR 76 H THR 76 -2.926 15.251 -27.464 572 HA THR 76 HA THR 76 -5.850 15.093 -27.697 573 HB THR 76 HB THR 76 -6.037 16.770 -25.833 574 HG1 THR 76 HG1 THR 76 -3.437 15.910 -25.088 575 HG21 THR 76 HG21 THR 76 -5.429 13.925 -25.623 576 HG22 THR 76 HG22 THR 76 -6.715 14.865 -24.866 577 HG23 THR 76 HG23 THR 76 -5.113 14.811 -24.131 Start of MODEL 10 1 H1 SER 1 H SER 1 0.600 -0.088 -1.918 2 HA SER 1 HA SER 1 1.793 -0.675 -4.546 3 HB2 SER 1 HB2 SER 1 1.837 2.074 -3.312 4 HB3 SER 1 HB3 SER 1 2.173 1.616 -4.981 5 HG SER 1 HG SER 1 -0.300 1.808 -3.651 6 H ASN 2 H ASN 2 3.358 -2.021 -3.660 7 HA ASN 2 HA ASN 2 5.186 -0.835 -1.694 8 HB2 ASN 2 HB2 ASN 2 5.147 -3.701 -2.649 9 HB3 ASN 2 HB3 ASN 2 5.946 -3.055 -1.219 10 HD21 ASN 2 HD21 ASN 2 4.599 -2.257 0.506 11 HD22 ASN 2 HD22 ASN 2 3.035 -2.947 0.753 12 H GLU 3 H GLU 3 7.528 -1.962 -2.099 13 HA GLU 3 HA GLU 3 8.481 -0.692 -4.488 14 HB2 GLU 3 HB2 GLU 3 10.685 -1.239 -3.702 15 HB3 GLU 3 HB3 GLU 3 9.731 -0.689 -2.331 16 HG2 GLU 3 HG2 GLU 3 9.488 -3.525 -2.580 17 HG3 GLU 3 HG3 GLU 3 11.191 -3.073 -2.583 18 H CYS 4 H CYS 4 10.188 -1.935 -5.823 19 HA CYS 4 HA CYS 4 9.195 -4.642 -6.419 20 HB2 CYS 4 HB2 CYS 4 9.312 -4.231 -8.770 21 HB3 CYS 4 HB3 CYS 4 8.391 -2.908 -8.061 22 H ILE 5 H ILE 5 10.812 -5.758 -7.995 23 HA ILE 5 HA ILE 5 13.342 -5.825 -6.641 24 HB ILE 5 HB ILE 5 12.437 -7.312 -9.109 25 HG12 ILE 5 HG12 ILE 5 12.650 -8.350 -6.283 26 HG13 ILE 5 HG13 ILE 5 11.156 -7.693 -6.943 27 HG21 ILE 5 HG21 ILE 5 14.675 -7.627 -9.268 28 HG22 ILE 5 HG22 ILE 5 14.954 -7.299 -7.559 29 HG23 ILE 5 HG23 ILE 5 14.338 -8.872 -8.066 30 HD11 ILE 5 HD11 ILE 5 11.895 -10.306 -7.024 31 HD12 ILE 5 HD12 ILE 5 10.723 -9.549 -8.103 32 HD13 ILE 5 HD13 ILE 5 12.399 -9.740 -8.615 33 H ARG 6 H ARG 6 15.329 -5.194 -7.374 34 HA ARG 6 HA ARG 6 15.419 -3.063 -9.251 35 HB2 ARG 6 HB2 ARG 6 17.603 -4.627 -7.871 36 HB3 ARG 6 HB3 ARG 6 17.909 -3.241 -8.908 37 HG2 ARG 6 HG2 ARG 6 17.873 -2.159 -6.927 38 HG3 ARG 6 HG3 ARG 6 16.138 -2.130 -7.254 39 HD2 ARG 6 HD2 ARG 6 15.681 -3.767 -5.705 40 HD3 ARG 6 HD3 ARG 6 17.297 -4.465 -5.811 41 HE ARG 6 HE ARG 6 17.569 -1.922 -4.728 42 HH11 ARG 6 HH11 ARG 6 16.074 -4.954 -3.898 43 HH12 ARG 6 HH12 ARG 6 16.233 -4.715 -2.190 44 HH21 ARG 6 HH21 ARG 6 17.784 -1.595 -2.481 45 HH22 ARG 6 HH22 ARG 6 17.205 -2.802 -1.385 46 H LYS 7 H LYS 7 16.348 -2.969 -11.291 47 HA LYS 7 HA LYS 7 16.036 -5.269 -12.915 48 HB2 LYS 7 HB2 LYS 7 15.824 -2.800 -13.582 49 HB3 LYS 7 HB3 LYS 7 17.578 -2.805 -13.705 50 HG2 LYS 7 HG2 LYS 7 17.499 -4.499 -15.416 51 HG3 LYS 7 HG3 LYS 7 15.750 -4.647 -15.232 52 HD2 LYS 7 HD2 LYS 7 16.151 -3.298 -17.156 53 HD3 LYS 7 HD3 LYS 7 15.575 -2.227 -15.876 54 HE2 LYS 7 HE2 LYS 7 17.352 -0.976 -16.461 55 HE3 LYS 7 HE3 LYS 7 18.246 -2.118 -15.458 56 HZ1 LYS 7 HZ1 LYS 7 19.448 -2.154 -17.391 57 HZ2 LYS 7 HZ2 LYS 7 18.097 -1.940 -18.387 58 HZ3 LYS 7 HZ3 LYS 7 18.389 -3.445 -17.670 59 H TRP 8 H TRP 8 17.505 -6.658 -13.793 60 HA TRP 8 HA TRP 8 19.408 -7.893 -13.954 61 HB2 TRP 8 HB2 TRP 8 20.540 -5.107 -13.783 62 HB3 TRP 8 HB3 TRP 8 21.583 -6.517 -13.947 63 HD1 TRP 8 HD1 TRP 8 19.452 -4.175 -15.944 64 HE1 TRP 8 HE1 TRP 8 19.466 -4.879 -18.419 65 HE3 TRP 8 HE3 TRP 8 21.663 -8.760 -15.471 66 HZ2 TRP 8 HZ2 TRP 8 20.301 -7.087 -19.967 67 HZ3 TRP 8 HZ3 TRP 8 22.032 -10.106 -17.498 68 HH2 TRP 8 HH2 TRP 8 21.365 -9.285 -19.699 69 H LEU 9 H LEU 9 18.327 -8.181 -11.552 70 HA LEU 9 HA LEU 9 20.634 -8.134 -9.723 71 HB2 LEU 9 HB2 LEU 9 18.926 -6.480 -9.071 72 HB3 LEU 9 HB3 LEU 9 17.737 -7.776 -8.968 73 HG LEU 9 HG LEU 9 20.190 -7.990 -7.298 74 HD11 LEU 9 HD11 LEU 9 19.460 -5.651 -7.028 75 HD12 LEU 9 HD12 LEU 9 19.249 -6.605 -5.561 76 HD13 LEU 9 HD13 LEU 9 17.856 -6.226 -6.573 77 HD21 LEU 9 HD21 LEU 9 17.590 -9.205 -7.501 78 HD22 LEU 9 HD22 LEU 9 17.847 -8.560 -5.880 79 HD23 LEU 9 HD23 LEU 9 18.995 -9.712 -6.564 80 H SER 10 H SER 10 17.372 -9.578 -9.843 81 HA SER 10 HA SER 10 18.159 -12.211 -10.265 82 HB2 SER 10 HB2 SER 10 18.870 -11.366 -7.683 83 HB3 SER 10 HB3 SER 10 17.428 -12.359 -7.471 84 HG SER 10 HG SER 10 18.633 -13.863 -8.966 85 H CYS 11 H CYS 11 16.358 -12.931 -11.169 86 HA CYS 11 HA CYS 11 13.769 -12.067 -10.091 87 HB2 CYS 11 HB2 CYS 11 12.822 -12.570 -12.215 88 HB3 CYS 11 HB3 CYS 11 14.334 -11.728 -12.539 89 H VAL 12 H VAL 12 15.867 -14.663 -9.990 90 HA VAL 12 HA VAL 12 14.366 -16.945 -10.231 91 HB VAL 12 HB VAL 12 15.830 -17.983 -8.552 92 HG11 VAL 12 HG11 VAL 12 16.838 -16.341 -10.785 93 HG12 VAL 12 HG12 VAL 12 18.052 -16.937 -9.651 94 HG13 VAL 12 HG13 VAL 12 16.992 -18.072 -10.487 95 HG21 VAL 12 HG21 VAL 12 16.370 -15.140 -7.876 96 HG22 VAL 12 HG22 VAL 12 16.196 -16.539 -6.818 97 HG23 VAL 12 HG23 VAL 12 17.691 -16.297 -7.722 98 H ASP 13 H ASP 13 14.318 -14.586 -7.642 99 HA ASP 13 HA ASP 13 12.845 -16.121 -5.773 100 HB2 ASP 13 HB2 ASP 13 13.212 -13.143 -6.116 101 HB3 ASP 13 HB3 ASP 13 12.294 -13.847 -4.787 102 H ARG 14 H ARG 14 11.667 -13.255 -7.534 103 HA ARG 14 HA ARG 14 9.182 -14.683 -8.133 104 HB2 ARG 14 HB2 ARG 14 7.914 -12.590 -7.448 105 HB3 ARG 14 HB3 ARG 14 8.562 -13.571 -6.140 106 HG2 ARG 14 HG2 ARG 14 10.515 -12.010 -6.050 107 HG3 ARG 14 HG3 ARG 14 9.659 -10.981 -7.200 108 HD2 ARG 14 HD2 ARG 14 9.104 -10.057 -5.141 109 HD3 ARG 14 HD3 ARG 14 7.718 -11.081 -5.512 110 HE ARG 14 HE ARG 14 9.292 -12.717 -4.061 111 HH11 ARG 14 HH11 ARG 14 8.125 -9.478 -3.539 112 HH12 ARG 14 HH12 ARG 14 8.098 -9.626 -1.813 113 HH21 ARG 14 HH21 ARG 14 9.260 -12.925 -1.790 114 HH22 ARG 14 HH22 ARG 14 8.745 -11.588 -0.819 115 H LYS 15 H LYS 15 10.198 -14.664 -10.260 116 HA LYS 15 HA LYS 15 10.898 -12.377 -11.684 117 HB2 LYS 15 HB2 LYS 15 10.322 -13.776 -13.724 118 HB3 LYS 15 HB3 LYS 15 11.491 -14.472 -12.610 119 HG2 LYS 15 HG2 LYS 15 9.990 -16.059 -11.826 120 HG3 LYS 15 HG3 LYS 15 8.586 -15.152 -12.393 121 HD2 LYS 15 HD2 LYS 15 10.614 -16.255 -14.312 122 HD3 LYS 15 HD3 LYS 15 9.289 -17.249 -13.704 123 HE2 LYS 15 HE2 LYS 15 7.696 -15.531 -14.521 124 HE3 LYS 15 HE3 LYS 15 9.054 -14.653 -15.222 125 HZ1 LYS 15 HZ1 LYS 15 9.433 -16.327 -16.772 126 HZ2 LYS 15 HZ2 LYS 15 7.746 -16.212 -16.727 127 HZ3 LYS 15 HZ3 LYS 15 8.529 -17.476 -15.919 128 H ASN 16 H ASN 16 7.784 -13.614 -10.830 129 HA ASN 16 HA ASN 16 6.303 -12.186 -12.820 130 HB2 ASN 16 HB2 ASN 16 5.523 -13.581 -10.261 131 HB3 ASN 16 HB3 ASN 16 4.349 -12.728 -11.261 132 HD21 ASN 16 HD21 ASN 16 5.784 -15.647 -10.662 133 HD22 ASN 16 HD22 ASN 16 5.398 -16.455 -12.141 134 H ASP 17 H ASP 17 7.652 -11.414 -9.745 135 HA ASP 17 HA ASP 17 6.176 -8.864 -9.719 136 HB2 ASP 17 HB2 ASP 17 7.499 -10.316 -7.417 137 HB3 ASP 17 HB3 ASP 17 6.684 -8.759 -7.304 138 H CYS 18 H CYS 18 8.511 -9.404 -11.327 139 HA CYS 18 HA CYS 18 10.880 -8.439 -10.170 140 HB2 CYS 18 HB2 CYS 18 9.876 -8.944 -12.891 141 HB3 CYS 18 HB3 CYS 18 11.119 -7.701 -12.790 142 H CYS 19 H CYS 19 8.919 -6.673 -12.563 143 HA CYS 19 HA CYS 19 8.486 -4.370 -11.054 144 HB2 CYS 19 HB2 CYS 19 11.162 -4.561 -11.652 145 HB3 CYS 19 HB3 CYS 19 10.560 -3.546 -12.958 146 H GLU 20 H GLU 20 8.567 -2.354 -12.881 147 HA GLU 20 HA GLU 20 6.564 -3.240 -14.792 148 HB2 GLU 20 HB2 GLU 20 6.290 -1.179 -13.362 149 HB3 GLU 20 HB3 GLU 20 7.561 -0.431 -14.318 150 HG2 GLU 20 HG2 GLU 20 6.022 -1.113 -16.326 151 HG3 GLU 20 HG3 GLU 20 4.773 -1.127 -15.082 152 H GLY 21 H GLY 21 7.218 -3.968 -16.704 153 HA2 GLY 21 HA2 GLY 21 8.124 -3.755 -18.845 154 HA3 GLY 21 HA3 GLY 21 9.044 -2.363 -18.292 155 H LEU 22 H LEU 22 9.076 -5.410 -16.585 156 HA LEU 22 HA LEU 22 11.799 -5.908 -17.591 157 HB2 LEU 22 HB2 LEU 22 10.781 -6.148 -14.766 158 HB3 LEU 22 HB3 LEU 22 12.339 -6.767 -15.312 159 HG LEU 22 HG LEU 22 11.474 -3.884 -15.147 160 HD11 LEU 22 HD11 LEU 22 12.524 -5.528 -13.222 161 HD12 LEU 22 HD12 LEU 22 12.626 -3.767 -13.240 162 HD13 LEU 22 HD13 LEU 22 13.956 -4.735 -13.879 163 HD21 LEU 22 HD21 LEU 22 13.867 -5.155 -16.440 164 HD22 LEU 22 HD22 LEU 22 13.896 -3.493 -15.850 165 HD23 LEU 22 HD23 LEU 22 12.753 -3.962 -17.109 166 H GLU 23 H GLU 23 12.526 -8.167 -17.299 167 HA GLU 23 HA GLU 23 10.407 -10.147 -17.031 168 HB2 GLU 23 HB2 GLU 23 11.635 -9.371 -19.582 169 HB3 GLU 23 HB3 GLU 23 11.683 -11.100 -19.266 170 HG2 GLU 23 HG2 GLU 23 9.212 -10.969 -18.805 171 HG3 GLU 23 HG3 GLU 23 9.269 -9.324 -19.437 172 H CYS 24 H CYS 24 11.356 -12.414 -17.238 173 HA CYS 24 HA CYS 24 13.768 -12.496 -15.620 174 HB2 CYS 24 HB2 CYS 24 11.610 -13.882 -15.246 175 HB3 CYS 24 HB3 CYS 24 12.224 -14.906 -16.540 176 H TYR 25 H TYR 25 15.729 -13.119 -16.299 177 HA TYR 25 HA TYR 25 15.982 -13.972 -19.105 178 HB2 TYR 25 HB2 TYR 25 17.077 -11.831 -18.544 179 HB3 TYR 25 HB3 TYR 25 18.044 -12.654 -17.325 180 HD1 TYR 25 HD1 TYR 25 17.228 -13.000 -20.962 181 HD2 TYR 25 HD2 TYR 25 20.192 -13.233 -17.918 182 HE1 TYR 25 HE1 TYR 25 18.927 -13.508 -22.664 183 HE2 TYR 25 HE2 TYR 25 21.900 -13.741 -19.614 184 HH TYR 25 HH TYR 25 22.317 -14.082 -21.763 185 H LYS 26 H LYS 26 17.330 -15.685 -19.652 186 HA LYS 26 HA LYS 26 17.872 -17.544 -17.451 187 HB2 LYS 26 HB2 LYS 26 17.590 -17.956 -20.428 188 HB3 LYS 26 HB3 LYS 26 18.118 -19.223 -19.327 189 HG2 LYS 26 HG2 LYS 26 15.975 -18.916 -18.079 190 HG3 LYS 26 HG3 LYS 26 15.454 -17.829 -19.369 191 HD2 LYS 26 HD2 LYS 26 16.447 -20.564 -20.051 192 HD3 LYS 26 HD3 LYS 26 14.803 -20.360 -19.437 193 HE2 LYS 26 HE2 LYS 26 14.591 -20.261 -21.771 194 HE3 LYS 26 HE3 LYS 26 14.531 -18.580 -21.241 195 HZ1 LYS 26 HZ1 LYS 26 16.113 -19.469 -23.193 196 HZ2 LYS 26 HZ2 LYS 26 17.171 -19.592 -21.881 197 HZ3 LYS 26 HZ3 LYS 26 16.461 -18.103 -22.256 198 H ARG 27 H ARG 27 19.872 -18.551 -17.199 199 HA ARG 27 HA ARG 27 22.089 -17.472 -18.800 200 HB2 ARG 27 HB2 ARG 27 22.174 -17.831 -15.801 201 HB3 ARG 27 HB3 ARG 27 23.444 -17.170 -16.822 202 HG2 ARG 27 HG2 ARG 27 21.558 -15.439 -17.453 203 HG3 ARG 27 HG3 ARG 27 20.923 -15.923 -15.879 204 HD2 ARG 27 HD2 ARG 27 22.913 -15.246 -14.774 205 HD3 ARG 27 HD3 ARG 27 23.770 -15.043 -16.302 206 HE ARG 27 HE ARG 27 21.636 -13.315 -16.417 207 HH11 ARG 27 HH11 ARG 27 24.377 -13.795 -14.325 208 HH12 ARG 27 HH12 ARG 27 24.501 -12.123 -13.886 209 HH21 ARG 27 HH21 ARG 27 21.787 -11.111 -15.847 210 HH22 ARG 27 HH22 ARG 27 23.027 -10.599 -14.752 211 H ARG 28 H ARG 28 24.112 -18.767 -18.535 212 HA ARG 28 HA ARG 28 23.530 -21.531 -18.936 213 HB2 ARG 28 HB2 ARG 28 26.042 -19.891 -18.877 214 HB3 ARG 28 HB3 ARG 28 26.132 -21.646 -18.922 215 HG2 ARG 28 HG2 ARG 28 24.465 -20.182 -20.922 216 HG3 ARG 28 HG3 ARG 28 26.214 -20.298 -21.129 217 HD2 ARG 28 HD2 ARG 28 25.683 -22.861 -20.601 218 HD3 ARG 28 HD3 ARG 28 24.130 -22.397 -21.295 219 HE ARG 28 HE ARG 28 26.091 -21.460 -23.014 220 HH11 ARG 28 HH11 ARG 28 24.966 -24.525 -21.808 221 HH12 ARG 28 HH12 ARG 28 25.421 -25.401 -23.232 222 HH21 ARG 28 HH21 ARG 28 26.694 -22.601 -24.895 223 HH22 ARG 28 HH22 ARG 28 26.404 -24.305 -24.988 224 H HIS 29 H HIS 29 25.976 -20.192 -16.728 225 HA HIS 29 HA HIS 29 25.124 -22.186 -14.730 226 HB2 HIS 29 HB2 HIS 29 27.496 -22.272 -15.931 227 HB3 HIS 29 HB3 HIS 29 27.897 -21.089 -14.689 228 HD1 HIS 29 HD1 HIS 29 27.911 -21.913 -12.228 229 HD2 HIS 29 HD2 HIS 29 27.127 -24.884 -15.024 230 HE1 HIS 29 HE1 HIS 29 28.157 -24.086 -10.987 231 H SER 30 H SER 30 24.270 -19.362 -15.129 232 HA SER 30 HA SER 30 25.143 -18.282 -12.529 233 HB2 SER 30 HB2 SER 30 24.437 -16.886 -15.102 234 HB3 SER 30 HB3 SER 30 24.383 -16.041 -13.556 235 HG SER 30 HG SER 30 26.632 -16.907 -13.328 236 H PHE 31 H PHE 31 23.342 -16.439 -11.959 237 HA PHE 31 HA PHE 31 20.879 -17.985 -11.651 238 HB2 PHE 31 HB2 PHE 31 20.333 -16.208 -9.937 239 HB3 PHE 31 HB3 PHE 31 21.745 -17.195 -9.572 240 HD1 PHE 31 HD2 PHE 31 20.590 -13.881 -10.649 241 HD2 PHE 31 HD1 PHE 31 23.936 -16.248 -9.501 242 HE1 PHE 31 HE2 PHE 31 21.946 -11.842 -10.409 243 HE2 PHE 31 HE1 PHE 31 25.297 -14.212 -9.259 244 HZ PHE 31 HZ PHE 31 24.303 -12.006 -9.712 245 H GLU 32 H GLU 32 18.811 -17.025 -11.993 246 HA GLU 32 HA GLU 32 18.726 -15.380 -14.343 247 HB2 GLU 32 HB2 GLU 32 16.314 -16.057 -12.694 248 HB3 GLU 32 HB3 GLU 32 16.444 -15.861 -14.436 249 HG2 GLU 32 HG2 GLU 32 18.109 -17.975 -13.963 250 HG3 GLU 32 HG3 GLU 32 16.829 -18.227 -12.778 251 H VAL 33 H VAL 33 18.305 -13.254 -14.513 252 HA VAL 33 HA VAL 33 17.486 -11.796 -12.092 253 HB VAL 33 HB VAL 33 19.083 -10.109 -12.376 254 HG11 VAL 33 HG11 VAL 33 21.247 -11.263 -12.415 255 HG12 VAL 33 HG12 VAL 33 20.056 -12.139 -11.451 256 HG13 VAL 33 HG13 VAL 33 20.463 -12.699 -13.073 257 HG21 VAL 33 HG21 VAL 33 20.603 -10.045 -14.379 258 HG22 VAL 33 HG22 VAL 33 19.559 -11.259 -15.119 259 HG23 VAL 33 HG23 VAL 33 18.911 -9.672 -14.708 260 H CYS 34 H CYS 34 16.579 -9.649 -12.542 261 HA CYS 34 HA CYS 34 14.645 -9.767 -14.612 262 HB2 CYS 34 HB2 CYS 34 15.480 -7.519 -12.773 263 HB3 CYS 34 HB3 CYS 34 14.120 -7.415 -13.885 264 H VAL 35 H VAL 35 14.478 -8.646 -16.526 265 HA VAL 35 HA VAL 35 16.748 -6.981 -17.347 266 HB VAL 35 HB VAL 35 16.742 -8.082 -19.586 267 HG11 VAL 35 HG11 VAL 35 18.379 -8.609 -17.765 268 HG12 VAL 35 HG12 VAL 35 17.385 -10.011 -17.364 269 HG13 VAL 35 HG13 VAL 35 18.150 -9.896 -18.949 270 HG21 VAL 35 HG21 VAL 35 15.469 -9.886 -20.108 271 HG22 VAL 35 HG22 VAL 35 15.459 -10.499 -18.454 272 HG23 VAL 35 HG23 VAL 35 14.396 -9.166 -18.906 273 HA PRO 36 HA PRO 36 13.634 -4.340 -18.976 274 HB2 PRO 36 HB2 PRO 36 15.071 -3.049 -20.883 275 HB3 PRO 36 HB3 PRO 36 15.278 -2.745 -19.154 276 HG2 PRO 36 HG2 PRO 36 16.917 -4.453 -20.988 277 HG3 PRO 36 HG3 PRO 36 17.455 -3.326 -19.728 278 HD2 PRO 36 HD2 PRO 36 17.360 -6.005 -19.344 279 HD3 PRO 36 HD3 PRO 36 17.073 -4.843 -18.034 280 H ILE 37 H ILE 37 12.002 -4.780 -20.310 281 HA ILE 37 HA ILE 37 12.313 -6.640 -22.476 282 HB ILE 37 HB ILE 37 9.904 -5.025 -21.633 283 HG12 ILE 37 HG12 ILE 37 10.184 -7.971 -21.218 284 HG13 ILE 37 HG13 ILE 37 11.032 -6.886 -20.122 285 HG21 ILE 37 HG21 ILE 37 9.812 -5.728 -23.986 286 HG22 ILE 37 HG22 ILE 37 10.069 -7.398 -23.485 287 HG23 ILE 37 HG23 ILE 37 8.601 -6.548 -23.000 288 HD11 ILE 37 HD11 ILE 37 8.313 -7.681 -20.088 289 HD12 ILE 37 HD12 ILE 37 9.172 -6.629 -18.963 290 HD13 ILE 37 HD13 ILE 37 8.379 -5.942 -20.380 291 HA PRO 38 HA PRO 38 13.174 -3.650 -25.623 292 HB2 PRO 38 HB2 PRO 38 12.764 -5.274 -27.759 293 HB3 PRO 38 HB3 PRO 38 14.208 -5.369 -26.743 294 HG2 PRO 38 HG2 PRO 38 11.740 -7.062 -26.690 295 HG3 PRO 38 HG3 PRO 38 13.438 -7.555 -26.559 296 HD2 PRO 38 HD2 PRO 38 11.818 -7.320 -24.402 297 HD3 PRO 38 HD3 PRO 38 13.561 -6.989 -24.328 298 H GLY 39 H GLY 39 11.958 -2.151 -26.615 299 HA2 GLY 39 HA2 GLY 39 10.170 -1.147 -27.664 300 HA3 GLY 39 HA3 GLY 39 9.532 -2.752 -27.988 301 H PHE 40 H PHE 40 10.174 -2.403 -24.721 302 HA PHE 40 HA PHE 40 7.501 -2.642 -23.940 303 HB2 PHE 40 HB2 PHE 40 9.056 -3.396 -22.366 304 HB3 PHE 40 HB3 PHE 40 10.026 -1.930 -22.480 305 HD1 PHE 40 HD1 PHE 40 6.704 -3.158 -21.346 306 HD2 PHE 40 HD2 PHE 40 9.789 -0.260 -20.896 307 HE1 PHE 40 HE1 PHE 40 5.562 -2.254 -19.364 308 HE2 PHE 40 HE2 PHE 40 8.652 0.647 -18.911 309 HZ PHE 40 HZ PHE 40 6.535 -0.350 -18.143 310 H CYS 41 H CYS 41 6.024 -1.204 -23.057 311 HA CYS 41 HA CYS 41 6.634 1.598 -22.809 312 HB2 CYS 41 HB2 CYS 41 5.160 2.425 -24.507 313 HB3 CYS 41 HB3 CYS 41 6.253 1.277 -25.274 314 H LEU 42 H LEU 42 4.175 2.707 -22.768 315 HA LEU 42 HA LEU 42 2.668 1.072 -20.835 316 HB2 LEU 42 HB2 LEU 42 2.857 4.068 -20.727 317 HB3 LEU 42 HB3 LEU 42 2.251 2.967 -19.492 318 HG LEU 42 HG LEU 42 5.138 3.221 -20.331 319 HD11 LEU 42 HD11 LEU 42 5.134 5.045 -19.058 320 HD12 LEU 42 HD12 LEU 42 4.894 3.964 -17.685 321 HD13 LEU 42 HD13 LEU 42 3.505 4.724 -18.462 322 HD21 LEU 42 HD21 LEU 42 5.591 1.433 -19.079 323 HD22 LEU 42 HD22 LEU 42 3.862 1.086 -19.136 324 HD23 LEU 42 HD23 LEU 42 4.538 1.980 -17.773 325 H VAL 43 H VAL 43 0.389 2.026 -20.506 326 HA VAL 43 HA VAL 43 -0.714 2.687 -23.160 327 HB VAL 43 HB VAL 43 -2.828 1.635 -22.359 328 HG11 VAL 43 HG11 VAL 43 -0.318 -0.010 -22.532 329 HG12 VAL 43 HG12 VAL 43 -1.925 -0.735 -22.451 330 HG13 VAL 43 HG13 VAL 43 -1.499 0.322 -23.797 331 HG21 VAL 43 HG21 VAL 43 -1.520 0.083 -20.266 332 HG22 VAL 43 HG22 VAL 43 -1.673 1.795 -19.874 333 HG23 VAL 43 HG23 VAL 43 -3.107 0.854 -20.281 334 H LYS 44 H LYS 44 -3.175 3.492 -22.667 335 HA LYS 44 HA LYS 44 -2.793 6.045 -21.373 336 HB2 LYS 44 HB2 LYS 44 -4.990 6.602 -22.248 337 HB3 LYS 44 HB3 LYS 44 -4.013 5.862 -23.509 338 HG2 LYS 44 HG2 LYS 44 -5.560 3.892 -22.064 339 HG3 LYS 44 HG3 LYS 44 -6.581 5.149 -22.767 340 HD2 LYS 44 HD2 LYS 44 -5.148 4.752 -24.899 341 HD3 LYS 44 HD3 LYS 44 -4.742 3.218 -24.128 342 HE2 LYS 44 HE2 LYS 44 -7.143 2.708 -23.938 343 HE3 LYS 44 HE3 LYS 44 -7.517 4.221 -24.762 344 HZ1 LYS 44 HZ1 LYS 44 -7.571 2.715 -26.475 345 HZ2 LYS 44 HZ2 LYS 44 -6.322 1.763 -25.847 346 HZ3 LYS 44 HZ3 LYS 44 -5.969 3.247 -26.578 347 H TRP 45 H TRP 45 -3.414 3.117 -20.156 348 HA TRP 45 HA TRP 45 -5.133 4.199 -18.021 349 HB2 TRP 45 HB2 TRP 45 -5.106 1.382 -19.123 350 HB3 TRP 45 HB3 TRP 45 -6.023 1.901 -17.711 351 HD1 TRP 45 HD1 TRP 45 -6.440 1.377 -21.300 352 HE1 TRP 45 HE1 TRP 45 -8.558 2.550 -22.173 353 HE3 TRP 45 HE3 TRP 45 -7.406 4.398 -17.291 354 HZ2 TRP 45 HZ2 TRP 45 -10.394 4.499 -21.281 355 HZ3 TRP 45 HZ3 TRP 45 -9.362 5.887 -17.381 356 HH2 TRP 45 HH2 TRP 45 -10.824 5.935 -19.336 357 H LYS 46 H LYS 46 -2.124 3.822 -18.470 358 HA LYS 46 HA LYS 46 -1.589 2.275 -16.020 359 HB2 LYS 46 HB2 LYS 46 -0.024 2.625 -18.551 360 HB3 LYS 46 HB3 LYS 46 0.821 2.275 -17.049 361 HG2 LYS 46 HG2 LYS 46 -1.454 0.516 -17.541 362 HG3 LYS 46 HG3 LYS 46 -0.195 0.418 -18.775 363 HD2 LYS 46 HD2 LYS 46 1.383 0.335 -16.659 364 HD3 LYS 46 HD3 LYS 46 -0.082 -0.263 -15.878 365 HE2 LYS 46 HE2 LYS 46 -0.026 -1.717 -18.194 366 HE3 LYS 46 HE3 LYS 46 1.689 -1.560 -17.816 367 HZ1 LYS 46 HZ1 LYS 46 -0.380 -3.045 -16.436 368 HZ2 LYS 46 HZ2 LYS 46 0.687 -2.206 -15.428 369 HZ3 LYS 46 HZ3 LYS 46 1.283 -3.339 -16.533 370 H GLN 47 H GLN 47 0.037 3.075 -14.585 371 HA GLN 47 HA GLN 47 -0.146 5.829 -14.069 372 HB2 GLN 47 HB2 GLN 47 1.193 3.519 -12.897 373 HB3 GLN 47 HB3 GLN 47 2.137 4.994 -12.739 374 HG2 GLN 47 HG2 GLN 47 0.478 6.062 -11.491 375 HG3 GLN 47 HG3 GLN 47 -0.757 4.902 -11.976 376 HE21 GLN 47 HE21 GLN 47 -1.383 4.151 -10.036 377 HE22 GLN 47 HE22 GLN 47 -0.348 3.338 -8.919 378 H CYS 48 H CYS 48 1.107 7.542 -14.579 379 HA CYS 48 HA CYS 48 3.238 7.080 -16.536 380 HB2 CYS 48 HB2 CYS 48 2.893 9.288 -17.299 381 HB3 CYS 48 HB3 CYS 48 1.279 8.659 -16.989 382 H ASP 49 H ASP 49 2.736 7.983 -13.285 383 HA ASP 49 HA ASP 49 4.788 9.731 -12.717 384 HB2 ASP 49 HB2 ASP 49 3.021 8.748 -11.141 385 HB3 ASP 49 HB3 ASP 49 4.131 7.398 -10.926 386 H GLY 50 H GLY 50 6.885 9.637 -13.145 387 HA2 GLY 50 HA2 GLY 50 9.052 8.757 -12.938 388 HA3 GLY 50 HA3 GLY 50 8.355 7.176 -12.613 389 H ARG 51 H ARG 51 6.590 7.276 -14.946 390 HA ARG 51 HA ARG 51 8.626 6.790 -17.017 391 HB2 ARG 51 HB2 ARG 51 5.949 5.494 -16.518 392 HB3 ARG 51 HB3 ARG 51 6.835 5.292 -18.024 393 HG2 ARG 51 HG2 ARG 51 7.393 3.412 -16.777 394 HG3 ARG 51 HG3 ARG 51 8.772 4.490 -16.559 395 HD2 ARG 51 HD2 ARG 51 8.051 5.118 -14.389 396 HD3 ARG 51 HD3 ARG 51 6.475 4.363 -14.623 397 HE ARG 51 HE ARG 51 7.387 2.361 -14.005 398 HH11 ARG 51 HH11 ARG 51 9.952 4.565 -14.835 399 HH12 ARG 51 HH12 ARG 51 11.213 3.502 -14.305 400 HH21 ARG 51 HH21 ARG 51 9.039 0.953 -13.304 401 HH22 ARG 51 HH22 ARG 51 10.693 1.447 -13.436 402 H GLU 52 H GLU 52 7.628 9.384 -16.589 403 HA GLU 52 HA GLU 52 5.449 10.073 -18.219 404 HB2 GLU 52 HB2 GLU 52 6.235 12.343 -18.061 405 HB3 GLU 52 HB3 GLU 52 6.477 11.557 -16.507 406 HG2 GLU 52 HG2 GLU 52 8.867 11.095 -17.403 407 HG3 GLU 52 HG3 GLU 52 8.497 12.392 -18.539 408 H ARG 53 H ARG 53 8.600 9.057 -19.020 409 HA ARG 53 HA ARG 53 8.158 9.860 -21.819 410 HB2 ARG 53 HB2 ARG 53 10.834 9.655 -20.426 411 HB3 ARG 53 HB3 ARG 53 10.564 10.120 -22.101 412 HG2 ARG 53 HG2 ARG 53 9.083 11.992 -21.002 413 HG3 ARG 53 HG3 ARG 53 10.112 11.667 -19.605 414 HD2 ARG 53 HD2 ARG 53 11.154 13.417 -20.809 415 HD3 ARG 53 HD3 ARG 53 12.088 11.959 -21.140 416 HE ARG 53 HE ARG 53 11.452 12.084 -23.343 417 HH11 ARG 53 HH11 ARG 53 9.501 14.253 -21.444 418 HH12 ARG 53 HH12 ARG 53 8.783 15.021 -22.820 419 HH21 ARG 53 HH21 ARG 53 10.513 13.087 -25.164 420 HH22 ARG 53 HH22 ARG 53 9.359 14.357 -24.936 421 H ASP 54 H ASP 54 7.546 7.374 -20.278 422 HA ASP 54 HA ASP 54 9.190 5.484 -21.831 423 HB2 ASP 54 HB2 ASP 54 8.773 5.539 -19.095 424 HB3 ASP 54 HB3 ASP 54 7.638 4.314 -19.653 425 H CYS 55 H CYS 55 6.015 6.650 -21.179 426 HA CYS 55 HA CYS 55 4.382 4.558 -21.913 427 HB2 CYS 55 HB2 CYS 55 3.986 7.463 -22.659 428 HB3 CYS 55 HB3 CYS 55 2.730 6.232 -22.559 429 H CYS 56 H CYS 56 3.090 4.423 -23.999 430 HA CYS 56 HA CYS 56 4.857 3.821 -26.125 431 HB2 CYS 56 HB2 CYS 56 1.943 3.689 -25.648 432 HB3 CYS 56 HB3 CYS 56 2.427 3.833 -27.335 433 H ALA 57 H ALA 57 4.045 4.629 -28.450 434 HA ALA 57 HA ALA 57 4.790 7.384 -28.564 435 HB1 ALA 57 HB1 ALA 57 5.588 6.250 -30.388 436 HB2 ALA 57 HB2 ALA 57 4.124 5.282 -30.566 437 HB3 ALA 57 HB3 ALA 57 4.131 6.972 -31.071 438 H GLY 58 H GLY 58 3.517 9.115 -28.469 439 HA2 GLY 58 HA2 GLY 58 1.612 10.363 -29.217 440 HA3 GLY 58 HA3 GLY 58 0.710 8.857 -29.311 441 H LEU 59 H LEU 59 2.009 8.189 -26.596 442 HA LEU 59 HA LEU 59 -0.168 9.251 -25.025 443 HB2 LEU 59 HB2 LEU 59 2.047 7.300 -24.512 444 HB3 LEU 59 HB3 LEU 59 1.057 7.914 -23.189 445 HG LEU 59 HG LEU 59 0.061 6.353 -25.572 446 HD11 LEU 59 HD11 LEU 59 -0.497 4.696 -23.719 447 HD12 LEU 59 HD12 LEU 59 0.625 5.615 -22.717 448 HD13 LEU 59 HD13 LEU 59 1.196 4.837 -24.192 449 HD21 LEU 59 HD21 LEU 59 -2.015 6.258 -24.033 450 HD22 LEU 59 HD22 LEU 59 -1.731 7.708 -24.996 451 HD23 LEU 59 HD23 LEU 59 -1.321 7.695 -23.280 452 H GLU 60 H GLU 60 0.460 9.929 -22.679 453 HA GLU 60 HA GLU 60 2.910 11.359 -22.351 454 HB2 GLU 60 HB2 GLU 60 2.085 13.604 -22.354 455 HB3 GLU 60 HB3 GLU 60 1.625 12.869 -23.884 456 HG2 GLU 60 HG2 GLU 60 -0.585 12.326 -22.530 457 HG3 GLU 60 HG3 GLU 60 -0.061 13.734 -21.608 458 H CYS 61 H CYS 61 3.077 12.383 -20.255 459 HA CYS 61 HA CYS 61 1.818 10.876 -18.215 460 HB2 CYS 61 HB2 CYS 61 4.117 12.153 -18.256 461 HB3 CYS 61 HB3 CYS 61 3.154 13.495 -17.642 462 H TRP 62 H TRP 62 -0.383 11.107 -18.208 463 HA TRP 62 HA TRP 62 -1.635 13.696 -18.261 464 HB2 TRP 62 HB2 TRP 62 -2.575 11.432 -19.123 465 HB3 TRP 62 HB3 TRP 62 -3.027 11.163 -17.442 466 HD1 TRP 62 HD1 TRP 62 -3.355 14.755 -18.181 467 HE1 TRP 62 HE1 TRP 62 -5.813 15.374 -18.625 468 HE3 TRP 62 HE3 TRP 62 -5.288 10.054 -18.730 469 HZ2 TRP 62 HZ2 TRP 62 -8.250 14.045 -19.138 470 HZ3 TRP 62 HZ3 TRP 62 -7.692 9.815 -19.197 471 HH2 TRP 62 HH2 TRP 62 -9.140 11.770 -19.395 472 H LYS 63 H LYS 63 -2.249 14.925 -16.586 473 HA LYS 63 HA LYS 63 -1.681 13.924 -13.889 474 HB2 LYS 63 HB2 LYS 63 -0.830 16.202 -15.024 475 HB3 LYS 63 HB3 LYS 63 -2.344 16.783 -14.345 476 HG2 LYS 63 HG2 LYS 63 -0.395 15.258 -12.662 477 HG3 LYS 63 HG3 LYS 63 -0.197 16.989 -12.948 478 HD2 LYS 63 HD2 LYS 63 -1.465 17.102 -11.065 479 HD3 LYS 63 HD3 LYS 63 -2.769 16.988 -12.250 480 HE2 LYS 63 HE2 LYS 63 -3.444 15.333 -10.850 481 HE3 LYS 63 HE3 LYS 63 -2.350 14.387 -11.858 482 HZ1 LYS 63 HZ1 LYS 63 -0.821 15.526 -9.838 483 HZ2 LYS 63 HZ2 LYS 63 -1.214 13.894 -10.041 484 HZ3 LYS 63 HZ3 LYS 63 -2.199 14.889 -9.092 485 H ARG 64 H ARG 64 -3.488 12.872 -13.224 486 HA ARG 64 HA ARG 64 -5.999 14.416 -13.231 487 HB2 ARG 64 HB2 ARG 64 -5.429 11.638 -13.977 488 HB3 ARG 64 HB3 ARG 64 -6.778 11.808 -12.863 489 HG2 ARG 64 HG2 ARG 64 -8.037 13.037 -14.368 490 HG3 ARG 64 HG3 ARG 64 -6.625 13.505 -15.317 491 HD2 ARG 64 HD2 ARG 64 -7.308 11.887 -16.716 492 HD3 ARG 64 HD3 ARG 64 -6.542 10.804 -15.553 493 HE ARG 64 HE ARG 64 -9.267 11.372 -14.899 494 HH11 ARG 64 HH11 ARG 64 -7.187 9.397 -16.872 495 HH12 ARG 64 HH12 ARG 64 -8.334 8.108 -17.022 496 HH21 ARG 64 HH21 ARG 64 -10.788 9.682 -15.091 497 HH22 ARG 64 HH22 ARG 64 -10.383 8.271 -16.009 498 H SER 65 H SER 65 -6.940 14.798 -11.318 499 HA SER 65 HA SER 65 -6.053 13.249 -8.981 500 HB2 SER 65 HB2 SER 65 -6.045 15.351 -7.649 501 HB3 SER 65 HB3 SER 65 -4.826 15.348 -8.923 502 HG SER 65 HG SER 65 -7.391 16.532 -9.182 503 H GLY 66 H GLY 66 -7.628 12.676 -7.577 504 HA2 GLY 66 HA2 GLY 66 -9.732 13.200 -6.458 505 HA3 GLY 66 HA3 GLY 66 -10.301 13.864 -7.983 506 H ASN 67 H ASN 67 -8.992 11.517 -9.387 507 HA ASN 67 HA ASN 67 -11.154 9.595 -8.842 508 HB2 ASN 67 HB2 ASN 67 -9.715 10.354 -11.372 509 HB3 ASN 67 HB3 ASN 67 -10.568 8.819 -11.241 510 HD21 ASN 67 HD21 ASN 67 -11.076 11.159 -12.933 511 HD22 ASN 67 HD22 ASN 67 -12.704 11.632 -12.601 512 H LYS 68 H LYS 68 -7.756 9.774 -9.883 513 HA LYS 68 HA LYS 68 -7.007 7.618 -8.163 514 HB2 LYS 68 HB2 LYS 68 -7.552 7.098 -11.028 515 HB3 LYS 68 HB3 LYS 68 -6.063 6.414 -10.386 516 HG2 LYS 68 HG2 LYS 68 -7.684 5.595 -8.470 517 HG3 LYS 68 HG3 LYS 68 -8.886 5.758 -9.751 518 HD2 LYS 68 HD2 LYS 68 -8.154 3.542 -9.926 519 HD3 LYS 68 HD3 LYS 68 -7.260 4.393 -11.189 520 HE2 LYS 68 HE2 LYS 68 -5.607 3.125 -10.186 521 HE3 LYS 68 HE3 LYS 68 -5.443 4.671 -9.357 522 HZ1 LYS 68 HZ1 LYS 68 -7.301 2.897 -8.079 523 HZ2 LYS 68 HZ2 LYS 68 -6.005 3.760 -7.419 524 HZ3 LYS 68 HZ3 LYS 68 -5.736 2.260 -8.154 525 H SER 69 H SER 69 -4.638 6.882 -8.892 526 HA SER 69 HA SER 69 -2.988 9.109 -8.560 527 HB2 SER 69 HB2 SER 69 -2.548 6.244 -9.256 528 HB3 SER 69 HB3 SER 69 -1.214 7.365 -9.522 529 HG SER 69 HG SER 69 -0.904 7.431 -7.452 530 H SER 70 H SER 70 -1.011 9.377 -10.174 531 HA SER 70 HA SER 70 -2.088 10.613 -12.495 532 HB2 SER 70 HB2 SER 70 0.837 10.024 -12.240 533 HB3 SER 70 HB3 SER 70 0.037 11.472 -12.848 534 HG SER 70 HG SER 70 0.924 11.873 -10.811 535 H VAL 71 H VAL 71 -2.545 9.738 -14.396 536 HA VAL 71 HA VAL 71 -1.218 7.210 -15.137 537 HB VAL 71 HB VAL 71 -3.279 6.741 -16.503 538 HG11 VAL 71 HG11 VAL 71 -4.332 5.650 -14.759 539 HG12 VAL 71 HG12 VAL 71 -2.718 5.919 -14.099 540 HG13 VAL 71 HG13 VAL 71 -4.053 6.971 -13.626 541 HG21 VAL 71 HG21 VAL 71 -5.096 8.301 -14.945 542 HG22 VAL 71 HG22 VAL 71 -3.928 9.372 -15.719 543 HG23 VAL 71 HG23 VAL 71 -4.886 8.261 -16.696 544 H CYS 72 H CYS 72 -1.612 6.857 -17.649 545 HA CYS 72 HA CYS 72 -0.561 9.273 -18.950 546 HB2 CYS 72 HB2 CYS 72 0.122 6.463 -19.085 547 HB3 CYS 72 HB3 CYS 72 -0.242 7.097 -20.688 548 H ALA 73 H ALA 73 -1.268 9.812 -21.084 549 HA ALA 73 HA ALA 73 -3.724 8.559 -22.034 550 HB1 ALA 73 HB1 ALA 73 -3.964 11.461 -22.079 551 HB2 ALA 73 HB2 ALA 73 -5.130 10.234 -21.583 552 HB3 ALA 73 HB3 ALA 73 -3.903 10.794 -20.446 553 HA PRO 74 HA PRO 74 -2.072 9.392 -26.015 554 HB2 PRO 74 HB2 PRO 74 -4.328 9.777 -27.477 555 HB3 PRO 74 HB3 PRO 74 -3.831 8.190 -26.875 556 HG2 PRO 74 HG2 PRO 74 -5.851 10.094 -25.754 557 HG3 PRO 74 HG3 PRO 74 -5.954 8.334 -25.937 558 HD2 PRO 74 HD2 PRO 74 -5.364 9.521 -23.576 559 HD3 PRO 74 HD3 PRO 74 -4.709 7.937 -24.040 560 H ILE 75 H ILE 75 -2.197 10.983 -27.880 561 HA ILE 75 HA ILE 75 -1.687 13.571 -26.984 562 HB ILE 75 HB ILE 75 -1.939 14.229 -29.417 563 HG12 ILE 75 HG12 ILE 75 -2.166 11.275 -29.938 564 HG13 ILE 75 HG13 ILE 75 -3.604 12.280 -29.789 565 HG21 ILE 75 HG21 ILE 75 0.145 13.316 -28.216 566 HG22 ILE 75 HG22 ILE 75 -0.169 11.832 -29.115 567 HG23 ILE 75 HG23 ILE 75 0.137 13.338 -29.980 568 HD11 ILE 75 HD11 ILE 75 -1.615 12.123 -31.952 569 HD12 ILE 75 HD12 ILE 75 -3.348 12.443 -32.015 570 HD13 ILE 75 HD13 ILE 75 -2.229 13.731 -31.569 571 H THR 76 H THR 76 -2.826 15.538 -27.261 572 HA THR 76 HA THR 76 -5.728 15.276 -27.667 573 HB THR 76 HB THR 76 -6.202 16.747 -25.808 574 HG1 THR 76 HG1 THR 76 -4.642 17.747 -24.674 575 HG21 THR 76 HG21 THR 76 -4.491 15.078 -24.214 576 HG22 THR 76 HG22 THR 76 -5.163 14.145 -25.551 577 HG23 THR 76 HG23 THR 76 -6.237 14.990 -24.437 Start of MODEL 11 1 H1 SER 1 H SER 1 5.502 1.982 -0.317 2 HA SER 1 HA SER 1 7.046 0.456 1.676 3 HB2 SER 1 HB2 SER 1 4.165 1.205 1.521 4 HB3 SER 1 HB3 SER 1 4.566 -0.366 2.216 5 HG SER 1 HG SER 1 4.542 1.195 3.837 6 H ASN 2 H ASN 2 5.080 0.313 -1.208 7 HA ASN 2 HA ASN 2 5.487 -2.595 -1.352 8 HB2 ASN 2 HB2 ASN 2 3.612 -0.922 -3.032 9 HB3 ASN 2 HB3 ASN 2 3.649 -2.678 -2.903 10 HD21 ASN 2 HD21 ASN 2 3.492 -3.410 -0.501 11 HD22 ASN 2 HD22 ASN 2 2.205 -2.679 0.390 12 H GLU 3 H GLU 3 7.784 -1.783 -1.887 13 HA GLU 3 HA GLU 3 8.204 -0.727 -4.519 14 HB2 GLU 3 HB2 GLU 3 10.603 -1.223 -4.051 15 HB3 GLU 3 HB3 GLU 3 9.831 -0.226 -2.825 16 HG2 GLU 3 HG2 GLU 3 9.769 -1.973 -1.276 17 HG3 GLU 3 HG3 GLU 3 10.058 -3.196 -2.511 18 H CYS 4 H CYS 4 9.847 -1.968 -5.962 19 HA CYS 4 HA CYS 4 8.961 -4.772 -6.177 20 HB2 CYS 4 HB2 CYS 4 9.057 -4.555 -8.612 21 HB3 CYS 4 HB3 CYS 4 7.938 -3.379 -7.927 22 H ILE 5 H ILE 5 10.498 -6.016 -7.717 23 HA ILE 5 HA ILE 5 13.081 -5.981 -6.530 24 HB ILE 5 HB ILE 5 12.110 -7.487 -8.961 25 HG12 ILE 5 HG12 ILE 5 12.544 -8.678 -6.246 26 HG13 ILE 5 HG13 ILE 5 11.048 -7.819 -6.587 27 HG21 ILE 5 HG21 ILE 5 14.725 -7.221 -7.785 28 HG22 ILE 5 HG22 ILE 5 14.170 -8.893 -7.709 29 HG23 ILE 5 HG23 ILE 5 14.238 -8.056 -9.261 30 HD11 ILE 5 HD11 ILE 5 10.467 -9.347 -8.303 31 HD12 ILE 5 HD12 ILE 5 12.064 -10.095 -8.261 32 HD13 ILE 5 HD13 ILE 5 10.961 -10.294 -6.900 33 H ARG 6 H ARG 6 14.811 -4.839 -7.079 34 HA ARG 6 HA ARG 6 14.807 -2.952 -9.162 35 HB2 ARG 6 HB2 ARG 6 17.104 -4.110 -7.575 36 HB3 ARG 6 HB3 ARG 6 17.243 -2.729 -8.654 37 HG2 ARG 6 HG2 ARG 6 16.948 -1.614 -6.709 38 HG3 ARG 6 HG3 ARG 6 15.252 -1.837 -7.141 39 HD2 ARG 6 HD2 ARG 6 14.927 -3.484 -5.566 40 HD3 ARG 6 HD3 ARG 6 16.630 -3.939 -5.539 41 HE ARG 6 HE ARG 6 16.968 -2.403 -3.882 42 HH11 ARG 6 HH11 ARG 6 13.962 -1.688 -5.486 43 HH12 ARG 6 HH12 ARG 6 13.509 -0.447 -4.364 44 HH21 ARG 6 HH21 ARG 6 16.382 -0.772 -2.400 45 HH22 ARG 6 HH22 ARG 6 14.886 0.074 -2.610 46 H LYS 7 H LYS 7 16.066 -2.858 -11.080 47 HA LYS 7 HA LYS 7 16.032 -5.250 -12.600 48 HB2 LYS 7 HB2 LYS 7 15.739 -2.913 -13.497 49 HB3 LYS 7 HB3 LYS 7 17.471 -2.685 -13.288 50 HG2 LYS 7 HG2 LYS 7 17.654 -4.831 -14.748 51 HG3 LYS 7 HG3 LYS 7 16.008 -4.414 -15.230 52 HD2 LYS 7 HD2 LYS 7 18.156 -2.333 -15.298 53 HD3 LYS 7 HD3 LYS 7 18.036 -3.516 -16.603 54 HE2 LYS 7 HE2 LYS 7 15.695 -2.855 -16.961 55 HE3 LYS 7 HE3 LYS 7 15.848 -1.653 -15.679 56 HZ1 LYS 7 HZ1 LYS 7 17.307 -0.379 -16.950 57 HZ2 LYS 7 HZ2 LYS 7 16.135 -0.871 -18.066 58 HZ3 LYS 7 HZ3 LYS 7 17.641 -1.640 -18.029 59 H TRP 8 H TRP 8 17.693 -6.541 -13.339 60 HA TRP 8 HA TRP 8 19.661 -7.675 -13.239 61 HB2 TRP 8 HB2 TRP 8 20.675 -4.860 -12.825 62 HB3 TRP 8 HB3 TRP 8 21.742 -6.249 -13.014 63 HD1 TRP 8 HD1 TRP 8 20.038 -3.654 -14.994 64 HE1 TRP 8 HE1 TRP 8 20.142 -4.207 -17.505 65 HE3 TRP 8 HE3 TRP 8 21.567 -8.522 -14.689 66 HZ2 TRP 8 HZ2 TRP 8 20.785 -6.417 -19.141 67 HZ3 TRP 8 HZ3 TRP 8 21.902 -9.786 -16.773 68 HH2 TRP 8 HH2 TRP 8 21.519 -8.753 -18.952 69 H LEU 9 H LEU 9 18.264 -8.018 -11.002 70 HA LEU 9 HA LEU 9 20.307 -7.916 -8.886 71 HB2 LEU 9 HB2 LEU 9 18.491 -6.289 -8.477 72 HB3 LEU 9 HB3 LEU 9 17.333 -7.617 -8.496 73 HG LEU 9 HG LEU 9 18.338 -8.551 -6.489 74 HD11 LEU 9 HD11 LEU 9 20.028 -7.082 -5.276 75 HD12 LEU 9 HD12 LEU 9 20.289 -6.296 -6.833 76 HD13 LEU 9 HD13 LEU 9 20.616 -8.019 -6.651 77 HD21 LEU 9 HD21 LEU 9 17.871 -5.611 -6.048 78 HD22 LEU 9 HD22 LEU 9 17.553 -6.943 -4.936 79 HD23 LEU 9 HD23 LEU 9 16.572 -6.753 -6.390 80 H SER 10 H SER 10 17.120 -9.417 -9.459 81 HA SER 10 HA SER 10 18.042 -12.041 -9.712 82 HB2 SER 10 HB2 SER 10 17.160 -12.828 -7.394 83 HB3 SER 10 HB3 SER 10 18.781 -12.142 -7.495 84 HG SER 10 HG SER 10 17.626 -11.223 -5.774 85 H CYS 11 H CYS 11 16.458 -12.983 -10.797 86 HA CYS 11 HA CYS 11 13.712 -12.039 -10.416 87 HB2 CYS 11 HB2 CYS 11 13.227 -12.918 -12.583 88 HB3 CYS 11 HB3 CYS 11 14.759 -12.060 -12.711 89 H VAL 12 H VAL 12 15.748 -14.695 -9.753 90 HA VAL 12 HA VAL 12 14.086 -16.893 -9.836 91 HB VAL 12 HB VAL 12 16.066 -16.312 -7.630 92 HG11 VAL 12 HG11 VAL 12 15.202 -18.248 -6.875 93 HG12 VAL 12 HG12 VAL 12 14.510 -18.672 -8.442 94 HG13 VAL 12 HG13 VAL 12 16.219 -18.967 -8.123 95 HG21 VAL 12 HG21 VAL 12 16.478 -16.638 -10.444 96 HG22 VAL 12 HG22 VAL 12 17.665 -16.350 -9.172 97 HG23 VAL 12 HG23 VAL 12 17.193 -17.999 -9.580 98 H ASP 13 H ASP 13 14.093 -14.235 -7.575 99 HA ASP 13 HA ASP 13 12.051 -15.566 -5.940 100 HB2 ASP 13 HB2 ASP 13 14.176 -14.377 -4.988 101 HB3 ASP 13 HB3 ASP 13 13.252 -12.902 -5.264 102 H ARG 14 H ARG 14 10.111 -15.294 -6.884 103 HA ARG 14 HA ARG 14 8.214 -14.271 -7.609 104 HB2 ARG 14 HB2 ARG 14 9.414 -11.700 -6.578 105 HB3 ARG 14 HB3 ARG 14 7.710 -12.060 -6.825 106 HG2 ARG 14 HG2 ARG 14 7.699 -13.604 -5.005 107 HG3 ARG 14 HG3 ARG 14 9.452 -13.499 -4.839 108 HD2 ARG 14 HD2 ARG 14 9.361 -11.342 -3.960 109 HD3 ARG 14 HD3 ARG 14 7.734 -11.059 -4.580 110 HE ARG 14 HE ARG 14 8.434 -12.250 -2.082 111 HH11 ARG 14 HH11 ARG 14 6.040 -12.217 -4.609 112 HH12 ARG 14 HH12 ARG 14 4.754 -12.747 -3.577 113 HH21 ARG 14 HH21 ARG 14 6.749 -12.949 -0.713 114 HH22 ARG 14 HH22 ARG 14 5.158 -13.162 -1.361 115 H LYS 15 H LYS 15 9.677 -14.797 -9.651 116 HA LYS 15 HA LYS 15 10.792 -12.730 -11.165 117 HB2 LYS 15 HB2 LYS 15 10.735 -14.226 -13.015 118 HB3 LYS 15 HB3 LYS 15 11.005 -15.210 -11.582 119 HG2 LYS 15 HG2 LYS 15 8.403 -15.462 -11.630 120 HG3 LYS 15 HG3 LYS 15 8.599 -15.018 -13.326 121 HD2 LYS 15 HD2 LYS 15 8.689 -17.363 -13.305 122 HD3 LYS 15 HD3 LYS 15 10.374 -16.851 -13.422 123 HE2 LYS 15 HE2 LYS 15 10.805 -17.370 -11.180 124 HE3 LYS 15 HE3 LYS 15 9.090 -17.421 -10.771 125 HZ1 LYS 15 HZ1 LYS 15 9.043 -19.573 -11.228 126 HZ2 LYS 15 HZ2 LYS 15 10.716 -19.548 -11.477 127 HZ3 LYS 15 HZ3 LYS 15 9.663 -19.321 -12.782 128 H ASN 16 H ASN 16 7.474 -13.743 -10.751 129 HA ASN 16 HA ASN 16 6.407 -12.310 -12.965 130 HB2 ASN 16 HB2 ASN 16 5.217 -14.187 -11.890 131 HB3 ASN 16 HB3 ASN 16 5.027 -13.220 -10.430 132 HD21 ASN 16 HD21 ASN 16 3.507 -11.614 -10.364 133 HD22 ASN 16 HD22 ASN 16 2.316 -11.392 -11.595 134 H ASP 17 H ASP 17 7.198 -11.482 -9.676 135 HA ASP 17 HA ASP 17 5.948 -8.846 -9.990 136 HB2 ASP 17 HB2 ASP 17 7.063 -10.219 -7.535 137 HB3 ASP 17 HB3 ASP 17 6.361 -8.604 -7.550 138 H CYS 18 H CYS 18 8.365 -9.570 -11.406 139 HA CYS 18 HA CYS 18 10.722 -8.693 -10.245 140 HB2 CYS 18 HB2 CYS 18 9.701 -8.943 -13.015 141 HB3 CYS 18 HB3 CYS 18 11.085 -7.878 -12.796 142 H CYS 19 H CYS 19 8.859 -6.720 -12.555 143 HA CYS 19 HA CYS 19 8.568 -4.465 -10.933 144 HB2 CYS 19 HB2 CYS 19 11.220 -4.777 -11.623 145 HB3 CYS 19 HB3 CYS 19 10.634 -3.655 -12.846 146 H GLU 20 H GLU 20 8.709 -2.381 -12.671 147 HA GLU 20 HA GLU 20 6.615 -3.070 -14.560 148 HB2 GLU 20 HB2 GLU 20 6.512 -1.046 -13.060 149 HB3 GLU 20 HB3 GLU 20 7.810 -0.351 -14.021 150 HG2 GLU 20 HG2 GLU 20 5.653 0.508 -14.715 151 HG3 GLU 20 HG3 GLU 20 6.402 -0.432 -16.005 152 H GLY 21 H GLY 21 7.156 -3.763 -16.519 153 HA2 GLY 21 HA2 GLY 21 8.033 -3.594 -18.665 154 HA3 GLY 21 HA3 GLY 21 8.995 -2.223 -18.134 155 H LEU 22 H LEU 22 9.015 -5.290 -16.459 156 HA LEU 22 HA LEU 22 11.687 -5.845 -17.560 157 HB2 LEU 22 HB2 LEU 22 10.796 -6.017 -14.689 158 HB3 LEU 22 HB3 LEU 22 12.308 -6.690 -15.293 159 HG LEU 22 HG LEU 22 11.537 -3.777 -15.172 160 HD11 LEU 22 HD11 LEU 22 12.719 -3.648 -13.285 161 HD12 LEU 22 HD12 LEU 22 14.010 -4.667 -13.918 162 HD13 LEU 22 HD13 LEU 22 12.570 -5.404 -13.217 163 HD21 LEU 22 HD21 LEU 22 14.008 -3.551 -15.896 164 HD22 LEU 22 HD22 LEU 22 12.787 -3.883 -17.125 165 HD23 LEU 22 HD23 LEU 22 13.807 -5.188 -16.521 166 H GLU 23 H GLU 23 12.372 -8.111 -17.308 167 HA GLU 23 HA GLU 23 10.411 -10.110 -16.698 168 HB2 GLU 23 HB2 GLU 23 10.041 -11.009 -18.852 169 HB3 GLU 23 HB3 GLU 23 9.781 -9.278 -19.014 170 HG2 GLU 23 HG2 GLU 23 12.020 -9.026 -19.954 171 HG3 GLU 23 HG3 GLU 23 12.281 -10.762 -19.794 172 H CYS 24 H CYS 24 11.286 -12.194 -16.579 173 HA CYS 24 HA CYS 24 14.100 -12.283 -16.107 174 HB2 CYS 24 HB2 CYS 24 12.125 -13.643 -15.012 175 HB3 CYS 24 HB3 CYS 24 12.444 -14.765 -16.331 176 H TYR 25 H TYR 25 15.714 -13.172 -17.302 177 HA TYR 25 HA TYR 25 14.985 -14.189 -19.971 178 HB2 TYR 25 HB2 TYR 25 16.719 -13.010 -20.963 179 HB3 TYR 25 HB3 TYR 25 16.179 -11.876 -19.729 180 HD1 TYR 25 HD2 TYR 25 17.420 -12.251 -17.367 181 HD2 TYR 25 HD1 TYR 25 18.991 -13.309 -21.176 182 HE1 TYR 25 HE2 TYR 25 19.698 -12.163 -16.445 183 HE2 TYR 25 HE1 TYR 25 21.273 -13.225 -20.265 184 HH TYR 25 HH TYR 25 22.415 -11.992 -18.269 185 H LYS 26 H LYS 26 16.899 -15.446 -20.961 186 HA LYS 26 HA LYS 26 17.579 -17.546 -19.081 187 HB2 LYS 26 HB2 LYS 26 16.715 -18.051 -21.362 188 HB3 LYS 26 HB3 LYS 26 18.181 -17.353 -22.037 189 HG2 LYS 26 HG2 LYS 26 19.469 -19.065 -20.709 190 HG3 LYS 26 HG3 LYS 26 17.918 -19.838 -20.370 191 HD2 LYS 26 HD2 LYS 26 18.749 -19.211 -23.183 192 HD3 LYS 26 HD3 LYS 26 19.311 -20.677 -22.375 193 HE2 LYS 26 HE2 LYS 26 16.410 -19.904 -22.625 194 HE3 LYS 26 HE3 LYS 26 17.244 -20.957 -23.767 195 HZ1 LYS 26 HZ1 LYS 26 17.831 -22.066 -21.371 196 HZ2 LYS 26 HZ2 LYS 26 16.606 -22.590 -22.413 197 HZ3 LYS 26 HZ3 LYS 26 16.240 -21.539 -21.139 198 H ARG 27 H ARG 27 19.473 -17.744 -18.087 199 HA ARG 27 HA ARG 27 21.635 -15.925 -18.799 200 HB2 ARG 27 HB2 ARG 27 20.744 -17.278 -16.377 201 HB3 ARG 27 HB3 ARG 27 22.479 -17.428 -16.624 202 HG2 ARG 27 HG2 ARG 27 21.129 -14.767 -16.830 203 HG3 ARG 27 HG3 ARG 27 21.583 -15.440 -15.263 204 HD2 ARG 27 HD2 ARG 27 23.908 -15.717 -16.171 205 HD3 ARG 27 HD3 ARG 27 23.391 -14.801 -17.585 206 HE ARG 27 HE ARG 27 22.767 -13.325 -15.288 207 HH11 ARG 27 HH11 ARG 27 25.548 -14.429 -17.067 208 HH12 ARG 27 HH12 ARG 27 26.548 -13.100 -16.582 209 HH21 ARG 27 HH21 ARG 27 24.073 -11.571 -14.642 210 HH22 ARG 27 HH22 ARG 27 25.709 -11.476 -15.201 211 H ARG 28 H ARG 28 23.911 -17.047 -18.252 212 HA ARG 28 HA ARG 28 24.048 -19.399 -20.017 213 HB2 ARG 28 HB2 ARG 28 26.221 -17.392 -19.390 214 HB3 ARG 28 HB3 ARG 28 26.331 -18.720 -20.538 215 HG2 ARG 28 HG2 ARG 28 24.242 -16.597 -20.836 216 HG3 ARG 28 HG3 ARG 28 25.888 -16.354 -21.426 217 HD2 ARG 28 HD2 ARG 28 24.085 -18.647 -22.193 218 HD3 ARG 28 HD3 ARG 28 24.359 -17.205 -23.168 219 HE ARG 28 HE ARG 28 26.831 -18.397 -22.562 220 HH11 ARG 28 HH11 ARG 28 23.976 -18.949 -24.476 221 HH12 ARG 28 HH12 ARG 28 24.805 -19.876 -25.682 222 HH21 ARG 28 HH21 ARG 28 27.934 -19.616 -24.144 223 HH22 ARG 28 HH22 ARG 28 27.056 -20.256 -25.492 224 H HIS 29 H HIS 29 26.190 -18.003 -17.535 225 HA HIS 29 HA HIS 29 26.253 -20.641 -16.227 226 HB2 HIS 29 HB2 HIS 29 28.655 -20.185 -15.687 227 HB3 HIS 29 HB3 HIS 29 28.338 -20.412 -17.404 228 HD1 HIS 29 HD1 HIS 29 30.097 -18.984 -18.448 229 HD2 HIS 29 HD2 HIS 29 28.019 -16.991 -15.455 230 HE1 HIS 29 HE1 HIS 29 30.898 -16.603 -18.546 231 H SER 30 H SER 30 24.712 -18.173 -15.670 232 HA SER 30 HA SER 30 25.423 -17.957 -12.851 233 HB2 SER 30 HB2 SER 30 25.652 -15.766 -14.815 234 HB3 SER 30 HB3 SER 30 24.790 -15.352 -13.333 235 HG SER 30 HG SER 30 27.281 -15.244 -13.530 236 H PHE 31 H PHE 31 23.687 -16.623 -11.675 237 HA PHE 31 HA PHE 31 21.169 -17.823 -12.217 238 HB2 PHE 31 HB2 PHE 31 20.363 -16.519 -10.298 239 HB3 PHE 31 HB3 PHE 31 21.894 -17.307 -9.931 240 HD1 PHE 31 HD2 PHE 31 20.226 -14.114 -10.554 241 HD2 PHE 31 HD1 PHE 31 23.905 -16.025 -9.591 242 HE1 PHE 31 HE2 PHE 31 21.176 -11.943 -9.890 243 HE2 PHE 31 HE1 PHE 31 24.861 -13.858 -8.925 244 HZ PHE 31 HZ PHE 31 23.496 -11.813 -9.074 245 H GLU 32 H GLU 32 19.420 -17.069 -13.262 246 HA GLU 32 HA GLU 32 19.688 -14.795 -14.960 247 HB2 GLU 32 HB2 GLU 32 17.293 -15.294 -15.542 248 HB3 GLU 32 HB3 GLU 32 18.408 -16.633 -15.775 249 HG2 GLU 32 HG2 GLU 32 17.073 -16.507 -13.152 250 HG3 GLU 32 HG3 GLU 32 16.041 -16.858 -14.538 251 H VAL 33 H VAL 33 18.416 -12.890 -14.974 252 HA VAL 33 HA VAL 33 16.977 -12.238 -12.511 253 HB VAL 33 HB VAL 33 18.126 -10.165 -12.166 254 HG11 VAL 33 HG11 VAL 33 20.115 -10.957 -11.279 255 HG12 VAL 33 HG12 VAL 33 19.140 -12.422 -11.404 256 HG13 VAL 33 HG13 VAL 33 20.380 -12.081 -12.611 257 HG21 VAL 33 HG21 VAL 33 18.681 -9.306 -14.235 258 HG22 VAL 33 HG22 VAL 33 20.259 -9.792 -13.616 259 HG23 VAL 33 HG23 VAL 33 19.416 -10.812 -14.782 260 H CYS 34 H CYS 34 16.080 -9.871 -12.775 261 HA CYS 34 HA CYS 34 14.366 -9.927 -15.047 262 HB2 CYS 34 HB2 CYS 34 14.788 -7.613 -13.151 263 HB3 CYS 34 HB3 CYS 34 13.368 -7.941 -14.140 264 H VAL 35 H VAL 35 14.485 -8.878 -16.947 265 HA VAL 35 HA VAL 35 16.679 -6.947 -17.320 266 HB VAL 35 HB VAL 35 16.919 -7.793 -19.646 267 HG11 VAL 35 HG11 VAL 35 17.945 -10.052 -18.915 268 HG12 VAL 35 HG12 VAL 35 18.590 -8.560 -18.229 269 HG13 VAL 35 HG13 VAL 35 17.476 -9.554 -17.289 270 HG21 VAL 35 HG21 VAL 35 15.430 -10.254 -18.828 271 HG22 VAL 35 HG22 VAL 35 14.563 -8.880 -19.515 272 HG23 VAL 35 HG23 VAL 35 15.833 -9.674 -20.444 273 HA PRO 36 HA PRO 36 13.717 -4.186 -19.019 274 HB2 PRO 36 HB2 PRO 36 15.234 -2.852 -20.833 275 HB3 PRO 36 HB3 PRO 36 15.398 -2.621 -19.088 276 HG2 PRO 36 HG2 PRO 36 17.053 -4.289 -20.942 277 HG3 PRO 36 HG3 PRO 36 17.579 -3.226 -19.625 278 HD2 PRO 36 HD2 PRO 36 17.419 -5.915 -19.351 279 HD3 PRO 36 HD3 PRO 36 17.119 -4.798 -18.004 280 H ILE 37 H ILE 37 12.102 -4.822 -20.297 281 HA ILE 37 HA ILE 37 12.446 -6.508 -22.555 282 HB ILE 37 HB ILE 37 10.040 -4.883 -21.721 283 HG12 ILE 37 HG12 ILE 37 10.117 -7.825 -21.402 284 HG13 ILE 37 HG13 ILE 37 11.173 -6.910 -20.331 285 HG21 ILE 37 HG21 ILE 37 9.958 -5.491 -24.085 286 HG22 ILE 37 HG22 ILE 37 10.245 -7.179 -23.665 287 HG23 ILE 37 HG23 ILE 37 8.755 -6.385 -23.155 288 HD11 ILE 37 HD11 ILE 37 8.403 -7.387 -20.085 289 HD12 ILE 37 HD12 ILE 37 9.457 -6.455 -19.021 290 HD13 ILE 37 HD13 ILE 37 8.626 -5.658 -20.356 291 HA PRO 38 HA PRO 38 13.434 -3.434 -25.585 292 HB2 PRO 38 HB2 PRO 38 13.098 -5.002 -27.775 293 HB3 PRO 38 HB3 PRO 38 14.505 -5.126 -26.712 294 HG2 PRO 38 HG2 PRO 38 12.035 -6.816 -26.788 295 HG3 PRO 38 HG3 PRO 38 13.727 -7.315 -26.610 296 HD2 PRO 38 HD2 PRO 38 12.034 -7.132 -24.506 297 HD3 PRO 38 HD3 PRO 38 13.772 -6.806 -24.362 298 H GLY 39 H GLY 39 12.269 -1.922 -26.627 299 HA2 GLY 39 HA2 GLY 39 10.510 -0.874 -27.674 300 HA3 GLY 39 HA3 GLY 39 9.902 -2.468 -28.098 301 H PHE 40 H PHE 40 10.408 -2.184 -24.783 302 HA PHE 40 HA PHE 40 7.713 -2.526 -24.122 303 HB2 PHE 40 HB2 PHE 40 9.260 -3.259 -22.513 304 HB3 PHE 40 HB3 PHE 40 10.135 -1.731 -22.526 305 HD1 PHE 40 HD1 PHE 40 6.845 -3.204 -21.615 306 HD2 PHE 40 HD2 PHE 40 9.715 -0.145 -20.896 307 HE1 PHE 40 HE1 PHE 40 5.548 -2.450 -19.665 308 HE2 PHE 40 HE2 PHE 40 8.424 0.613 -18.944 309 HZ PHE 40 HZ PHE 40 6.336 -0.539 -18.326 310 H CYS 41 H CYS 41 6.152 -1.152 -23.284 311 HA CYS 41 HA CYS 41 6.687 1.683 -23.042 312 HB2 CYS 41 HB2 CYS 41 5.128 2.417 -24.704 313 HB3 CYS 41 HB3 CYS 41 6.231 1.290 -25.485 314 H LEU 42 H LEU 42 4.166 2.682 -22.963 315 HA LEU 42 HA LEU 42 2.767 1.020 -20.976 316 HB2 LEU 42 HB2 LEU 42 2.938 4.014 -20.805 317 HB3 LEU 42 HB3 LEU 42 2.387 2.878 -19.574 318 HG LEU 42 HG LEU 42 5.242 3.138 -20.515 319 HD11 LEU 42 HD11 LEU 42 3.688 4.671 -18.598 320 HD12 LEU 42 HD12 LEU 42 5.288 4.985 -19.269 321 HD13 LEU 42 HD13 LEU 42 5.111 3.919 -17.876 322 HD21 LEU 42 HD21 LEU 42 5.432 1.934 -18.164 323 HD22 LEU 42 HD22 LEU 42 5.192 1.028 -19.658 324 HD23 LEU 42 HD23 LEU 42 3.821 1.367 -18.601 325 H VAL 43 H VAL 43 0.487 1.852 -20.585 326 HA VAL 43 HA VAL 43 -0.700 2.591 -23.178 327 HB VAL 43 HB VAL 43 -2.781 1.516 -22.327 328 HG11 VAL 43 HG11 VAL 43 -1.676 -0.877 -22.317 329 HG12 VAL 43 HG12 VAL 43 -1.706 0.112 -23.779 330 HG13 VAL 43 HG13 VAL 43 -0.244 0.034 -22.794 331 HG21 VAL 43 HG21 VAL 43 -1.512 1.634 -19.878 332 HG22 VAL 43 HG22 VAL 43 -2.995 0.751 -20.241 333 HG23 VAL 43 HG23 VAL 43 -1.439 -0.077 -20.302 334 H LYS 44 H LYS 44 -3.151 3.373 -22.593 335 HA LYS 44 HA LYS 44 -2.742 5.913 -21.281 336 HB2 LYS 44 HB2 LYS 44 -4.916 6.504 -22.115 337 HB3 LYS 44 HB3 LYS 44 -4.045 5.672 -23.397 338 HG2 LYS 44 HG2 LYS 44 -5.468 3.710 -21.951 339 HG3 LYS 44 HG3 LYS 44 -6.576 5.050 -22.254 340 HD2 LYS 44 HD2 LYS 44 -6.877 4.034 -24.240 341 HD3 LYS 44 HD3 LYS 44 -5.364 4.836 -24.668 342 HE2 LYS 44 HE2 LYS 44 -4.102 2.877 -24.230 343 HE3 LYS 44 HE3 LYS 44 -5.467 2.090 -23.440 344 HZ1 LYS 44 HZ1 LYS 44 -5.862 1.163 -25.405 345 HZ2 LYS 44 HZ2 LYS 44 -4.788 2.190 -26.214 346 HZ3 LYS 44 HZ3 LYS 44 -6.384 2.681 -25.942 347 H TRP 45 H TRP 45 -3.295 2.969 -20.076 348 HA TRP 45 HA TRP 45 -4.952 4.012 -17.874 349 HB2 TRP 45 HB2 TRP 45 -4.951 1.232 -19.062 350 HB3 TRP 45 HB3 TRP 45 -5.762 1.660 -17.558 351 HD1 TRP 45 HD1 TRP 45 -6.387 1.409 -21.176 352 HE1 TRP 45 HE1 TRP 45 -8.613 2.540 -21.798 353 HE3 TRP 45 HE3 TRP 45 -7.241 3.963 -16.830 354 HZ2 TRP 45 HZ2 TRP 45 -10.484 4.285 -20.604 355 HZ3 TRP 45 HZ3 TRP 45 -9.272 5.341 -16.652 356 HH2 TRP 45 HH2 TRP 45 -10.859 5.497 -18.501 357 H LYS 46 H LYS 46 -1.966 3.724 -18.391 358 HA LYS 46 HA LYS 46 -1.334 2.150 -15.980 359 HB2 LYS 46 HB2 LYS 46 0.167 2.526 -18.552 360 HB3 LYS 46 HB3 LYS 46 1.032 2.128 -17.072 361 HG2 LYS 46 HG2 LYS 46 -1.279 0.416 -17.578 362 HG3 LYS 46 HG3 LYS 46 -0.032 0.327 -18.824 363 HD2 LYS 46 HD2 LYS 46 1.513 0.220 -16.630 364 HD3 LYS 46 HD3 LYS 46 0.042 -0.515 -15.989 365 HE2 LYS 46 HE2 LYS 46 0.144 -1.910 -18.204 366 HE3 LYS 46 HE3 LYS 46 1.848 -1.457 -18.172 367 HZ1 LYS 46 HZ1 LYS 46 1.104 -2.335 -15.615 368 HZ2 LYS 46 HZ2 LYS 46 2.211 -3.036 -16.685 369 HZ3 LYS 46 HZ3 LYS 46 0.581 -3.489 -16.737 370 H GLN 47 H GLN 47 0.248 2.977 -14.553 371 HA GLN 47 HA GLN 47 0.097 5.721 -14.052 372 HB2 GLN 47 HB2 GLN 47 1.474 3.422 -12.917 373 HB3 GLN 47 HB3 GLN 47 2.433 4.891 -12.801 374 HG2 GLN 47 HG2 GLN 47 0.961 5.911 -11.386 375 HG3 GLN 47 HG3 GLN 47 -0.423 5.002 -11.992 376 HE21 GLN 47 HE21 GLN 47 -0.971 4.649 -9.775 377 HE22 GLN 47 HE22 GLN 47 -0.184 3.404 -8.872 378 H CYS 48 H CYS 48 1.326 7.445 -14.594 379 HA CYS 48 HA CYS 48 3.400 6.997 -16.615 380 HB2 CYS 48 HB2 CYS 48 3.011 9.197 -17.378 381 HB3 CYS 48 HB3 CYS 48 1.412 8.556 -17.015 382 H ASP 49 H ASP 49 2.985 7.899 -13.354 383 HA ASP 49 HA ASP 49 5.029 9.672 -12.847 384 HB2 ASP 49 HB2 ASP 49 3.286 8.479 -11.263 385 HB3 ASP 49 HB3 ASP 49 4.632 7.381 -10.967 386 H GLY 50 H GLY 50 7.115 9.604 -13.337 387 HA2 GLY 50 HA2 GLY 50 9.298 8.751 -13.193 388 HA3 GLY 50 HA3 GLY 50 8.631 7.162 -12.849 389 H ARG 51 H ARG 51 6.797 7.238 -15.127 390 HA ARG 51 HA ARG 51 8.777 6.783 -17.260 391 HB2 ARG 51 HB2 ARG 51 6.136 5.444 -16.682 392 HB3 ARG 51 HB3 ARG 51 6.983 5.255 -18.212 393 HG2 ARG 51 HG2 ARG 51 7.607 3.385 -16.981 394 HG3 ARG 51 HG3 ARG 51 8.974 4.486 -16.802 395 HD2 ARG 51 HD2 ARG 51 8.308 5.098 -14.612 396 HD3 ARG 51 HD3 ARG 51 6.733 4.330 -14.802 397 HE ARG 51 HE ARG 51 8.496 2.287 -15.114 398 HH11 ARG 51 HH11 ARG 51 7.986 4.700 -12.658 399 HH12 ARG 51 HH12 ARG 51 8.552 3.693 -11.366 400 HH21 ARG 51 HH21 ARG 51 9.243 0.951 -13.423 401 HH22 ARG 51 HH22 ARG 51 9.267 1.561 -11.803 402 H GLU 52 H GLU 52 7.783 9.361 -16.824 403 HA GLU 52 HA GLU 52 5.534 10.012 -18.386 404 HB2 GLU 52 HB2 GLU 52 6.264 12.293 -18.225 405 HB3 GLU 52 HB3 GLU 52 6.597 11.504 -16.690 406 HG2 GLU 52 HG2 GLU 52 8.955 11.153 -17.546 407 HG3 GLU 52 HG3 GLU 52 8.539 12.269 -18.845 408 H ARG 53 H ARG 53 8.662 9.023 -19.272 409 HA ARG 53 HA ARG 53 8.153 9.852 -22.052 410 HB2 ARG 53 HB2 ARG 53 10.852 9.602 -22.018 411 HB3 ARG 53 HB3 ARG 53 10.002 11.125 -21.793 412 HG2 ARG 53 HG2 ARG 53 10.383 11.158 -19.521 413 HG3 ARG 53 HG3 ARG 53 10.610 9.410 -19.429 414 HD2 ARG 53 HD2 ARG 53 12.774 9.527 -20.291 415 HD3 ARG 53 HD3 ARG 53 12.519 11.136 -20.963 416 HE ARG 53 HE ARG 53 13.348 10.486 -18.294 417 HH11 ARG 53 HH11 ARG 53 11.758 12.857 -20.287 418 HH12 ARG 53 HH12 ARG 53 12.103 14.177 -19.220 419 HH21 ARG 53 HH21 ARG 53 13.808 12.216 -16.880 420 HH22 ARG 53 HH22 ARG 53 13.270 13.811 -17.282 421 H ASP 54 H ASP 54 7.643 7.343 -20.455 422 HA ASP 54 HA ASP 54 9.229 5.473 -22.088 423 HB2 ASP 54 HB2 ASP 54 8.839 5.515 -19.329 424 HB3 ASP 54 HB3 ASP 54 7.761 4.244 -19.900 425 H CYS 55 H CYS 55 6.068 6.617 -21.338 426 HA CYS 55 HA CYS 55 4.425 4.521 -22.037 427 HB2 CYS 55 HB2 CYS 55 3.994 7.427 -22.761 428 HB3 CYS 55 HB3 CYS 55 2.747 6.191 -22.629 429 H CYS 56 H CYS 56 3.089 4.358 -24.080 430 HA CYS 56 HA CYS 56 4.800 3.795 -26.261 431 HB2 CYS 56 HB2 CYS 56 1.903 3.614 -25.701 432 HB3 CYS 56 HB3 CYS 56 2.341 3.759 -27.400 433 H ALA 57 H ALA 57 3.909 4.592 -28.557 434 HA ALA 57 HA ALA 57 4.599 7.360 -28.688 435 HB1 ALA 57 HB1 ALA 57 3.740 6.839 -31.182 436 HB2 ALA 57 HB2 ALA 57 5.343 6.399 -30.589 437 HB3 ALA 57 HB3 ALA 57 4.052 5.197 -30.616 438 H GLY 58 H GLY 58 3.302 9.072 -28.565 439 HA2 GLY 58 HA2 GLY 58 1.352 10.284 -29.248 440 HA3 GLY 58 HA3 GLY 58 0.473 8.763 -29.311 441 H LEU 59 H LEU 59 1.859 8.112 -26.641 442 HA LEU 59 HA LEU 59 -0.276 9.154 -25.001 443 HB2 LEU 59 HB2 LEU 59 1.962 7.212 -24.571 444 HB3 LEU 59 HB3 LEU 59 1.027 7.823 -23.208 445 HG LEU 59 HG LEU 59 -0.054 6.251 -25.546 446 HD11 LEU 59 HD11 LEU 59 -0.096 5.346 -22.707 447 HD12 LEU 59 HD12 LEU 59 1.380 5.156 -23.654 448 HD13 LEU 59 HD13 LEU 59 -0.118 4.398 -24.195 449 HD21 LEU 59 HD21 LEU 59 -2.091 6.175 -23.980 450 HD22 LEU 59 HD22 LEU 59 -1.811 7.645 -24.912 451 HD23 LEU 59 HD23 LEU 59 -1.368 7.585 -23.205 452 H GLU 60 H GLU 60 0.421 9.831 -22.673 453 HA GLU 60 HA GLU 60 2.870 11.275 -22.415 454 HB2 GLU 60 HB2 GLU 60 2.055 13.512 -22.420 455 HB3 GLU 60 HB3 GLU 60 1.509 12.768 -23.917 456 HG2 GLU 60 HG2 GLU 60 -0.675 12.303 -22.708 457 HG3 GLU 60 HG3 GLU 60 -0.092 13.411 -21.466 458 H CYS 61 H CYS 61 3.088 12.302 -20.325 459 HA CYS 61 HA CYS 61 1.899 10.791 -18.250 460 HB2 CYS 61 HB2 CYS 61 4.180 12.086 -18.348 461 HB3 CYS 61 HB3 CYS 61 3.222 13.426 -17.727 462 H TRP 62 H TRP 62 -0.301 10.991 -18.166 463 HA TRP 62 HA TRP 62 -1.580 13.572 -18.186 464 HB2 TRP 62 HB2 TRP 62 -2.515 11.298 -19.043 465 HB3 TRP 62 HB3 TRP 62 -2.938 11.026 -17.354 466 HD1 TRP 62 HD1 TRP 62 -3.295 14.616 -18.111 467 HE1 TRP 62 HE1 TRP 62 -5.765 15.220 -18.508 468 HE3 TRP 62 HE3 TRP 62 -5.217 9.902 -18.577 469 HZ2 TRP 62 HZ2 TRP 62 -8.206 13.875 -18.960 470 HZ3 TRP 62 HZ3 TRP 62 -7.629 9.647 -18.991 471 HH2 TRP 62 HH2 TRP 62 -9.091 11.595 -19.176 472 H LYS 63 H LYS 63 -2.235 14.761 -16.488 473 HA LYS 63 HA LYS 63 -1.607 13.729 -13.809 474 HB2 LYS 63 HB2 LYS 63 -0.667 15.970 -14.880 475 HB3 LYS 63 HB3 LYS 63 -2.196 16.612 -14.294 476 HG2 LYS 63 HG2 LYS 63 -0.564 15.016 -12.404 477 HG3 LYS 63 HG3 LYS 63 0.003 16.634 -12.824 478 HD2 LYS 63 HD2 LYS 63 -2.821 16.112 -11.936 479 HD3 LYS 63 HD3 LYS 63 -1.519 16.416 -10.784 480 HE2 LYS 63 HE2 LYS 63 -1.971 18.290 -13.071 481 HE3 LYS 63 HE3 LYS 63 -2.987 18.391 -11.634 482 HZ1 LYS 63 HZ1 LYS 63 -0.122 18.949 -11.926 483 HZ2 LYS 63 HZ2 LYS 63 -0.686 18.386 -10.434 484 HZ3 LYS 63 HZ3 LYS 63 -1.308 19.817 -11.088 485 H ARG 64 H ARG 64 -3.437 12.698 -13.161 486 HA ARG 64 HA ARG 64 -5.929 14.272 -13.172 487 HB2 ARG 64 HB2 ARG 64 -5.367 11.484 -13.836 488 HB3 ARG 64 HB3 ARG 64 -6.671 11.657 -12.668 489 HG2 ARG 64 HG2 ARG 64 -8.013 12.836 -14.146 490 HG3 ARG 64 HG3 ARG 64 -6.651 13.289 -15.173 491 HD2 ARG 64 HD2 ARG 64 -7.367 11.619 -16.489 492 HD3 ARG 64 HD3 ARG 64 -6.554 10.577 -15.321 493 HE ARG 64 HE ARG 64 -8.599 9.810 -14.650 494 HH11 ARG 64 HH11 ARG 64 -9.031 12.792 -16.395 495 HH12 ARG 64 HH12 ARG 64 -10.760 12.687 -16.405 496 HH21 ARG 64 HH21 ARG 64 -10.874 9.661 -14.657 497 HH22 ARG 64 HH22 ARG 64 -11.808 10.906 -15.416 498 H SER 65 H SER 65 -6.950 14.650 -11.282 499 HA SER 65 HA SER 65 -5.963 13.281 -8.873 500 HB2 SER 65 HB2 SER 65 -6.317 15.561 -7.711 501 HB3 SER 65 HB3 SER 65 -4.869 15.356 -8.697 502 HG SER 65 HG SER 65 -6.006 16.409 -10.402 503 H GLY 66 H GLY 66 -7.515 12.543 -7.557 504 HA2 GLY 66 HA2 GLY 66 -9.632 12.915 -6.409 505 HA3 GLY 66 HA3 GLY 66 -10.243 13.618 -7.899 506 H ASN 67 H ASN 67 -8.714 11.305 -9.282 507 HA ASN 67 HA ASN 67 -10.866 9.329 -8.912 508 HB2 ASN 67 HB2 ASN 67 -10.678 10.490 -11.156 509 HB3 ASN 67 HB3 ASN 67 -9.141 9.657 -11.369 510 HD21 ASN 67 HD21 ASN 67 -11.672 9.483 -12.860 511 HD22 ASN 67 HD22 ASN 67 -12.106 7.811 -12.840 512 H LYS 68 H LYS 68 -7.411 9.625 -9.701 513 HA LYS 68 HA LYS 68 -6.654 7.543 -7.941 514 HB2 LYS 68 HB2 LYS 68 -5.759 6.039 -9.840 515 HB3 LYS 68 HB3 LYS 68 -7.466 5.937 -9.428 516 HG2 LYS 68 HG2 LYS 68 -8.097 7.184 -11.335 517 HG3 LYS 68 HG3 LYS 68 -6.429 7.661 -11.659 518 HD2 LYS 68 HD2 LYS 68 -7.047 5.929 -13.205 519 HD3 LYS 68 HD3 LYS 68 -5.883 5.267 -12.056 520 HE2 LYS 68 HE2 LYS 68 -7.432 3.920 -11.053 521 HE3 LYS 68 HE3 LYS 68 -8.773 5.003 -11.420 522 HZ1 LYS 68 HZ1 LYS 68 -8.396 4.309 -13.820 523 HZ2 LYS 68 HZ2 LYS 68 -9.095 3.164 -12.790 524 HZ3 LYS 68 HZ3 LYS 68 -7.459 3.045 -13.201 525 H SER 69 H SER 69 -4.285 6.746 -8.738 526 HA SER 69 HA SER 69 -2.621 8.963 -8.469 527 HB2 SER 69 HB2 SER 69 -2.173 6.114 -9.284 528 HB3 SER 69 HB3 SER 69 -0.849 7.270 -9.427 529 HG SER 69 HG SER 69 -1.265 7.772 -7.168 530 H SER 70 H SER 70 -0.700 9.238 -10.147 531 HA SER 70 HA SER 70 -1.865 10.473 -12.431 532 HB2 SER 70 HB2 SER 70 1.076 9.931 -12.252 533 HB3 SER 70 HB3 SER 70 0.238 11.365 -12.843 534 HG SER 70 HG SER 70 0.904 10.631 -10.240 535 H VAL 71 H VAL 71 -2.360 9.591 -14.319 536 HA VAL 71 HA VAL 71 -1.012 7.088 -15.101 537 HB VAL 71 HB VAL 71 -3.081 6.535 -16.376 538 HG11 VAL 71 HG11 VAL 71 -4.067 6.846 -13.616 539 HG12 VAL 71 HG12 VAL 71 -3.917 5.400 -14.615 540 HG13 VAL 71 HG13 VAL 71 -2.502 6.050 -13.787 541 HG21 VAL 71 HG21 VAL 71 -4.113 8.630 -16.706 542 HG22 VAL 71 HG22 VAL 71 -5.171 7.753 -15.601 543 HG23 VAL 71 HG23 VAL 71 -4.090 9.002 -14.982 544 H CYS 72 H CYS 72 -1.462 6.729 -17.601 545 HA CYS 72 HA CYS 72 -0.486 9.162 -18.926 546 HB2 CYS 72 HB2 CYS 72 0.226 6.361 -19.088 547 HB3 CYS 72 HB3 CYS 72 -0.193 6.993 -20.678 548 H ALA 73 H ALA 73 -1.263 9.700 -21.035 549 HA ALA 73 HA ALA 73 -3.726 8.419 -21.922 550 HB1 ALA 73 HB1 ALA 73 -4.038 11.305 -21.960 551 HB2 ALA 73 HB2 ALA 73 -5.142 10.054 -21.385 552 HB3 ALA 73 HB3 ALA 73 -3.872 10.665 -20.325 553 HA PRO 74 HA PRO 74 -2.204 9.305 -25.942 554 HB2 PRO 74 HB2 PRO 74 -4.506 9.669 -27.335 555 HB3 PRO 74 HB3 PRO 74 -3.971 8.085 -26.760 556 HG2 PRO 74 HG2 PRO 74 -5.983 9.952 -25.567 557 HG3 PRO 74 HG3 PRO 74 -6.067 8.192 -25.761 558 HD2 PRO 74 HD2 PRO 74 -5.425 9.370 -23.408 559 HD3 PRO 74 HD3 PRO 74 -4.761 7.799 -23.902 560 H ILE 75 H ILE 75 -2.390 10.908 -27.786 561 HA ILE 75 HA ILE 75 -1.873 13.489 -26.903 562 HB ILE 75 HB ILE 75 -2.266 14.169 -29.312 563 HG12 ILE 75 HG12 ILE 75 -2.511 11.216 -29.838 564 HG13 ILE 75 HG13 ILE 75 -3.939 12.222 -29.618 565 HG21 ILE 75 HG21 ILE 75 -0.237 13.224 -30.040 566 HG22 ILE 75 HG22 ILE 75 -0.101 13.330 -28.286 567 HG23 ILE 75 HG23 ILE 75 -0.460 11.782 -29.050 568 HD11 ILE 75 HD11 ILE 75 -3.751 12.298 -31.878 569 HD12 ILE 75 HD12 ILE 75 -2.749 13.688 -31.459 570 HD13 ILE 75 HD13 ILE 75 -1.994 12.143 -31.851 571 H THR 76 H THR 76 -3.036 15.450 -27.092 572 HA THR 76 HA THR 76 -5.954 15.178 -27.340 573 HB THR 76 HB THR 76 -6.371 16.533 -25.424 574 HG1 THR 76 HG1 THR 76 -4.916 17.916 -24.774 575 HG21 THR 76 HG21 THR 76 -4.294 14.981 -24.086 576 HG22 THR 76 HG22 THR 76 -5.229 14.032 -25.242 577 HG23 THR 76 HG23 THR 76 -6.048 14.888 -23.936 Start of MODEL 12 1 H1 SER 1 H SER 1 0.295 0.276 -2.766 2 HA SER 1 HA SER 1 1.245 -2.149 -4.064 3 HB2 SER 1 HB2 SER 1 1.447 0.781 -4.768 4 HB3 SER 1 HB3 SER 1 2.267 -0.479 -5.690 5 HG SER 1 HG SER 1 -0.432 0.149 -5.537 6 H ASN 2 H ASN 2 2.865 -3.085 -2.951 7 HA ASN 2 HA ASN 2 4.854 -1.625 -1.527 8 HB2 ASN 2 HB2 ASN 2 4.472 -4.511 -2.259 9 HB3 ASN 2 HB3 ASN 2 5.997 -3.971 -1.561 10 HD21 ASN 2 HD21 ASN 2 5.525 -2.376 0.378 11 HD22 ASN 2 HD22 ASN 2 4.438 -3.022 1.557 12 H GLU 3 H GLU 3 7.268 -2.481 -2.024 13 HA GLU 3 HA GLU 3 7.947 -1.239 -4.523 14 HB2 GLU 3 HB2 GLU 3 9.594 -2.510 -2.340 15 HB3 GLU 3 HB3 GLU 3 10.309 -1.850 -3.805 16 HG2 GLU 3 HG2 GLU 3 9.242 0.336 -3.246 17 HG3 GLU 3 HG3 GLU 3 8.760 -0.363 -1.701 18 H CYS 4 H CYS 4 9.539 -2.277 -6.021 19 HA CYS 4 HA CYS 4 8.859 -5.117 -6.414 20 HB2 CYS 4 HB2 CYS 4 8.978 -4.778 -8.792 21 HB3 CYS 4 HB3 CYS 4 7.912 -3.548 -8.119 22 H ILE 5 H ILE 5 10.543 -6.180 -7.954 23 HA ILE 5 HA ILE 5 13.075 -6.022 -6.617 24 HB ILE 5 HB ILE 5 12.259 -7.652 -9.025 25 HG12 ILE 5 HG12 ILE 5 12.648 -8.697 -6.236 26 HG13 ILE 5 HG13 ILE 5 11.111 -7.982 -6.710 27 HG21 ILE 5 HG21 ILE 5 14.265 -9.054 -8.076 28 HG22 ILE 5 HG22 ILE 5 14.546 -7.700 -9.169 29 HG23 ILE 5 HG23 ILE 5 14.771 -7.492 -7.433 30 HD11 ILE 5 HD11 ILE 5 11.663 -10.586 -6.933 31 HD12 ILE 5 HD12 ILE 5 10.544 -9.737 -7.999 32 HD13 ILE 5 HD13 ILE 5 12.203 -10.034 -8.519 33 H ARG 6 H ARG 6 14.802 -4.873 -7.182 34 HA ARG 6 HA ARG 6 14.814 -2.923 -9.135 35 HB2 ARG 6 HB2 ARG 6 17.092 -4.376 -7.798 36 HB3 ARG 6 HB3 ARG 6 17.347 -3.029 -8.899 37 HG2 ARG 6 HG2 ARG 6 17.343 -1.896 -6.936 38 HG3 ARG 6 HG3 ARG 6 15.613 -1.857 -7.277 39 HD2 ARG 6 HD2 ARG 6 15.127 -3.453 -5.685 40 HD3 ARG 6 HD3 ARG 6 16.750 -4.141 -5.731 41 HE ARG 6 HE ARG 6 17.191 -1.689 -4.719 42 HH11 ARG 6 HH11 ARG 6 14.922 -4.197 -3.894 43 HH12 ARG 6 HH12 ARG 6 14.858 -3.768 -2.216 44 HH21 ARG 6 HH21 ARG 6 17.116 -1.114 -2.514 45 HH22 ARG 6 HH22 ARG 6 16.105 -2.013 -1.433 46 H LYS 7 H LYS 7 16.226 -2.754 -11.060 47 HA LYS 7 HA LYS 7 15.799 -5.037 -12.781 48 HB2 LYS 7 HB2 LYS 7 15.394 -2.661 -13.493 49 HB3 LYS 7 HB3 LYS 7 17.135 -2.410 -13.449 50 HG2 LYS 7 HG2 LYS 7 17.406 -4.174 -15.145 51 HG3 LYS 7 HG3 LYS 7 15.651 -4.340 -15.222 52 HD2 LYS 7 HD2 LYS 7 16.440 -2.935 -17.037 53 HD3 LYS 7 HD3 LYS 7 15.477 -1.982 -15.906 54 HE2 LYS 7 HE2 LYS 7 17.259 -0.757 -15.210 55 HE3 LYS 7 HE3 LYS 7 18.395 -2.089 -15.420 56 HZ1 LYS 7 HZ1 LYS 7 18.850 -1.478 -17.512 57 HZ2 LYS 7 HZ2 LYS 7 18.239 0.029 -17.048 58 HZ3 LYS 7 HZ3 LYS 7 17.249 -1.068 -17.871 59 H TRP 8 H TRP 8 17.327 -6.352 -13.661 60 HA TRP 8 HA TRP 8 19.289 -7.487 -13.843 61 HB2 TRP 8 HB2 TRP 8 20.238 -4.639 -13.715 62 HB3 TRP 8 HB3 TRP 8 21.394 -5.965 -13.799 63 HD1 TRP 8 HD1 TRP 8 19.210 -3.838 -15.947 64 HE1 TRP 8 HE1 TRP 8 19.323 -4.642 -18.389 65 HE3 TRP 8 HE3 TRP 8 21.598 -8.300 -15.222 66 HZ2 TRP 8 HZ2 TRP 8 20.294 -6.873 -19.820 67 HZ3 TRP 8 HZ3 TRP 8 22.081 -9.710 -17.180 68 HH2 TRP 8 HH2 TRP 8 21.442 -9.010 -19.431 69 H LEU 9 H LEU 9 18.240 -7.829 -11.430 70 HA LEU 9 HA LEU 9 20.567 -7.704 -9.631 71 HB2 LEU 9 HB2 LEU 9 18.414 -6.205 -9.193 72 HB3 LEU 9 HB3 LEU 9 17.835 -7.703 -8.470 73 HG LEU 9 HG LEU 9 20.242 -6.089 -7.641 74 HD11 LEU 9 HD11 LEU 9 18.742 -5.056 -6.369 75 HD12 LEU 9 HD12 LEU 9 18.579 -6.569 -5.478 76 HD13 LEU 9 HD13 LEU 9 17.475 -6.203 -6.804 77 HD21 LEU 9 HD21 LEU 9 20.341 -7.816 -5.783 78 HD22 LEU 9 HD22 LEU 9 20.914 -8.330 -7.370 79 HD23 LEU 9 HD23 LEU 9 19.318 -8.825 -6.806 80 H SER 10 H SER 10 17.344 -9.234 -9.785 81 HA SER 10 HA SER 10 18.237 -11.849 -10.139 82 HB2 SER 10 HB2 SER 10 17.780 -12.690 -7.765 83 HB3 SER 10 HB3 SER 10 19.300 -11.834 -8.020 84 HG SER 10 HG SER 10 17.762 -9.935 -7.385 85 H CYS 11 H CYS 11 16.521 -12.814 -10.978 86 HA CYS 11 HA CYS 11 13.849 -11.890 -10.199 87 HB2 CYS 11 HB2 CYS 11 13.062 -12.738 -12.285 88 HB3 CYS 11 HB3 CYS 11 14.561 -11.880 -12.625 89 H VAL 12 H VAL 12 15.990 -14.434 -9.680 90 HA VAL 12 HA VAL 12 14.465 -16.726 -9.642 91 HB VAL 12 HB VAL 12 15.961 -17.608 -7.962 92 HG11 VAL 12 HG11 VAL 12 16.723 -16.816 -10.390 93 HG12 VAL 12 HG12 VAL 12 17.830 -15.838 -9.425 94 HG13 VAL 12 HG13 VAL 12 17.826 -17.593 -9.255 95 HG21 VAL 12 HG21 VAL 12 15.994 -15.862 -6.342 96 HG22 VAL 12 HG22 VAL 12 17.652 -16.092 -6.896 97 HG23 VAL 12 HG23 VAL 12 16.706 -14.728 -7.490 98 H ASP 13 H ASP 13 14.406 -14.027 -7.429 99 HA ASP 13 HA ASP 13 12.956 -15.306 -5.347 100 HB2 ASP 13 HB2 ASP 13 14.264 -13.221 -5.031 101 HB3 ASP 13 HB3 ASP 13 13.090 -12.359 -6.021 102 H ARG 14 H ARG 14 11.864 -12.836 -7.683 103 HA ARG 14 HA ARG 14 9.310 -14.237 -7.915 104 HB2 ARG 14 HB2 ARG 14 9.396 -11.267 -7.405 105 HB3 ARG 14 HB3 ARG 14 7.988 -12.320 -7.433 106 HG2 ARG 14 HG2 ARG 14 8.674 -13.379 -5.386 107 HG3 ARG 14 HG3 ARG 14 10.189 -12.475 -5.387 108 HD2 ARG 14 HD2 ARG 14 8.973 -11.178 -3.955 109 HD3 ARG 14 HD3 ARG 14 8.544 -10.411 -5.483 110 HE ARG 14 HE ARG 14 6.699 -12.454 -4.957 111 HH11 ARG 14 HH11 ARG 14 7.653 -9.340 -3.726 112 HH12 ARG 14 HH12 ARG 14 6.080 -8.958 -3.107 113 HH21 ARG 14 HH21 ARG 14 4.625 -11.962 -4.148 114 HH22 ARG 14 HH22 ARG 14 4.359 -10.451 -3.347 115 H LYS 15 H LYS 15 10.404 -14.704 -9.986 116 HA LYS 15 HA LYS 15 11.107 -12.784 -11.875 117 HB2 LYS 15 HB2 LYS 15 10.673 -14.573 -13.561 118 HB3 LYS 15 HB3 LYS 15 11.689 -15.088 -12.221 119 HG2 LYS 15 HG2 LYS 15 8.821 -15.566 -11.840 120 HG3 LYS 15 HG3 LYS 15 9.559 -16.467 -13.166 121 HD2 LYS 15 HD2 LYS 15 11.420 -16.863 -11.279 122 HD3 LYS 15 HD3 LYS 15 10.001 -16.670 -10.246 123 HE2 LYS 15 HE2 LYS 15 9.895 -18.918 -10.623 124 HE3 LYS 15 HE3 LYS 15 8.942 -18.346 -11.991 125 HZ1 LYS 15 HZ1 LYS 15 11.526 -18.322 -12.887 126 HZ2 LYS 15 HZ2 LYS 15 10.350 -19.480 -13.257 127 HZ3 LYS 15 HZ3 LYS 15 11.426 -19.746 -11.979 128 H ASN 16 H ASN 16 7.980 -13.901 -10.856 129 HA ASN 16 HA ASN 16 6.575 -12.803 -13.120 130 HB2 ASN 16 HB2 ASN 16 5.296 -13.551 -10.501 131 HB3 ASN 16 HB3 ASN 16 4.609 -13.618 -12.121 132 HD21 ASN 16 HD21 ASN 16 6.006 -15.078 -13.627 133 HD22 ASN 16 HD22 ASN 16 6.382 -16.631 -12.971 134 H ASP 17 H ASP 17 7.671 -11.685 -10.050 135 HA ASP 17 HA ASP 17 6.120 -9.202 -10.393 136 HB2 ASP 17 HB2 ASP 17 7.187 -10.465 -7.859 137 HB3 ASP 17 HB3 ASP 17 6.448 -8.868 -7.937 138 H CYS 18 H CYS 18 8.622 -9.812 -11.696 139 HA CYS 18 HA CYS 18 10.895 -8.812 -10.497 140 HB2 CYS 18 HB2 CYS 18 9.956 -9.190 -13.251 141 HB3 CYS 18 HB3 CYS 18 11.155 -7.913 -13.080 142 H CYS 19 H CYS 19 8.976 -6.901 -12.813 143 HA CYS 19 HA CYS 19 8.543 -4.687 -11.169 144 HB2 CYS 19 HB2 CYS 19 11.219 -4.855 -11.795 145 HB3 CYS 19 HB3 CYS 19 10.610 -3.756 -13.029 146 H GLU 20 H GLU 20 8.614 -2.572 -12.873 147 HA GLU 20 HA GLU 20 6.565 -3.308 -14.781 148 HB2 GLU 20 HB2 GLU 20 6.202 -1.317 -13.464 149 HB3 GLU 20 HB3 GLU 20 7.735 -0.637 -13.991 150 HG2 GLU 20 HG2 GLU 20 6.890 0.105 -15.926 151 HG3 GLU 20 HG3 GLU 20 5.896 -1.331 -16.164 152 H GLY 21 H GLY 21 7.117 -4.024 -16.728 153 HA2 GLY 21 HA2 GLY 21 8.010 -3.924 -18.866 154 HA3 GLY 21 HA3 GLY 21 8.897 -2.482 -18.391 155 H LEU 22 H LEU 22 9.036 -5.558 -16.697 156 HA LEU 22 HA LEU 22 11.756 -5.972 -17.735 157 HB2 LEU 22 HB2 LEU 22 10.847 -6.099 -14.868 158 HB3 LEU 22 HB3 LEU 22 12.384 -6.749 -15.435 159 HG LEU 22 HG LEU 22 11.534 -3.855 -15.428 160 HD11 LEU 22 HD11 LEU 22 12.675 -5.447 -13.440 161 HD12 LEU 22 HD12 LEU 22 12.571 -3.687 -13.475 162 HD13 LEU 22 HD13 LEU 22 14.005 -4.498 -14.104 163 HD21 LEU 22 HD21 LEU 22 12.820 -4.013 -17.357 164 HD22 LEU 22 HD22 LEU 22 13.873 -5.252 -16.673 165 HD23 LEU 22 HD23 LEU 22 14.003 -3.581 -16.121 166 H GLU 23 H GLU 23 12.519 -8.159 -17.643 167 HA GLU 23 HA GLU 23 10.479 -10.202 -17.147 168 HB2 GLU 23 HB2 GLU 23 11.677 -9.501 -19.750 169 HB3 GLU 23 HB3 GLU 23 11.662 -11.219 -19.374 170 HG2 GLU 23 HG2 GLU 23 9.113 -10.178 -18.724 171 HG3 GLU 23 HG3 GLU 23 9.547 -9.584 -20.327 172 H CYS 24 H CYS 24 11.477 -12.449 -17.310 173 HA CYS 24 HA CYS 24 14.001 -12.396 -15.842 174 HB2 CYS 24 HB2 CYS 24 11.901 -13.689 -15.098 175 HB3 CYS 24 HB3 CYS 24 12.321 -14.839 -16.362 176 H TYR 25 H TYR 25 15.822 -12.601 -16.950 177 HA TYR 25 HA TYR 25 15.802 -13.964 -19.534 178 HB2 TYR 25 HB2 TYR 25 16.840 -11.713 -19.334 179 HB3 TYR 25 HB3 TYR 25 18.025 -12.388 -18.221 180 HD1 TYR 25 HD1 TYR 25 16.720 -12.778 -21.689 181 HD2 TYR 25 HD2 TYR 25 20.016 -13.269 -19.045 182 HE1 TYR 25 HE1 TYR 25 18.150 -13.390 -23.594 183 HE2 TYR 25 HE2 TYR 25 21.456 -13.882 -20.943 184 HH TYR 25 HH TYR 25 20.280 -13.727 -24.265 185 H LYS 26 H LYS 26 17.431 -15.530 -20.071 186 HA LYS 26 HA LYS 26 18.120 -17.216 -17.774 187 HB2 LYS 26 HB2 LYS 26 18.522 -18.969 -19.527 188 HB3 LYS 26 HB3 LYS 26 16.864 -18.387 -19.437 189 HG2 LYS 26 HG2 LYS 26 17.215 -16.988 -21.380 190 HG3 LYS 26 HG3 LYS 26 18.913 -17.469 -21.447 191 HD2 LYS 26 HD2 LYS 26 17.830 -18.802 -23.055 192 HD3 LYS 26 HD3 LYS 26 18.062 -19.859 -21.660 193 HE2 LYS 26 HE2 LYS 26 15.826 -20.125 -22.594 194 HE3 LYS 26 HE3 LYS 26 15.754 -19.452 -20.966 195 HZ1 LYS 26 HZ1 LYS 26 15.878 -17.450 -23.023 196 HZ2 LYS 26 HZ2 LYS 26 14.820 -17.586 -21.710 197 HZ3 LYS 26 HZ3 LYS 26 14.507 -18.434 -23.142 198 H ARG 27 H ARG 27 20.149 -17.382 -17.086 199 HA ARG 27 HA ARG 27 22.290 -16.315 -18.797 200 HB2 ARG 27 HB2 ARG 27 21.686 -15.498 -16.326 201 HB3 ARG 27 HB3 ARG 27 22.751 -16.833 -15.905 202 HG2 ARG 27 HG2 ARG 27 24.596 -15.762 -16.617 203 HG3 ARG 27 HG3 ARG 27 23.763 -15.007 -17.977 204 HD2 ARG 27 HD2 ARG 27 22.807 -13.340 -16.550 205 HD3 ARG 27 HD3 ARG 27 23.397 -14.165 -15.108 206 HE ARG 27 HE ARG 27 25.467 -13.230 -15.452 207 HH11 ARG 27 HH11 ARG 27 23.496 -12.778 -18.284 208 HH12 ARG 27 HH12 ARG 27 24.608 -11.688 -19.045 209 HH21 ARG 27 HH21 ARG 27 26.939 -11.797 -16.442 210 HH22 ARG 27 HH22 ARG 27 26.567 -11.131 -17.995 211 H ARG 28 H ARG 28 24.398 -17.379 -18.672 212 HA ARG 28 HA ARG 28 24.244 -20.117 -19.216 213 HB2 ARG 28 HB2 ARG 28 26.404 -18.132 -18.867 214 HB3 ARG 28 HB3 ARG 28 26.869 -19.809 -18.613 215 HG2 ARG 28 HG2 ARG 28 25.487 -20.035 -20.917 216 HG3 ARG 28 HG3 ARG 28 26.134 -18.402 -21.085 217 HD2 ARG 28 HD2 ARG 28 27.919 -19.497 -21.924 218 HD3 ARG 28 HD3 ARG 28 28.333 -19.679 -20.220 219 HE ARG 28 HE ARG 28 26.729 -21.838 -20.902 220 HH11 ARG 28 HH11 ARG 28 29.837 -20.540 -21.781 221 HH12 ARG 28 HH12 ARG 28 30.516 -22.085 -22.174 222 HH21 ARG 28 HH21 ARG 28 27.612 -23.877 -21.415 223 HH22 ARG 28 HH22 ARG 28 29.249 -23.982 -21.965 224 H HIS 29 H HIS 29 26.018 -18.660 -16.484 225 HA HIS 29 HA HIS 29 25.206 -20.974 -14.850 226 HB2 HIS 29 HB2 HIS 29 27.882 -19.573 -14.941 227 HB3 HIS 29 HB3 HIS 29 27.420 -20.704 -13.674 228 HD1 HIS 29 HD1 HIS 29 27.369 -23.204 -14.276 229 HD2 HIS 29 HD2 HIS 29 28.447 -20.734 -17.438 230 HE1 HIS 29 HE1 HIS 29 28.269 -24.740 -16.052 231 H SER 30 H SER 30 26.003 -17.551 -14.943 232 HA SER 30 HA SER 30 25.729 -16.923 -12.246 233 HB2 SER 30 HB2 SER 30 26.553 -15.150 -13.482 234 HB3 SER 30 HB3 SER 30 25.396 -15.389 -14.792 235 HG SER 30 HG SER 30 25.029 -14.125 -12.303 236 H PHE 31 H PHE 31 23.983 -15.988 -11.067 237 HA PHE 31 HA PHE 31 21.569 -17.395 -11.267 238 HB2 PHE 31 HB2 PHE 31 20.729 -15.661 -9.614 239 HB3 PHE 31 HB3 PHE 31 22.181 -16.536 -9.136 240 HD1 PHE 31 HD2 PHE 31 20.941 -13.334 -10.500 241 HD2 PHE 31 HD1 PHE 31 24.199 -15.407 -8.709 242 HE1 PHE 31 HE2 PHE 31 22.113 -11.196 -10.163 243 HE2 PHE 31 HE1 PHE 31 25.375 -13.274 -8.369 244 HZ PHE 31 HZ PHE 31 24.333 -11.164 -9.097 245 H GLU 32 H GLU 32 19.441 -16.652 -11.750 246 HA GLU 32 HA GLU 32 19.344 -15.025 -14.112 247 HB2 GLU 32 HB2 GLU 32 16.933 -15.982 -12.592 248 HB3 GLU 32 HB3 GLU 32 17.103 -15.701 -14.320 249 HG2 GLU 32 HG2 GLU 32 18.119 -17.992 -12.684 250 HG3 GLU 32 HG3 GLU 32 17.061 -18.020 -14.094 251 H VAL 33 H VAL 33 18.650 -12.968 -14.344 252 HA VAL 33 HA VAL 33 17.556 -11.593 -11.986 253 HB VAL 33 HB VAL 33 18.967 -9.720 -12.229 254 HG11 VAL 33 HG11 VAL 33 21.211 -10.630 -11.961 255 HG12 VAL 33 HG12 VAL 33 20.025 -11.632 -11.121 256 HG13 VAL 33 HG13 VAL 33 20.688 -12.158 -12.669 257 HG21 VAL 33 HG21 VAL 33 20.707 -9.682 -14.099 258 HG22 VAL 33 HG22 VAL 33 19.727 -10.927 -14.873 259 HG23 VAL 33 HG23 VAL 33 19.036 -9.338 -14.544 260 H CYS 34 H CYS 34 16.608 -9.431 -12.583 261 HA CYS 34 HA CYS 34 14.758 -9.786 -14.721 262 HB2 CYS 34 HB2 CYS 34 15.334 -7.387 -12.970 263 HB3 CYS 34 HB3 CYS 34 13.986 -7.497 -14.097 264 H VAL 35 H VAL 35 14.540 -8.610 -16.633 265 HA VAL 35 HA VAL 35 16.796 -6.913 -17.427 266 HB VAL 35 HB VAL 35 16.865 -8.004 -19.651 267 HG11 VAL 35 HG11 VAL 35 18.445 -8.584 -17.815 268 HG12 VAL 35 HG12 VAL 35 17.403 -9.949 -17.412 269 HG13 VAL 35 HG13 VAL 35 18.200 -9.880 -18.984 270 HG21 VAL 35 HG21 VAL 35 15.607 -9.808 -20.239 271 HG22 VAL 35 HG22 VAL 35 15.486 -10.406 -18.585 272 HG23 VAL 35 HG23 VAL 35 14.483 -9.053 -19.109 273 HA PRO 36 HA PRO 36 13.706 -4.304 -19.142 274 HB2 PRO 36 HB2 PRO 36 15.112 -3.115 -21.137 275 HB3 PRO 36 HB3 PRO 36 15.368 -2.744 -19.428 276 HG2 PRO 36 HG2 PRO 36 16.934 -4.550 -21.229 277 HG3 PRO 36 HG3 PRO 36 17.521 -3.381 -20.031 278 HD2 PRO 36 HD2 PRO 36 17.397 -6.040 -19.535 279 HD3 PRO 36 HD3 PRO 36 17.161 -4.820 -18.267 280 H ILE 37 H ILE 37 12.054 -4.632 -20.496 281 HA ILE 37 HA ILE 37 12.295 -6.617 -22.588 282 HB ILE 37 HB ILE 37 9.903 -5.006 -21.690 283 HG12 ILE 37 HG12 ILE 37 10.222 -7.941 -21.237 284 HG13 ILE 37 HG13 ILE 37 11.099 -6.833 -20.189 285 HG21 ILE 37 HG21 ILE 37 8.574 -6.606 -22.971 286 HG22 ILE 37 HG22 ILE 37 9.693 -5.725 -24.010 287 HG23 ILE 37 HG23 ILE 37 10.052 -7.385 -23.536 288 HD11 ILE 37 HD11 ILE 37 8.137 -7.116 -20.538 289 HD12 ILE 37 HD12 ILE 37 9.100 -7.307 -19.073 290 HD13 ILE 37 HD13 ILE 37 8.867 -5.706 -19.772 291 HA PRO 38 HA PRO 38 13.030 -3.670 -25.809 292 HB2 PRO 38 HB2 PRO 38 12.602 -5.345 -27.901 293 HB3 PRO 38 HB3 PRO 38 14.072 -5.390 -26.921 294 HG2 PRO 38 HG2 PRO 38 11.641 -7.132 -26.771 295 HG3 PRO 38 HG3 PRO 38 13.353 -7.587 -26.673 296 HD2 PRO 38 HD2 PRO 38 11.782 -7.341 -24.482 297 HD3 PRO 38 HD3 PRO 38 13.519 -6.971 -24.457 298 H GLY 39 H GLY 39 11.745 -2.202 -26.754 299 HA2 GLY 39 HA2 GLY 39 9.917 -1.271 -27.809 300 HA3 GLY 39 HA3 GLY 39 9.292 -2.895 -28.056 301 H PHE 40 H PHE 40 10.015 -2.505 -24.832 302 HA PHE 40 HA PHE 40 7.378 -2.721 -23.958 303 HB2 PHE 40 HB2 PHE 40 9.018 -3.416 -22.430 304 HB3 PHE 40 HB3 PHE 40 9.930 -1.918 -22.587 305 HD1 PHE 40 HD1 PHE 40 6.634 -3.189 -21.409 306 HD2 PHE 40 HD2 PHE 40 9.722 -0.295 -20.964 307 HE1 PHE 40 HE1 PHE 40 5.509 -2.302 -19.409 308 HE2 PHE 40 HE2 PHE 40 8.602 0.597 -18.963 309 HZ PHE 40 HZ PHE 40 6.493 -0.407 -18.183 310 H CYS 41 H CYS 41 5.912 -1.276 -23.075 311 HA CYS 41 HA CYS 41 6.491 1.534 -22.895 312 HB2 CYS 41 HB2 CYS 41 5.012 2.324 -24.598 313 HB3 CYS 41 HB3 CYS 41 6.089 1.154 -25.355 314 H LEU 42 H LEU 42 4.021 2.620 -22.853 315 HA LEU 42 HA LEU 42 2.517 0.988 -20.917 316 HB2 LEU 42 HB2 LEU 42 2.736 3.976 -20.740 317 HB3 LEU 42 HB3 LEU 42 2.160 2.843 -19.518 318 HG LEU 42 HG LEU 42 5.027 3.100 -20.425 319 HD11 LEU 42 HD11 LEU 42 5.185 4.841 -19.064 320 HD12 LEU 42 HD12 LEU 42 4.709 3.803 -17.720 321 HD13 LEU 42 HD13 LEU 42 3.484 4.695 -18.623 322 HD21 LEU 42 HD21 LEU 42 5.110 1.862 -18.042 323 HD22 LEU 42 HD22 LEU 42 5.055 1.005 -19.582 324 HD23 LEU 42 HD23 LEU 42 3.576 1.242 -18.650 325 H VAL 43 H VAL 43 0.269 2.077 -20.533 326 HA VAL 43 HA VAL 43 -0.838 2.775 -23.174 327 HB VAL 43 HB VAL 43 -2.976 1.770 -22.374 328 HG11 VAL 43 HG11 VAL 43 -1.968 -0.657 -22.355 329 HG12 VAL 43 HG12 VAL 43 -1.899 0.341 -23.808 330 HG13 VAL 43 HG13 VAL 43 -0.480 0.193 -22.770 331 HG21 VAL 43 HG21 VAL 43 -1.788 1.857 -19.896 332 HG22 VAL 43 HG22 VAL 43 -3.262 0.978 -20.302 333 HG23 VAL 43 HG23 VAL 43 -1.708 0.145 -20.314 334 H LYS 44 H LYS 44 -3.273 3.640 -22.648 335 HA LYS 44 HA LYS 44 -2.809 6.160 -21.316 336 HB2 LYS 44 HB2 LYS 44 -4.927 6.839 -22.216 337 HB3 LYS 44 HB3 LYS 44 -4.060 5.966 -23.472 338 HG2 LYS 44 HG2 LYS 44 -5.550 4.019 -22.155 339 HG3 LYS 44 HG3 LYS 44 -6.626 5.414 -22.285 340 HD2 LYS 44 HD2 LYS 44 -6.178 5.527 -24.692 341 HD3 LYS 44 HD3 LYS 44 -5.108 4.130 -24.557 342 HE2 LYS 44 HE2 LYS 44 -7.180 3.301 -25.336 343 HE3 LYS 44 HE3 LYS 44 -7.087 2.864 -23.630 344 HZ1 LYS 44 HZ1 LYS 44 -8.598 5.155 -24.766 345 HZ2 LYS 44 HZ2 LYS 44 -8.476 4.793 -23.118 346 HZ3 LYS 44 HZ3 LYS 44 -9.264 3.721 -24.165 347 H TRP 45 H TRP 45 -3.500 3.236 -20.140 348 HA TRP 45 HA TRP 45 -5.187 4.328 -17.985 349 HB2 TRP 45 HB2 TRP 45 -5.262 1.582 -19.241 350 HB3 TRP 45 HB3 TRP 45 -6.034 1.957 -17.702 351 HD1 TRP 45 HD1 TRP 45 -6.582 2.145 -21.399 352 HE1 TRP 45 HE1 TRP 45 -8.850 3.259 -21.890 353 HE3 TRP 45 HE3 TRP 45 -7.651 3.909 -16.720 354 HZ2 TRP 45 HZ2 TRP 45 -10.830 4.696 -20.481 355 HZ3 TRP 45 HZ3 TRP 45 -9.752 5.143 -16.377 356 HH2 TRP 45 HH2 TRP 45 -11.307 5.528 -18.220 357 H LYS 46 H LYS 46 -2.187 3.876 -18.454 358 HA LYS 46 HA LYS 46 -1.687 2.307 -16.011 359 HB2 LYS 46 HB2 LYS 46 -0.116 2.598 -18.549 360 HB3 LYS 46 HB3 LYS 46 0.704 2.184 -17.049 361 HG2 LYS 46 HG2 LYS 46 -1.663 0.559 -17.589 362 HG3 LYS 46 HG3 LYS 46 -0.386 0.402 -18.798 363 HD2 LYS 46 HD2 LYS 46 1.056 0.295 -16.503 364 HD3 LYS 46 HD3 LYS 46 -0.452 -0.463 -15.987 365 HE2 LYS 46 HE2 LYS 46 -0.278 -1.946 -18.006 366 HE3 LYS 46 HE3 LYS 46 1.334 -1.285 -18.270 367 HZ1 LYS 46 HZ1 LYS 46 0.392 -3.122 -16.206 368 HZ2 LYS 46 HZ2 LYS 46 1.580 -2.006 -15.756 369 HZ3 LYS 46 HZ3 LYS 46 1.873 -3.083 -17.027 370 H GLN 47 H GLN 47 -0.207 3.100 -14.500 371 HA GLN 47 HA GLN 47 -0.226 5.826 -14.006 372 HB2 GLN 47 HB2 GLN 47 1.150 3.485 -12.910 373 HB3 GLN 47 HB3 GLN 47 2.055 4.980 -12.719 374 HG2 GLN 47 HG2 GLN 47 0.511 5.904 -11.314 375 HG3 GLN 47 HG3 GLN 47 -0.822 4.966 -11.984 376 HE21 GLN 47 HE21 GLN 47 -1.134 4.842 -9.547 377 HE22 GLN 47 HE22 GLN 47 -0.433 3.473 -8.760 378 H CYS 48 H CYS 48 1.135 7.514 -14.414 379 HA CYS 48 HA CYS 48 3.183 7.036 -16.465 380 HB2 CYS 48 HB2 CYS 48 2.855 9.246 -17.215 381 HB3 CYS 48 HB3 CYS 48 1.235 8.657 -16.855 382 H ASP 49 H ASP 49 2.724 8.008 -13.207 383 HA ASP 49 HA ASP 49 4.855 9.676 -12.690 384 HB2 ASP 49 HB2 ASP 49 2.994 8.485 -11.145 385 HB3 ASP 49 HB3 ASP 49 4.398 7.516 -10.710 386 H GLY 50 H GLY 50 6.944 9.475 -13.127 387 HA2 GLY 50 HA2 GLY 50 9.070 8.506 -12.908 388 HA3 GLY 50 HA3 GLY 50 8.306 6.970 -12.527 389 H ARG 51 H ARG 51 6.530 7.070 -14.850 390 HA ARG 51 HA ARG 51 8.527 6.437 -16.921 391 HB2 ARG 51 HB2 ARG 51 5.748 5.307 -16.544 392 HB3 ARG 51 HB3 ARG 51 6.857 4.875 -17.839 393 HG2 ARG 51 HG2 ARG 51 7.353 4.427 -14.903 394 HG3 ARG 51 HG3 ARG 51 6.809 3.202 -16.051 395 HD2 ARG 51 HD2 ARG 51 9.034 2.772 -16.146 396 HD3 ARG 51 HD3 ARG 51 8.971 4.053 -17.356 397 HE ARG 51 HE ARG 51 9.420 5.087 -14.739 398 HH11 ARG 51 HH11 ARG 51 10.976 3.533 -17.437 399 HH12 ARG 51 HH12 ARG 51 12.543 4.174 -17.071 400 HH21 ARG 51 HH21 ARG 51 11.477 5.937 -14.246 401 HH22 ARG 51 HH22 ARG 51 12.827 5.541 -15.254 402 H GLU 52 H GLU 52 7.649 9.076 -16.587 403 HA GLU 52 HA GLU 52 5.480 9.745 -18.278 404 HB2 GLU 52 HB2 GLU 52 6.352 12.036 -18.165 405 HB3 GLU 52 HB3 GLU 52 6.308 11.286 -16.575 406 HG2 GLU 52 HG2 GLU 52 8.804 10.673 -17.200 407 HG3 GLU 52 HG3 GLU 52 8.628 12.091 -18.232 408 H ARG 53 H ARG 53 8.597 8.636 -18.956 409 HA ARG 53 HA ARG 53 8.349 9.541 -21.749 410 HB2 ARG 53 HB2 ARG 53 10.628 9.951 -21.919 411 HB3 ARG 53 HB3 ARG 53 10.268 10.523 -20.296 412 HG2 ARG 53 HG2 ARG 53 10.976 8.187 -19.521 413 HG3 ARG 53 HG3 ARG 53 11.678 8.018 -21.131 414 HD2 ARG 53 HD2 ARG 53 13.006 10.050 -20.746 415 HD3 ARG 53 HD3 ARG 53 12.321 10.178 -19.126 416 HE ARG 53 HE ARG 53 13.471 7.646 -19.384 417 HH11 ARG 53 HH11 ARG 53 14.441 10.990 -19.300 418 HH12 ARG 53 HH12 ARG 53 16.002 10.655 -18.629 419 HH21 ARG 53 HH21 ARG 53 15.525 7.193 -18.500 420 HH22 ARG 53 HH22 ARG 53 16.619 8.496 -18.175 421 H ASP 54 H ASP 54 7.620 7.026 -20.151 422 HA ASP 54 HA ASP 54 9.117 5.081 -21.777 423 HB2 ASP 54 HB2 ASP 54 8.788 5.078 -19.074 424 HB3 ASP 54 HB3 ASP 54 7.436 4.067 -19.576 425 H CYS 55 H CYS 55 6.018 6.440 -21.146 426 HA CYS 55 HA CYS 55 4.259 4.475 -21.939 427 HB2 CYS 55 HB2 CYS 55 4.072 7.411 -22.648 428 HB3 CYS 55 HB3 CYS 55 2.734 6.267 -22.581 429 H CYS 56 H CYS 56 3.036 4.350 -24.022 430 HA CYS 56 HA CYS 56 4.809 3.746 -26.142 431 HB2 CYS 56 HB2 CYS 56 1.894 3.635 -25.681 432 HB3 CYS 56 HB3 CYS 56 2.384 3.795 -27.364 433 H ALA 57 H ALA 57 4.022 4.579 -28.465 434 HA ALA 57 HA ALA 57 4.811 7.317 -28.568 435 HB1 ALA 57 HB1 ALA 57 5.515 6.496 -30.518 436 HB2 ALA 57 HB2 ALA 57 4.374 5.151 -30.459 437 HB3 ALA 57 HB3 ALA 57 3.858 6.719 -31.081 438 H GLY 58 H GLY 58 3.584 9.080 -28.462 439 HA2 GLY 58 HA2 GLY 58 1.702 10.379 -29.167 440 HA3 GLY 58 HA3 GLY 58 0.763 8.896 -29.271 441 H LEU 59 H LEU 59 2.043 8.144 -26.581 442 HA LEU 59 HA LEU 59 -0.085 9.250 -24.978 443 HB2 LEU 59 HB2 LEU 59 2.084 7.238 -24.500 444 HB3 LEU 59 HB3 LEU 59 1.106 7.854 -23.170 445 HG LEU 59 HG LEU 59 0.085 6.343 -25.575 446 HD11 LEU 59 HD11 LEU 59 0.644 5.571 -22.733 447 HD12 LEU 59 HD12 LEU 59 1.147 4.770 -24.220 448 HD13 LEU 59 HD13 LEU 59 -0.540 4.702 -23.709 449 HD21 LEU 59 HD21 LEU 59 -1.993 6.288 -24.007 450 HD22 LEU 59 HD22 LEU 59 -1.698 7.699 -25.022 451 HD23 LEU 59 HD23 LEU 59 -1.274 7.740 -23.310 452 H GLU 60 H GLU 60 0.536 9.924 -22.653 453 HA GLU 60 HA GLU 60 3.040 11.263 -22.305 454 HB2 GLU 60 HB2 GLU 60 2.276 13.533 -22.286 455 HB3 GLU 60 HB3 GLU 60 1.817 12.825 -23.828 456 HG2 GLU 60 HG2 GLU 60 -0.429 12.333 -22.542 457 HG3 GLU 60 HG3 GLU 60 0.118 13.684 -21.551 458 H CYS 61 H CYS 61 3.222 12.287 -20.203 459 HA CYS 61 HA CYS 61 1.914 10.802 -18.174 460 HB2 CYS 61 HB2 CYS 61 4.253 11.938 -18.161 461 HB3 CYS 61 HB3 CYS 61 3.373 13.374 -17.648 462 H TRP 62 H TRP 62 -0.272 11.096 -18.136 463 HA TRP 62 HA TRP 62 -1.442 13.728 -18.189 464 HB2 TRP 62 HB2 TRP 62 -2.453 11.495 -19.060 465 HB3 TRP 62 HB3 TRP 62 -2.919 11.240 -17.381 466 HD1 TRP 62 HD1 TRP 62 -3.122 14.841 -18.121 467 HE1 TRP 62 HE1 TRP 62 -5.557 15.543 -18.572 468 HE3 TRP 62 HE3 TRP 62 -5.212 10.210 -18.674 469 HZ2 TRP 62 HZ2 TRP 62 -8.035 14.297 -19.093 470 HZ3 TRP 62 HZ3 TRP 62 -7.621 10.051 -19.146 471 HH2 TRP 62 HH2 TRP 62 -9.002 12.055 -19.350 472 H LYS 63 H LYS 63 -2.039 14.962 -16.508 473 HA LYS 63 HA LYS 63 -1.499 13.929 -13.816 474 HB2 LYS 63 HB2 LYS 63 -0.542 16.165 -14.910 475 HB3 LYS 63 HB3 LYS 63 -2.058 16.814 -14.299 476 HG2 LYS 63 HG2 LYS 63 -0.320 15.213 -12.482 477 HG3 LYS 63 HG3 LYS 63 0.101 16.889 -12.840 478 HD2 LYS 63 HD2 LYS 63 -2.635 16.074 -11.893 479 HD3 LYS 63 HD3 LYS 63 -1.330 16.491 -10.780 480 HE2 LYS 63 HE2 LYS 63 -1.132 18.659 -12.129 481 HE3 LYS 63 HE3 LYS 63 -2.703 18.233 -12.805 482 HZ1 LYS 63 HZ1 LYS 63 -2.043 18.770 -9.966 483 HZ2 LYS 63 HZ2 LYS 63 -3.506 18.075 -10.454 484 HZ3 LYS 63 HZ3 LYS 63 -3.099 19.636 -10.966 485 H ARG 64 H ARG 64 -3.346 12.929 -13.172 486 HA ARG 64 HA ARG 64 -5.803 14.558 -13.169 487 HB2 ARG 64 HB2 ARG 64 -5.323 11.781 -13.960 488 HB3 ARG 64 HB3 ARG 64 -6.649 11.958 -12.818 489 HG2 ARG 64 HG2 ARG 64 -7.915 13.222 -14.278 490 HG3 ARG 64 HG3 ARG 64 -6.511 13.718 -15.225 491 HD2 ARG 64 HD2 ARG 64 -7.144 12.137 -16.673 492 HD3 ARG 64 HD3 ARG 64 -6.483 10.993 -15.506 493 HE ARG 64 HE ARG 64 -8.615 10.327 -15.000 494 HH11 ARG 64 HH11 ARG 64 -8.738 13.324 -16.768 495 HH12 ARG 64 HH12 ARG 64 -10.459 13.292 -16.959 496 HH21 ARG 64 HH21 ARG 64 -10.883 10.273 -15.246 497 HH22 ARG 64 HH22 ARG 64 -11.678 11.556 -16.094 498 H SER 65 H SER 65 -6.701 14.985 -11.251 499 HA SER 65 HA SER 65 -5.901 13.370 -8.927 500 HB2 SER 65 HB2 SER 65 -5.354 15.224 -7.630 501 HB3 SER 65 HB3 SER 65 -4.729 15.694 -9.212 502 HG SER 65 HG SER 65 -5.954 17.379 -8.956 503 H GLY 66 H GLY 66 -7.499 12.891 -7.508 504 HA2 GLY 66 HA2 GLY 66 -9.574 13.511 -6.392 505 HA3 GLY 66 HA3 GLY 66 -10.108 14.213 -7.912 506 H ASN 67 H ASN 67 -8.903 11.790 -9.307 507 HA ASN 67 HA ASN 67 -11.159 9.976 -8.761 508 HB2 ASN 67 HB2 ASN 67 -11.066 11.139 -11.018 509 HB3 ASN 67 HB3 ASN 67 -9.632 10.176 -11.359 510 HD21 ASN 67 HD21 ASN 67 -11.336 9.698 -13.137 511 HD22 ASN 67 HD22 ASN 67 -12.278 8.274 -12.874 512 H LYS 68 H LYS 68 -7.777 10.024 -9.865 513 HA LYS 68 HA LYS 68 -7.121 7.775 -8.211 514 HB2 LYS 68 HB2 LYS 68 -7.903 7.319 -10.950 515 HB3 LYS 68 HB3 LYS 68 -6.220 6.866 -10.717 516 HG2 LYS 68 HG2 LYS 68 -7.238 5.676 -8.574 517 HG3 LYS 68 HG3 LYS 68 -8.684 5.676 -9.585 518 HD2 LYS 68 HD2 LYS 68 -6.181 4.823 -10.898 519 HD3 LYS 68 HD3 LYS 68 -6.813 3.740 -9.655 520 HE2 LYS 68 HE2 LYS 68 -8.884 4.713 -11.448 521 HE3 LYS 68 HE3 LYS 68 -7.608 3.847 -12.301 522 HZ1 LYS 68 HZ1 LYS 68 -8.941 2.119 -11.723 523 HZ2 LYS 68 HZ2 LYS 68 -9.515 2.862 -10.315 524 HZ3 LYS 68 HZ3 LYS 68 -7.974 2.165 -10.335 525 H SER 69 H SER 69 -4.769 6.981 -8.998 526 HA SER 69 HA SER 69 -3.060 9.168 -8.550 527 HB2 SER 69 HB2 SER 69 -2.709 6.288 -9.200 528 HB3 SER 69 HB3 SER 69 -1.331 7.346 -9.498 529 HG SER 69 HG SER 69 -1.884 8.107 -7.224 530 H SER 70 H SER 70 -1.033 9.386 -10.103 531 HA SER 70 HA SER 70 -1.998 10.661 -12.447 532 HB2 SER 70 HB2 SER 70 0.240 11.322 -12.835 533 HB3 SER 70 HB3 SER 70 0.094 11.247 -11.079 534 HG SER 70 HG SER 70 1.279 9.337 -12.805 535 H VAL 71 H VAL 71 -2.488 9.783 -14.336 536 HA VAL 71 HA VAL 71 -1.206 7.233 -15.080 537 HB VAL 71 HB VAL 71 -3.289 6.847 -16.477 538 HG11 VAL 71 HG11 VAL 71 -4.587 6.593 -14.040 539 HG12 VAL 71 HG12 VAL 71 -3.540 5.396 -14.805 540 HG13 VAL 71 HG13 VAL 71 -2.874 6.529 -13.630 541 HG21 VAL 71 HG21 VAL 71 -3.884 9.439 -15.672 542 HG22 VAL 71 HG22 VAL 71 -4.963 8.318 -16.502 543 HG23 VAL 71 HG23 VAL 71 -4.984 8.421 -14.741 544 H CYS 72 H CYS 72 -1.593 6.890 -17.592 545 HA CYS 72 HA CYS 72 -0.492 9.287 -18.885 546 HB2 CYS 72 HB2 CYS 72 0.094 6.449 -19.053 547 HB3 CYS 72 HB3 CYS 72 -0.220 7.134 -20.645 548 H ALA 73 H ALA 73 -1.177 9.834 -21.033 549 HA ALA 73 HA ALA 73 -3.676 8.664 -21.972 550 HB1 ALA 73 HB1 ALA 73 -3.801 11.581 -22.002 551 HB2 ALA 73 HB2 ALA 73 -5.026 10.396 -21.548 552 HB3 ALA 73 HB3 ALA 73 -3.799 10.888 -20.380 553 HA PRO 74 HA PRO 74 -2.002 9.432 -25.956 554 HB2 PRO 74 HB2 PRO 74 -4.248 9.872 -27.417 555 HB3 PRO 74 HB3 PRO 74 -3.795 8.276 -26.809 556 HG2 PRO 74 HG2 PRO 74 -5.760 10.239 -25.694 557 HG3 PRO 74 HG3 PRO 74 -5.912 8.481 -25.869 558 HD2 PRO 74 HD2 PRO 74 -5.286 9.661 -23.514 559 HD3 PRO 74 HD3 PRO 74 -4.675 8.058 -23.971 560 H ILE 75 H ILE 75 -2.147 11.017 -27.852 561 HA ILE 75 HA ILE 75 -1.515 13.587 -26.982 562 HB ILE 75 HB ILE 75 -1.836 14.250 -29.406 563 HG12 ILE 75 HG12 ILE 75 -2.192 11.305 -29.907 564 HG13 ILE 75 HG13 ILE 75 -3.583 12.367 -29.714 565 HG21 ILE 75 HG21 ILE 75 0.155 13.174 -30.103 566 HG22 ILE 75 HG22 ILE 75 0.280 13.368 -28.355 567 HG23 ILE 75 HG23 ILE 75 -0.134 11.798 -29.040 568 HD11 ILE 75 HD11 ILE 75 -3.347 12.384 -31.979 569 HD12 ILE 75 HD12 ILE 75 -2.350 13.775 -31.552 570 HD13 ILE 75 HD13 ILE 75 -1.592 12.225 -31.911 571 H THR 76 H THR 76 -2.594 15.589 -27.209 572 HA THR 76 HA THR 76 -5.480 15.510 -27.676 573 HB THR 76 HB THR 76 -5.846 16.937 -25.629 574 HG1 THR 76 HG1 THR 76 -4.166 16.620 -23.988 575 HG21 THR 76 HG21 THR 76 -4.827 14.141 -25.111 576 HG22 THR 76 HG22 THR 76 -6.437 14.541 -25.710 577 HG23 THR 76 HG23 THR 76 -5.943 15.053 -24.096 Start of MODEL 13 1 H1 SER 1 H SER 1 6.858 1.389 1.478 2 HA SER 1 HA SER 1 4.320 0.303 0.466 3 HB2 SER 1 HB2 SER 1 5.036 1.345 -1.713 4 HB3 SER 1 HB3 SER 1 4.752 2.499 -0.411 5 HG SER 1 HG SER 1 6.829 2.959 -0.340 6 H ASN 2 H ASN 2 4.276 -1.421 -0.924 7 HA ASN 2 HA ASN 2 6.496 -3.218 -0.811 8 HB2 ASN 2 HB2 ASN 2 3.884 -3.366 -2.333 9 HB3 ASN 2 HB3 ASN 2 5.052 -4.680 -2.229 10 HD21 ASN 2 HD21 ASN 2 2.738 -2.755 -0.481 11 HD22 ASN 2 HD22 ASN 2 2.587 -3.811 0.877 12 H GLU 3 H GLU 3 8.265 -2.730 -1.964 13 HA GLU 3 HA GLU 3 8.057 -1.521 -4.587 14 HB2 GLU 3 HB2 GLU 3 10.264 -2.122 -2.680 15 HB3 GLU 3 HB3 GLU 3 10.672 -1.972 -4.384 16 HG2 GLU 3 HG2 GLU 3 9.109 0.130 -2.924 17 HG3 GLU 3 HG3 GLU 3 10.871 0.111 -2.950 18 H CYS 4 H CYS 4 9.723 -2.490 -6.252 19 HA CYS 4 HA CYS 4 9.066 -5.349 -6.506 20 HB2 CYS 4 HB2 CYS 4 9.335 -5.020 -8.943 21 HB3 CYS 4 HB3 CYS 4 8.073 -3.995 -8.266 22 H ILE 5 H ILE 5 10.702 -6.497 -8.026 23 HA ILE 5 HA ILE 5 13.246 -6.387 -6.728 24 HB ILE 5 HB ILE 5 12.368 -7.978 -9.140 25 HG12 ILE 5 HG12 ILE 5 12.837 -9.164 -6.442 26 HG13 ILE 5 HG13 ILE 5 11.347 -8.263 -6.703 27 HG21 ILE 5 HG21 ILE 5 14.453 -9.299 -7.859 28 HG22 ILE 5 HG22 ILE 5 14.524 -8.454 -9.405 29 HG23 ILE 5 HG23 ILE 5 14.959 -7.611 -7.920 30 HD11 ILE 5 HD11 ILE 5 10.736 -9.734 -8.514 31 HD12 ILE 5 HD12 ILE 5 12.268 -10.596 -8.363 32 HD13 ILE 5 HD13 ILE 5 11.081 -10.672 -7.062 33 H ARG 6 H ARG 6 14.844 -5.047 -7.211 34 HA ARG 6 HA ARG 6 14.882 -3.232 -9.298 35 HB2 ARG 6 HB2 ARG 6 17.155 -4.405 -7.696 36 HB3 ARG 6 HB3 ARG 6 17.362 -3.078 -8.830 37 HG2 ARG 6 HG2 ARG 6 17.089 -1.877 -6.931 38 HG3 ARG 6 HG3 ARG 6 15.393 -2.042 -7.388 39 HD2 ARG 6 HD2 ARG 6 14.955 -3.572 -5.739 40 HD3 ARG 6 HD3 ARG 6 16.616 -4.160 -5.695 41 HE ARG 6 HE ARG 6 16.559 -1.503 -4.788 42 HH11 ARG 6 HH11 ARG 6 15.547 -4.692 -3.822 43 HH12 ARG 6 HH12 ARG 6 15.655 -4.354 -2.126 44 HH21 ARG 6 HH21 ARG 6 16.704 -1.047 -2.558 45 HH22 ARG 6 HH22 ARG 6 16.312 -2.281 -1.408 46 H LYS 7 H LYS 7 16.162 -3.094 -11.213 47 HA LYS 7 HA LYS 7 16.102 -5.462 -12.783 48 HB2 LYS 7 HB2 LYS 7 15.748 -3.213 -13.730 49 HB3 LYS 7 HB3 LYS 7 17.420 -2.803 -13.367 50 HG2 LYS 7 HG2 LYS 7 18.031 -4.802 -14.846 51 HG3 LYS 7 HG3 LYS 7 16.358 -4.725 -15.406 52 HD2 LYS 7 HD2 LYS 7 18.288 -2.407 -15.478 53 HD3 LYS 7 HD3 LYS 7 17.969 -3.479 -16.843 54 HE2 LYS 7 HE2 LYS 7 15.722 -2.766 -17.000 55 HE3 LYS 7 HE3 LYS 7 15.784 -1.976 -15.425 56 HZ1 LYS 7 HZ1 LYS 7 17.695 -0.649 -16.676 57 HZ2 LYS 7 HZ2 LYS 7 16.075 -0.167 -16.720 58 HZ3 LYS 7 HZ3 LYS 7 16.734 -1.037 -18.013 59 H TRP 8 H TRP 8 17.748 -6.753 -13.530 60 HA TRP 8 HA TRP 8 19.712 -7.896 -13.440 61 HB2 TRP 8 HB2 TRP 8 20.688 -5.056 -13.187 62 HB3 TRP 8 HB3 TRP 8 21.799 -6.421 -13.251 63 HD1 TRP 8 HD1 TRP 8 20.247 -3.987 -15.461 64 HE1 TRP 8 HE1 TRP 8 20.332 -4.757 -17.915 65 HE3 TRP 8 HE3 TRP 8 21.446 -8.904 -14.730 66 HZ2 TRP 8 HZ2 TRP 8 20.840 -7.133 -19.352 67 HZ3 TRP 8 HZ3 TRP 8 21.713 -10.358 -16.698 68 HH2 TRP 8 HH2 TRP 8 21.416 -9.488 -18.959 69 H LEU 9 H LEU 9 18.393 -8.204 -11.160 70 HA LEU 9 HA LEU 9 20.463 -7.948 -9.080 71 HB2 LEU 9 HB2 LEU 9 18.569 -6.490 -8.605 72 HB3 LEU 9 HB3 LEU 9 17.468 -7.860 -8.743 73 HG LEU 9 HG LEU 9 18.429 -8.860 -6.744 74 HD11 LEU 9 HD11 LEU 9 19.955 -7.161 -5.423 75 HD12 LEU 9 HD12 LEU 9 20.381 -6.641 -7.053 76 HD13 LEU 9 HD13 LEU 9 20.636 -8.317 -6.567 77 HD21 LEU 9 HD21 LEU 9 17.618 -7.258 -5.116 78 HD22 LEU 9 HD22 LEU 9 16.563 -7.271 -6.530 79 HD23 LEU 9 HD23 LEU 9 17.721 -5.959 -6.306 80 H SER 10 H SER 10 17.382 -9.711 -9.341 81 HA SER 10 HA SER 10 18.502 -12.259 -9.719 82 HB2 SER 10 HB2 SER 10 17.831 -13.043 -7.290 83 HB3 SER 10 HB3 SER 10 19.430 -12.371 -7.603 84 HG SER 10 HG SER 10 17.196 -11.129 -6.402 85 H CYS 11 H CYS 11 16.881 -13.114 -10.830 86 HA CYS 11 HA CYS 11 14.142 -12.382 -10.337 87 HB2 CYS 11 HB2 CYS 11 14.961 -12.759 -12.625 88 HB3 CYS 11 HB3 CYS 11 15.310 -14.438 -12.224 89 H VAL 12 H VAL 12 16.260 -14.777 -9.189 90 HA VAL 12 HA VAL 12 14.710 -17.015 -8.809 91 HB VAL 12 HB VAL 12 16.028 -17.346 -6.663 92 HG11 VAL 12 HG11 VAL 12 18.225 -16.911 -8.391 93 HG12 VAL 12 HG12 VAL 12 17.370 -18.420 -8.068 94 HG13 VAL 12 HG13 VAL 12 16.849 -17.376 -9.391 95 HG21 VAL 12 HG21 VAL 12 17.323 -15.737 -5.797 96 HG22 VAL 12 HG22 VAL 12 17.899 -15.216 -7.381 97 HG23 VAL 12 HG23 VAL 12 16.351 -14.632 -6.771 98 H ASP 13 H ASP 13 14.530 -13.945 -7.167 99 HA ASP 13 HA ASP 13 12.981 -14.781 -4.949 100 HB2 ASP 13 HB2 ASP 13 13.535 -12.139 -6.255 101 HB3 ASP 13 HB3 ASP 13 12.297 -12.256 -5.008 102 H ARG 14 H ARG 14 11.819 -12.628 -7.529 103 HA ARG 14 HA ARG 14 9.417 -14.284 -7.798 104 HB2 ARG 14 HB2 ARG 14 9.197 -11.292 -7.561 105 HB3 ARG 14 HB3 ARG 14 7.917 -12.495 -7.465 106 HG2 ARG 14 HG2 ARG 14 8.766 -13.263 -5.324 107 HG3 ARG 14 HG3 ARG 14 10.098 -12.109 -5.425 108 HD2 ARG 14 HD2 ARG 14 8.764 -10.319 -4.958 109 HD3 ARG 14 HD3 ARG 14 7.339 -11.052 -5.694 110 HE ARG 14 HE ARG 14 6.792 -11.947 -3.659 111 HH11 ARG 14 HH11 ARG 14 10.105 -10.881 -3.585 112 HH12 ARG 14 HH12 ARG 14 10.287 -11.142 -1.882 113 HH21 ARG 14 HH21 ARG 14 7.020 -12.294 -1.417 114 HH22 ARG 14 HH22 ARG 14 8.532 -11.946 -0.650 115 H LYS 15 H LYS 15 9.013 -14.669 -9.866 116 HA LYS 15 HA LYS 15 10.393 -13.171 -11.920 117 HB2 LYS 15 HB2 LYS 15 8.381 -15.319 -12.486 118 HB3 LYS 15 HB3 LYS 15 9.835 -14.898 -13.381 119 HG2 LYS 15 HG2 LYS 15 11.092 -15.709 -11.281 120 HG3 LYS 15 HG3 LYS 15 9.565 -16.490 -10.864 121 HD2 LYS 15 HD2 LYS 15 9.739 -18.019 -12.531 122 HD3 LYS 15 HD3 LYS 15 10.542 -16.891 -13.627 123 HE2 LYS 15 HE2 LYS 15 12.078 -18.647 -13.006 124 HE3 LYS 15 HE3 LYS 15 12.608 -17.122 -12.295 125 HZ1 LYS 15 HZ1 LYS 15 10.862 -18.707 -10.620 126 HZ2 LYS 15 HZ2 LYS 15 12.286 -17.883 -10.227 127 HZ3 LYS 15 HZ3 LYS 15 12.365 -19.415 -10.937 128 H ASN 16 H ASN 16 6.989 -14.021 -11.264 129 HA ASN 16 HA ASN 16 5.915 -12.300 -13.228 130 HB2 ASN 16 HB2 ASN 16 3.780 -12.572 -11.836 131 HB3 ASN 16 HB3 ASN 16 4.502 -14.039 -12.489 132 HD21 ASN 16 HD21 ASN 16 5.340 -15.553 -11.123 133 HD22 ASN 16 HD22 ASN 16 5.172 -15.479 -9.405 134 H ASP 17 H ASP 17 7.299 -11.662 -10.203 135 HA ASP 17 HA ASP 17 6.052 -8.992 -10.133 136 HB2 ASP 17 HB2 ASP 17 6.924 -10.843 -7.948 137 HB3 ASP 17 HB3 ASP 17 6.969 -9.105 -7.669 138 H CYS 18 H CYS 18 8.308 -9.732 -11.762 139 HA CYS 18 HA CYS 18 10.788 -9.094 -10.675 140 HB2 CYS 18 HB2 CYS 18 9.611 -9.139 -13.391 141 HB3 CYS 18 HB3 CYS 18 11.062 -8.159 -13.199 142 H CYS 19 H CYS 19 8.956 -6.886 -12.789 143 HA CYS 19 HA CYS 19 8.840 -4.711 -11.059 144 HB2 CYS 19 HB2 CYS 19 11.474 -5.167 -11.898 145 HB3 CYS 19 HB3 CYS 19 10.908 -3.819 -12.880 146 H GLU 20 H GLU 20 9.057 -2.539 -12.632 147 HA GLU 20 HA GLU 20 6.962 -3.003 -14.587 148 HB2 GLU 20 HB2 GLU 20 6.717 -1.119 -13.068 149 HB3 GLU 20 HB3 GLU 20 8.253 -0.453 -13.606 150 HG2 GLU 20 HG2 GLU 20 6.186 -0.932 -15.669 151 HG3 GLU 20 HG3 GLU 20 5.918 0.393 -14.537 152 H GLY 21 H GLY 21 7.504 -3.574 -16.585 153 HA2 GLY 21 HA2 GLY 21 8.411 -3.283 -18.706 154 HA3 GLY 21 HA3 GLY 21 9.411 -1.986 -18.069 155 H LEU 22 H LEU 22 9.260 -5.234 -16.734 156 HA LEU 22 HA LEU 22 11.969 -5.739 -17.766 157 HB2 LEU 22 HB2 LEU 22 10.927 -6.136 -14.974 158 HB3 LEU 22 HB3 LEU 22 12.390 -6.919 -15.568 159 HG LEU 22 HG LEU 22 11.920 -3.966 -15.185 160 HD11 LEU 22 HD11 LEU 22 12.792 -5.926 -13.429 161 HD12 LEU 22 HD12 LEU 22 12.996 -4.184 -13.252 162 HD13 LEU 22 HD13 LEU 22 14.273 -5.151 -13.991 163 HD21 LEU 22 HD21 LEU 22 14.297 -3.747 -15.921 164 HD22 LEU 22 HD22 LEU 22 13.174 -4.197 -17.205 165 HD23 LEU 22 HD23 LEU 22 14.221 -5.418 -16.479 166 H GLU 23 H GLU 23 12.577 -8.104 -17.527 167 HA GLU 23 HA GLU 23 10.291 -9.916 -17.661 168 HB2 GLU 23 HB2 GLU 23 11.834 -9.035 -19.959 169 HB3 GLU 23 HB3 GLU 23 11.917 -10.779 -19.756 170 HG2 GLU 23 HG2 GLU 23 9.256 -10.287 -19.397 171 HG3 GLU 23 HG3 GLU 23 9.699 -9.091 -20.613 172 H CYS 24 H CYS 24 10.711 -11.895 -16.847 173 HA CYS 24 HA CYS 24 13.130 -12.317 -15.423 174 HB2 CYS 24 HB2 CYS 24 10.913 -13.215 -14.726 175 HB3 CYS 24 HB3 CYS 24 10.974 -14.332 -16.086 176 H TYR 25 H TYR 25 14.959 -12.555 -16.574 177 HA TYR 25 HA TYR 25 14.967 -14.335 -18.897 178 HB2 TYR 25 HB2 TYR 25 15.978 -12.131 -19.204 179 HB3 TYR 25 HB3 TYR 25 17.080 -12.431 -17.865 180 HD1 TYR 25 HD1 TYR 25 16.274 -13.285 -21.346 181 HD2 TYR 25 HD2 TYR 25 19.014 -13.845 -18.139 182 HE1 TYR 25 HE1 TYR 25 17.897 -14.266 -22.912 183 HE2 TYR 25 HE2 TYR 25 20.645 -14.826 -19.696 184 HH TYR 25 HH TYR 25 19.901 -15.941 -22.675 185 H LYS 26 H LYS 26 16.522 -16.006 -19.117 186 HA LYS 26 HA LYS 26 17.431 -17.087 -16.535 187 HB2 LYS 26 HB2 LYS 26 17.507 -19.283 -17.838 188 HB3 LYS 26 HB3 LYS 26 15.917 -18.627 -17.474 189 HG2 LYS 26 HG2 LYS 26 15.456 -18.154 -19.651 190 HG3 LYS 26 HG3 LYS 26 17.151 -17.890 -20.069 191 HD2 LYS 26 HD2 LYS 26 16.582 -19.890 -21.152 192 HD3 LYS 26 HD3 LYS 26 17.445 -20.405 -19.701 193 HE2 LYS 26 HE2 LYS 26 14.455 -20.158 -19.739 194 HE3 LYS 26 HE3 LYS 26 15.262 -21.615 -20.317 195 HZ1 LYS 26 HZ1 LYS 26 16.439 -21.569 -18.069 196 HZ2 LYS 26 HZ2 LYS 26 14.819 -22.052 -18.095 197 HZ3 LYS 26 HZ3 LYS 26 15.227 -20.491 -17.588 198 H ARG 27 H ARG 27 19.504 -16.550 -16.235 199 HA ARG 27 HA ARG 27 21.372 -15.953 -18.218 200 HB2 ARG 27 HB2 ARG 27 21.492 -16.593 -15.320 201 HB3 ARG 27 HB3 ARG 27 22.994 -16.725 -16.225 202 HG2 ARG 27 HG2 ARG 27 21.457 -14.261 -16.687 203 HG3 ARG 27 HG3 ARG 27 22.117 -14.460 -15.062 204 HD2 ARG 27 HD2 ARG 27 24.303 -14.460 -15.808 205 HD3 ARG 27 HD3 ARG 27 23.855 -14.966 -17.436 206 HE ARG 27 HE ARG 27 23.986 -12.277 -16.431 207 HH11 ARG 27 HH11 ARG 27 22.562 -14.375 -18.817 208 HH12 ARG 27 HH12 ARG 27 22.246 -13.095 -19.942 209 HH21 ARG 27 HH21 ARG 27 23.574 -10.584 -17.903 210 HH22 ARG 27 HH22 ARG 27 22.823 -10.940 -19.421 211 H ARG 28 H ARG 28 23.602 -17.285 -18.127 212 HA ARG 28 HA ARG 28 23.029 -19.729 -19.490 213 HB2 ARG 28 HB2 ARG 28 25.453 -18.134 -18.863 214 HB3 ARG 28 HB3 ARG 28 25.693 -19.846 -19.184 215 HG2 ARG 28 HG2 ARG 28 24.082 -19.174 -21.247 216 HG3 ARG 28 HG3 ARG 28 24.963 -17.665 -21.006 217 HD2 ARG 28 HD2 ARG 28 26.447 -18.676 -22.388 218 HD3 ARG 28 HD3 ARG 28 27.010 -19.375 -20.870 219 HE ARG 28 HE ARG 28 25.156 -21.151 -21.693 220 HH11 ARG 28 HH11 ARG 28 27.892 -19.682 -23.266 221 HH12 ARG 28 HH12 ARG 28 28.193 -21.040 -24.298 222 HH21 ARG 28 HH21 ARG 28 25.543 -22.946 -23.047 223 HH22 ARG 28 HH22 ARG 28 26.856 -22.895 -24.172 224 H HIS 29 H HIS 29 25.415 -19.340 -16.891 225 HA HIS 29 HA HIS 29 24.265 -21.705 -15.567 226 HB2 HIS 29 HB2 HIS 29 27.103 -21.175 -16.368 227 HB3 HIS 29 HB3 HIS 29 26.774 -22.147 -14.937 228 HD1 HIS 29 HD1 HIS 29 26.819 -22.280 -18.617 229 HD2 HIS 29 HD2 HIS 29 25.399 -24.606 -15.481 230 HE1 HIS 29 HE1 HIS 29 26.318 -24.530 -19.623 231 H SER 30 H SER 30 24.024 -18.799 -15.056 232 HA SER 30 HA SER 30 25.337 -18.632 -12.428 233 HB2 SER 30 HB2 SER 30 24.512 -16.588 -14.439 234 HB3 SER 30 HB3 SER 30 24.474 -16.135 -12.735 235 HG SER 30 HG SER 30 26.524 -15.890 -14.092 236 H PHE 31 H PHE 31 22.454 -16.980 -13.646 237 HA PHE 31 HA PHE 31 20.525 -18.473 -12.285 238 HB2 PHE 31 HB2 PHE 31 20.045 -16.802 -10.428 239 HB3 PHE 31 HB3 PHE 31 21.461 -17.824 -10.205 240 HD1 PHE 31 HD1 PHE 31 23.696 -16.901 -10.325 241 HD2 PHE 31 HD2 PHE 31 20.264 -14.435 -10.833 242 HE1 PHE 31 HE1 PHE 31 25.091 -14.898 -10.006 243 HE2 PHE 31 HE2 PHE 31 21.653 -12.429 -10.516 244 HZ PHE 31 HZ PHE 31 24.070 -12.659 -10.100 245 H GLU 32 H GLU 32 18.444 -17.691 -12.624 246 HA GLU 32 HA GLU 32 18.115 -15.927 -14.800 247 HB2 GLU 32 HB2 GLU 32 15.686 -16.115 -14.294 248 HB3 GLU 32 HB3 GLU 32 16.499 -17.668 -14.412 249 HG2 GLU 32 HG2 GLU 32 16.701 -17.121 -11.746 250 HG3 GLU 32 HG3 GLU 32 15.130 -16.430 -12.154 251 H VAL 33 H VAL 33 17.517 -13.812 -14.928 252 HA VAL 33 HA VAL 33 16.870 -12.337 -12.501 253 HB VAL 33 HB VAL 33 19.186 -11.506 -14.253 254 HG11 VAL 33 HG11 VAL 33 17.738 -10.233 -11.979 255 HG12 VAL 33 HG12 VAL 33 19.467 -9.938 -12.173 256 HG13 VAL 33 HG13 VAL 33 18.348 -9.514 -13.469 257 HG21 VAL 33 HG21 VAL 33 20.486 -11.883 -12.096 258 HG22 VAL 33 HG22 VAL 33 19.090 -12.811 -11.547 259 HG23 VAL 33 HG23 VAL 33 19.977 -13.321 -12.982 260 H CYS 34 H CYS 34 15.898 -10.304 -12.887 261 HA CYS 34 HA CYS 34 14.311 -10.192 -15.230 262 HB2 CYS 34 HB2 CYS 34 14.780 -7.926 -13.292 263 HB3 CYS 34 HB3 CYS 34 13.372 -8.191 -14.314 264 H VAL 35 H VAL 35 14.437 -8.916 -17.032 265 HA VAL 35 HA VAL 35 16.795 -7.180 -17.305 266 HB VAL 35 HB VAL 35 16.937 -7.960 -19.711 267 HG11 VAL 35 HG11 VAL 35 17.819 -9.329 -17.285 268 HG12 VAL 35 HG12 VAL 35 17.836 -10.349 -18.724 269 HG13 VAL 35 HG13 VAL 35 18.738 -8.834 -18.706 270 HG21 VAL 35 HG21 VAL 35 14.694 -9.047 -19.712 271 HG22 VAL 35 HG22 VAL 35 15.992 -10.083 -20.305 272 HG23 VAL 35 HG23 VAL 35 15.358 -10.310 -18.676 273 HA PRO 36 HA PRO 36 14.061 -4.185 -18.988 274 HB2 PRO 36 HB2 PRO 36 15.691 -2.913 -20.747 275 HB3 PRO 36 HB3 PRO 36 15.844 -2.736 -18.994 276 HG2 PRO 36 HG2 PRO 36 17.413 -4.466 -20.868 277 HG3 PRO 36 HG3 PRO 36 17.987 -3.473 -19.516 278 HD2 PRO 36 HD2 PRO 36 17.643 -6.151 -19.313 279 HD3 PRO 36 HD3 PRO 36 17.397 -5.050 -17.942 280 H ILE 37 H ILE 37 12.439 -4.530 -20.358 281 HA ILE 37 HA ILE 37 12.737 -6.201 -22.671 282 HB ILE 37 HB ILE 37 10.371 -4.570 -21.741 283 HG12 ILE 37 HG12 ILE 37 10.481 -7.544 -21.596 284 HG13 ILE 37 HG13 ILE 37 11.410 -6.634 -20.410 285 HG21 ILE 37 HG21 ILE 37 10.851 -5.913 -24.210 286 HG22 ILE 37 HG22 ILE 37 9.586 -6.769 -23.329 287 HG23 ILE 37 HG23 ILE 37 9.406 -5.050 -23.680 288 HD11 ILE 37 HD11 ILE 37 9.024 -7.349 -19.818 289 HD12 ILE 37 HD12 ILE 37 9.509 -5.688 -19.473 290 HD13 ILE 37 HD13 ILE 37 8.518 -6.041 -20.887 291 HA PRO 38 HA PRO 38 13.861 -2.906 -25.434 292 HB2 PRO 38 HB2 PRO 38 13.794 -4.391 -27.705 293 HB3 PRO 38 HB3 PRO 38 15.119 -4.477 -26.539 294 HG2 PRO 38 HG2 PRO 38 12.774 -6.307 -26.880 295 HG3 PRO 38 HG3 PRO 38 14.475 -6.711 -26.588 296 HD2 PRO 38 HD2 PRO 38 12.617 -6.724 -24.620 297 HD3 PRO 38 HD3 PRO 38 14.316 -6.302 -24.326 298 H GLY 39 H GLY 39 12.508 -1.373 -26.114 299 HA2 GLY 39 HA2 GLY 39 10.838 -0.413 -27.421 300 HA3 GLY 39 HA3 GLY 39 10.327 -2.024 -27.903 301 H PHE 40 H PHE 40 10.672 -1.727 -24.554 302 HA PHE 40 HA PHE 40 7.957 -2.219 -24.037 303 HB2 PHE 40 HB2 PHE 40 9.446 -2.936 -22.370 304 HB3 PHE 40 HB3 PHE 40 10.272 -1.383 -22.311 305 HD1 PHE 40 HD1 PHE 40 7.117 -3.109 -21.447 306 HD2 PHE 40 HD2 PHE 40 9.602 0.287 -20.809 307 HE1 PHE 40 HE1 PHE 40 5.707 -2.440 -19.544 308 HE2 PHE 40 HE2 PHE 40 8.199 0.961 -18.904 309 HZ PHE 40 HZ PHE 40 6.249 -0.403 -18.269 310 H CYS 41 H CYS 41 6.306 -0.928 -23.250 311 HA CYS 41 HA CYS 41 6.734 1.932 -22.968 312 HB2 CYS 41 HB2 CYS 41 5.113 2.584 -24.621 313 HB3 CYS 41 HB3 CYS 41 6.299 1.544 -25.403 314 H LEU 42 H LEU 42 4.170 2.821 -22.894 315 HA LEU 42 HA LEU 42 2.852 1.114 -20.889 316 HB2 LEU 42 HB2 LEU 42 2.901 4.115 -20.757 317 HB3 LEU 42 HB3 LEU 42 2.369 2.979 -19.518 318 HG LEU 42 HG LEU 42 5.227 3.314 -20.424 319 HD11 LEU 42 HD11 LEU 42 5.019 4.141 -17.798 320 HD12 LEU 42 HD12 LEU 42 3.603 4.847 -18.575 321 HD13 LEU 42 HD13 LEU 42 5.214 5.179 -19.211 322 HD21 LEU 42 HD21 LEU 42 5.061 1.164 -19.557 323 HD22 LEU 42 HD22 LEU 42 3.867 1.635 -18.348 324 HD23 LEU 42 HD23 LEU 42 5.552 2.124 -18.161 325 H VAL 43 H VAL 43 0.540 2.007 -20.460 326 HA VAL 43 HA VAL 43 -0.689 2.576 -23.078 327 HB VAL 43 HB VAL 43 -2.732 1.473 -22.173 328 HG11 VAL 43 HG11 VAL 43 -0.240 -0.225 -22.245 329 HG12 VAL 43 HG12 VAL 43 -1.892 -0.821 -22.414 330 HG13 VAL 43 HG13 VAL 43 -1.213 0.259 -23.633 331 HG21 VAL 43 HG21 VAL 43 -1.473 1.721 -19.740 332 HG22 VAL 43 HG22 VAL 43 -2.906 0.746 -20.066 333 HG23 VAL 43 HG23 VAL 43 -1.306 0.003 -20.102 334 H LYS 44 H LYS 44 -3.154 3.310 -22.503 335 HA LYS 44 HA LYS 44 -2.806 5.898 -21.264 336 HB2 LYS 44 HB2 LYS 44 -5.007 6.405 -22.111 337 HB3 LYS 44 HB3 LYS 44 -4.087 5.601 -23.375 338 HG2 LYS 44 HG2 LYS 44 -5.406 3.557 -22.001 339 HG3 LYS 44 HG3 LYS 44 -6.588 4.855 -22.177 340 HD2 LYS 44 HD2 LYS 44 -6.533 4.770 -24.484 341 HD3 LYS 44 HD3 LYS 44 -4.918 4.059 -24.523 342 HE2 LYS 44 HE2 LYS 44 -6.864 2.365 -23.178 343 HE3 LYS 44 HE3 LYS 44 -7.308 2.714 -24.848 344 HZ1 LYS 44 HZ1 LYS 44 -5.975 0.938 -25.197 345 HZ2 LYS 44 HZ2 LYS 44 -5.046 1.196 -23.806 346 HZ3 LYS 44 HZ3 LYS 44 -4.768 2.124 -25.193 347 H TRP 45 H TRP 45 -3.279 2.985 -19.974 348 HA TRP 45 HA TRP 45 -4.989 4.040 -17.818 349 HB2 TRP 45 HB2 TRP 45 -4.940 1.287 -19.046 350 HB3 TRP 45 HB3 TRP 45 -5.608 1.579 -17.443 351 HD1 TRP 45 HD1 TRP 45 -6.370 2.038 -21.127 352 HE1 TRP 45 HE1 TRP 45 -8.790 2.877 -21.390 353 HE3 TRP 45 HE3 TRP 45 -7.425 3.022 -16.223 354 HZ2 TRP 45 HZ2 TRP 45 -10.869 3.832 -19.737 355 HZ3 TRP 45 HZ3 TRP 45 -9.651 3.897 -15.647 356 HH2 TRP 45 HH2 TRP 45 -11.336 4.293 -17.370 357 H LYS 46 H LYS 46 -1.963 3.697 -18.387 358 HA LYS 46 HA LYS 46 -1.312 2.270 -15.893 359 HB2 LYS 46 HB2 LYS 46 0.164 2.572 -18.484 360 HB3 LYS 46 HB3 LYS 46 1.060 2.287 -16.998 361 HG2 LYS 46 HG2 LYS 46 -1.198 0.471 -17.406 362 HG3 LYS 46 HG3 LYS 46 0.072 0.349 -18.626 363 HD2 LYS 46 HD2 LYS 46 1.597 0.414 -16.430 364 HD3 LYS 46 HD3 LYS 46 0.137 -0.296 -15.735 365 HE2 LYS 46 HE2 LYS 46 0.226 -1.901 -17.749 366 HE3 LYS 46 HE3 LYS 46 1.892 -1.352 -17.927 367 HZ1 LYS 46 HZ1 LYS 46 2.404 -2.137 -15.750 368 HZ2 LYS 46 HZ2 LYS 46 1.641 -3.397 -16.581 369 HZ3 LYS 46 HZ3 LYS 46 0.786 -2.505 -15.426 370 H GLN 47 H GLN 47 0.179 3.196 -14.458 371 HA GLN 47 HA GLN 47 -0.016 5.929 -14.033 372 HB2 GLN 47 HB2 GLN 47 1.566 3.720 -12.926 373 HB3 GLN 47 HB3 GLN 47 2.340 5.292 -12.782 374 HG2 GLN 47 HG2 GLN 47 0.761 6.099 -11.349 375 HG3 GLN 47 HG3 GLN 47 -0.509 5.056 -11.986 376 HE21 GLN 47 HE21 GLN 47 -0.644 5.050 -9.467 377 HE22 GLN 47 HE22 GLN 47 0.124 3.701 -8.711 378 H CYS 48 H CYS 48 1.273 7.686 -14.462 379 HA CYS 48 HA CYS 48 3.264 7.290 -16.590 380 HB2 CYS 48 HB2 CYS 48 2.785 9.463 -17.367 381 HB3 CYS 48 HB3 CYS 48 1.214 8.786 -16.948 382 H ASP 49 H ASP 49 2.848 8.305 -13.338 383 HA ASP 49 HA ASP 49 4.895 10.099 -12.921 384 HB2 ASP 49 HB2 ASP 49 4.958 9.305 -10.611 385 HB3 ASP 49 HB3 ASP 49 3.295 9.413 -11.180 386 H GLY 50 H GLY 50 6.982 10.008 -13.405 387 HA2 GLY 50 HA2 GLY 50 9.163 9.158 -13.218 388 HA3 GLY 50 HA3 GLY 50 8.492 7.584 -12.812 389 H ARG 51 H ARG 51 6.662 7.576 -15.097 390 HA ARG 51 HA ARG 51 8.645 7.034 -17.206 391 HB2 ARG 51 HB2 ARG 51 5.950 5.754 -16.720 392 HB3 ARG 51 HB3 ARG 51 6.997 5.401 -18.087 393 HG2 ARG 51 HG2 ARG 51 7.979 5.066 -15.281 394 HG3 ARG 51 HG3 ARG 51 7.015 3.814 -16.065 395 HD2 ARG 51 HD2 ARG 51 8.629 3.534 -17.788 396 HD3 ARG 51 HD3 ARG 51 9.509 4.977 -17.283 397 HE ARG 51 HE ARG 51 9.700 2.340 -16.150 398 HH11 ARG 51 HH11 ARG 51 10.169 5.744 -15.594 399 HH12 ARG 51 HH12 ARG 51 11.345 5.512 -14.343 400 HH21 ARG 51 HH21 ARG 51 11.247 2.020 -14.504 401 HH22 ARG 51 HH22 ARG 51 11.958 3.393 -13.724 402 H GLU 52 H GLU 52 7.592 9.625 -16.835 403 HA GLU 52 HA GLU 52 5.367 10.186 -18.465 404 HB2 GLU 52 HB2 GLU 52 6.080 12.495 -18.375 405 HB3 GLU 52 HB3 GLU 52 6.304 11.757 -16.795 406 HG2 GLU 52 HG2 GLU 52 8.733 11.331 -17.708 407 HG3 GLU 52 HG3 GLU 52 8.326 12.685 -18.761 408 H ARG 53 H ARG 53 8.537 9.252 -19.251 409 HA ARG 53 HA ARG 53 8.085 10.015 -22.060 410 HB2 ARG 53 HB2 ARG 53 10.752 9.874 -20.641 411 HB3 ARG 53 HB3 ARG 53 10.502 10.280 -22.334 412 HG2 ARG 53 HG2 ARG 53 9.019 12.189 -21.392 413 HG3 ARG 53 HG3 ARG 53 9.906 11.892 -19.895 414 HD2 ARG 53 HD2 ARG 53 11.105 12.568 -22.579 415 HD3 ARG 53 HD3 ARG 53 10.965 13.655 -21.198 416 HE ARG 53 HE ARG 53 12.417 11.241 -20.629 417 HH11 ARG 53 HH11 ARG 53 12.632 14.492 -21.856 418 HH12 ARG 53 HH12 ARG 53 14.321 14.653 -21.503 419 HH21 ARG 53 HH21 ARG 53 14.640 11.441 -20.159 420 HH22 ARG 53 HH22 ARG 53 15.462 12.917 -20.538 421 H ASP 54 H ASP 54 7.477 7.539 -20.528 422 HA ASP 54 HA ASP 54 9.140 5.658 -22.071 423 HB2 ASP 54 HB2 ASP 54 8.807 5.732 -19.332 424 HB3 ASP 54 HB3 ASP 54 7.651 4.503 -19.835 425 H CYS 55 H CYS 55 5.959 6.767 -21.340 426 HA CYS 55 HA CYS 55 4.347 4.643 -22.024 427 HB2 CYS 55 HB2 CYS 55 3.878 7.533 -22.782 428 HB3 CYS 55 HB3 CYS 55 2.649 6.281 -22.638 429 H CYS 56 H CYS 56 3.035 4.409 -24.062 430 HA CYS 56 HA CYS 56 4.767 3.874 -26.235 431 HB2 CYS 56 HB2 CYS 56 1.876 3.602 -25.673 432 HB3 CYS 56 HB3 CYS 56 2.310 3.738 -27.373 433 H ALA 57 H ALA 57 3.852 4.611 -28.542 434 HA ALA 57 HA ALA 57 4.459 7.391 -28.719 435 HB1 ALA 57 HB1 ALA 57 5.171 6.516 -30.653 436 HB2 ALA 57 HB2 ALA 57 4.031 5.172 -30.577 437 HB3 ALA 57 HB3 ALA 57 3.506 6.740 -31.190 438 H GLY 58 H GLY 58 3.133 9.091 -28.686 439 HA2 GLY 58 HA2 GLY 58 1.148 10.247 -29.319 440 HA3 GLY 58 HA3 GLY 58 0.302 8.707 -29.364 441 H LEU 59 H LEU 59 1.734 8.117 -26.698 442 HA LEU 59 HA LEU 59 -0.417 9.112 -25.050 443 HB2 LEU 59 HB2 LEU 59 1.882 7.241 -24.621 444 HB3 LEU 59 HB3 LEU 59 0.941 7.839 -23.255 445 HG LEU 59 HG LEU 59 -0.125 6.221 -25.570 446 HD11 LEU 59 HD11 LEU 59 1.129 4.761 -24.229 447 HD12 LEU 59 HD12 LEU 59 -0.535 4.566 -23.682 448 HD13 LEU 59 HD13 LEU 59 0.596 5.534 -22.737 449 HD21 LEU 59 HD21 LEU 59 -1.929 7.523 -24.920 450 HD22 LEU 59 HD22 LEU 59 -1.430 7.555 -23.229 451 HD23 LEU 59 HD23 LEU 59 -2.114 6.083 -23.918 452 H GLU 60 H GLU 60 0.232 9.877 -22.762 453 HA GLU 60 HA GLU 60 2.656 11.380 -22.524 454 HB2 GLU 60 HB2 GLU 60 1.731 13.599 -22.508 455 HB3 GLU 60 HB3 GLU 60 1.309 12.835 -24.034 456 HG2 GLU 60 HG2 GLU 60 -0.880 12.200 -22.701 457 HG3 GLU 60 HG3 GLU 60 -0.422 13.615 -21.755 458 H CYS 61 H CYS 61 2.855 12.437 -20.449 459 HA CYS 61 HA CYS 61 1.709 10.924 -18.349 460 HB2 CYS 61 HB2 CYS 61 3.966 12.220 -18.443 461 HB3 CYS 61 HB3 CYS 61 3.006 13.599 -17.917 462 H TRP 62 H TRP 62 -0.505 11.086 -18.312 463 HA TRP 62 HA TRP 62 -1.847 13.622 -18.363 464 HB2 TRP 62 HB2 TRP 62 -2.730 11.299 -19.128 465 HB3 TRP 62 HB3 TRP 62 -3.117 11.067 -17.426 466 HD1 TRP 62 HD1 TRP 62 -3.600 14.620 -18.249 467 HE1 TRP 62 HE1 TRP 62 -6.092 15.137 -18.632 468 HE3 TRP 62 HE3 TRP 62 -5.375 9.840 -18.617 469 HZ2 TRP 62 HZ2 TRP 62 -8.493 13.709 -19.035 470 HZ3 TRP 62 HZ3 TRP 62 -7.781 9.501 -19.001 471 HH2 TRP 62 HH2 TRP 62 -9.306 11.397 -19.205 472 H LYS 63 H LYS 63 -2.448 14.875 -16.702 473 HA LYS 63 HA LYS 63 -1.756 13.965 -13.999 474 HB2 LYS 63 HB2 LYS 63 -0.942 16.200 -15.165 475 HB3 LYS 63 HB3 LYS 63 -2.497 16.796 -14.598 476 HG2 LYS 63 HG2 LYS 63 -0.697 15.384 -12.688 477 HG3 LYS 63 HG3 LYS 63 -0.354 17.058 -13.134 478 HD2 LYS 63 HD2 LYS 63 -3.090 16.228 -12.230 479 HD3 LYS 63 HD3 LYS 63 -1.823 16.607 -11.061 480 HE2 LYS 63 HE2 LYS 63 -2.607 18.476 -13.286 481 HE3 LYS 63 HE3 LYS 63 -3.376 18.506 -11.700 482 HZ1 LYS 63 HZ1 LYS 63 -1.609 19.491 -10.778 483 HZ2 LYS 63 HZ2 LYS 63 -1.183 19.908 -12.361 484 HZ3 LYS 63 HZ3 LYS 63 -0.491 18.548 -11.629 485 H ARG 64 H ARG 64 -3.513 12.879 -13.254 486 HA ARG 64 HA ARG 64 -6.064 14.357 -13.212 487 HB2 ARG 64 HB2 ARG 64 -5.444 11.567 -13.894 488 HB3 ARG 64 HB3 ARG 64 -6.780 11.752 -12.767 489 HG2 ARG 64 HG2 ARG 64 -8.075 12.920 -14.294 490 HG3 ARG 64 HG3 ARG 64 -6.683 13.363 -15.284 491 HD2 ARG 64 HD2 ARG 64 -7.350 11.680 -16.607 492 HD3 ARG 64 HD3 ARG 64 -6.594 10.644 -15.397 493 HE ARG 64 HE ARG 64 -8.669 9.899 -14.805 494 HH11 ARG 64 HH11 ARG 64 -9.008 12.876 -16.578 495 HH12 ARG 64 HH12 ARG 64 -10.737 12.789 -16.650 496 HH21 ARG 64 HH21 ARG 64 -10.945 9.773 -14.893 497 HH22 ARG 64 HH22 ARG 64 -11.838 11.023 -15.690 498 H SER 65 H SER 65 -6.915 14.794 -11.275 499 HA SER 65 HA SER 65 -5.943 13.298 -8.937 500 HB2 SER 65 HB2 SER 65 -6.001 15.496 -7.673 501 HB3 SER 65 HB3 SER 65 -4.706 15.341 -8.860 502 HG SER 65 HG SER 65 -5.516 16.973 -9.894 503 H GLY 66 H GLY 66 -7.470 12.735 -7.482 504 HA2 GLY 66 HA2 GLY 66 -9.531 13.258 -6.294 505 HA3 GLY 66 HA3 GLY 66 -10.153 13.929 -7.795 506 H ASN 67 H ASN 67 -8.873 11.554 -9.220 507 HA ASN 67 HA ASN 67 -11.023 9.639 -8.596 508 HB2 ASN 67 HB2 ASN 67 -11.121 10.757 -10.844 509 HB3 ASN 67 HB3 ASN 67 -9.594 9.972 -11.241 510 HD21 ASN 67 HD21 ASN 67 -12.049 9.654 -12.622 511 HD22 ASN 67 HD22 ASN 67 -12.513 7.996 -12.486 512 H LYS 68 H LYS 68 -7.688 9.838 -9.819 513 HA LYS 68 HA LYS 68 -6.881 7.620 -8.183 514 HB2 LYS 68 HB2 LYS 68 -7.354 7.284 -11.107 515 HB3 LYS 68 HB3 LYS 68 -5.949 6.493 -10.405 516 HG2 LYS 68 HG2 LYS 68 -7.629 5.579 -8.664 517 HG3 LYS 68 HG3 LYS 68 -8.848 6.015 -9.864 518 HD2 LYS 68 HD2 LYS 68 -8.382 3.814 -10.412 519 HD3 LYS 68 HD3 LYS 68 -7.325 4.704 -11.510 520 HE2 LYS 68 HE2 LYS 68 -5.922 3.067 -10.651 521 HE3 LYS 68 HE3 LYS 68 -5.564 4.465 -9.638 522 HZ1 LYS 68 HZ1 LYS 68 -7.624 2.547 -8.788 523 HZ2 LYS 68 HZ2 LYS 68 -6.650 3.558 -7.846 524 HZ3 LYS 68 HZ3 LYS 68 -5.992 2.171 -8.555 525 H SER 69 H SER 69 -4.511 6.957 -8.987 526 HA SER 69 HA SER 69 -2.914 9.243 -8.596 527 HB2 SER 69 HB2 SER 69 -2.414 6.372 -9.191 528 HB3 SER 69 HB3 SER 69 -1.095 7.499 -9.505 529 HG SER 69 HG SER 69 -1.290 8.201 -7.334 530 H SER 70 H SER 70 -0.913 9.527 -10.172 531 HA SER 70 HA SER 70 -1.955 10.704 -12.531 532 HB2 SER 70 HB2 SER 70 0.840 10.415 -12.832 533 HB3 SER 70 HB3 SER 70 -0.042 11.845 -12.299 534 HG SER 70 HG SER 70 0.967 9.752 -10.669 535 H VAL 71 H VAL 71 -2.484 9.732 -14.361 536 HA VAL 71 HA VAL 71 -1.080 7.245 -15.097 537 HB VAL 71 HB VAL 71 -3.167 6.674 -16.389 538 HG11 VAL 71 HG11 VAL 71 -2.477 5.930 -13.980 539 HG12 VAL 71 HG12 VAL 71 -3.871 6.898 -13.498 540 HG13 VAL 71 HG13 VAL 71 -4.078 5.540 -14.605 541 HG21 VAL 71 HG21 VAL 71 -3.891 9.283 -15.641 542 HG22 VAL 71 HG22 VAL 71 -4.865 8.103 -16.519 543 HG23 VAL 71 HG23 VAL 71 -4.969 8.199 -14.761 544 H CYS 72 H CYS 72 -1.537 6.821 -17.586 545 HA CYS 72 HA CYS 72 -0.633 9.250 -18.971 546 HB2 CYS 72 HB2 CYS 72 0.158 6.464 -19.075 547 HB3 CYS 72 HB3 CYS 72 -0.266 7.062 -20.676 548 H ALA 73 H ALA 73 -1.427 9.703 -21.097 549 HA ALA 73 HA ALA 73 -3.852 8.325 -21.941 550 HB1 ALA 73 HB1 ALA 73 -4.078 10.591 -20.396 551 HB2 ALA 73 HB2 ALA 73 -4.237 11.207 -22.042 552 HB3 ALA 73 HB3 ALA 73 -5.318 9.937 -21.466 553 HA PRO 74 HA PRO 74 -2.367 9.146 -25.988 554 HB2 PRO 74 HB2 PRO 74 -4.682 9.404 -27.383 555 HB3 PRO 74 HB3 PRO 74 -4.098 7.853 -26.768 556 HG2 PRO 74 HG2 PRO 74 -6.162 9.692 -25.619 557 HG3 PRO 74 HG3 PRO 74 -6.195 7.925 -25.765 558 HD2 PRO 74 HD2 PRO 74 -5.583 9.185 -23.447 559 HD3 PRO 74 HD3 PRO 74 -4.874 7.621 -23.900 560 H ILE 75 H ILE 75 -2.701 10.684 -27.907 561 HA ILE 75 HA ILE 75 -2.209 13.304 -27.104 562 HB ILE 75 HB ILE 75 -2.689 13.905 -29.519 563 HG12 ILE 75 HG12 ILE 75 -2.875 10.931 -29.948 564 HG13 ILE 75 HG13 ILE 75 -4.319 11.915 -29.728 565 HG21 ILE 75 HG21 ILE 75 -0.646 13.044 -30.255 566 HG22 ILE 75 HG22 ILE 75 -0.479 13.107 -28.502 567 HG23 ILE 75 HG23 ILE 75 -0.817 11.572 -29.300 568 HD11 ILE 75 HD11 ILE 75 -2.396 11.847 -31.991 569 HD12 ILE 75 HD12 ILE 75 -4.160 11.877 -32.003 570 HD13 ILE 75 HD13 ILE 75 -3.254 13.347 -31.642 571 H THR 76 H THR 76 -3.428 15.229 -27.317 572 HA THR 76 HA THR 76 -6.322 14.948 -27.635 573 HB THR 76 HB THR 76 -6.536 16.529 -25.581 574 HG1 THR 76 HG1 THR 76 -3.993 15.319 -25.167 575 HG21 THR 76 HG21 THR 76 -6.830 13.802 -25.937 576 HG22 THR 76 HG22 THR 76 -7.417 14.740 -24.563 577 HG23 THR 76 HG23 THR 76 -5.856 13.926 -24.473 Start of MODEL 14 1 H1 SER 1 H SER 1 2.078 -0.802 1.649 2 HA SER 1 HA SER 1 3.210 0.066 -0.898 3 HB2 SER 1 HB2 SER 1 3.636 0.895 1.965 4 HB3 SER 1 HB3 SER 1 4.764 1.379 0.698 5 HG SER 1 HG SER 1 2.854 2.794 1.242 6 H ASN 2 H ASN 2 4.357 -1.579 -1.772 7 HA ASN 2 HA ASN 2 6.706 -2.478 -0.275 8 HB2 ASN 2 HB2 ASN 2 4.789 -4.322 -1.719 9 HB3 ASN 2 HB3 ASN 2 6.357 -4.805 -1.078 10 HD21 ASN 2 HD21 ASN 2 6.665 -4.842 1.176 11 HD22 ASN 2 HD22 ASN 2 5.323 -4.948 2.259 12 H GLU 3 H GLU 3 8.379 -1.836 -1.454 13 HA GLU 3 HA GLU 3 8.333 -1.061 -4.116 14 HB2 GLU 3 HB2 GLU 3 10.543 -1.927 -2.280 15 HB3 GLU 3 HB3 GLU 3 10.883 -1.559 -3.965 16 HG2 GLU 3 HG2 GLU 3 10.292 0.683 -3.723 17 HG3 GLU 3 HG3 GLU 3 9.427 0.385 -2.216 18 H CYS 4 H CYS 4 9.612 -2.072 -5.917 19 HA CYS 4 HA CYS 4 8.878 -4.905 -6.113 20 HB2 CYS 4 HB2 CYS 4 9.048 -4.603 -8.537 21 HB3 CYS 4 HB3 CYS 4 7.962 -3.409 -7.835 22 H ILE 5 H ILE 5 10.400 -6.142 -7.692 23 HA ILE 5 HA ILE 5 12.937 -6.310 -6.428 24 HB ILE 5 HB ILE 5 12.082 -7.577 -9.033 25 HG12 ILE 5 HG12 ILE 5 11.955 -8.741 -6.244 26 HG13 ILE 5 HG13 ILE 5 10.570 -8.059 -7.089 27 HG21 ILE 5 HG21 ILE 5 14.303 -8.025 -9.036 28 HG22 ILE 5 HG22 ILE 5 14.457 -7.822 -7.292 29 HG23 ILE 5 HG23 ILE 5 13.797 -9.320 -7.950 30 HD11 ILE 5 HD11 ILE 5 11.551 -10.689 -7.191 31 HD12 ILE 5 HD12 ILE 5 10.210 -9.989 -8.097 32 HD13 ILE 5 HD13 ILE 5 11.837 -9.973 -8.777 33 H ARG 6 H ARG 6 14.566 -4.952 -6.734 34 HA ARG 6 HA ARG 6 14.780 -3.012 -8.685 35 HB2 ARG 6 HB2 ARG 6 16.858 -4.391 -7.001 36 HB3 ARG 6 HB3 ARG 6 17.293 -3.118 -8.135 37 HG2 ARG 6 HG2 ARG 6 16.960 -1.751 -6.402 38 HG3 ARG 6 HG3 ARG 6 15.248 -1.953 -6.776 39 HD2 ARG 6 HD2 ARG 6 15.221 -2.483 -4.556 40 HD3 ARG 6 HD3 ARG 6 15.524 -4.081 -5.239 41 HE ARG 6 HE ARG 6 17.998 -2.922 -4.784 42 HH11 ARG 6 HH11 ARG 6 15.232 -3.910 -2.917 43 HH12 ARG 6 HH12 ARG 6 16.156 -4.264 -1.493 44 HH21 ARG 6 HH21 ARG 6 19.226 -3.384 -2.918 45 HH22 ARG 6 HH22 ARG 6 18.427 -3.963 -1.495 46 H LYS 7 H LYS 7 16.044 -2.806 -10.574 47 HA LYS 7 HA LYS 7 15.988 -5.078 -12.276 48 HB2 LYS 7 HB2 LYS 7 15.738 -2.654 -12.973 49 HB3 LYS 7 HB3 LYS 7 17.479 -2.500 -12.774 50 HG2 LYS 7 HG2 LYS 7 17.922 -3.977 -14.545 51 HG3 LYS 7 HG3 LYS 7 16.258 -4.566 -14.576 52 HD2 LYS 7 HD2 LYS 7 16.509 -3.102 -16.432 53 HD3 LYS 7 HD3 LYS 7 15.558 -2.237 -15.222 54 HE2 LYS 7 HE2 LYS 7 17.581 -1.064 -14.485 55 HE3 LYS 7 HE3 LYS 7 18.519 -1.922 -15.706 56 HZ1 LYS 7 HZ1 LYS 7 17.509 0.468 -16.126 57 HZ2 LYS 7 HZ2 LYS 7 16.176 -0.446 -16.623 58 HZ3 LYS 7 HZ3 LYS 7 17.677 -0.665 -17.371 59 H TRP 8 H TRP 8 17.668 -6.280 -13.154 60 HA TRP 8 HA TRP 8 19.602 -7.479 -13.070 61 HB2 TRP 8 HB2 TRP 8 20.596 -4.668 -12.642 62 HB3 TRP 8 HB3 TRP 8 21.701 -6.035 -12.748 63 HD1 TRP 8 HD1 TRP 8 20.066 -3.523 -14.868 64 HE1 TRP 8 HE1 TRP 8 20.262 -4.152 -17.357 65 HE3 TRP 8 HE3 TRP 8 21.575 -8.382 -14.361 66 HZ2 TRP 8 HZ2 TRP 8 20.963 -6.409 -18.899 67 HZ3 TRP 8 HZ3 TRP 8 21.986 -9.707 -16.392 68 HH2 TRP 8 HH2 TRP 8 21.686 -8.739 -18.614 69 H LEU 9 H LEU 9 18.203 -7.817 -10.799 70 HA LEU 9 HA LEU 9 20.277 -7.792 -8.705 71 HB2 LEU 9 HB2 LEU 9 18.211 -6.282 -8.407 72 HB3 LEU 9 HB3 LEU 9 17.338 -7.785 -8.111 73 HG LEU 9 HG LEU 9 19.290 -8.114 -6.334 74 HD11 LEU 9 HD11 LEU 9 19.936 -5.621 -7.240 75 HD12 LEU 9 HD12 LEU 9 20.392 -6.285 -5.672 76 HD13 LEU 9 HD13 LEU 9 18.967 -5.257 -5.811 77 HD21 LEU 9 HD21 LEU 9 17.394 -8.182 -5.172 78 HD22 LEU 9 HD22 LEU 9 16.589 -7.081 -6.291 79 HD23 LEU 9 HD23 LEU 9 17.552 -6.438 -4.959 80 H SER 10 H SER 10 17.140 -9.371 -9.347 81 HA SER 10 HA SER 10 18.185 -11.960 -9.648 82 HB2 SER 10 HB2 SER 10 17.451 -12.950 -7.483 83 HB3 SER 10 HB3 SER 10 18.790 -11.817 -7.300 84 HG SER 10 HG SER 10 16.298 -11.717 -6.247 85 H CYS 11 H CYS 11 16.695 -13.032 -10.755 86 HA CYS 11 HA CYS 11 13.911 -12.129 -10.606 87 HB2 CYS 11 HB2 CYS 11 14.890 -12.136 -12.833 88 HB3 CYS 11 HB3 CYS 11 15.342 -13.829 -12.658 89 H VAL 12 H VAL 12 15.957 -14.804 -9.857 90 HA VAL 12 HA VAL 12 14.248 -16.966 -9.888 91 HB VAL 12 HB VAL 12 15.594 -17.929 -8.075 92 HG11 VAL 12 HG11 VAL 12 17.534 -16.467 -9.816 93 HG12 VAL 12 HG12 VAL 12 17.531 -18.159 -9.312 94 HG13 VAL 12 HG13 VAL 12 16.387 -17.598 -10.532 95 HG21 VAL 12 HG21 VAL 12 17.564 -16.427 -7.313 96 HG22 VAL 12 HG22 VAL 12 16.508 -15.095 -7.778 97 HG23 VAL 12 HG23 VAL 12 15.991 -16.238 -6.540 98 H ASP 13 H ASP 13 14.345 -14.281 -7.661 99 HA ASP 13 HA ASP 13 12.805 -15.400 -5.582 100 HB2 ASP 13 HB2 ASP 13 14.184 -13.216 -5.605 101 HB3 ASP 13 HB3 ASP 13 12.744 -12.480 -6.300 102 H ARG 14 H ARG 14 11.743 -12.965 -7.964 103 HA ARG 14 HA ARG 14 9.239 -14.401 -8.327 104 HB2 ARG 14 HB2 ARG 14 9.396 -11.593 -7.227 105 HB3 ARG 14 HB3 ARG 14 7.933 -12.284 -7.918 106 HG2 ARG 14 HG2 ARG 14 7.773 -13.901 -6.199 107 HG3 ARG 14 HG3 ARG 14 9.397 -13.534 -5.611 108 HD2 ARG 14 HD2 ARG 14 8.729 -11.479 -4.713 109 HD3 ARG 14 HD3 ARG 14 7.243 -11.447 -5.659 110 HE ARG 14 HE ARG 14 6.902 -13.618 -4.102 111 HH11 ARG 14 HH11 ARG 14 7.825 -10.333 -3.406 112 HH12 ARG 14 HH12 ARG 14 7.125 -10.335 -1.820 113 HH21 ARG 14 HH21 ARG 14 5.977 -13.632 -2.017 114 HH22 ARG 14 HH22 ARG 14 6.076 -12.212 -1.031 115 H LYS 15 H LYS 15 9.371 -14.651 -10.475 116 HA LYS 15 HA LYS 15 10.510 -12.705 -12.223 117 HB2 LYS 15 HB2 LYS 15 9.729 -14.185 -14.027 118 HB3 LYS 15 HB3 LYS 15 10.581 -15.077 -12.774 119 HG2 LYS 15 HG2 LYS 15 8.263 -15.568 -11.808 120 HG3 LYS 15 HG3 LYS 15 7.645 -15.021 -13.368 121 HD2 LYS 15 HD2 LYS 15 9.258 -16.696 -14.410 122 HD3 LYS 15 HD3 LYS 15 9.447 -17.358 -12.786 123 HE2 LYS 15 HE2 LYS 15 7.774 -18.640 -13.909 124 HE3 LYS 15 HE3 LYS 15 6.968 -17.645 -12.697 125 HZ1 LYS 15 HZ1 LYS 15 6.158 -17.814 -15.216 126 HZ2 LYS 15 HZ2 LYS 15 7.199 -16.489 -15.354 127 HZ3 LYS 15 HZ3 LYS 15 5.911 -16.440 -14.260 128 H ASN 16 H ASN 16 7.222 -13.608 -11.322 129 HA ASN 16 HA ASN 16 5.982 -11.855 -13.220 130 HB2 ASN 16 HB2 ASN 16 4.931 -13.365 -10.826 131 HB3 ASN 16 HB3 ASN 16 3.909 -12.343 -11.832 132 HD21 ASN 16 HD21 ASN 16 4.115 -12.832 -14.234 133 HD22 ASN 16 HD22 ASN 16 4.109 -14.504 -14.671 134 H ASP 17 H ASP 17 7.226 -11.547 -10.014 135 HA ASP 17 HA ASP 17 5.979 -8.896 -9.745 136 HB2 ASP 17 HB2 ASP 17 5.990 -10.911 -7.926 137 HB3 ASP 17 HB3 ASP 17 7.434 -10.028 -7.436 138 H CYS 18 H CYS 18 8.245 -9.416 -11.455 139 HA CYS 18 HA CYS 18 10.682 -8.690 -10.246 140 HB2 CYS 18 HB2 CYS 18 9.634 -8.858 -13.015 141 HB3 CYS 18 HB3 CYS 18 11.038 -7.823 -12.773 142 H CYS 19 H CYS 19 8.802 -6.661 -12.493 143 HA CYS 19 HA CYS 19 8.527 -4.443 -10.820 144 HB2 CYS 19 HB2 CYS 19 11.173 -4.741 -11.511 145 HB3 CYS 19 HB3 CYS 19 10.594 -3.606 -12.726 146 H GLU 20 H GLU 20 8.664 -2.318 -12.506 147 HA GLU 20 HA GLU 20 6.563 -2.961 -14.406 148 HB2 GLU 20 HB2 GLU 20 6.403 -0.990 -12.884 149 HB3 GLU 20 HB3 GLU 20 7.763 -0.271 -13.735 150 HG2 GLU 20 HG2 GLU 20 6.538 0.126 -15.645 151 HG3 GLU 20 HG3 GLU 20 5.344 -1.113 -15.260 152 H GLY 21 H GLY 21 7.103 -3.604 -16.383 153 HA2 GLY 21 HA2 GLY 21 7.964 -3.345 -18.532 154 HA3 GLY 21 HA3 GLY 21 8.966 -2.026 -17.945 155 H LEU 22 H LEU 22 9.031 -4.981 -16.179 156 HA LEU 22 HA LEU 22 11.631 -5.641 -17.401 157 HB2 LEU 22 HB2 LEU 22 10.774 -5.852 -14.520 158 HB3 LEU 22 HB3 LEU 22 12.272 -6.525 -15.161 159 HG LEU 22 HG LEU 22 11.528 -3.610 -14.960 160 HD11 LEU 22 HD11 LEU 22 14.024 -4.458 -13.779 161 HD12 LEU 22 HD12 LEU 22 12.654 -5.339 -13.102 162 HD13 LEU 22 HD13 LEU 22 12.676 -3.577 -13.059 163 HD21 LEU 22 HD21 LEU 22 13.548 -5.012 -16.581 164 HD22 LEU 22 HD22 LEU 22 14.130 -3.622 -15.665 165 HD23 LEU 22 HD23 LEU 22 12.802 -3.430 -16.810 166 H GLU 23 H GLU 23 12.235 -7.884 -17.389 167 HA GLU 23 HA GLU 23 10.106 -9.810 -16.868 168 HB2 GLU 23 HB2 GLU 23 10.168 -10.782 -19.049 169 HB3 GLU 23 HB3 GLU 23 9.908 -9.054 -19.254 170 HG2 GLU 23 HG2 GLU 23 12.272 -8.759 -19.783 171 HG3 GLU 23 HG3 GLU 23 12.533 -10.490 -19.578 172 H CYS 24 H CYS 24 10.937 -12.099 -17.233 173 HA CYS 24 HA CYS 24 13.469 -12.338 -15.865 174 HB2 CYS 24 HB2 CYS 24 11.207 -13.777 -15.696 175 HB3 CYS 24 HB3 CYS 24 12.070 -14.755 -16.878 176 H TYR 25 H TYR 25 15.357 -13.136 -16.663 177 HA TYR 25 HA TYR 25 15.509 -13.407 -19.579 178 HB2 TYR 25 HB2 TYR 25 16.974 -11.796 -18.080 179 HB3 TYR 25 HB3 TYR 25 17.942 -13.248 -17.851 180 HD1 TYR 25 HD1 TYR 25 16.221 -11.624 -20.753 181 HD2 TYR 25 HD2 TYR 25 19.801 -13.316 -19.200 182 HE1 TYR 25 HE1 TYR 25 17.342 -11.210 -22.903 183 HE2 TYR 25 HE2 TYR 25 20.933 -12.906 -21.344 184 HH TYR 25 HH TYR 25 20.346 -12.578 -23.702 185 H LYS 26 H LYS 26 17.343 -14.937 -20.299 186 HA LYS 26 HA LYS 26 17.321 -17.393 -18.681 187 HB2 LYS 26 HB2 LYS 26 16.522 -17.032 -21.542 188 HB3 LYS 26 HB3 LYS 26 17.277 -18.541 -21.049 189 HG2 LYS 26 HG2 LYS 26 15.094 -19.093 -20.757 190 HG3 LYS 26 HG3 LYS 26 15.443 -18.438 -19.156 191 HD2 LYS 26 HD2 LYS 26 14.524 -16.276 -19.839 192 HD3 LYS 26 HD3 LYS 26 14.184 -16.925 -21.446 193 HE2 LYS 26 HE2 LYS 26 12.136 -17.147 -20.416 194 HE3 LYS 26 HE3 LYS 26 12.849 -18.733 -20.123 195 HZ1 LYS 26 HZ1 LYS 26 12.246 -16.593 -18.248 196 HZ2 LYS 26 HZ2 LYS 26 13.687 -17.434 -17.973 197 HZ3 LYS 26 HZ3 LYS 26 12.218 -18.270 -18.024 198 H ARG 27 H ARG 27 19.312 -18.064 -18.266 199 HA ARG 27 HA ARG 27 21.460 -17.338 -20.149 200 HB2 ARG 27 HB2 ARG 27 21.470 -17.577 -17.145 201 HB3 ARG 27 HB3 ARG 27 22.955 -17.599 -18.087 202 HG2 ARG 27 HG2 ARG 27 21.770 -15.380 -19.076 203 HG3 ARG 27 HG3 ARG 27 21.176 -15.365 -17.414 204 HD2 ARG 27 HD2 ARG 27 23.354 -15.298 -16.526 205 HD3 ARG 27 HD3 ARG 27 24.082 -15.757 -18.066 206 HE ARG 27 HE ARG 27 22.798 -13.368 -18.531 207 HH11 ARG 27 HH11 ARG 27 25.316 -14.512 -16.416 208 HH12 ARG 27 HH12 ARG 27 26.130 -12.983 -16.347 209 HH21 ARG 27 HH21 ARG 27 23.861 -11.352 -18.448 210 HH22 ARG 27 HH22 ARG 27 25.302 -11.187 -17.501 211 H ARG 28 H ARG 28 23.365 -18.849 -20.048 212 HA ARG 28 HA ARG 28 22.451 -21.517 -20.517 213 HB2 ARG 28 HB2 ARG 28 25.235 -20.343 -20.448 214 HB3 ARG 28 HB3 ARG 28 24.864 -21.989 -20.945 215 HG2 ARG 28 HG2 ARG 28 23.220 -20.705 -22.590 216 HG3 ARG 28 HG3 ARG 28 24.418 -19.429 -22.360 217 HD2 ARG 28 HD2 ARG 28 26.096 -20.637 -23.359 218 HD3 ARG 28 HD3 ARG 28 25.362 -22.189 -22.958 219 HE ARG 28 HE ARG 28 24.909 -20.618 -25.316 220 HH11 ARG 28 HH11 ARG 28 23.545 -23.002 -23.176 221 HH12 ARG 28 HH12 ARG 28 22.478 -23.656 -24.373 222 HH21 ARG 28 HH21 ARG 28 23.508 -21.470 -26.901 223 HH22 ARG 28 HH22 ARG 28 22.457 -22.785 -26.492 224 H HIS 29 H HIS 29 25.111 -20.428 -18.408 225 HA HIS 29 HA HIS 29 24.208 -22.391 -16.406 226 HB2 HIS 29 HB2 HIS 29 27.060 -21.772 -17.205 227 HB3 HIS 29 HB3 HIS 29 26.592 -22.810 -15.861 228 HD1 HIS 29 HD1 HIS 29 28.208 -23.613 -18.538 229 HD2 HIS 29 HD2 HIS 29 24.240 -24.455 -17.639 230 HE1 HIS 29 HE1 HIS 29 27.615 -25.622 -19.929 231 H SER 30 H SER 30 23.781 -19.465 -16.684 232 HA SER 30 HA SER 30 25.005 -18.641 -14.132 233 HB2 SER 30 HB2 SER 30 24.734 -17.172 -16.713 234 HB3 SER 30 HB3 SER 30 24.560 -16.250 -15.220 235 HG SER 30 HG SER 30 26.781 -16.763 -16.320 236 H PHE 31 H PHE 31 23.742 -17.082 -12.890 237 HA PHE 31 HA PHE 31 20.991 -17.855 -12.768 238 HB2 PHE 31 HB2 PHE 31 20.862 -16.482 -10.804 239 HB3 PHE 31 HB3 PHE 31 22.416 -17.309 -10.771 240 HD1 PHE 31 HD1 PHE 31 24.480 -16.052 -11.407 241 HD2 PHE 31 HD2 PHE 31 20.724 -14.136 -10.822 242 HE1 PHE 31 HE1 PHE 31 25.625 -13.889 -11.162 243 HE2 PHE 31 HE2 PHE 31 21.864 -11.970 -10.576 244 HZ PHE 31 HZ PHE 31 24.318 -11.844 -10.744 245 H GLU 32 H GLU 32 19.230 -16.843 -13.531 246 HA GLU 32 HA GLU 32 19.631 -14.514 -15.226 247 HB2 GLU 32 HB2 GLU 32 17.346 -14.932 -15.994 248 HB3 GLU 32 HB3 GLU 32 18.323 -16.390 -16.096 249 HG2 GLU 32 HG2 GLU 32 17.287 -16.808 -13.698 250 HG3 GLU 32 HG3 GLU 32 16.021 -15.763 -14.339 251 H VAL 33 H VAL 33 18.461 -12.579 -15.029 252 HA VAL 33 HA VAL 33 17.033 -12.152 -12.501 253 HB VAL 33 HB VAL 33 18.182 -10.083 -12.054 254 HG11 VAL 33 HG11 VAL 33 20.121 -10.960 -11.183 255 HG12 VAL 33 HG12 VAL 33 19.191 -12.430 -11.482 256 HG13 VAL 33 HG13 VAL 33 20.451 -11.936 -12.613 257 HG21 VAL 33 HG21 VAL 33 19.389 -10.579 -14.732 258 HG22 VAL 33 HG22 VAL 33 18.760 -9.085 -14.039 259 HG23 VAL 33 HG23 VAL 33 20.330 -9.702 -13.524 260 H CYS 34 H CYS 34 16.115 -9.782 -12.545 261 HA CYS 34 HA CYS 34 14.317 -9.664 -14.738 262 HB2 CYS 34 HB2 CYS 34 14.886 -7.575 -12.624 263 HB3 CYS 34 HB3 CYS 34 13.481 -7.615 -13.683 264 H VAL 35 H VAL 35 14.595 -8.782 -16.670 265 HA VAL 35 HA VAL 35 16.622 -6.663 -16.975 266 HB VAL 35 HB VAL 35 16.835 -7.546 -19.370 267 HG11 VAL 35 HG11 VAL 35 18.643 -7.762 -17.815 268 HG12 VAL 35 HG12 VAL 35 17.858 -9.125 -17.016 269 HG13 VAL 35 HG13 VAL 35 18.464 -9.298 -18.664 270 HG21 VAL 35 HG21 VAL 35 16.178 -9.736 -19.869 271 HG22 VAL 35 HG22 VAL 35 15.877 -10.129 -18.177 272 HG23 VAL 35 HG23 VAL 35 14.784 -9.046 -19.038 273 HA PRO 36 HA PRO 36 13.556 -4.135 -18.840 274 HB2 PRO 36 HB2 PRO 36 15.019 -2.784 -20.686 275 HB3 PRO 36 HB3 PRO 36 15.149 -2.482 -18.949 276 HG2 PRO 36 HG2 PRO 36 16.916 -4.121 -20.724 277 HG3 PRO 36 HG3 PRO 36 17.366 -2.984 -19.441 278 HD2 PRO 36 HD2 PRO 36 17.351 -5.665 -19.071 279 HD3 PRO 36 HD3 PRO 36 16.974 -4.520 -17.769 280 H ILE 37 H ILE 37 12.013 -4.464 -20.316 281 HA ILE 37 HA ILE 37 12.457 -6.361 -22.448 282 HB ILE 37 HB ILE 37 9.972 -4.812 -21.709 283 HG12 ILE 37 HG12 ILE 37 10.141 -7.734 -21.292 284 HG13 ILE 37 HG13 ILE 37 11.161 -6.760 -20.239 285 HG21 ILE 37 HG21 ILE 37 10.280 -7.182 -23.546 286 HG22 ILE 37 HG22 ILE 37 8.774 -6.366 -23.132 287 HG23 ILE 37 HG23 ILE 37 10.009 -5.519 -24.064 288 HD11 ILE 37 HD11 ILE 37 8.379 -7.281 -20.046 289 HD12 ILE 37 HD12 ILE 37 9.414 -6.364 -18.952 290 HD13 ILE 37 HD13 ILE 37 8.611 -5.551 -20.294 291 HA PRO 38 HA PRO 38 13.379 -3.329 -25.537 292 HB2 PRO 38 HB2 PRO 38 13.093 -4.944 -27.699 293 HB3 PRO 38 HB3 PRO 38 14.495 -5.015 -26.626 294 HG2 PRO 38 HG2 PRO 38 12.064 -6.762 -26.687 295 HG3 PRO 38 HG3 PRO 38 13.765 -7.220 -26.490 296 HD2 PRO 38 HD2 PRO 38 12.053 -7.036 -24.399 297 HD3 PRO 38 HD3 PRO 38 13.784 -6.669 -24.252 298 H GLY 39 H GLY 39 12.181 -1.857 -26.596 299 HA2 GLY 39 HA2 GLY 39 10.410 -0.875 -27.689 300 HA3 GLY 39 HA3 GLY 39 9.831 -2.489 -28.071 301 H PHE 40 H PHE 40 10.321 -2.137 -24.767 302 HA PHE 40 HA PHE 40 7.610 -2.466 -24.124 303 HB2 PHE 40 HB2 PHE 40 9.134 -3.232 -22.511 304 HB3 PHE 40 HB3 PHE 40 10.037 -1.720 -22.514 305 HD1 PHE 40 HD1 PHE 40 6.710 -3.129 -21.631 306 HD2 PHE 40 HD2 PHE 40 9.645 -0.141 -20.870 307 HE1 PHE 40 HE1 PHE 40 5.418 -2.360 -19.684 308 HE2 PHE 40 HE2 PHE 40 8.358 0.631 -18.921 309 HZ PHE 40 HZ PHE 40 6.241 -0.478 -18.326 310 H CYS 41 H CYS 41 6.068 -1.072 -23.286 311 HA CYS 41 HA CYS 41 6.647 1.753 -23.028 312 HB2 CYS 41 HB2 CYS 41 5.007 2.485 -24.666 313 HB3 CYS 41 HB3 CYS 41 6.219 1.478 -25.452 314 H LEU 42 H LEU 42 4.145 2.794 -22.948 315 HA LEU 42 HA LEU 42 2.721 1.148 -20.964 316 HB2 LEU 42 HB2 LEU 42 2.926 4.142 -20.817 317 HB3 LEU 42 HB3 LEU 42 2.340 3.028 -19.583 318 HG LEU 42 HG LEU 42 5.210 3.230 -20.490 319 HD11 LEU 42 HD11 LEU 42 5.364 5.033 -19.209 320 HD12 LEU 42 HD12 LEU 42 4.946 4.028 -17.823 321 HD13 LEU 42 HD13 LEU 42 3.681 4.881 -18.706 322 HD21 LEU 42 HD21 LEU 42 5.094 1.124 -19.615 323 HD22 LEU 42 HD22 LEU 42 3.735 1.515 -18.559 324 HD23 LEU 42 HD23 LEU 42 5.364 2.045 -18.135 325 H VAL 43 H VAL 43 0.438 1.817 -20.649 326 HA VAL 43 HA VAL 43 -0.731 2.629 -23.225 327 HB VAL 43 HB VAL 43 -2.806 1.519 -22.408 328 HG11 VAL 43 HG11 VAL 43 -1.254 0.352 -23.888 329 HG12 VAL 43 HG12 VAL 43 -0.351 -0.234 -22.489 330 HG13 VAL 43 HG13 VAL 43 -2.012 -0.766 -22.756 331 HG21 VAL 43 HG21 VAL 43 -1.431 -0.055 -20.374 332 HG22 VAL 43 HG22 VAL 43 -1.605 1.646 -19.942 333 HG23 VAL 43 HG23 VAL 43 -3.030 0.687 -20.343 334 H LYS 44 H LYS 44 -3.183 3.393 -22.677 335 HA LYS 44 HA LYS 44 -2.829 5.929 -21.368 336 HB2 LYS 44 HB2 LYS 44 -5.050 6.445 -22.145 337 HB3 LYS 44 HB3 LYS 44 -4.176 5.643 -23.443 338 HG2 LYS 44 HG2 LYS 44 -5.578 3.710 -21.849 339 HG3 LYS 44 HG3 LYS 44 -6.679 4.974 -22.402 340 HD2 LYS 44 HD2 LYS 44 -5.512 4.599 -24.702 341 HD3 LYS 44 HD3 LYS 44 -5.041 3.049 -24.001 342 HE2 LYS 44 HE2 LYS 44 -7.044 2.582 -25.100 343 HE3 LYS 44 HE3 LYS 44 -7.523 2.784 -23.415 344 HZ1 LYS 44 HZ1 LYS 44 -8.492 4.149 -25.630 345 HZ2 LYS 44 HZ2 LYS 44 -7.609 5.277 -24.729 346 HZ3 LYS 44 HZ3 LYS 44 -8.874 4.419 -24.004 347 H TRP 45 H TRP 45 -3.359 2.948 -20.162 348 HA TRP 45 HA TRP 45 -4.942 3.993 -17.907 349 HB2 TRP 45 HB2 TRP 45 -4.941 1.196 -19.057 350 HB3 TRP 45 HB3 TRP 45 -5.752 1.659 -17.563 351 HD1 TRP 45 HD1 TRP 45 -6.467 1.187 -21.102 352 HE1 TRP 45 HE1 TRP 45 -8.663 2.346 -21.778 353 HE3 TRP 45 HE3 TRP 45 -7.117 4.154 -16.990 354 HZ2 TRP 45 HZ2 TRP 45 -10.436 4.265 -20.710 355 HZ3 TRP 45 HZ3 TRP 45 -9.089 5.623 -16.896 356 HH2 TRP 45 HH2 TRP 45 -10.712 5.675 -18.718 357 H LYS 46 H LYS 46 -1.950 3.607 -18.582 358 HA LYS 46 HA LYS 46 -1.246 2.079 -16.163 359 HB2 LYS 46 HB2 LYS 46 0.141 2.445 -18.792 360 HB3 LYS 46 HB3 LYS 46 1.093 2.114 -17.350 361 HG2 LYS 46 HG2 LYS 46 -1.186 0.321 -17.684 362 HG3 LYS 46 HG3 LYS 46 -0.006 0.233 -18.995 363 HD2 LYS 46 HD2 LYS 46 1.612 0.272 -16.802 364 HD3 LYS 46 HD3 LYS 46 0.212 -0.615 -16.194 365 HE2 LYS 46 HE2 LYS 46 0.390 -2.042 -18.282 366 HE3 LYS 46 HE3 LYS 46 1.956 -1.280 -18.554 367 HZ1 LYS 46 HZ1 LYS 46 1.874 -2.157 -15.905 368 HZ2 LYS 46 HZ2 LYS 46 2.850 -2.727 -17.162 369 HZ3 LYS 46 HZ3 LYS 46 1.342 -3.437 -16.874 370 H GLN 47 H GLN 47 0.213 2.947 -14.696 371 HA GLN 47 HA GLN 47 0.112 5.672 -14.212 372 HB2 GLN 47 HB2 GLN 47 1.616 3.387 -13.154 373 HB3 GLN 47 HB3 GLN 47 2.451 4.925 -12.980 374 HG2 GLN 47 HG2 GLN 47 0.982 5.712 -11.462 375 HG3 GLN 47 HG3 GLN 47 -0.392 4.894 -12.203 376 HE21 GLN 47 HE21 GLN 47 -1.126 4.168 -10.202 377 HE22 GLN 47 HE22 GLN 47 -0.344 2.884 -9.351 378 H CYS 48 H CYS 48 1.460 7.398 -14.594 379 HA CYS 48 HA CYS 48 3.460 6.982 -16.711 380 HB2 CYS 48 HB2 CYS 48 3.029 9.168 -17.484 381 HB3 CYS 48 HB3 CYS 48 1.442 8.507 -17.104 382 H ASP 49 H ASP 49 3.013 7.971 -13.461 383 HA ASP 49 HA ASP 49 5.069 9.743 -12.997 384 HB2 ASP 49 HB2 ASP 49 3.336 8.813 -11.351 385 HB3 ASP 49 HB3 ASP 49 4.456 7.474 -11.110 386 H GLY 50 H GLY 50 7.158 9.641 -13.461 387 HA2 GLY 50 HA2 GLY 50 9.332 8.776 -13.267 388 HA3 GLY 50 HA3 GLY 50 8.648 7.207 -12.867 389 H ARG 51 H ARG 51 6.836 7.207 -15.164 390 HA ARG 51 HA ARG 51 8.831 6.664 -17.262 391 HB2 ARG 51 HB2 ARG 51 6.119 5.394 -16.835 392 HB3 ARG 51 HB3 ARG 51 7.228 5.013 -18.146 393 HG2 ARG 51 HG2 ARG 51 7.676 4.538 -15.207 394 HG3 ARG 51 HG3 ARG 51 7.384 3.321 -16.452 395 HD2 ARG 51 HD2 ARG 51 9.479 4.097 -17.578 396 HD3 ARG 51 HD3 ARG 51 9.786 5.120 -16.175 397 HE ARG 51 HE ARG 51 9.390 2.560 -15.208 398 HH11 ARG 51 HH11 ARG 51 11.618 4.176 -17.341 399 HH12 ARG 51 HH12 ARG 51 12.939 3.118 -16.974 400 HH21 ARG 51 HH21 ARG 51 11.123 1.161 -14.716 401 HH22 ARG 51 HH22 ARG 51 12.657 1.403 -15.481 402 H GLU 52 H GLU 52 7.720 9.253 -16.854 403 HA GLU 52 HA GLU 52 5.527 9.801 -18.528 404 HB2 GLU 52 HB2 GLU 52 6.192 12.116 -18.386 405 HB3 GLU 52 HB3 GLU 52 6.416 11.360 -16.815 406 HG2 GLU 52 HG2 GLU 52 8.846 11.040 -17.495 407 HG3 GLU 52 HG3 GLU 52 8.503 12.159 -18.813 408 H ARG 53 H ARG 53 8.735 8.937 -19.257 409 HA ARG 53 HA ARG 53 8.359 9.791 -22.052 410 HB2 ARG 53 HB2 ARG 53 11.041 9.439 -21.888 411 HB3 ARG 53 HB3 ARG 53 10.237 10.986 -21.666 412 HG2 ARG 53 HG2 ARG 53 10.493 10.944 -19.375 413 HG3 ARG 53 HG3 ARG 53 10.668 9.188 -19.324 414 HD2 ARG 53 HD2 ARG 53 12.687 11.042 -20.574 415 HD3 ARG 53 HD3 ARG 53 12.776 10.478 -18.906 416 HE ARG 53 HE ARG 53 12.537 8.306 -20.726 417 HH11 ARG 53 HH11 ARG 53 14.797 10.624 -19.444 418 HH12 ARG 53 HH12 ARG 53 16.182 9.618 -19.713 419 HH21 ARG 53 HH21 ARG 53 14.352 6.973 -21.085 420 HH22 ARG 53 HH22 ARG 53 15.927 7.542 -20.648 421 H ASP 54 H ASP 54 7.667 7.264 -20.563 422 HA ASP 54 HA ASP 54 9.224 5.390 -22.222 423 HB2 ASP 54 HB2 ASP 54 9.027 5.363 -19.491 424 HB3 ASP 54 HB3 ASP 54 7.743 4.250 -19.952 425 H CYS 55 H CYS 55 6.121 6.624 -21.432 426 HA CYS 55 HA CYS 55 4.391 4.587 -22.093 427 HB2 CYS 55 HB2 CYS 55 4.063 7.499 -22.845 428 HB3 CYS 55 HB3 CYS 55 2.772 6.313 -22.682 429 H CYS 56 H CYS 56 3.039 4.429 -24.114 430 HA CYS 56 HA CYS 56 4.735 3.851 -26.322 431 HB2 CYS 56 HB2 CYS 56 1.874 3.556 -25.668 432 HB3 CYS 56 HB3 CYS 56 2.227 3.746 -27.383 433 H ALA 57 H ALA 57 3.740 4.590 -28.605 434 HA ALA 57 HA ALA 57 4.389 7.350 -28.823 435 HB1 ALA 57 HB1 ALA 57 3.384 5.306 -30.778 436 HB2 ALA 57 HB2 ALA 57 3.631 6.992 -31.233 437 HB3 ALA 57 HB3 ALA 57 4.990 6.026 -30.660 438 H GLY 58 H GLY 58 3.118 9.115 -28.932 439 HA2 GLY 58 HA2 GLY 58 1.153 10.340 -29.324 440 HA3 GLY 58 HA3 GLY 58 0.256 8.831 -29.409 441 H LEU 59 H LEU 59 1.792 8.135 -26.798 442 HA LEU 59 HA LEU 59 -0.312 9.048 -25.053 443 HB2 LEU 59 HB2 LEU 59 1.454 6.869 -25.133 444 HB3 LEU 59 HB3 LEU 59 1.861 7.770 -23.674 445 HG LEU 59 HG LEU 59 -0.363 7.506 -22.816 446 HD11 LEU 59 HD11 LEU 59 -0.964 6.381 -25.534 447 HD12 LEU 59 HD12 LEU 59 -1.752 7.718 -24.695 448 HD13 LEU 59 HD13 LEU 59 -1.988 6.062 -24.133 449 HD21 LEU 59 HD21 LEU 59 0.414 5.571 -22.046 450 HD22 LEU 59 HD22 LEU 59 1.318 5.272 -23.531 451 HD23 LEU 59 HD23 LEU 59 -0.374 4.786 -23.416 452 H GLU 60 H GLU 60 0.402 9.772 -22.767 453 HA GLU 60 HA GLU 60 2.792 11.318 -22.553 454 HB2 GLU 60 HB2 GLU 60 1.896 13.519 -22.564 455 HB3 GLU 60 HB3 GLU 60 1.338 12.745 -24.040 456 HG2 GLU 60 HG2 GLU 60 -0.722 12.164 -22.432 457 HG3 GLU 60 HG3 GLU 60 -0.182 13.668 -21.690 458 H CYS 61 H CYS 61 3.081 12.227 -20.462 459 HA CYS 61 HA CYS 61 1.908 10.725 -18.380 460 HB2 CYS 61 HB2 CYS 61 4.201 11.968 -18.491 461 HB3 CYS 61 HB3 CYS 61 3.284 13.347 -17.893 462 H TRP 62 H TRP 62 -0.296 10.950 -18.292 463 HA TRP 62 HA TRP 62 -1.556 13.535 -18.258 464 HB2 TRP 62 HB2 TRP 62 -2.522 11.261 -19.085 465 HB3 TRP 62 HB3 TRP 62 -2.907 10.999 -17.386 466 HD1 TRP 62 HD1 TRP 62 -3.267 14.586 -18.107 467 HE1 TRP 62 HE1 TRP 62 -5.741 15.203 -18.463 468 HE3 TRP 62 HE3 TRP 62 -5.213 9.885 -18.604 469 HZ2 TRP 62 HZ2 TRP 62 -8.192 13.874 -18.897 470 HZ3 TRP 62 HZ3 TRP 62 -7.632 9.644 -18.987 471 HH2 TRP 62 HH2 TRP 62 -9.088 11.598 -19.130 472 H LYS 63 H LYS 63 -2.111 14.746 -16.549 473 HA LYS 63 HA LYS 63 -1.427 13.720 -13.884 474 HB2 LYS 63 HB2 LYS 63 -0.542 15.965 -14.998 475 HB3 LYS 63 HB3 LYS 63 -2.053 16.596 -14.356 476 HG2 LYS 63 HG2 LYS 63 -0.288 15.023 -12.552 477 HG3 LYS 63 HG3 LYS 63 0.165 16.681 -12.958 478 HD2 LYS 63 HD2 LYS 63 -2.560 15.929 -11.918 479 HD3 LYS 63 HD3 LYS 63 -1.222 16.393 -10.863 480 HE2 LYS 63 HE2 LYS 63 -1.052 18.521 -12.184 481 HE3 LYS 63 HE3 LYS 63 -2.546 18.058 -12.997 482 HZ1 LYS 63 HZ1 LYS 63 -3.350 17.811 -10.519 483 HZ2 LYS 63 HZ2 LYS 63 -3.389 19.304 -11.314 484 HZ3 LYS 63 HZ3 LYS 63 -2.128 18.948 -10.244 485 H ARG 64 H ARG 64 -3.228 12.683 -13.170 486 HA ARG 64 HA ARG 64 -5.707 14.274 -13.044 487 HB2 ARG 64 HB2 ARG 64 -5.224 11.484 -13.845 488 HB3 ARG 64 HB3 ARG 64 -6.555 11.697 -12.714 489 HG2 ARG 64 HG2 ARG 64 -7.776 12.997 -14.197 490 HG3 ARG 64 HG3 ARG 64 -6.358 13.390 -15.170 491 HD2 ARG 64 HD2 ARG 64 -7.066 11.782 -16.551 492 HD3 ARG 64 HD3 ARG 64 -6.463 10.654 -15.338 493 HE ARG 64 HE ARG 64 -8.619 10.064 -14.906 494 HH11 ARG 64 HH11 ARG 64 -8.614 13.198 -16.421 495 HH12 ARG 64 HH12 ARG 64 -10.340 13.295 -16.524 496 HH21 ARG 64 HH21 ARG 64 -10.893 10.180 -15.036 497 HH22 ARG 64 HH22 ARG 64 -11.637 11.579 -15.735 498 H SER 65 H SER 65 -6.556 14.631 -11.086 499 HA SER 65 HA SER 65 -5.601 13.013 -8.823 500 HB2 SER 65 HB2 SER 65 -5.620 15.152 -7.462 501 HB3 SER 65 HB3 SER 65 -4.333 15.031 -8.662 502 HG SER 65 HG SER 65 -6.795 16.399 -9.032 503 H GLY 66 H GLY 66 -7.149 12.342 -7.456 504 HA2 GLY 66 HA2 GLY 66 -9.187 12.827 -6.208 505 HA3 GLY 66 HA3 GLY 66 -9.799 13.631 -7.645 506 H ASN 67 H ASN 67 -8.577 11.337 -9.254 507 HA ASN 67 HA ASN 67 -10.794 9.454 -8.797 508 HB2 ASN 67 HB2 ASN 67 -10.940 9.081 -11.103 509 HB3 ASN 67 HB3 ASN 67 -10.629 10.810 -10.995 510 HD21 ASN 67 HD21 ASN 67 -9.907 8.240 -12.749 511 HD22 ASN 67 HD22 ASN 67 -8.298 8.621 -13.249 512 H LYS 68 H LYS 68 -7.357 9.760 -9.438 513 HA LYS 68 HA LYS 68 -6.657 7.425 -8.075 514 HB2 LYS 68 HB2 LYS 68 -7.535 6.973 -10.778 515 HB3 LYS 68 HB3 LYS 68 -5.831 6.564 -10.630 516 HG2 LYS 68 HG2 LYS 68 -6.720 5.328 -8.452 517 HG3 LYS 68 HG3 LYS 68 -8.205 5.292 -9.403 518 HD2 LYS 68 HD2 LYS 68 -5.511 4.276 -10.307 519 HD3 LYS 68 HD3 LYS 68 -6.855 3.276 -9.751 520 HE2 LYS 68 HE2 LYS 68 -6.863 5.086 -12.165 521 HE3 LYS 68 HE3 LYS 68 -6.739 3.327 -12.189 522 HZ1 LYS 68 HZ1 LYS 68 -9.050 4.854 -11.117 523 HZ2 LYS 68 HZ2 LYS 68 -8.932 3.172 -11.236 524 HZ3 LYS 68 HZ3 LYS 68 -8.998 4.116 -12.638 525 H SER 69 H SER 69 -4.327 6.653 -9.045 526 HA SER 69 HA SER 69 -2.625 8.862 -8.596 527 HB2 SER 69 HB2 SER 69 -2.187 6.020 -9.459 528 HB3 SER 69 HB3 SER 69 -0.847 7.165 -9.478 529 HG SER 69 HG SER 69 -2.162 6.009 -7.344 530 H SER 70 H SER 70 -0.675 9.161 -10.207 531 HA SER 70 HA SER 70 -1.746 10.425 -12.509 532 HB2 SER 70 HB2 SER 70 1.173 9.792 -12.284 533 HB3 SER 70 HB3 SER 70 0.389 11.260 -12.867 534 HG SER 70 HG SER 70 -0.240 11.638 -10.657 535 H VAL 71 H VAL 71 -2.291 9.536 -14.376 536 HA VAL 71 HA VAL 71 -0.954 7.039 -15.196 537 HB VAL 71 HB VAL 71 -3.070 6.572 -16.498 538 HG11 VAL 71 HG11 VAL 71 -3.930 6.610 -13.687 539 HG12 VAL 71 HG12 VAL 71 -3.779 5.259 -14.813 540 HG13 VAL 71 HG13 VAL 71 -2.353 5.880 -13.983 541 HG21 VAL 71 HG21 VAL 71 -4.798 8.069 -14.759 542 HG22 VAL 71 HG22 VAL 71 -3.725 9.158 -15.639 543 HG23 VAL 71 HG23 VAL 71 -4.751 8.028 -16.522 544 H CYS 72 H CYS 72 -1.435 6.702 -17.693 545 HA CYS 72 HA CYS 72 -0.479 9.148 -19.010 546 HB2 CYS 72 HB2 CYS 72 0.271 6.370 -19.180 547 HB3 CYS 72 HB3 CYS 72 -0.218 6.960 -20.765 548 H ALA 73 H ALA 73 -1.265 9.672 -21.130 549 HA ALA 73 HA ALA 73 -3.751 8.405 -21.974 550 HB1 ALA 73 HB1 ALA 73 -3.991 11.314 -21.995 551 HB2 ALA 73 HB2 ALA 73 -5.150 10.082 -21.493 552 HB3 ALA 73 HB3 ALA 73 -3.898 10.622 -20.375 553 HA PRO 74 HA PRO 74 -2.226 9.222 -26.010 554 HB2 PRO 74 HB2 PRO 74 -4.541 9.479 -27.405 555 HB3 PRO 74 HB3 PRO 74 -3.955 7.927 -26.794 556 HG2 PRO 74 HG2 PRO 74 -6.023 9.758 -25.640 557 HG3 PRO 74 HG3 PRO 74 -6.052 7.992 -25.792 558 HD2 PRO 74 HD2 PRO 74 -5.443 9.244 -23.469 559 HD3 PRO 74 HD3 PRO 74 -4.731 7.683 -23.929 560 H ILE 75 H ILE 75 -2.570 10.766 -27.925 561 HA ILE 75 HA ILE 75 -2.091 13.387 -27.103 562 HB ILE 75 HB ILE 75 -2.542 13.993 -29.522 563 HG12 ILE 75 HG12 ILE 75 -2.683 11.024 -29.983 564 HG13 ILE 75 HG13 ILE 75 -4.148 11.971 -29.743 565 HG21 ILE 75 HG21 ILE 75 -0.640 11.694 -29.103 566 HG22 ILE 75 HG22 ILE 75 -0.516 12.981 -30.302 567 HG23 ILE 75 HG23 ILE 75 -0.324 13.352 -28.588 568 HD11 ILE 75 HD11 ILE 75 -2.166 12.117 -31.977 569 HD12 ILE 75 HD12 ILE 75 -3.908 11.853 -32.050 570 HD13 ILE 75 HD13 ILE 75 -3.274 13.446 -31.639 571 H THR 76 H THR 76 -3.318 15.286 -27.221 572 HA THR 76 HA THR 76 -5.966 15.500 -28.067 573 HB THR 76 HB THR 76 -6.705 14.018 -26.381 574 HG1 THR 76 HG1 THR 76 -7.898 15.995 -26.471 575 HG21 THR 76 HG21 THR 76 -4.492 15.144 -24.876 576 HG22 THR 76 HG22 THR 76 -5.318 13.598 -24.677 577 HG23 THR 76 HG23 THR 76 -5.966 15.049 -23.912 Start of MODEL 15 1 H1 SER 1 H SER 1 5.630 2.703 1.437 2 HA SER 1 HA SER 1 3.739 0.886 0.349 3 HB2 SER 1 HB2 SER 1 4.309 3.105 -0.652 4 HB3 SER 1 HB3 SER 1 5.873 2.444 -1.129 5 HG SER 1 HG SER 1 3.400 2.086 -2.253 6 H ASN 2 H ASN 2 4.349 -0.561 -1.550 7 HA ASN 2 HA ASN 2 6.630 -2.222 -0.730 8 HB2 ASN 2 HB2 ASN 2 4.337 -3.247 -0.723 9 HB3 ASN 2 HB3 ASN 2 4.289 -3.021 -2.470 10 HD21 ASN 2 HD21 ASN 2 4.877 -4.699 -3.625 11 HD22 ASN 2 HD22 ASN 2 5.923 -5.975 -3.114 12 H GLU 3 H GLU 3 8.383 -2.191 -1.959 13 HA GLU 3 HA GLU 3 8.256 -1.030 -4.624 14 HB2 GLU 3 HB2 GLU 3 10.522 -1.802 -2.798 15 HB3 GLU 3 HB3 GLU 3 10.797 -1.352 -4.474 16 HG2 GLU 3 HG2 GLU 3 9.611 0.805 -3.983 17 HG3 GLU 3 HG3 GLU 3 9.646 0.348 -2.281 18 H CYS 4 H CYS 4 9.977 -2.155 -6.178 19 HA CYS 4 HA CYS 4 9.261 -5.013 -6.275 20 HB2 CYS 4 HB2 CYS 4 9.378 -4.838 -8.731 21 HB3 CYS 4 HB3 CYS 4 8.160 -3.761 -8.055 22 H ILE 5 H ILE 5 10.834 -6.237 -7.793 23 HA ILE 5 HA ILE 5 13.424 -6.062 -6.631 24 HB ILE 5 HB ILE 5 12.502 -7.680 -9.009 25 HG12 ILE 5 HG12 ILE 5 12.941 -8.677 -6.202 26 HG13 ILE 5 HG13 ILE 5 11.388 -8.021 -6.709 27 HG21 ILE 5 HG21 ILE 5 14.519 -9.111 -8.115 28 HG22 ILE 5 HG22 ILE 5 14.779 -7.771 -9.232 29 HG23 ILE 5 HG23 ILE 5 15.068 -7.550 -7.506 30 HD11 ILE 5 HD11 ILE 5 11.857 -10.584 -6.812 31 HD12 ILE 5 HD12 ILE 5 10.943 -9.787 -8.093 32 HD13 ILE 5 HD13 ILE 5 12.649 -10.171 -8.332 33 H ARG 6 H ARG 6 15.285 -5.206 -7.389 34 HA ARG 6 HA ARG 6 15.144 -3.254 -9.463 35 HB2 ARG 6 HB2 ARG 6 17.494 -4.353 -7.911 36 HB3 ARG 6 HB3 ARG 6 17.594 -3.001 -9.030 37 HG2 ARG 6 HG2 ARG 6 17.253 -1.743 -7.219 38 HG3 ARG 6 HG3 ARG 6 15.562 -2.211 -7.402 39 HD2 ARG 6 HD2 ARG 6 15.877 -2.796 -5.222 40 HD3 ARG 6 HD3 ARG 6 16.366 -4.302 -5.999 41 HE ARG 6 HE ARG 6 18.481 -3.958 -5.218 42 HH11 ARG 6 HH11 ARG 6 16.761 -0.932 -5.154 43 HH12 ARG 6 HH12 ARG 6 18.032 -0.077 -4.344 44 HH21 ARG 6 HH21 ARG 6 20.161 -2.843 -4.151 45 HH22 ARG 6 HH22 ARG 6 19.966 -1.165 -3.775 46 H LYS 7 H LYS 7 16.394 -3.194 -11.401 47 HA LYS 7 HA LYS 7 16.269 -5.569 -12.915 48 HB2 LYS 7 HB2 LYS 7 16.070 -3.493 -14.064 49 HB3 LYS 7 HB3 LYS 7 17.597 -2.908 -13.414 50 HG2 LYS 7 HG2 LYS 7 18.812 -4.539 -14.743 51 HG3 LYS 7 HG3 LYS 7 17.291 -5.184 -15.363 52 HD2 LYS 7 HD2 LYS 7 18.335 -3.666 -16.971 53 HD3 LYS 7 HD3 LYS 7 16.791 -3.028 -16.399 54 HE2 LYS 7 HE2 LYS 7 18.497 -1.281 -16.500 55 HE3 LYS 7 HE3 LYS 7 17.961 -1.561 -14.845 56 HZ1 LYS 7 HZ1 LYS 7 19.934 -2.820 -14.409 57 HZ2 LYS 7 HZ2 LYS 7 20.389 -1.327 -15.060 58 HZ3 LYS 7 HZ3 LYS 7 20.428 -2.717 -16.023 59 H TRP 8 H TRP 8 17.876 -6.927 -13.700 60 HA TRP 8 HA TRP 8 19.734 -8.232 -13.519 61 HB2 TRP 8 HB2 TRP 8 20.824 -5.441 -13.393 62 HB3 TRP 8 HB3 TRP 8 21.911 -6.814 -13.201 63 HD1 TRP 8 HD1 TRP 8 21.031 -4.576 -15.785 64 HE1 TRP 8 HE1 TRP 8 21.170 -5.631 -18.128 65 HE3 TRP 8 HE3 TRP 8 21.077 -9.511 -14.452 66 HZ2 TRP 8 HZ2 TRP 8 21.282 -8.214 -19.263 67 HZ3 TRP 8 HZ3 TRP 8 21.200 -11.211 -16.227 68 HH2 TRP 8 HH2 TRP 8 21.300 -10.574 -18.581 69 H LEU 9 H LEU 9 18.356 -8.418 -11.262 70 HA LEU 9 HA LEU 9 20.377 -8.216 -9.127 71 HB2 LEU 9 HB2 LEU 9 18.493 -6.745 -8.705 72 HB3 LEU 9 HB3 LEU 9 17.373 -8.090 -8.908 73 HG LEU 9 HG LEU 9 19.392 -8.478 -6.809 74 HD11 LEU 9 HD11 LEU 9 18.939 -6.060 -6.593 75 HD12 LEU 9 HD12 LEU 9 18.360 -6.995 -5.215 76 HD13 LEU 9 HD13 LEU 9 17.220 -6.423 -6.433 77 HD21 LEU 9 HD21 LEU 9 16.792 -8.743 -5.831 78 HD22 LEU 9 HD22 LEU 9 17.867 -10.033 -6.370 79 HD23 LEU 9 HD23 LEU 9 16.723 -9.310 -7.501 80 H SER 10 H SER 10 17.289 -9.954 -9.434 81 HA SER 10 HA SER 10 18.395 -12.513 -9.794 82 HB2 SER 10 HB2 SER 10 18.786 -11.606 -7.200 83 HB3 SER 10 HB3 SER 10 17.344 -12.613 -7.073 84 HG SER 10 HG SER 10 19.931 -13.342 -7.447 85 H CYS 11 H CYS 11 16.787 -13.354 -10.936 86 HA CYS 11 HA CYS 11 14.029 -12.657 -10.352 87 HB2 CYS 11 HB2 CYS 11 14.874 -12.716 -12.690 88 HB3 CYS 11 HB3 CYS 11 15.139 -14.449 -12.521 89 H VAL 12 H VAL 12 16.215 -15.069 -9.483 90 HA VAL 12 HA VAL 12 14.784 -17.418 -9.430 91 HB VAL 12 HB VAL 12 16.097 -18.026 -7.404 92 HG11 VAL 12 HG11 VAL 12 17.879 -16.657 -9.395 93 HG12 VAL 12 HG12 VAL 12 18.153 -18.166 -8.522 94 HG13 VAL 12 HG13 VAL 12 16.951 -18.097 -9.811 95 HG21 VAL 12 HG21 VAL 12 16.946 -15.143 -7.578 96 HG22 VAL 12 HG22 VAL 12 16.183 -15.965 -6.217 97 HG23 VAL 12 HG23 VAL 12 17.838 -16.367 -6.675 98 H ASP 13 H ASP 13 14.397 -14.588 -7.431 99 HA ASP 13 HA ASP 13 12.211 -15.948 -5.996 100 HB2 ASP 13 HB2 ASP 13 14.281 -14.010 -5.047 101 HB3 ASP 13 HB3 ASP 13 12.690 -13.993 -4.290 102 H ARG 14 H ARG 14 10.254 -15.203 -6.445 103 HA ARG 14 HA ARG 14 8.547 -13.862 -7.124 104 HB2 ARG 14 HB2 ARG 14 10.436 -12.027 -5.799 105 HB3 ARG 14 HB3 ARG 14 9.308 -11.256 -6.906 106 HG2 ARG 14 HG2 ARG 14 7.466 -12.468 -5.673 107 HG3 ARG 14 HG3 ARG 14 8.683 -12.886 -4.464 108 HD2 ARG 14 HD2 ARG 14 9.181 -10.408 -4.309 109 HD3 ARG 14 HD3 ARG 14 7.722 -10.150 -5.266 110 HE ARG 14 HE ARG 14 7.855 -10.764 -2.492 111 HH11 ARG 14 HH11 ARG 14 5.955 -11.271 -5.364 112 HH12 ARG 14 HH12 ARG 14 4.471 -11.500 -4.500 113 HH21 ARG 14 HH21 ARG 14 5.908 -11.063 -1.342 114 HH22 ARG 14 HH22 ARG 14 4.445 -11.381 -2.212 115 H LYS 15 H LYS 15 9.014 -14.696 -9.281 116 HA LYS 15 HA LYS 15 10.516 -13.016 -11.092 117 HB2 LYS 15 HB2 LYS 15 9.753 -14.669 -12.811 118 HB3 LYS 15 HB3 LYS 15 10.642 -15.379 -11.469 119 HG2 LYS 15 HG2 LYS 15 7.753 -15.312 -11.057 120 HG3 LYS 15 HG3 LYS 15 8.258 -16.277 -12.445 121 HD2 LYS 15 HD2 LYS 15 9.755 -16.619 -9.902 122 HD3 LYS 15 HD3 LYS 15 8.124 -17.290 -9.994 123 HE2 LYS 15 HE2 LYS 15 9.564 -19.025 -10.677 124 HE3 LYS 15 HE3 LYS 15 8.852 -18.389 -12.159 125 HZ1 LYS 15 HZ1 LYS 15 11.371 -17.202 -11.304 126 HZ2 LYS 15 HZ2 LYS 15 10.821 -17.567 -12.860 127 HZ3 LYS 15 HZ3 LYS 15 11.445 -18.793 -11.875 128 H ASN 16 H ASN 16 7.187 -13.553 -10.206 129 HA ASN 16 HA ASN 16 6.101 -12.143 -12.468 130 HB2 ASN 16 HB2 ASN 16 4.832 -13.040 -9.872 131 HB3 ASN 16 HB3 ASN 16 3.950 -12.328 -11.220 132 HD21 ASN 16 HD21 ASN 16 3.202 -13.636 -12.739 133 HD22 ASN 16 HD22 ASN 16 3.639 -15.295 -12.942 134 H ASP 17 H ASP 17 7.494 -11.257 -9.505 135 HA ASP 17 HA ASP 17 6.256 -8.587 -9.640 136 HB2 ASP 17 HB2 ASP 17 7.452 -10.094 -7.314 137 HB3 ASP 17 HB3 ASP 17 7.080 -8.373 -7.248 138 H CYS 18 H CYS 18 8.442 -9.459 -11.307 139 HA CYS 18 HA CYS 18 10.970 -8.742 -10.438 140 HB2 CYS 18 HB2 CYS 18 9.615 -8.793 -13.095 141 HB3 CYS 18 HB3 CYS 18 11.171 -7.977 -12.979 142 H CYS 19 H CYS 19 9.010 -6.627 -12.530 143 HA CYS 19 HA CYS 19 9.000 -4.375 -10.899 144 HB2 CYS 19 HB2 CYS 19 11.579 -4.865 -11.780 145 HB3 CYS 19 HB3 CYS 19 10.987 -3.654 -12.914 146 H GLU 20 H GLU 20 9.188 -2.286 -12.631 147 HA GLU 20 HA GLU 20 6.956 -2.827 -14.417 148 HB2 GLU 20 HB2 GLU 20 6.900 -0.860 -12.920 149 HB3 GLU 20 HB3 GLU 20 8.312 -0.210 -13.743 150 HG2 GLU 20 HG2 GLU 20 7.103 0.108 -15.755 151 HG3 GLU 20 HG3 GLU 20 5.730 -0.819 -15.152 152 H GLY 21 H GLY 21 7.380 -3.497 -16.413 153 HA2 GLY 21 HA2 GLY 21 8.152 -3.265 -18.601 154 HA3 GLY 21 HA3 GLY 21 9.248 -2.004 -18.055 155 H LEU 22 H LEU 22 9.262 -4.937 -16.270 156 HA LEU 22 HA LEU 22 11.771 -5.721 -17.602 157 HB2 LEU 22 HB2 LEU 22 10.973 -5.907 -14.704 158 HB3 LEU 22 HB3 LEU 22 12.390 -6.711 -15.379 159 HG LEU 22 HG LEU 22 11.915 -3.742 -15.149 160 HD11 LEU 22 HD11 LEU 22 13.143 -3.815 -13.297 161 HD12 LEU 22 HD12 LEU 22 14.359 -4.844 -14.055 162 HD13 LEU 22 HD13 LEU 22 12.924 -5.564 -13.327 163 HD21 LEU 22 HD21 LEU 22 14.258 -3.595 -16.055 164 HD22 LEU 22 HD22 LEU 22 13.022 -4.062 -17.224 165 HD23 LEU 22 HD23 LEU 22 14.095 -5.283 -16.541 166 H GLU 23 H GLU 23 12.302 -8.036 -17.459 167 HA GLU 23 HA GLU 23 10.118 -9.865 -16.944 168 HB2 GLU 23 HB2 GLU 23 9.924 -10.752 -19.134 169 HB3 GLU 23 HB3 GLU 23 9.805 -9.007 -19.304 170 HG2 GLU 23 HG2 GLU 23 12.140 -8.908 -20.004 171 HG3 GLU 23 HG3 GLU 23 12.267 -10.657 -19.826 172 H CYS 24 H CYS 24 10.825 -11.849 -16.362 173 HA CYS 24 HA CYS 24 13.442 -12.277 -15.588 174 HB2 CYS 24 HB2 CYS 24 11.205 -13.593 -15.095 175 HB3 CYS 24 HB3 CYS 24 11.780 -14.625 -16.401 176 H TYR 25 H TYR 25 15.222 -13.253 -16.466 177 HA TYR 25 HA TYR 25 15.139 -13.660 -19.376 178 HB2 TYR 25 HB2 TYR 25 16.711 -11.939 -18.330 179 HB3 TYR 25 HB3 TYR 25 17.621 -13.307 -17.701 180 HD1 TYR 25 HD1 TYR 25 16.130 -12.262 -20.973 181 HD2 TYR 25 HD2 TYR 25 19.474 -13.910 -18.922 182 HE1 TYR 25 HE1 TYR 25 17.349 -12.421 -23.103 183 HE2 TYR 25 HE2 TYR 25 20.703 -14.072 -21.047 184 HH TYR 25 HH TYR 25 19.816 -14.263 -23.676 185 H LYS 26 H LYS 26 16.607 -15.345 -20.244 186 HA LYS 26 HA LYS 26 16.487 -17.744 -18.546 187 HB2 LYS 26 HB2 LYS 26 15.204 -18.012 -20.552 188 HB3 LYS 26 HB3 LYS 26 16.523 -17.408 -21.546 189 HG2 LYS 26 HG2 LYS 26 17.116 -19.791 -19.915 190 HG3 LYS 26 HG3 LYS 26 15.967 -20.009 -21.238 191 HD2 LYS 26 HD2 LYS 26 17.533 -19.594 -22.847 192 HD3 LYS 26 HD3 LYS 26 18.472 -18.518 -21.810 193 HE2 LYS 26 HE2 LYS 26 19.886 -20.293 -21.809 194 HE3 LYS 26 HE3 LYS 26 18.845 -20.797 -20.478 195 HZ1 LYS 26 HZ1 LYS 26 17.539 -21.795 -22.591 196 HZ2 LYS 26 HZ2 LYS 26 18.661 -22.666 -21.674 197 HZ3 LYS 26 HZ3 LYS 26 19.140 -21.932 -23.121 198 H ARG 27 H ARG 27 18.272 -19.004 -18.204 199 HA ARG 27 HA ARG 27 20.786 -18.245 -19.498 200 HB2 ARG 27 HB2 ARG 27 20.153 -18.061 -16.596 201 HB3 ARG 27 HB3 ARG 27 21.748 -18.653 -17.042 202 HG2 ARG 27 HG2 ARG 27 20.716 -16.132 -18.259 203 HG3 ARG 27 HG3 ARG 27 21.364 -16.119 -16.617 204 HD2 ARG 27 HD2 ARG 27 23.268 -15.672 -17.800 205 HD3 ARG 27 HD3 ARG 27 23.344 -17.432 -17.752 206 HE ARG 27 HE ARG 27 21.948 -16.761 -20.046 207 HH11 ARG 27 HH11 ARG 27 25.134 -16.257 -18.733 208 HH12 ARG 27 HH12 ARG 27 25.903 -16.187 -20.283 209 HH21 ARG 27 HH21 ARG 27 22.951 -16.670 -22.093 210 HH22 ARG 27 HH22 ARG 27 24.661 -16.420 -22.194 211 H ARG 28 H ARG 28 22.478 -19.865 -19.255 212 HA ARG 28 HA ARG 28 21.441 -22.507 -19.563 213 HB2 ARG 28 HB2 ARG 28 24.219 -21.347 -19.542 214 HB3 ARG 28 HB3 ARG 28 23.948 -23.082 -19.645 215 HG2 ARG 28 HG2 ARG 28 24.191 -22.428 -21.857 216 HG3 ARG 28 HG3 ARG 28 22.442 -22.527 -21.646 217 HD2 ARG 28 HD2 ARG 28 22.289 -20.139 -21.382 218 HD3 ARG 28 HD3 ARG 28 24.045 -19.986 -21.406 219 HE ARG 28 HE ARG 28 22.299 -20.274 -23.671 220 HH11 ARG 28 HH11 ARG 28 25.538 -20.716 -22.474 221 HH12 ARG 28 HH12 ARG 28 26.267 -20.645 -24.044 222 HH21 ARG 28 HH21 ARG 28 23.247 -20.178 -25.744 223 HH22 ARG 28 HH22 ARG 28 24.964 -20.338 -25.903 224 H HIS 29 H HIS 29 24.039 -21.406 -17.383 225 HA HIS 29 HA HIS 29 22.906 -23.149 -15.298 226 HB2 HIS 29 HB2 HIS 29 25.338 -23.487 -14.574 227 HB3 HIS 29 HB3 HIS 29 24.813 -24.333 -16.028 228 HD1 HIS 29 HD1 HIS 29 27.380 -22.087 -14.790 229 HD2 HIS 29 HD2 HIS 29 25.686 -22.966 -18.480 230 HE1 HIS 29 HE1 HIS 29 28.993 -21.194 -16.500 231 H SER 30 H SER 30 22.660 -20.242 -15.809 232 HA SER 30 HA SER 30 23.864 -19.263 -13.303 233 HB2 SER 30 HB2 SER 30 24.624 -18.250 -15.579 234 HB3 SER 30 HB3 SER 30 23.065 -17.426 -15.543 235 HG SER 30 HG SER 30 25.164 -17.252 -13.646 236 H PHE 31 H PHE 31 22.576 -18.208 -11.862 237 HA PHE 31 HA PHE 31 19.883 -18.772 -11.713 238 HB2 PHE 31 HB2 PHE 31 19.756 -16.988 -10.001 239 HB3 PHE 31 HB3 PHE 31 21.156 -18.031 -9.777 240 HD1 PHE 31 HD1 PHE 31 23.407 -17.211 -10.289 241 HD2 PHE 31 HD2 PHE 31 19.997 -14.678 -10.545 242 HE1 PHE 31 HE1 PHE 31 24.877 -15.238 -10.291 243 HE2 PHE 31 HE2 PHE 31 21.460 -12.701 -10.549 244 HZ PHE 31 HZ PHE 31 23.904 -12.979 -10.421 245 H GLU 32 H GLU 32 18.068 -17.954 -12.559 246 HA GLU 32 HA GLU 32 18.142 -16.180 -14.734 247 HB2 GLU 32 HB2 GLU 32 15.691 -16.734 -13.070 248 HB3 GLU 32 HB3 GLU 32 15.772 -16.346 -14.782 249 HG2 GLU 32 HG2 GLU 32 16.611 -18.902 -13.441 250 HG3 GLU 32 HG3 GLU 32 15.281 -18.661 -14.573 251 H VAL 33 H VAL 33 17.440 -14.044 -14.963 252 HA VAL 33 HA VAL 33 16.830 -12.505 -12.568 253 HB VAL 33 HB VAL 33 19.160 -11.755 -14.338 254 HG11 VAL 33 HG11 VAL 33 19.468 -10.161 -12.272 255 HG12 VAL 33 HG12 VAL 33 18.380 -9.729 -13.594 256 HG13 VAL 33 HG13 VAL 33 17.730 -10.405 -12.100 257 HG21 VAL 33 HG21 VAL 33 19.930 -13.551 -13.039 258 HG22 VAL 33 HG22 VAL 33 20.448 -12.111 -12.162 259 HG23 VAL 33 HG23 VAL 33 19.037 -13.017 -11.615 260 H CYS 34 H CYS 34 15.857 -10.492 -12.991 261 HA CYS 34 HA CYS 34 14.314 -10.392 -15.368 262 HB2 CYS 34 HB2 CYS 34 14.732 -8.124 -13.420 263 HB3 CYS 34 HB3 CYS 34 13.347 -8.396 -14.473 264 H VAL 35 H VAL 35 14.366 -8.907 -17.074 265 HA VAL 35 HA VAL 35 16.772 -7.249 -17.324 266 HB VAL 35 HB VAL 35 16.865 -7.988 -19.775 267 HG11 VAL 35 HG11 VAL 35 17.888 -10.334 -18.776 268 HG12 VAL 35 HG12 VAL 35 18.735 -8.787 -18.847 269 HG13 VAL 35 HG13 VAL 35 17.899 -9.269 -17.370 270 HG21 VAL 35 HG21 VAL 35 15.988 -10.136 -20.340 271 HG22 VAL 35 HG22 VAL 35 15.452 -10.416 -18.683 272 HG23 VAL 35 HG23 VAL 35 14.666 -9.183 -19.667 273 HA PRO 36 HA PRO 36 14.083 -4.204 -18.988 274 HB2 PRO 36 HB2 PRO 36 15.718 -2.944 -20.750 275 HB3 PRO 36 HB3 PRO 36 15.887 -2.781 -18.999 276 HG2 PRO 36 HG2 PRO 36 17.415 -4.522 -20.894 277 HG3 PRO 36 HG3 PRO 36 18.014 -3.546 -19.541 278 HD2 PRO 36 HD2 PRO 36 17.634 -6.219 -19.353 279 HD3 PRO 36 HD3 PRO 36 17.413 -5.124 -17.972 280 H ILE 37 H ILE 37 12.431 -4.666 -20.294 281 HA ILE 37 HA ILE 37 12.688 -6.282 -22.627 282 HB ILE 37 HB ILE 37 10.362 -4.606 -21.675 283 HG12 ILE 37 HG12 ILE 37 10.394 -7.581 -21.559 284 HG13 ILE 37 HG13 ILE 37 11.377 -6.715 -20.382 285 HG21 ILE 37 HG21 ILE 37 10.794 -5.967 -24.153 286 HG22 ILE 37 HG22 ILE 37 9.494 -6.758 -23.265 287 HG23 ILE 37 HG23 ILE 37 9.394 -5.034 -23.625 288 HD11 ILE 37 HD11 ILE 37 9.597 -6.236 -19.160 289 HD12 ILE 37 HD12 ILE 37 8.744 -5.570 -20.554 290 HD13 ILE 37 HD13 ILE 37 8.666 -7.298 -20.215 291 HA PRO 38 HA PRO 38 13.855 -3.020 -25.412 292 HB2 PRO 38 HB2 PRO 38 13.742 -4.513 -27.677 293 HB3 PRO 38 HB3 PRO 38 15.075 -4.621 -26.521 294 HG2 PRO 38 HG2 PRO 38 12.692 -6.405 -26.837 295 HG3 PRO 38 HG3 PRO 38 14.387 -6.842 -26.555 296 HD2 PRO 38 HD2 PRO 38 12.543 -6.811 -24.573 297 HD3 PRO 38 HD3 PRO 38 14.252 -6.420 -24.294 298 H GLY 39 H GLY 39 12.504 -1.463 -26.044 299 HA2 GLY 39 HA2 GLY 39 10.852 -0.479 -27.362 300 HA3 GLY 39 HA3 GLY 39 10.301 -2.082 -27.826 301 H PHE 40 H PHE 40 10.690 -1.768 -24.484 302 HA PHE 40 HA PHE 40 7.975 -2.204 -23.930 303 HB2 PHE 40 HB2 PHE 40 9.472 -2.924 -22.271 304 HB3 PHE 40 HB3 PHE 40 10.322 -1.381 -22.241 305 HD1 PHE 40 HD1 PHE 40 6.972 -2.845 -21.524 306 HD2 PHE 40 HD2 PHE 40 9.875 0.111 -20.545 307 HE1 PHE 40 HE1 PHE 40 5.596 -2.131 -19.614 308 HE2 PHE 40 HE2 PHE 40 8.504 0.829 -18.633 309 HZ PHE 40 HZ PHE 40 6.360 -0.291 -18.166 310 H CYS 41 H CYS 41 6.360 -0.874 -23.114 311 HA CYS 41 HA CYS 41 6.819 1.966 -22.821 312 HB2 CYS 41 HB2 CYS 41 5.295 2.687 -24.530 313 HB3 CYS 41 HB3 CYS 41 6.476 1.621 -25.282 314 H LEU 42 H LEU 42 4.274 2.908 -22.834 315 HA LEU 42 HA LEU 42 2.831 1.187 -20.931 316 HB2 LEU 42 HB2 LEU 42 2.885 4.175 -20.692 317 HB3 LEU 42 HB3 LEU 42 2.388 2.981 -19.493 318 HG LEU 42 HG LEU 42 5.236 3.352 -20.407 319 HD11 LEU 42 HD11 LEU 42 3.651 5.007 -18.697 320 HD12 LEU 42 HD12 LEU 42 5.346 5.175 -19.153 321 HD13 LEU 42 HD13 LEU 42 4.904 4.205 -17.749 322 HD21 LEU 42 HD21 LEU 42 5.474 2.233 -18.041 323 HD22 LEU 42 HD22 LEU 42 5.188 1.257 -19.482 324 HD23 LEU 42 HD23 LEU 42 3.850 1.644 -18.399 325 H VAL 43 H VAL 43 0.519 1.945 -20.629 326 HA VAL 43 HA VAL 43 -0.575 2.718 -23.253 327 HB VAL 43 HB VAL 43 -2.666 1.579 -22.506 328 HG11 VAL 43 HG11 VAL 43 -1.672 -0.764 -22.661 329 HG12 VAL 43 HG12 VAL 43 -1.319 0.349 -23.985 330 HG13 VAL 43 HG13 VAL 43 -0.102 0.034 -22.747 331 HG21 VAL 43 HG21 VAL 43 -2.881 0.501 -20.515 332 HG22 VAL 43 HG22 VAL 43 -1.163 0.125 -20.404 333 HG23 VAL 43 HG23 VAL 43 -1.736 1.745 -20.015 334 H LYS 44 H LYS 44 -3.080 3.408 -22.731 335 HA LYS 44 HA LYS 44 -2.791 5.950 -21.403 336 HB2 LYS 44 HB2 LYS 44 -4.996 6.442 -22.240 337 HB3 LYS 44 HB3 LYS 44 -4.071 5.669 -23.521 338 HG2 LYS 44 HG2 LYS 44 -5.397 3.616 -22.117 339 HG3 LYS 44 HG3 LYS 44 -6.574 4.901 -22.397 340 HD2 LYS 44 HD2 LYS 44 -6.469 4.687 -24.674 341 HD3 LYS 44 HD3 LYS 44 -4.805 4.098 -24.650 342 HE2 LYS 44 HE2 LYS 44 -6.634 2.292 -23.300 343 HE3 LYS 44 HE3 LYS 44 -7.095 2.573 -24.979 344 HZ1 LYS 44 HZ1 LYS 44 -4.706 1.281 -23.897 345 HZ2 LYS 44 HZ2 LYS 44 -4.532 2.164 -25.329 346 HZ3 LYS 44 HZ3 LYS 44 -5.630 0.879 -25.256 347 H TRP 45 H TRP 45 -3.235 2.986 -20.200 348 HA TRP 45 HA TRP 45 -4.940 3.965 -18.004 349 HB2 TRP 45 HB2 TRP 45 -4.868 1.238 -19.292 350 HB3 TRP 45 HB3 TRP 45 -5.565 1.509 -17.696 351 HD1 TRP 45 HD1 TRP 45 -6.346 1.801 -21.355 352 HE1 TRP 45 HE1 TRP 45 -8.730 2.720 -21.662 353 HE3 TRP 45 HE3 TRP 45 -7.294 3.223 -16.536 354 HZ2 TRP 45 HZ2 TRP 45 -10.745 3.893 -20.073 355 HZ3 TRP 45 HZ3 TRP 45 -9.474 4.236 -16.014 356 HH2 TRP 45 HH2 TRP 45 -11.163 4.564 -17.747 357 H LYS 46 H LYS 46 -1.999 3.979 -18.365 358 HA LYS 46 HA LYS 46 -1.287 2.331 -16.027 359 HB2 LYS 46 HB2 LYS 46 0.333 2.992 -18.484 360 HB3 LYS 46 HB3 LYS 46 1.066 2.389 -17.003 361 HG2 LYS 46 HG2 LYS 46 -1.182 0.771 -17.899 362 HG3 LYS 46 HG3 LYS 46 0.131 0.860 -19.077 363 HD2 LYS 46 HD2 LYS 46 1.587 0.426 -16.890 364 HD3 LYS 46 HD3 LYS 46 0.084 -0.333 -16.359 365 HE2 LYS 46 HE2 LYS 46 1.770 -1.017 -18.754 366 HE3 LYS 46 HE3 LYS 46 1.378 -2.038 -17.372 367 HZ1 LYS 46 HZ1 LYS 46 -0.164 -1.483 -19.754 368 HZ2 LYS 46 HZ2 LYS 46 -1.056 -1.455 -18.317 369 HZ3 LYS 46 HZ3 LYS 46 -0.183 -2.839 -18.744 370 H GLN 47 H GLN 47 0.483 3.204 -14.708 371 HA GLN 47 HA GLN 47 0.039 5.947 -14.096 372 HB2 GLN 47 HB2 GLN 47 1.506 3.700 -12.944 373 HB3 GLN 47 HB3 GLN 47 2.344 5.233 -12.747 374 HG2 GLN 47 HG2 GLN 47 0.611 6.160 -11.497 375 HG3 GLN 47 HG3 GLN 47 -0.548 4.945 -12.034 376 HE21 GLN 47 HE21 GLN 47 -1.021 4.690 -9.769 377 HE22 GLN 47 HE22 GLN 47 -0.015 3.683 -8.791 378 H CYS 48 H CYS 48 1.091 7.718 -14.744 379 HA CYS 48 HA CYS 48 3.280 7.398 -16.644 380 HB2 CYS 48 HB2 CYS 48 2.812 9.581 -17.383 381 HB3 CYS 48 HB3 CYS 48 1.229 8.901 -17.018 382 H ASP 49 H ASP 49 2.740 8.289 -13.379 383 HA ASP 49 HA ASP 49 4.751 10.086 -12.820 384 HB2 ASP 49 HB2 ASP 49 3.147 9.390 -11.133 385 HB3 ASP 49 HB3 ASP 49 3.803 7.756 -11.140 386 H GLY 50 H GLY 50 6.848 10.030 -13.266 387 HA2 GLY 50 HA2 GLY 50 9.035 9.214 -13.075 388 HA3 GLY 50 HA3 GLY 50 8.385 7.633 -12.666 389 H ARG 51 H ARG 51 6.585 7.577 -14.973 390 HA ARG 51 HA ARG 51 8.605 7.058 -17.054 391 HB2 ARG 51 HB2 ARG 51 5.886 5.766 -16.817 392 HB3 ARG 51 HB3 ARG 51 7.204 5.294 -17.881 393 HG2 ARG 51 HG2 ARG 51 7.144 5.068 -14.881 394 HG3 ARG 51 HG3 ARG 51 7.052 3.749 -16.049 395 HD2 ARG 51 HD2 ARG 51 9.313 4.458 -16.877 396 HD3 ARG 51 HD3 ARG 51 9.390 5.569 -15.511 397 HE ARG 51 HE ARG 51 8.841 3.155 -14.377 398 HH11 ARG 51 HH11 ARG 51 11.314 4.346 -16.516 399 HH12 ARG 51 HH12 ARG 51 12.525 3.249 -15.940 400 HH21 ARG 51 HH21 ARG 51 10.426 1.706 -13.608 401 HH22 ARG 51 HH22 ARG 51 12.018 1.747 -14.285 402 H GLU 52 H GLU 52 7.580 9.632 -16.774 403 HA GLU 52 HA GLU 52 5.340 10.130 -18.432 404 HB2 GLU 52 HB2 GLU 52 5.969 12.454 -18.310 405 HB3 GLU 52 HB3 GLU 52 6.209 11.721 -16.730 406 HG2 GLU 52 HG2 GLU 52 8.643 11.429 -17.418 407 HG3 GLU 52 HG3 GLU 52 8.276 12.531 -18.743 408 H ARG 53 H ARG 53 8.500 9.190 -19.149 409 HA ARG 53 HA ARG 53 8.142 10.006 -21.957 410 HB2 ARG 53 HB2 ARG 53 10.764 9.816 -20.462 411 HB3 ARG 53 HB3 ARG 53 10.571 10.242 -22.157 412 HG2 ARG 53 HG2 ARG 53 9.028 12.129 -21.142 413 HG3 ARG 53 HG3 ARG 53 10.037 11.849 -19.721 414 HD2 ARG 53 HD2 ARG 53 11.203 13.505 -20.838 415 HD3 ARG 53 HD3 ARG 53 12.007 12.038 -21.393 416 HE ARG 53 HE ARG 53 9.881 12.790 -23.129 417 HH11 ARG 53 HH11 ARG 53 13.176 13.522 -22.275 418 HH12 ARG 53 HH12 ARG 53 13.577 14.155 -23.837 419 HH21 ARG 53 HH21 ARG 53 10.398 13.621 -25.190 420 HH22 ARG 53 HH22 ARG 53 11.996 14.211 -25.495 421 H ASP 54 H ASP 54 7.459 7.518 -20.480 422 HA ASP 54 HA ASP 54 9.133 5.639 -22.017 423 HB2 ASP 54 HB2 ASP 54 8.877 5.668 -19.308 424 HB3 ASP 54 HB3 ASP 54 7.585 4.557 -19.751 425 H CYS 55 H CYS 55 5.958 6.778 -21.317 426 HA CYS 55 HA CYS 55 4.327 4.679 -22.030 427 HB2 CYS 55 HB2 CYS 55 3.911 7.578 -22.789 428 HB3 CYS 55 HB3 CYS 55 2.662 6.343 -22.667 429 H CYS 56 H CYS 56 3.039 4.471 -24.087 430 HA CYS 56 HA CYS 56 4.788 3.903 -26.235 431 HB2 CYS 56 HB2 CYS 56 1.799 3.901 -25.920 432 HB3 CYS 56 HB3 CYS 56 2.536 3.613 -27.493 433 H ALA 57 H ALA 57 3.843 4.664 -28.555 434 HA ALA 57 HA ALA 57 4.534 7.439 -28.709 435 HB1 ALA 57 HB1 ALA 57 5.327 6.178 -30.499 436 HB2 ALA 57 HB2 ALA 57 3.782 5.359 -30.731 437 HB3 ALA 57 HB3 ALA 57 3.958 7.053 -31.185 438 H GLY 58 H GLY 58 3.224 9.151 -28.705 439 HA2 GLY 58 HA2 GLY 58 1.269 10.329 -29.388 440 HA3 GLY 58 HA3 GLY 58 0.410 8.798 -29.463 441 H LEU 59 H LEU 59 1.824 8.246 -26.746 442 HA LEU 59 HA LEU 59 -0.389 9.213 -25.157 443 HB2 LEU 59 HB2 LEU 59 1.917 7.367 -24.671 444 HB3 LEU 59 HB3 LEU 59 0.952 7.968 -23.324 445 HG LEU 59 HG LEU 59 -0.070 6.326 -25.641 446 HD11 LEU 59 HD11 LEU 59 1.148 4.859 -24.296 447 HD12 LEU 59 HD12 LEU 59 -0.508 4.702 -23.709 448 HD13 LEU 59 HD13 LEU 59 0.659 5.669 -22.807 449 HD21 LEU 59 HD21 LEU 59 -1.881 7.640 -25.017 450 HD22 LEU 59 HD22 LEU 59 -1.418 7.647 -23.315 451 HD23 LEU 59 HD23 LEU 59 -2.087 6.185 -24.041 452 H GLU 60 H GLU 60 0.247 9.953 -22.830 453 HA GLU 60 HA GLU 60 2.627 11.520 -22.586 454 HB2 GLU 60 HB2 GLU 60 1.697 13.707 -22.607 455 HB3 GLU 60 HB3 GLU 60 1.159 12.923 -24.086 456 HG2 GLU 60 HG2 GLU 60 -0.933 12.316 -22.625 457 HG3 GLU 60 HG3 GLU 60 -0.396 13.699 -21.674 458 H CYS 61 H CYS 61 2.817 12.544 -20.500 459 HA CYS 61 HA CYS 61 1.693 10.986 -18.417 460 HB2 CYS 61 HB2 CYS 61 3.947 12.228 -18.458 461 HB3 CYS 61 HB3 CYS 61 3.021 13.658 -18.015 462 H TRP 62 H TRP 62 -0.511 11.131 -18.319 463 HA TRP 62 HA TRP 62 -1.849 13.684 -18.311 464 HB2 TRP 62 HB2 TRP 62 -2.730 11.389 -19.185 465 HB3 TRP 62 HB3 TRP 62 -3.157 11.107 -17.500 466 HD1 TRP 62 HD1 TRP 62 -3.584 14.689 -18.207 467 HE1 TRP 62 HE1 TRP 62 -6.060 15.250 -18.635 468 HE3 TRP 62 HE3 TRP 62 -5.397 9.947 -18.801 469 HZ2 TRP 62 HZ2 TRP 62 -8.464 13.864 -19.154 470 HZ3 TRP 62 HZ3 TRP 62 -7.797 9.650 -19.260 471 HH2 TRP 62 HH2 TRP 62 -9.296 11.569 -19.432 472 H LYS 63 H LYS 63 -2.510 14.843 -16.597 473 HA LYS 63 HA LYS 63 -1.826 13.811 -13.935 474 HB2 LYS 63 HB2 LYS 63 -1.038 16.118 -15.008 475 HB3 LYS 63 HB3 LYS 63 -2.583 16.660 -14.368 476 HG2 LYS 63 HG2 LYS 63 -0.747 15.146 -12.582 477 HG3 LYS 63 HG3 LYS 63 -0.389 16.835 -12.947 478 HD2 LYS 63 HD2 LYS 63 -3.112 15.979 -12.017 479 HD3 LYS 63 HD3 LYS 63 -1.813 16.317 -10.870 480 HE2 LYS 63 HE2 LYS 63 -2.639 18.268 -13.004 481 HE3 LYS 63 HE3 LYS 63 -3.396 18.231 -11.412 482 HZ1 LYS 63 HZ1 LYS 63 -1.693 19.335 -10.555 483 HZ2 LYS 63 HZ2 LYS 63 -1.086 19.552 -12.119 484 HZ3 LYS 63 HZ3 LYS 63 -0.567 18.240 -11.185 485 H ARG 64 H ARG 64 -3.589 12.674 -13.276 486 HA ARG 64 HA ARG 64 -6.167 14.103 -13.254 487 HB2 ARG 64 HB2 ARG 64 -5.446 11.344 -13.904 488 HB3 ARG 64 HB3 ARG 64 -6.755 11.456 -12.734 489 HG2 ARG 64 HG2 ARG 64 -8.168 12.532 -14.218 490 HG3 ARG 64 HG3 ARG 64 -6.837 13.073 -15.244 491 HD2 ARG 64 HD2 ARG 64 -6.781 11.143 -16.406 492 HD3 ARG 64 HD3 ARG 64 -7.103 10.158 -14.981 493 HE ARG 64 HE ARG 64 -8.997 11.019 -16.903 494 HH11 ARG 64 HH11 ARG 64 -8.604 10.460 -13.489 495 HH12 ARG 64 HH12 ARG 64 -10.282 10.126 -13.218 496 HH21 ARG 64 HH21 ARG 64 -11.209 10.581 -16.558 497 HH22 ARG 64 HH22 ARG 64 -11.763 10.194 -14.964 498 H SER 65 H SER 65 -7.077 14.556 -11.346 499 HA SER 65 HA SER 65 -6.095 13.161 -8.950 500 HB2 SER 65 HB2 SER 65 -6.692 16.115 -8.935 501 HB3 SER 65 HB3 SER 65 -5.805 15.167 -7.740 502 HG SER 65 HG SER 65 -4.973 16.136 -10.232 503 H GLY 66 H GLY 66 -7.638 12.540 -7.548 504 HA2 GLY 66 HA2 GLY 66 -9.735 13.021 -6.396 505 HA3 GLY 66 HA3 GLY 66 -10.348 13.652 -7.918 506 H ASN 67 H ASN 67 -8.972 11.305 -9.289 507 HA ASN 67 HA ASN 67 -11.074 9.333 -8.684 508 HB2 ASN 67 HB2 ASN 67 -9.729 10.102 -11.264 509 HB3 ASN 67 HB3 ASN 67 -10.549 8.554 -11.091 510 HD21 ASN 67 HD21 ASN 67 -10.893 11.793 -11.848 511 HD22 ASN 67 HD22 ASN 67 -12.619 11.881 -11.837 512 H LYS 68 H LYS 68 -7.715 9.613 -9.827 513 HA LYS 68 HA LYS 68 -6.849 7.493 -8.116 514 HB2 LYS 68 HB2 LYS 68 -7.489 6.930 -10.943 515 HB3 LYS 68 HB3 LYS 68 -5.926 6.339 -10.395 516 HG2 LYS 68 HG2 LYS 68 -7.271 5.353 -8.414 517 HG3 LYS 68 HG3 LYS 68 -8.662 5.575 -9.476 518 HD2 LYS 68 HD2 LYS 68 -8.004 3.410 -9.969 519 HD3 LYS 68 HD3 LYS 68 -7.197 4.345 -11.231 520 HE2 LYS 68 HE2 LYS 68 -5.111 4.144 -10.212 521 HE3 LYS 68 HE3 LYS 68 -5.810 3.738 -8.646 522 HZ1 LYS 68 HZ1 LYS 68 -6.684 1.683 -9.987 523 HZ2 LYS 68 HZ2 LYS 68 -5.122 1.695 -9.336 524 HZ3 LYS 68 HZ3 LYS 68 -5.356 2.026 -10.978 525 H SER 69 H SER 69 -4.477 6.827 -8.923 526 HA SER 69 HA SER 69 -2.898 9.118 -8.643 527 HB2 SER 69 HB2 SER 69 -2.358 6.266 -9.353 528 HB3 SER 69 HB3 SER 69 -1.071 7.448 -9.589 529 HG SER 69 HG SER 69 -2.393 6.739 -7.193 530 H SER 70 H SER 70 -1.008 9.526 -10.275 531 HA SER 70 HA SER 70 -2.181 10.641 -12.603 532 HB2 SER 70 HB2 SER 70 0.778 10.223 -12.375 533 HB3 SER 70 HB3 SER 70 -0.109 11.609 -13.010 534 HG SER 70 HG SER 70 0.953 11.570 -10.731 535 H VAL 71 H VAL 71 -2.619 9.710 -14.481 536 HA VAL 71 HA VAL 71 -1.161 7.253 -15.209 537 HB VAL 71 HB VAL 71 -3.210 6.643 -16.532 538 HG11 VAL 71 HG11 VAL 71 -4.238 5.574 -14.732 539 HG12 VAL 71 HG12 VAL 71 -2.585 5.839 -14.174 540 HG13 VAL 71 HG13 VAL 71 -3.882 6.898 -13.622 541 HG21 VAL 71 HG21 VAL 71 -5.064 8.163 -14.950 542 HG22 VAL 71 HG22 VAL 71 -3.991 9.245 -15.838 543 HG23 VAL 71 HG23 VAL 71 -4.936 8.035 -16.705 544 H CYS 72 H CYS 72 -1.579 6.841 -17.712 545 HA CYS 72 HA CYS 72 -0.674 9.289 -19.061 546 HB2 CYS 72 HB2 CYS 72 0.123 6.504 -19.190 547 HB3 CYS 72 HB3 CYS 72 -0.280 7.125 -20.787 548 H ALA 73 H ALA 73 -1.445 9.767 -21.188 549 HA ALA 73 HA ALA 73 -3.857 8.392 -22.076 550 HB1 ALA 73 HB1 ALA 73 -5.216 9.900 -21.160 551 HB2 ALA 73 HB2 ALA 73 -3.876 10.968 -20.743 552 HB3 ALA 73 HB3 ALA 73 -4.596 11.042 -22.351 553 HA PRO 74 HA PRO 74 -2.321 9.263 -26.094 554 HB2 PRO 74 HB2 PRO 74 -4.619 9.512 -27.517 555 HB3 PRO 74 HB3 PRO 74 -4.029 7.961 -26.908 556 HG2 PRO 74 HG2 PRO 74 -6.125 9.769 -25.770 557 HG3 PRO 74 HG3 PRO 74 -6.140 8.004 -25.933 558 HD2 PRO 74 HD2 PRO 74 -5.569 9.247 -23.595 559 HD3 PRO 74 HD3 PRO 74 -4.840 7.694 -24.054 560 H ILE 75 H ILE 75 -2.551 10.825 -27.968 561 HA ILE 75 HA ILE 75 -2.150 13.441 -27.121 562 HB ILE 75 HB ILE 75 -2.522 14.061 -29.550 563 HG12 ILE 75 HG12 ILE 75 -2.631 11.091 -30.024 564 HG13 ILE 75 HG13 ILE 75 -4.104 12.040 -29.852 565 HG21 ILE 75 HG21 ILE 75 -0.622 11.760 -29.202 566 HG22 ILE 75 HG22 ILE 75 -0.440 13.188 -30.220 567 HG23 ILE 75 HG23 ILE 75 -0.345 13.337 -28.466 568 HD11 ILE 75 HD11 ILE 75 -3.879 12.098 -32.105 569 HD12 ILE 75 HD12 ILE 75 -2.919 13.520 -31.696 570 HD13 ILE 75 HD13 ILE 75 -2.120 11.987 -32.047 571 H THR 76 H THR 76 -3.391 15.348 -27.363 572 HA THR 76 HA THR 76 -6.287 14.953 -27.676 573 HB THR 76 HB THR 76 -6.716 16.511 -25.818 574 HG1 THR 76 HG1 THR 76 -4.968 17.710 -25.451 575 HG21 THR 76 HG21 THR 76 -5.109 14.664 -24.296 576 HG22 THR 76 HG22 THR 76 -5.905 13.838 -25.635 577 HG23 THR 76 HG23 THR 76 -6.862 14.745 -24.465 Start of MODEL 16 1 H1 SER 1 H SER 1 3.084 -3.028 -1.884 2 HA SER 1 HA SER 1 3.197 -0.198 -1.074 3 HB2 SER 1 HB2 SER 1 2.122 -1.286 0.690 4 HB3 SER 1 HB3 SER 1 3.099 -2.746 0.514 5 HG SER 1 HG SER 1 3.519 -1.040 2.293 6 H ASN 2 H ASN 2 5.095 -3.207 -0.791 7 HA ASN 2 HA ASN 2 7.548 -1.792 -0.384 8 HB2 ASN 2 HB2 ASN 2 7.225 -4.010 0.581 9 HB3 ASN 2 HB3 ASN 2 7.029 -4.704 -1.026 10 HD21 ASN 2 HD21 ASN 2 8.737 -5.853 -1.531 11 HD22 ASN 2 HD22 ASN 2 10.384 -5.420 -1.235 12 H GLU 3 H GLU 3 9.375 -1.773 -1.784 13 HA GLU 3 HA GLU 3 8.794 -1.071 -4.440 14 HB2 GLU 3 HB2 GLU 3 11.281 -1.541 -2.869 15 HB3 GLU 3 HB3 GLU 3 11.415 -1.493 -4.622 16 HG2 GLU 3 HG2 GLU 3 10.194 0.681 -2.939 17 HG3 GLU 3 HG3 GLU 3 11.852 0.679 -3.535 18 H CYS 4 H CYS 4 10.263 -2.143 -6.259 19 HA CYS 4 HA CYS 4 9.544 -4.997 -6.271 20 HB2 CYS 4 HB2 CYS 4 9.577 -4.799 -8.746 21 HB3 CYS 4 HB3 CYS 4 8.388 -3.743 -7.991 22 H ILE 5 H ILE 5 10.983 -6.264 -7.897 23 HA ILE 5 HA ILE 5 13.620 -6.257 -6.858 24 HB ILE 5 HB ILE 5 12.541 -7.688 -9.290 25 HG12 ILE 5 HG12 ILE 5 13.032 -8.901 -6.583 26 HG13 ILE 5 HG13 ILE 5 11.509 -8.095 -6.943 27 HG21 ILE 5 HG21 ILE 5 15.196 -7.440 -8.273 28 HG22 ILE 5 HG22 ILE 5 14.654 -9.105 -8.069 29 HG23 ILE 5 HG23 ILE 5 14.623 -8.357 -9.666 30 HD11 ILE 5 HD11 ILE 5 12.340 -10.051 -8.951 31 HD12 ILE 5 HD12 ILE 5 12.016 -10.726 -7.353 32 HD13 ILE 5 HD13 ILE 5 10.771 -9.796 -8.187 33 H ARG 6 H ARG 6 15.357 -5.155 -7.477 34 HA ARG 6 HA ARG 6 15.262 -3.197 -9.501 35 HB2 ARG 6 HB2 ARG 6 17.580 -4.407 -7.993 36 HB3 ARG 6 HB3 ARG 6 17.755 -3.065 -9.114 37 HG2 ARG 6 HG2 ARG 6 17.563 -1.897 -7.183 38 HG3 ARG 6 HG3 ARG 6 15.852 -2.030 -7.591 39 HD2 ARG 6 HD2 ARG 6 15.440 -3.575 -5.952 40 HD3 ARG 6 HD3 ARG 6 17.090 -4.197 -5.976 41 HE ARG 6 HE ARG 6 16.071 -2.118 -4.316 42 HH11 ARG 6 HH11 ARG 6 18.921 -3.217 -5.986 43 HH12 ARG 6 HH12 ARG 6 20.019 -2.418 -4.910 44 HH21 ARG 6 HH21 ARG 6 17.506 -1.061 -2.892 45 HH22 ARG 6 HH22 ARG 6 19.213 -1.193 -3.150 46 H LYS 7 H LYS 7 16.251 -3.088 -11.520 47 HA LYS 7 HA LYS 7 16.155 -5.399 -13.098 48 HB2 LYS 7 HB2 LYS 7 15.967 -2.989 -13.866 49 HB3 LYS 7 HB3 LYS 7 17.721 -2.907 -13.764 50 HG2 LYS 7 HG2 LYS 7 17.977 -4.548 -15.467 51 HG3 LYS 7 HG3 LYS 7 16.251 -4.916 -15.451 52 HD2 LYS 7 HD2 LYS 7 16.511 -3.548 -17.324 53 HD3 LYS 7 HD3 LYS 7 15.927 -2.443 -16.077 54 HE2 LYS 7 HE2 LYS 7 18.159 -1.633 -15.683 55 HE3 LYS 7 HE3 LYS 7 18.833 -2.838 -16.779 56 HZ1 LYS 7 HZ1 LYS 7 17.275 -1.706 -18.487 57 HZ2 LYS 7 HZ2 LYS 7 18.751 -0.978 -18.097 58 HZ3 LYS 7 HZ3 LYS 7 17.316 -0.401 -17.412 59 H TRP 8 H TRP 8 17.652 -6.853 -13.761 60 HA TRP 8 HA TRP 8 19.547 -8.112 -13.721 61 HB2 TRP 8 HB2 TRP 8 20.696 -5.327 -13.712 62 HB3 TRP 8 HB3 TRP 8 21.728 -6.754 -13.730 63 HD1 TRP 8 HD1 TRP 8 20.021 -4.435 -16.015 64 HE1 TRP 8 HE1 TRP 8 20.004 -5.363 -18.415 65 HE3 TRP 8 HE3 TRP 8 21.408 -9.258 -15.033 66 HZ2 TRP 8 HZ2 TRP 8 20.510 -7.814 -19.720 67 HZ3 TRP 8 HZ3 TRP 8 21.619 -10.830 -16.912 68 HH2 TRP 8 HH2 TRP 8 21.178 -10.121 -19.207 69 H LEU 9 H LEU 9 18.353 -8.198 -11.353 70 HA LEU 9 HA LEU 9 20.559 -7.952 -9.414 71 HB2 LEU 9 HB2 LEU 9 18.617 -6.390 -9.058 72 HB3 LEU 9 HB3 LEU 9 17.624 -7.814 -8.757 73 HG LEU 9 HG LEU 9 19.274 -8.356 -6.883 74 HD11 LEU 9 HD11 LEU 9 20.969 -6.993 -6.436 75 HD12 LEU 9 HD12 LEU 9 19.919 -5.575 -6.460 76 HD13 LEU 9 HD13 LEU 9 20.624 -6.177 -7.960 77 HD21 LEU 9 HD21 LEU 9 17.142 -6.338 -6.987 78 HD22 LEU 9 HD22 LEU 9 18.198 -6.235 -5.578 79 HD23 LEU 9 HD23 LEU 9 17.337 -7.735 -5.928 80 H SER 10 H SER 10 17.428 -9.631 -9.777 81 HA SER 10 HA SER 10 18.470 -12.219 -9.859 82 HB2 SER 10 HB2 SER 10 18.752 -11.165 -7.309 83 HB3 SER 10 HB3 SER 10 17.274 -12.121 -7.198 84 HG SER 10 HG SER 10 19.222 -13.319 -6.768 85 H CYS 11 H CYS 11 16.909 -13.523 -10.583 86 HA CYS 11 HA CYS 11 14.147 -12.556 -10.446 87 HB2 CYS 11 HB2 CYS 11 15.078 -13.022 -12.681 88 HB3 CYS 11 HB3 CYS 11 15.370 -14.692 -12.206 89 H VAL 12 H VAL 12 16.213 -14.984 -9.210 90 HA VAL 12 HA VAL 12 14.570 -17.153 -8.789 91 HB VAL 12 HB VAL 12 15.923 -17.668 -6.804 92 HG11 VAL 12 HG11 VAL 12 17.640 -18.315 -8.086 93 HG12 VAL 12 HG12 VAL 12 16.766 -17.531 -9.403 94 HG13 VAL 12 HG13 VAL 12 18.040 -16.660 -8.547 95 HG21 VAL 12 HG21 VAL 12 16.492 -15.881 -5.566 96 HG22 VAL 12 HG22 VAL 12 17.888 -15.795 -6.641 97 HG23 VAL 12 HG23 VAL 12 16.473 -14.789 -6.951 98 H ASP 13 H ASP 13 14.568 -14.061 -7.171 99 HA ASP 13 HA ASP 13 12.990 -14.803 -4.938 100 HB2 ASP 13 HB2 ASP 13 13.300 -12.097 -6.256 101 HB3 ASP 13 HB3 ASP 13 12.616 -12.385 -4.658 102 H ARG 14 H ARG 14 11.970 -12.662 -7.594 103 HA ARG 14 HA ARG 14 9.468 -14.156 -7.822 104 HB2 ARG 14 HB2 ARG 14 9.495 -11.156 -7.471 105 HB3 ARG 14 HB3 ARG 14 8.087 -12.204 -7.588 106 HG2 ARG 14 HG2 ARG 14 8.123 -11.937 -5.344 107 HG3 ARG 14 HG3 ARG 14 9.225 -13.311 -5.456 108 HD2 ARG 14 HD2 ARG 14 10.503 -11.946 -4.164 109 HD3 ARG 14 HD3 ARG 14 11.005 -11.363 -5.751 110 HE ARG 14 HE ARG 14 10.030 -9.356 -5.268 111 HH11 ARG 14 HH11 ARG 14 8.739 -11.775 -3.122 112 HH12 ARG 14 HH12 ARG 14 7.844 -10.639 -2.169 113 HH21 ARG 14 HH21 ARG 14 8.855 -7.850 -4.020 114 HH22 ARG 14 HH22 ARG 14 7.910 -8.407 -2.681 115 H LYS 15 H LYS 15 9.270 -14.636 -9.898 116 HA LYS 15 HA LYS 15 10.592 -13.063 -11.930 117 HB2 LYS 15 HB2 LYS 15 9.836 -14.800 -13.474 118 HB3 LYS 15 HB3 LYS 15 10.604 -15.513 -12.062 119 HG2 LYS 15 HG2 LYS 15 8.115 -15.608 -11.190 120 HG3 LYS 15 HG3 LYS 15 7.763 -15.583 -12.920 121 HD2 LYS 15 HD2 LYS 15 8.829 -17.606 -13.296 122 HD3 LYS 15 HD3 LYS 15 9.813 -17.475 -11.836 123 HE2 LYS 15 HE2 LYS 15 6.835 -17.954 -11.910 124 HE3 LYS 15 HE3 LYS 15 8.062 -19.187 -11.627 125 HZ1 LYS 15 HZ1 LYS 15 8.775 -17.807 -9.676 126 HZ2 LYS 15 HZ2 LYS 15 7.256 -18.535 -9.526 127 HZ3 LYS 15 HZ3 LYS 15 7.370 -16.887 -9.892 128 H ASN 16 H ASN 16 7.295 -13.743 -10.887 129 HA ASN 16 HA ASN 16 6.098 -12.272 -13.048 130 HB2 ASN 16 HB2 ASN 16 3.997 -12.562 -11.647 131 HB3 ASN 16 HB3 ASN 16 4.788 -14.047 -12.167 132 HD21 ASN 16 HD21 ASN 16 3.434 -12.467 -9.605 133 HD22 ASN 16 HD22 ASN 16 4.122 -13.385 -8.313 134 H ASP 17 H ASP 17 7.342 -11.541 -9.924 135 HA ASP 17 HA ASP 17 6.114 -8.865 -10.028 136 HB2 ASP 17 HB2 ASP 17 7.208 -10.409 -7.667 137 HB3 ASP 17 HB3 ASP 17 6.641 -8.742 -7.591 138 H CYS 18 H CYS 18 8.432 -9.656 -11.556 139 HA CYS 18 HA CYS 18 10.871 -8.951 -10.434 140 HB2 CYS 18 HB2 CYS 18 9.766 -9.093 -13.174 141 HB3 CYS 18 HB3 CYS 18 11.196 -8.086 -12.979 142 H CYS 19 H CYS 19 9.063 -6.824 -12.649 143 HA CYS 19 HA CYS 19 8.923 -4.598 -10.973 144 HB2 CYS 19 HB2 CYS 19 11.544 -5.031 -11.682 145 HB3 CYS 19 HB3 CYS 19 11.015 -3.871 -12.896 146 H GLU 20 H GLU 20 9.122 -2.476 -12.633 147 HA GLU 20 HA GLU 20 6.985 -3.007 -14.522 148 HB2 GLU 20 HB2 GLU 20 6.803 -1.050 -13.084 149 HB3 GLU 20 HB3 GLU 20 8.331 -0.429 -13.696 150 HG2 GLU 20 HG2 GLU 20 7.426 0.262 -15.666 151 HG3 GLU 20 HG3 GLU 20 6.176 -0.980 -15.658 152 H GLY 21 H GLY 21 7.468 -3.673 -16.504 153 HA2 GLY 21 HA2 GLY 21 8.329 -3.499 -18.655 154 HA3 GLY 21 HA3 GLY 21 9.354 -2.181 -18.108 155 H LEU 22 H LEU 22 9.213 -5.355 -16.608 156 HA LEU 22 HA LEU 22 11.876 -5.955 -17.704 157 HB2 LEU 22 HB2 LEU 22 10.971 -6.214 -14.843 158 HB3 LEU 22 HB3 LEU 22 12.451 -6.931 -15.475 159 HG LEU 22 HG LEU 22 11.814 -3.998 -15.196 160 HD11 LEU 22 HD11 LEU 22 12.874 -5.813 -13.395 161 HD12 LEU 22 HD12 LEU 22 12.994 -4.056 -13.313 162 HD13 LEU 22 HD13 LEU 22 14.286 -4.993 -14.063 163 HD21 LEU 22 HD21 LEU 22 14.447 -4.169 -15.913 164 HD22 LEU 22 HD22 LEU 22 13.123 -3.724 -16.990 165 HD23 LEU 22 HD23 LEU 22 13.699 -5.391 -16.943 166 H GLU 23 H GLU 23 12.465 -8.264 -17.521 167 HA GLU 23 HA GLU 23 10.211 -10.100 -17.255 168 HB2 GLU 23 HB2 GLU 23 11.517 -9.373 -19.787 169 HB3 GLU 23 HB3 GLU 23 11.401 -11.104 -19.505 170 HG2 GLU 23 HG2 GLU 23 9.042 -9.263 -19.273 171 HG3 GLU 23 HG3 GLU 23 9.509 -10.037 -20.786 172 H CYS 24 H CYS 24 10.804 -12.255 -16.864 173 HA CYS 24 HA CYS 24 13.353 -12.553 -15.576 174 HB2 CYS 24 HB2 CYS 24 11.169 -13.579 -14.792 175 HB3 CYS 24 HB3 CYS 24 11.329 -14.727 -16.116 176 H TYR 25 H TYR 25 15.056 -12.628 -16.937 177 HA TYR 25 HA TYR 25 14.942 -14.495 -19.204 178 HB2 TYR 25 HB2 TYR 25 15.507 -12.272 -19.909 179 HB3 TYR 25 HB3 TYR 25 16.736 -12.126 -18.658 180 HD1 TYR 25 HD1 TYR 25 15.914 -14.464 -21.464 181 HD2 TYR 25 HD2 TYR 25 18.915 -12.292 -19.372 182 HE1 TYR 25 HE1 TYR 25 17.608 -15.301 -23.039 183 HE2 TYR 25 HE2 TYR 25 20.618 -13.121 -20.941 184 HH TYR 25 HH TYR 25 19.898 -14.520 -23.863 185 H LYS 26 H LYS 26 16.549 -16.032 -19.514 186 HA LYS 26 HA LYS 26 17.954 -16.818 -17.081 187 HB2 LYS 26 HB2 LYS 26 17.596 -18.283 -19.702 188 HB3 LYS 26 HB3 LYS 26 18.348 -18.947 -18.258 189 HG2 LYS 26 HG2 LYS 26 16.330 -19.054 -17.104 190 HG3 LYS 26 HG3 LYS 26 15.539 -17.913 -18.197 191 HD2 LYS 26 HD2 LYS 26 15.837 -19.656 -20.011 192 HD3 LYS 26 HD3 LYS 26 16.293 -20.779 -18.729 193 HE2 LYS 26 HE2 LYS 26 14.065 -20.016 -17.631 194 HE3 LYS 26 HE3 LYS 26 13.653 -19.472 -19.257 195 HZ1 LYS 26 HZ1 LYS 26 14.157 -21.763 -20.028 196 HZ2 LYS 26 HZ2 LYS 26 12.833 -21.672 -18.979 197 HZ3 LYS 26 HZ3 LYS 26 14.324 -22.236 -18.412 198 H ARG 27 H ARG 27 20.155 -17.037 -16.914 199 HA ARG 27 HA ARG 27 21.712 -15.625 -18.946 200 HB2 ARG 27 HB2 ARG 27 22.116 -16.271 -16.054 201 HB3 ARG 27 HB3 ARG 27 23.525 -15.969 -17.063 202 HG2 ARG 27 HG2 ARG 27 21.781 -13.890 -17.658 203 HG3 ARG 27 HG3 ARG 27 21.649 -14.107 -15.912 204 HD2 ARG 27 HD2 ARG 27 23.770 -13.426 -15.535 205 HD3 ARG 27 HD3 ARG 27 24.382 -14.170 -17.011 206 HE ARG 27 HE ARG 27 22.955 -12.100 -17.960 207 HH11 ARG 27 HH11 ARG 27 25.381 -12.333 -15.475 208 HH12 ARG 27 HH12 ARG 27 25.971 -10.722 -15.719 209 HH21 ARG 27 HH21 ARG 27 23.723 -9.978 -18.290 210 HH22 ARG 27 HH22 ARG 27 25.026 -9.383 -17.320 211 H ARG 28 H ARG 28 24.139 -16.553 -18.919 212 HA ARG 28 HA ARG 28 23.976 -19.044 -20.278 213 HB2 ARG 28 HB2 ARG 28 25.632 -17.227 -20.773 214 HB3 ARG 28 HB3 ARG 28 26.463 -17.648 -19.282 215 HG2 ARG 28 HG2 ARG 28 27.541 -18.637 -21.233 216 HG3 ARG 28 HG3 ARG 28 26.920 -19.873 -20.136 217 HD2 ARG 28 HD2 ARG 28 25.024 -20.261 -21.552 218 HD3 ARG 28 HD3 ARG 28 25.453 -18.894 -22.579 219 HE ARG 28 HE ARG 28 26.572 -21.542 -22.657 220 HH11 ARG 28 HH11 ARG 28 27.094 -18.185 -23.417 221 HH12 ARG 28 HH12 ARG 28 28.252 -18.511 -24.664 222 HH21 ARG 28 HH21 ARG 28 28.096 -21.985 -24.296 223 HH22 ARG 28 HH22 ARG 28 28.820 -20.675 -25.162 224 H HIS 29 H HIS 29 26.037 -18.247 -17.480 225 HA HIS 29 HA HIS 29 25.391 -20.892 -16.360 226 HB2 HIS 29 HB2 HIS 29 28.089 -19.561 -16.584 227 HB3 HIS 29 HB3 HIS 29 27.779 -20.903 -15.488 228 HD1 HIS 29 HD1 HIS 29 29.792 -21.044 -17.884 229 HD2 HIS 29 HD2 HIS 29 25.880 -22.441 -17.944 230 HE1 HIS 29 HE1 HIS 29 29.729 -22.790 -19.693 231 H SER 30 H SER 30 24.344 -18.176 -15.810 232 HA SER 30 HA SER 30 25.002 -18.090 -12.942 233 HB2 SER 30 HB2 SER 30 24.906 -15.857 -14.925 234 HB3 SER 30 HB3 SER 30 24.377 -15.536 -13.274 235 HG SER 30 HG SER 30 26.842 -16.800 -13.826 236 H PHE 31 H PHE 31 23.294 -17.196 -11.587 237 HA PHE 31 HA PHE 31 20.810 -18.361 -12.053 238 HB2 PHE 31 HB2 PHE 31 20.010 -16.986 -10.150 239 HB3 PHE 31 HB3 PHE 31 21.543 -17.783 -9.811 240 HD1 PHE 31 HD2 PHE 31 19.881 -14.587 -10.415 241 HD2 PHE 31 HD1 PHE 31 23.585 -16.512 -9.580 242 HE1 PHE 31 HE2 PHE 31 20.871 -12.415 -9.818 243 HE2 PHE 31 HE1 PHE 31 24.580 -14.343 -8.981 244 HZ PHE 31 HZ PHE 31 23.223 -12.291 -9.098 245 H GLU 32 H GLU 32 19.008 -17.748 -13.088 246 HA GLU 32 HA GLU 32 19.026 -15.657 -14.944 247 HB2 GLU 32 HB2 GLU 32 16.579 -16.083 -15.138 248 HB3 GLU 32 HB3 GLU 32 17.561 -17.536 -15.257 249 HG2 GLU 32 HG2 GLU 32 17.085 -17.940 -12.828 250 HG3 GLU 32 HG3 GLU 32 15.925 -16.616 -12.911 251 H VAL 33 H VAL 33 18.213 -13.602 -14.953 252 HA VAL 33 HA VAL 33 17.014 -12.584 -12.474 253 HB VAL 33 HB VAL 33 18.407 -10.656 -12.408 254 HG11 VAL 33 HG11 VAL 33 20.303 -11.612 -11.581 255 HG12 VAL 33 HG12 VAL 33 19.301 -13.057 -11.725 256 HG13 VAL 33 HG13 VAL 33 20.500 -12.686 -12.965 257 HG21 VAL 33 HG21 VAL 33 20.417 -10.764 -14.178 258 HG22 VAL 33 HG22 VAL 33 19.140 -11.506 -15.142 259 HG23 VAL 33 HG23 VAL 33 18.916 -9.888 -14.478 260 H CYS 34 H CYS 34 16.339 -10.170 -12.897 261 HA CYS 34 HA CYS 34 14.471 -10.249 -15.067 262 HB2 CYS 34 HB2 CYS 34 15.148 -7.956 -13.213 263 HB3 CYS 34 HB3 CYS 34 13.721 -8.080 -14.237 264 H VAL 35 H VAL 35 14.383 -8.943 -16.889 265 HA VAL 35 HA VAL 35 16.735 -7.296 -17.486 266 HB VAL 35 HB VAL 35 16.817 -8.218 -19.790 267 HG11 VAL 35 HG11 VAL 35 17.219 -10.375 -17.726 268 HG12 VAL 35 HG12 VAL 35 18.098 -10.146 -19.239 269 HG13 VAL 35 HG13 VAL 35 18.301 -8.996 -17.917 270 HG21 VAL 35 HG21 VAL 35 15.162 -10.514 -18.791 271 HG22 VAL 35 HG22 VAL 35 14.430 -9.133 -19.607 272 HG23 VAL 35 HG23 VAL 35 15.623 -10.122 -20.448 273 HA PRO 36 HA PRO 36 13.838 -4.423 -19.110 274 HB2 PRO 36 HB2 PRO 36 15.339 -3.206 -21.017 275 HB3 PRO 36 HB3 PRO 36 15.592 -2.947 -19.287 276 HG2 PRO 36 HG2 PRO 36 17.078 -4.737 -21.172 277 HG3 PRO 36 HG3 PRO 36 17.713 -3.674 -19.902 278 HD2 PRO 36 HD2 PRO 36 17.431 -6.345 -19.559 279 HD3 PRO 36 HD3 PRO 36 17.246 -5.186 -18.227 280 H ILE 37 H ILE 37 12.155 -4.758 -20.408 281 HA ILE 37 HA ILE 37 12.327 -6.571 -22.632 282 HB ILE 37 HB ILE 37 10.014 -4.882 -21.673 283 HG12 ILE 37 HG12 ILE 37 10.162 -7.847 -21.359 284 HG13 ILE 37 HG13 ILE 37 11.104 -6.846 -20.260 285 HG21 ILE 37 HG21 ILE 37 9.792 -5.480 -24.029 286 HG22 ILE 37 HG22 ILE 37 10.059 -7.176 -23.629 287 HG23 ILE 37 HG23 ILE 37 8.617 -6.350 -23.041 288 HD11 ILE 37 HD11 ILE 37 8.472 -5.786 -20.421 289 HD12 ILE 37 HD12 ILE 37 8.374 -7.520 -20.113 290 HD13 ILE 37 HD13 ILE 37 9.307 -6.484 -19.034 291 HA PRO 38 HA PRO 38 13.248 -3.510 -25.695 292 HB2 PRO 38 HB2 PRO 38 12.756 -5.056 -27.873 293 HB3 PRO 38 HB3 PRO 38 14.211 -5.225 -26.883 294 HG2 PRO 38 HG2 PRO 38 11.694 -6.844 -26.840 295 HG3 PRO 38 HG3 PRO 38 13.379 -7.392 -26.750 296 HD2 PRO 38 HD2 PRO 38 11.799 -7.173 -24.562 297 HD3 PRO 38 HD3 PRO 38 13.552 -6.896 -24.506 298 H GLY 39 H GLY 39 12.069 -1.953 -26.649 299 HA2 GLY 39 HA2 GLY 39 10.292 -0.855 -27.614 300 HA3 GLY 39 HA3 GLY 39 9.614 -2.428 -28.005 301 H PHE 40 H PHE 40 10.299 -2.192 -24.724 302 HA PHE 40 HA PHE 40 7.638 -2.449 -23.917 303 HB2 PHE 40 HB2 PHE 40 9.209 -3.225 -22.371 304 HB3 PHE 40 HB3 PHE 40 10.178 -1.759 -22.474 305 HD1 PHE 40 HD1 PHE 40 6.833 -2.951 -21.359 306 HD2 PHE 40 HD2 PHE 40 10.003 -0.161 -20.820 307 HE1 PHE 40 HE1 PHE 40 5.718 -2.078 -19.348 308 HE2 PHE 40 HE2 PHE 40 8.893 0.715 -18.807 309 HZ PHE 40 HZ PHE 40 6.747 -0.243 -18.068 310 H CYS 41 H CYS 41 6.165 -1.034 -22.991 311 HA CYS 41 HA CYS 41 6.753 1.756 -22.658 312 HB2 CYS 41 HB2 CYS 41 5.161 2.583 -24.335 313 HB3 CYS 41 HB3 CYS 41 6.476 1.689 -25.090 314 H LEU 42 H LEU 42 4.318 2.877 -22.604 315 HA LEU 42 HA LEU 42 2.774 1.174 -20.759 316 HB2 LEU 42 HB2 LEU 42 2.876 4.170 -20.608 317 HB3 LEU 42 HB3 LEU 42 2.308 3.028 -19.390 318 HG LEU 42 HG LEU 42 5.193 3.304 -20.223 319 HD11 LEU 42 HD11 LEU 42 5.273 5.174 -19.035 320 HD12 LEU 42 HD12 LEU 42 4.844 4.230 -17.609 321 HD13 LEU 42 HD13 LEU 42 3.581 5.008 -18.562 322 HD21 LEU 42 HD21 LEU 42 5.128 1.255 -19.236 323 HD22 LEU 42 HD22 LEU 42 3.697 1.637 -18.277 324 HD23 LEU 42 HD23 LEU 42 5.277 2.250 -17.788 325 H VAL 43 H VAL 43 0.466 2.003 -20.495 326 HA VAL 43 HA VAL 43 -0.590 2.686 -23.158 327 HB VAL 43 HB VAL 43 -2.702 1.602 -22.400 328 HG11 VAL 43 HG11 VAL 43 -0.165 -0.005 -22.515 329 HG12 VAL 43 HG12 VAL 43 -1.762 -0.754 -22.470 330 HG13 VAL 43 HG13 VAL 43 -1.322 0.309 -23.808 331 HG21 VAL 43 HG21 VAL 43 -1.406 0.079 -20.274 332 HG22 VAL 43 HG22 VAL 43 -1.609 1.789 -19.891 333 HG23 VAL 43 HG23 VAL 43 -3.010 0.811 -20.329 334 H LYS 44 H LYS 44 -3.075 3.449 -22.715 335 HA LYS 44 HA LYS 44 -2.761 6.011 -21.423 336 HB2 LYS 44 HB2 LYS 44 -4.957 6.523 -22.337 337 HB3 LYS 44 HB3 LYS 44 -3.935 5.812 -23.580 338 HG2 LYS 44 HG2 LYS 44 -5.476 3.807 -22.167 339 HG3 LYS 44 HG3 LYS 44 -6.499 5.038 -22.909 340 HD2 LYS 44 HD2 LYS 44 -5.056 4.670 -25.008 341 HD3 LYS 44 HD3 LYS 44 -4.532 3.184 -24.213 342 HE2 LYS 44 HE2 LYS 44 -6.938 2.555 -23.983 343 HE3 LYS 44 HE3 LYS 44 -7.347 3.963 -24.962 344 HZ1 LYS 44 HZ1 LYS 44 -5.462 1.900 -25.927 345 HZ2 LYS 44 HZ2 LYS 44 -6.311 3.055 -26.826 346 HZ3 LYS 44 HZ3 LYS 44 -7.133 1.743 -26.143 347 H TRP 45 H TRP 45 -3.337 3.086 -20.197 348 HA TRP 45 HA TRP 45 -5.129 4.140 -18.108 349 HB2 TRP 45 HB2 TRP 45 -5.002 1.314 -19.183 350 HB3 TRP 45 HB3 TRP 45 -5.963 1.820 -17.796 351 HD1 TRP 45 HD1 TRP 45 -6.246 1.308 -21.417 352 HE1 TRP 45 HE1 TRP 45 -8.391 2.392 -22.335 353 HE3 TRP 45 HE3 TRP 45 -7.480 4.204 -17.389 354 HZ2 TRP 45 HZ2 TRP 45 -10.348 4.233 -21.468 355 HZ3 TRP 45 HZ3 TRP 45 -9.503 5.598 -17.514 356 HH2 TRP 45 HH2 TRP 45 -10.907 5.611 -19.512 357 H LYS 46 H LYS 46 -2.114 3.895 -18.457 358 HA LYS 46 HA LYS 46 -1.593 2.394 -15.974 359 HB2 LYS 46 HB2 LYS 46 0.040 2.702 -18.474 360 HB3 LYS 46 HB3 LYS 46 0.822 2.345 -16.940 361 HG2 LYS 46 HG2 LYS 46 -1.454 0.613 -17.510 362 HG3 LYS 46 HG3 LYS 46 -0.159 0.500 -18.703 363 HD2 LYS 46 HD2 LYS 46 1.268 0.474 -16.401 364 HD3 LYS 46 HD3 LYS 46 -0.213 -0.331 -15.879 365 HE2 LYS 46 HE2 LYS 46 0.212 -1.589 -18.222 366 HE3 LYS 46 HE3 LYS 46 1.875 -1.220 -17.768 367 HZ1 LYS 46 HZ1 LYS 46 0.373 -2.253 -15.572 368 HZ2 LYS 46 HZ2 LYS 46 1.843 -2.790 -16.216 369 HZ3 LYS 46 HZ3 LYS 46 0.383 -3.330 -16.876 370 H GLN 47 H GLN 47 -0.139 3.291 -14.476 371 HA GLN 47 HA GLN 47 -0.321 6.031 -14.057 372 HB2 GLN 47 HB2 GLN 47 1.138 3.793 -12.859 373 HB3 GLN 47 HB3 GLN 47 1.963 5.337 -12.692 374 HG2 GLN 47 HG2 GLN 47 0.280 6.252 -11.408 375 HG3 GLN 47 HG3 GLN 47 -0.930 5.117 -12.002 376 HE21 GLN 47 HE21 GLN 47 -1.582 4.527 -9.950 377 HE22 GLN 47 HE22 GLN 47 -0.606 3.555 -8.908 378 H CYS 48 H CYS 48 0.992 7.768 -14.456 379 HA CYS 48 HA CYS 48 3.099 7.329 -16.457 380 HB2 CYS 48 HB2 CYS 48 2.669 9.467 -17.307 381 HB3 CYS 48 HB3 CYS 48 1.067 8.865 -16.892 382 H ASP 49 H ASP 49 2.520 8.371 -13.240 383 HA ASP 49 HA ASP 49 4.563 10.143 -12.721 384 HB2 ASP 49 HB2 ASP 49 2.738 9.163 -11.151 385 HB3 ASP 49 HB3 ASP 49 3.941 7.928 -10.787 386 H GLY 50 H GLY 50 6.670 10.023 -13.095 387 HA2 GLY 50 HA2 GLY 50 8.829 9.150 -12.792 388 HA3 GLY 50 HA3 GLY 50 8.120 7.590 -12.403 389 H ARG 51 H ARG 51 6.410 7.565 -14.775 390 HA ARG 51 HA ARG 51 8.491 6.989 -16.777 391 HB2 ARG 51 HB2 ARG 51 5.759 5.733 -16.464 392 HB3 ARG 51 HB3 ARG 51 6.938 5.323 -17.703 393 HG2 ARG 51 HG2 ARG 51 7.304 4.955 -14.737 394 HG3 ARG 51 HG3 ARG 51 6.923 3.685 -15.902 395 HD2 ARG 51 HD2 ARG 51 9.204 5.121 -16.824 396 HD3 ARG 51 HD3 ARG 51 9.464 4.673 -15.138 397 HE ARG 51 HE ARG 51 8.490 2.527 -16.792 398 HH11 ARG 51 HH11 ARG 51 11.303 4.211 -15.625 399 HH12 ARG 51 HH12 ARG 51 12.371 2.869 -15.873 400 HH21 ARG 51 HH21 ARG 51 9.884 0.752 -17.123 401 HH22 ARG 51 HH22 ARG 51 11.562 0.902 -16.727 402 H GLU 52 H GLU 52 7.488 9.587 -16.529 403 HA GLU 52 HA GLU 52 5.325 10.133 -18.262 404 HB2 GLU 52 HB2 GLU 52 6.043 12.441 -18.165 405 HB3 GLU 52 HB3 GLU 52 6.175 11.722 -16.566 406 HG2 GLU 52 HG2 GLU 52 8.651 11.276 -17.342 407 HG3 GLU 52 HG3 GLU 52 8.306 12.623 -18.427 408 H ARG 53 H ARG 53 8.524 9.169 -18.871 409 HA ARG 53 HA ARG 53 8.235 9.923 -21.704 410 HB2 ARG 53 HB2 ARG 53 10.822 9.716 -20.153 411 HB3 ARG 53 HB3 ARG 53 10.662 10.143 -21.852 412 HG2 ARG 53 HG2 ARG 53 9.280 12.118 -21.086 413 HG3 ARG 53 HG3 ARG 53 9.826 11.740 -19.451 414 HD2 ARG 53 HD2 ARG 53 12.150 11.972 -20.176 415 HD3 ARG 53 HD3 ARG 53 11.605 12.341 -21.812 416 HE ARG 53 HE ARG 53 11.226 14.486 -21.138 417 HH11 ARG 53 HH11 ARG 53 11.309 12.437 -18.325 418 HH12 ARG 53 HH12 ARG 53 11.191 13.753 -17.203 419 HH21 ARG 53 HH21 ARG 53 11.071 16.226 -19.672 420 HH22 ARG 53 HH22 ARG 53 11.055 15.906 -17.971 421 H ASP 54 H ASP 54 7.492 7.466 -20.197 422 HA ASP 54 HA ASP 54 9.184 5.543 -21.655 423 HB2 ASP 54 HB2 ASP 54 8.825 5.621 -18.954 424 HB3 ASP 54 HB3 ASP 54 7.547 4.508 -19.434 425 H CYS 55 H CYS 55 6.013 6.754 -21.117 426 HA CYS 55 HA CYS 55 4.370 4.663 -21.838 427 HB2 CYS 55 HB2 CYS 55 4.038 7.552 -22.670 428 HB3 CYS 55 HB3 CYS 55 2.762 6.343 -22.577 429 H CYS 56 H CYS 56 3.131 4.496 -23.954 430 HA CYS 56 HA CYS 56 4.944 3.805 -26.014 431 HB2 CYS 56 HB2 CYS 56 1.954 3.922 -25.799 432 HB3 CYS 56 HB3 CYS 56 2.714 3.625 -27.359 433 H ALA 57 H ALA 57 4.160 4.564 -28.384 434 HA ALA 57 HA ALA 57 4.970 7.306 -28.546 435 HB1 ALA 57 HB1 ALA 57 5.794 6.336 -30.395 436 HB2 ALA 57 HB2 ALA 57 4.551 5.084 -30.415 437 HB3 ALA 57 HB3 ALA 57 4.205 6.682 -31.077 438 H GLY 58 H GLY 58 3.671 9.001 -28.343 439 HA2 GLY 58 HA2 GLY 58 1.818 10.274 -29.241 440 HA3 GLY 58 HA3 GLY 58 0.906 8.775 -29.347 441 H LEU 59 H LEU 59 2.099 8.120 -26.586 442 HA LEU 59 HA LEU 59 -0.119 9.208 -25.099 443 HB2 LEU 59 HB2 LEU 59 2.077 7.263 -24.501 444 HB3 LEU 59 HB3 LEU 59 1.072 7.907 -23.205 445 HG LEU 59 HG LEU 59 0.091 6.318 -25.575 446 HD11 LEU 59 HD11 LEU 59 0.636 5.607 -22.710 447 HD12 LEU 59 HD12 LEU 59 1.210 4.810 -24.174 448 HD13 LEU 59 HD13 LEU 59 -0.486 4.683 -23.709 449 HD21 LEU 59 HD21 LEU 59 -1.695 7.691 -25.022 450 HD22 LEU 59 HD22 LEU 59 -1.297 7.688 -23.304 451 HD23 LEU 59 HD23 LEU 59 -1.994 6.250 -24.051 452 H GLU 60 H GLU 60 0.405 9.952 -22.763 453 HA GLU 60 HA GLU 60 2.846 11.441 -22.441 454 HB2 GLU 60 HB2 GLU 60 1.940 13.637 -22.416 455 HB3 GLU 60 HB3 GLU 60 1.397 12.893 -23.913 456 HG2 GLU 60 HG2 GLU 60 -0.693 12.269 -22.419 457 HG3 GLU 60 HG3 GLU 60 -0.152 13.681 -21.513 458 H CYS 61 H CYS 61 2.817 12.697 -20.352 459 HA CYS 61 HA CYS 61 1.742 11.009 -18.292 460 HB2 CYS 61 HB2 CYS 61 4.001 12.276 -18.310 461 HB3 CYS 61 HB3 CYS 61 3.053 13.671 -17.807 462 H TRP 62 H TRP 62 -0.476 11.175 -18.296 463 HA TRP 62 HA TRP 62 -1.780 13.747 -18.233 464 HB2 TRP 62 HB2 TRP 62 -2.663 11.508 -19.233 465 HB3 TRP 62 HB3 TRP 62 -3.143 11.153 -17.577 466 HD1 TRP 62 HD1 TRP 62 -3.503 14.773 -18.167 467 HE1 TRP 62 HE1 TRP 62 -5.962 15.380 -18.623 468 HE3 TRP 62 HE3 TRP 62 -5.368 10.075 -18.936 469 HZ2 TRP 62 HZ2 TRP 62 -8.374 14.044 -19.228 470 HZ3 TRP 62 HZ3 TRP 62 -7.762 9.827 -19.448 471 HH2 TRP 62 HH2 TRP 62 -9.232 11.771 -19.590 472 H LYS 63 H LYS 63 -2.268 14.902 -16.488 473 HA LYS 63 HA LYS 63 -1.814 13.703 -13.851 474 HB2 LYS 63 HB2 LYS 63 -0.663 15.860 -14.599 475 HB3 LYS 63 HB3 LYS 63 -2.237 16.629 -14.439 476 HG2 LYS 63 HG2 LYS 63 -0.899 16.994 -12.456 477 HG3 LYS 63 HG3 LYS 63 -2.305 15.996 -12.078 478 HD2 LYS 63 HD2 LYS 63 -0.035 14.378 -12.850 479 HD3 LYS 63 HD3 LYS 63 0.356 15.431 -11.489 480 HE2 LYS 63 HE2 LYS 63 -2.036 14.552 -10.678 481 HE3 LYS 63 HE3 LYS 63 -1.555 13.175 -11.669 482 HZ1 LYS 63 HZ1 LYS 63 -0.601 12.559 -9.731 483 HZ2 LYS 63 HZ2 LYS 63 -0.430 14.142 -9.161 484 HZ3 LYS 63 HZ3 LYS 63 0.667 13.530 -10.293 485 H ARG 64 H ARG 64 -3.670 12.699 -13.263 486 HA ARG 64 HA ARG 64 -6.134 14.317 -13.282 487 HB2 ARG 64 HB2 ARG 64 -5.610 11.504 -13.972 488 HB3 ARG 64 HB3 ARG 64 -7.011 11.754 -12.937 489 HG2 ARG 64 HG2 ARG 64 -8.138 12.988 -14.536 490 HG3 ARG 64 HG3 ARG 64 -6.659 13.392 -15.410 491 HD2 ARG 64 HD2 ARG 64 -7.600 11.805 -16.793 492 HD3 ARG 64 HD3 ARG 64 -6.517 10.824 -15.807 493 HE ARG 64 HE ARG 64 -9.172 11.008 -14.736 494 HH11 ARG 64 HH11 ARG 64 -7.114 9.323 -16.984 495 HH12 ARG 64 HH12 ARG 64 -8.068 7.877 -16.974 496 HH21 ARG 64 HH21 ARG 64 -10.435 9.108 -14.715 497 HH22 ARG 64 HH22 ARG 64 -9.957 7.756 -15.683 498 H SER 65 H SER 65 -7.071 14.755 -11.386 499 HA SER 65 HA SER 65 -6.298 13.173 -9.031 500 HB2 SER 65 HB2 SER 65 -6.192 15.255 -7.698 501 HB3 SER 65 HB3 SER 65 -4.985 15.234 -8.984 502 HG SER 65 HG SER 65 -6.015 16.799 -10.005 503 H GLY 66 H GLY 66 -7.889 12.827 -7.522 504 HA2 GLY 66 HA2 GLY 66 -10.004 13.511 -6.509 505 HA3 GLY 66 HA3 GLY 66 -10.531 14.007 -8.111 506 H ASN 67 H ASN 67 -9.377 11.587 -9.358 507 HA ASN 67 HA ASN 67 -11.443 9.679 -8.481 508 HB2 ASN 67 HB2 ASN 67 -10.454 10.485 -11.176 509 HB3 ASN 67 HB3 ASN 67 -10.960 8.814 -10.953 510 HD21 ASN 67 HD21 ASN 67 -12.251 10.503 -12.695 511 HD22 ASN 67 HD22 ASN 67 -13.840 10.833 -12.101 512 H LYS 68 H LYS 68 -8.211 9.847 -9.966 513 HA LYS 68 HA LYS 68 -7.322 7.649 -8.301 514 HB2 LYS 68 HB2 LYS 68 -7.383 7.450 -11.315 515 HB3 LYS 68 HB3 LYS 68 -6.434 6.387 -10.284 516 HG2 LYS 68 HG2 LYS 68 -9.429 6.680 -10.168 517 HG3 LYS 68 HG3 LYS 68 -8.563 5.386 -10.999 518 HD2 LYS 68 HD2 LYS 68 -8.395 5.988 -8.046 519 HD3 LYS 68 HD3 LYS 68 -9.353 4.696 -8.774 520 HE2 LYS 68 HE2 LYS 68 -7.117 3.938 -9.817 521 HE3 LYS 68 HE3 LYS 68 -6.372 4.969 -8.596 522 HZ1 LYS 68 HZ1 LYS 68 -8.208 2.693 -8.074 523 HZ2 LYS 68 HZ2 LYS 68 -7.546 3.703 -6.888 524 HZ3 LYS 68 HZ3 LYS 68 -6.537 2.707 -7.810 525 H SER 69 H SER 69 -4.925 7.072 -9.258 526 HA SER 69 HA SER 69 -3.423 9.445 -8.763 527 HB2 SER 69 HB2 SER 69 -2.829 6.575 -9.196 528 HB3 SER 69 HB3 SER 69 -1.537 7.704 -9.610 529 HG SER 69 HG SER 69 -1.451 8.384 -7.540 530 H SER 70 H SER 70 -1.376 9.735 -10.293 531 HA SER 70 HA SER 70 -2.382 10.822 -12.708 532 HB2 SER 70 HB2 SER 70 -0.324 11.798 -12.932 533 HB3 SER 70 HB3 SER 70 -0.213 11.363 -11.226 534 HG SER 70 HG SER 70 1.614 10.719 -12.553 535 H VAL 71 H VAL 71 -2.766 9.845 -14.574 536 HA VAL 71 HA VAL 71 -1.346 7.330 -15.167 537 HB VAL 71 HB VAL 71 -3.377 6.799 -16.607 538 HG11 VAL 71 HG11 VAL 71 -4.312 5.583 -14.906 539 HG12 VAL 71 HG12 VAL 71 -2.761 6.002 -14.177 540 HG13 VAL 71 HG13 VAL 71 -4.210 6.913 -13.752 541 HG21 VAL 71 HG21 VAL 71 -4.851 8.699 -14.825 542 HG22 VAL 71 HG22 VAL 71 -4.186 9.245 -16.363 543 HG23 VAL 71 HG23 VAL 71 -5.377 7.945 -16.330 544 H CYS 72 H CYS 72 -1.682 6.860 -17.677 545 HA CYS 72 HA CYS 72 -0.598 9.220 -19.043 546 HB2 CYS 72 HB2 CYS 72 -0.102 6.333 -19.197 547 HB3 CYS 72 HB3 CYS 72 -0.248 7.109 -20.770 548 H ALA 73 H ALA 73 -1.302 9.768 -21.159 549 HA ALA 73 HA ALA 73 -3.762 8.541 -22.126 550 HB1 ALA 73 HB1 ALA 73 -5.154 10.234 -21.700 551 HB2 ALA 73 HB2 ALA 73 -3.939 10.772 -20.541 552 HB3 ALA 73 HB3 ALA 73 -3.965 11.448 -22.169 553 HA PRO 74 HA PRO 74 -2.045 9.336 -26.088 554 HB2 PRO 74 HB2 PRO 74 -4.285 9.674 -27.584 555 HB3 PRO 74 HB3 PRO 74 -3.776 8.101 -26.958 556 HG2 PRO 74 HG2 PRO 74 -5.836 9.992 -25.887 557 HG3 PRO 74 HG3 PRO 74 -5.913 8.227 -26.050 558 HD2 PRO 74 HD2 PRO 74 -5.371 9.449 -23.696 559 HD3 PRO 74 HD3 PRO 74 -4.689 7.869 -24.131 560 H ILE 75 H ILE 75 -2.018 10.913 -27.903 561 HA ILE 75 HA ILE 75 -1.611 13.511 -27.043 562 HB ILE 75 HB ILE 75 -1.810 14.142 -29.491 563 HG12 ILE 75 HG12 ILE 75 -1.983 11.177 -29.972 564 HG13 ILE 75 HG13 ILE 75 -3.433 12.172 -29.894 565 HG21 ILE 75 HG21 ILE 75 -0.008 11.779 -29.131 566 HG22 ILE 75 HG22 ILE 75 0.297 13.295 -29.978 567 HG23 ILE 75 HG23 ILE 75 0.252 13.263 -28.215 568 HD11 ILE 75 HD11 ILE 75 -2.939 12.024 -32.162 569 HD12 ILE 75 HD12 ILE 75 -2.318 13.606 -31.688 570 HD13 ILE 75 HD13 ILE 75 -1.210 12.250 -31.895 571 H THR 76 H THR 76 -2.761 15.463 -27.367 572 HA THR 76 HA THR 76 -5.647 15.169 -27.847 573 HB THR 76 HB THR 76 -6.226 16.559 -26.000 574 HG1 THR 76 HG1 THR 76 -3.431 16.863 -25.514 575 HG21 THR 76 HG21 THR 76 -4.254 15.059 -24.461 576 HG22 THR 76 HG22 THR 76 -5.078 14.074 -25.670 577 HG23 THR 76 HG23 THR 76 -6.014 14.948 -24.458 Start of MODEL 17 1 H1 SER 1 H SER 1 3.547 -0.974 1.922 2 HA SER 1 HA SER 1 4.041 0.529 -0.550 3 HB2 SER 1 HB2 SER 1 5.170 0.700 2.232 4 HB3 SER 1 HB3 SER 1 6.043 1.395 0.867 5 HG SER 1 HG SER 1 4.054 2.559 0.403 6 H ASN 2 H ASN 2 4.244 -2.405 -0.292 7 HA ASN 2 HA ASN 2 6.977 -3.159 -0.194 8 HB2 ASN 2 HB2 ASN 2 4.717 -4.607 -1.589 9 HB3 ASN 2 HB3 ASN 2 6.238 -5.303 -1.040 10 HD21 ASN 2 HD21 ASN 2 6.653 -4.951 1.361 11 HD22 ASN 2 HD22 ASN 2 5.311 -5.239 2.411 12 H GLU 3 H GLU 3 8.450 -2.436 -1.583 13 HA GLU 3 HA GLU 3 7.822 -1.485 -4.189 14 HB2 GLU 3 HB2 GLU 3 10.305 -1.878 -2.594 15 HB3 GLU 3 HB3 GLU 3 10.474 -1.727 -4.338 16 HG2 GLU 3 HG2 GLU 3 8.931 0.272 -2.725 17 HG3 GLU 3 HG3 GLU 3 10.678 0.387 -2.933 18 H CYS 4 H CYS 4 9.295 -2.324 -6.077 19 HA CYS 4 HA CYS 4 8.704 -5.183 -6.335 20 HB2 CYS 4 HB2 CYS 4 8.873 -4.840 -8.735 21 HB3 CYS 4 HB3 CYS 4 7.781 -3.646 -8.040 22 H ILE 5 H ILE 5 10.310 -6.326 -7.903 23 HA ILE 5 HA ILE 5 12.835 -6.386 -6.590 24 HB ILE 5 HB ILE 5 11.981 -7.733 -9.154 25 HG12 ILE 5 HG12 ILE 5 12.159 -8.900 -6.373 26 HG13 ILE 5 HG13 ILE 5 10.665 -8.283 -7.069 27 HG21 ILE 5 HG21 ILE 5 14.282 -7.861 -9.235 28 HG22 ILE 5 HG22 ILE 5 14.445 -7.914 -7.481 29 HG23 ILE 5 HG23 ILE 5 13.874 -9.334 -8.355 30 HD11 ILE 5 HD11 ILE 5 11.460 -10.853 -7.196 31 HD12 ILE 5 HD12 ILE 5 10.378 -10.090 -8.362 32 HD13 ILE 5 HD13 ILE 5 12.097 -10.239 -8.722 33 H ARG 6 H ARG 6 14.490 -5.073 -6.930 34 HA ARG 6 HA ARG 6 14.621 -3.102 -8.878 35 HB2 ARG 6 HB2 ARG 6 16.841 -4.425 -7.314 36 HB3 ARG 6 HB3 ARG 6 17.063 -2.987 -8.301 37 HG2 ARG 6 HG2 ARG 6 16.726 -1.973 -6.311 38 HG3 ARG 6 HG3 ARG 6 15.037 -2.135 -6.798 39 HD2 ARG 6 HD2 ARG 6 14.661 -3.914 -5.359 40 HD3 ARG 6 HD3 ARG 6 16.375 -4.317 -5.251 41 HE ARG 6 HE ARG 6 16.173 -1.832 -4.132 42 HH11 ARG 6 HH11 ARG 6 14.690 -4.929 -3.561 43 HH12 ARG 6 HH12 ARG 6 14.476 -4.660 -1.864 44 HH21 ARG 6 HH21 ARG 6 15.896 -1.465 -1.898 45 HH22 ARG 6 HH22 ARG 6 15.161 -2.689 -0.919 46 H LYS 7 H LYS 7 15.720 -2.891 -10.824 47 HA LYS 7 HA LYS 7 15.773 -5.153 -12.497 48 HB2 LYS 7 HB2 LYS 7 15.497 -2.711 -13.170 49 HB3 LYS 7 HB3 LYS 7 17.244 -2.572 -13.022 50 HG2 LYS 7 HG2 LYS 7 17.558 -4.239 -14.746 51 HG3 LYS 7 HG3 LYS 7 15.815 -4.492 -14.851 52 HD2 LYS 7 HD2 LYS 7 16.605 -3.053 -16.659 53 HD3 LYS 7 HD3 LYS 7 15.522 -2.173 -15.578 54 HE2 LYS 7 HE2 LYS 7 17.284 -0.971 -14.609 55 HE3 LYS 7 HE3 LYS 7 18.500 -2.094 -15.217 56 HZ1 LYS 7 HZ1 LYS 7 18.738 -0.826 -16.998 57 HZ2 LYS 7 HZ2 LYS 7 17.590 0.264 -16.402 58 HZ3 LYS 7 HZ3 LYS 7 17.105 -1.016 -17.398 59 H TRP 8 H TRP 8 17.422 -6.418 -13.266 60 HA TRP 8 HA TRP 8 19.375 -7.581 -13.184 61 HB2 TRP 8 HB2 TRP 8 20.359 -4.747 -12.888 62 HB3 TRP 8 HB3 TRP 8 21.467 -6.115 -12.978 63 HD1 TRP 8 HD1 TRP 8 19.659 -3.717 -15.132 64 HE1 TRP 8 HE1 TRP 8 19.830 -4.416 -17.604 65 HE3 TRP 8 HE3 TRP 8 21.454 -8.464 -14.512 66 HZ2 TRP 8 HZ2 TRP 8 20.622 -6.679 -19.094 67 HZ3 TRP 8 HZ3 TRP 8 21.892 -9.830 -16.511 68 HH2 TRP 8 HH2 TRP 8 21.484 -8.954 -18.754 69 H LEU 9 H LEU 9 18.063 -7.920 -10.905 70 HA LEU 9 HA LEU 9 20.144 -7.711 -8.830 71 HB2 LEU 9 HB2 LEU 9 18.191 -6.250 -8.403 72 HB3 LEU 9 HB3 LEU 9 17.161 -7.680 -8.401 73 HG LEU 9 HG LEU 9 18.530 -8.513 -6.448 74 HD11 LEU 9 HD11 LEU 9 20.156 -6.363 -7.110 75 HD12 LEU 9 HD12 LEU 9 20.263 -7.366 -5.663 76 HD13 LEU 9 HD13 LEU 9 19.339 -5.865 -5.629 77 HD21 LEU 9 HD21 LEU 9 17.489 -6.432 -5.023 78 HD22 LEU 9 HD22 LEU 9 16.581 -7.841 -5.572 79 HD23 LEU 9 HD23 LEU 9 16.557 -6.354 -6.520 80 H SER 10 H SER 10 17.115 -9.491 -9.465 81 HA SER 10 HA SER 10 18.282 -12.019 -9.684 82 HB2 SER 10 HB2 SER 10 18.419 -11.157 -7.063 83 HB3 SER 10 HB3 SER 10 16.955 -12.142 -7.078 84 HG SER 10 HG SER 10 18.383 -13.690 -6.846 85 H CYS 11 H CYS 11 16.807 -13.451 -10.420 86 HA CYS 11 HA CYS 11 14.020 -12.549 -10.501 87 HB2 CYS 11 HB2 CYS 11 15.594 -13.389 -12.526 88 HB3 CYS 11 HB3 CYS 11 14.860 -14.922 -12.064 89 H VAL 12 H VAL 12 16.052 -14.924 -9.093 90 HA VAL 12 HA VAL 12 14.408 -17.104 -8.729 91 HB VAL 12 HB VAL 12 16.264 -15.981 -6.629 92 HG11 VAL 12 HG11 VAL 12 15.466 -18.839 -7.150 93 HG12 VAL 12 HG12 VAL 12 16.420 -18.219 -5.801 94 HG13 VAL 12 HG13 VAL 12 14.709 -17.810 -5.935 95 HG21 VAL 12 HG21 VAL 12 17.536 -18.041 -8.026 96 HG22 VAL 12 HG22 VAL 12 16.816 -17.009 -9.262 97 HG23 VAL 12 HG23 VAL 12 17.923 -16.322 -8.073 98 H ASP 13 H ASP 13 14.286 -13.985 -7.169 99 HA ASP 13 HA ASP 13 12.622 -14.688 -4.996 100 HB2 ASP 13 HB2 ASP 13 12.942 -12.031 -6.408 101 HB3 ASP 13 HB3 ASP 13 12.145 -12.263 -4.855 102 H ARG 14 H ARG 14 11.679 -12.734 -7.824 103 HA ARG 14 HA ARG 14 9.279 -14.327 -8.179 104 HB2 ARG 14 HB2 ARG 14 9.199 -11.426 -7.351 105 HB3 ARG 14 HB3 ARG 14 7.838 -12.251 -8.098 106 HG2 ARG 14 HG2 ARG 14 7.264 -12.554 -5.934 107 HG3 ARG 14 HG3 ARG 14 8.305 -13.968 -6.121 108 HD2 ARG 14 HD2 ARG 14 10.157 -12.176 -5.427 109 HD3 ARG 14 HD3 ARG 14 8.762 -11.445 -4.634 110 HE ARG 14 HE ARG 14 8.892 -14.202 -4.031 111 HH11 ARG 14 HH11 ARG 14 10.454 -11.174 -3.314 112 HH12 ARG 14 HH12 ARG 14 10.986 -11.671 -1.742 113 HH21 ARG 14 HH21 ARG 14 9.586 -14.868 -1.963 114 HH22 ARG 14 HH22 ARG 14 10.492 -13.773 -0.974 115 H LYS 15 H LYS 15 9.497 -14.766 -10.279 116 HA LYS 15 HA LYS 15 10.654 -12.900 -12.133 117 HB2 LYS 15 HB2 LYS 15 10.359 -14.616 -13.786 118 HB3 LYS 15 HB3 LYS 15 10.928 -15.378 -12.306 119 HG2 LYS 15 HG2 LYS 15 8.338 -15.695 -11.896 120 HG3 LYS 15 HG3 LYS 15 8.294 -15.579 -13.657 121 HD2 LYS 15 HD2 LYS 15 10.036 -17.364 -13.746 122 HD3 LYS 15 HD3 LYS 15 9.876 -17.540 -11.997 123 HE2 LYS 15 HE2 LYS 15 7.487 -18.069 -12.298 124 HE3 LYS 15 HE3 LYS 15 7.698 -17.950 -14.045 125 HZ1 LYS 15 HZ1 LYS 15 7.877 -20.205 -13.621 126 HZ2 LYS 15 HZ2 LYS 15 8.759 -19.988 -12.194 127 HZ3 LYS 15 HZ3 LYS 15 9.497 -19.720 -13.693 128 H ASN 16 H ASN 16 7.454 -13.788 -11.122 129 HA ASN 16 HA ASN 16 6.157 -12.537 -13.384 130 HB2 ASN 16 HB2 ASN 16 5.177 -13.859 -10.865 131 HB3 ASN 16 HB3 ASN 16 4.078 -12.953 -11.901 132 HD21 ASN 16 HD21 ASN 16 2.979 -14.205 -13.205 133 HD22 ASN 16 HD22 ASN 16 3.547 -15.654 -13.957 134 H ASP 17 H ASP 17 7.240 -11.640 -10.236 135 HA ASP 17 HA ASP 17 5.831 -9.063 -10.475 136 HB2 ASP 17 HB2 ASP 17 6.762 -10.569 -8.028 137 HB3 ASP 17 HB3 ASP 17 6.253 -8.884 -7.981 138 H CYS 18 H CYS 18 8.306 -9.733 -11.798 139 HA CYS 18 HA CYS 18 10.613 -8.886 -10.529 140 HB2 CYS 18 HB2 CYS 18 9.692 -9.087 -13.324 141 HB3 CYS 18 HB3 CYS 18 11.008 -7.948 -13.056 142 H CYS 19 H CYS 19 8.822 -6.827 -12.822 143 HA CYS 19 HA CYS 19 8.461 -4.639 -11.125 144 HB2 CYS 19 HB2 CYS 19 11.139 -4.915 -11.707 145 HB3 CYS 19 HB3 CYS 19 10.604 -3.756 -12.920 146 H GLU 20 H GLU 20 8.634 -2.484 -12.748 147 HA GLU 20 HA GLU 20 6.627 -3.099 -14.748 148 HB2 GLU 20 HB2 GLU 20 6.232 -1.174 -13.348 149 HB3 GLU 20 HB3 GLU 20 7.791 -0.486 -13.779 150 HG2 GLU 20 HG2 GLU 20 7.085 -0.028 -15.988 151 HG3 GLU 20 HG3 GLU 20 5.622 -0.992 -15.792 152 H GLY 21 H GLY 21 7.241 -3.720 -16.711 153 HA2 GLY 21 HA2 GLY 21 8.198 -3.484 -18.814 154 HA3 GLY 21 HA3 GLY 21 9.125 -2.120 -18.206 155 H LEU 22 H LEU 22 9.073 -5.313 -16.739 156 HA LEU 22 HA LEU 22 11.811 -5.771 -17.709 157 HB2 LEU 22 HB2 LEU 22 10.796 -6.095 -14.891 158 HB3 LEU 22 HB3 LEU 22 12.344 -6.714 -15.463 159 HG LEU 22 HG LEU 22 11.516 -3.828 -15.195 160 HD11 LEU 22 HD11 LEU 22 12.602 -3.839 -13.257 161 HD12 LEU 22 HD12 LEU 22 13.994 -4.662 -13.962 162 HD13 LEU 22 HD13 LEU 22 12.623 -5.599 -13.367 163 HD21 LEU 22 HD21 LEU 22 12.867 -3.489 -16.954 164 HD22 LEU 22 HD22 LEU 22 13.586 -5.097 -16.842 165 HD23 LEU 22 HD23 LEU 22 14.168 -3.796 -15.802 166 H GLU 23 H GLU 23 12.504 -8.037 -17.547 167 HA GLU 23 HA GLU 23 10.351 -9.997 -17.342 168 HB2 GLU 23 HB2 GLU 23 11.730 -9.223 -19.843 169 HB3 GLU 23 HB3 GLU 23 11.552 -10.950 -19.567 170 HG2 GLU 23 HG2 GLU 23 9.219 -9.088 -19.334 171 HG3 GLU 23 HG3 GLU 23 9.734 -9.731 -20.893 172 H CYS 24 H CYS 24 11.263 -12.272 -17.599 173 HA CYS 24 HA CYS 24 13.638 -12.450 -15.940 174 HB2 CYS 24 HB2 CYS 24 11.317 -13.887 -15.997 175 HB3 CYS 24 HB3 CYS 24 12.400 -14.948 -16.892 176 H TYR 25 H TYR 25 15.611 -12.957 -16.639 177 HA TYR 25 HA TYR 25 15.960 -13.571 -19.474 178 HB2 TYR 25 HB2 TYR 25 17.265 -11.716 -18.545 179 HB3 TYR 25 HB3 TYR 25 17.987 -12.801 -17.362 180 HD1 TYR 25 HD1 TYR 25 17.636 -12.345 -21.047 181 HD2 TYR 25 HD2 TYR 25 20.012 -13.828 -17.845 182 HE1 TYR 25 HE1 TYR 25 19.441 -12.865 -22.635 183 HE2 TYR 25 HE2 TYR 25 21.824 -14.351 -19.424 184 HH TYR 25 HH TYR 25 21.469 -14.631 -22.603 185 H LYS 26 H LYS 26 17.215 -15.310 -20.211 186 HA LYS 26 HA LYS 26 17.055 -17.660 -18.536 187 HB2 LYS 26 HB2 LYS 26 17.791 -18.870 -20.543 188 HB3 LYS 26 HB3 LYS 26 16.428 -17.815 -20.890 189 HG2 LYS 26 HG2 LYS 26 18.379 -16.139 -21.538 190 HG3 LYS 26 HG3 LYS 26 19.239 -17.657 -21.812 191 HD2 LYS 26 HD2 LYS 26 16.559 -16.955 -23.006 192 HD3 LYS 26 HD3 LYS 26 18.106 -16.790 -23.839 193 HE2 LYS 26 HE2 LYS 26 17.083 -19.383 -22.695 194 HE3 LYS 26 HE3 LYS 26 16.827 -18.884 -24.367 195 HZ1 LYS 26 HZ1 LYS 26 19.569 -18.687 -23.582 196 HZ2 LYS 26 HZ2 LYS 26 18.884 -19.478 -24.910 197 HZ3 LYS 26 HZ3 LYS 26 18.977 -20.263 -23.415 198 H ARG 27 H ARG 27 18.637 -18.392 -17.289 199 HA ARG 27 HA ARG 27 21.418 -17.965 -18.068 200 HB2 ARG 27 HB2 ARG 27 20.418 -16.189 -16.365 201 HB3 ARG 27 HB3 ARG 27 20.742 -17.472 -15.206 202 HG2 ARG 27 HG2 ARG 27 22.652 -16.133 -15.165 203 HG3 ARG 27 HG3 ARG 27 23.101 -17.516 -16.164 204 HD2 ARG 27 HD2 ARG 27 23.377 -16.250 -17.992 205 HD3 ARG 27 HD3 ARG 27 21.919 -15.312 -17.672 206 HE ARG 27 HE ARG 27 24.584 -14.545 -17.093 207 HH11 ARG 27 HH11 ARG 27 21.338 -14.367 -15.848 208 HH12 ARG 27 HH12 ARG 27 21.614 -12.896 -14.975 209 HH21 ARG 27 HH21 ARG 27 24.960 -12.608 -15.948 210 HH22 ARG 27 HH22 ARG 27 23.674 -11.895 -15.034 211 H ARG 28 H ARG 28 22.694 -19.671 -17.628 212 HA ARG 28 HA ARG 28 21.577 -21.796 -15.918 213 HB2 ARG 28 HB2 ARG 28 22.925 -23.366 -17.390 214 HB3 ARG 28 HB3 ARG 28 21.509 -22.629 -18.130 215 HG2 ARG 28 HG2 ARG 28 23.799 -20.970 -18.576 216 HG3 ARG 28 HG3 ARG 28 24.149 -22.626 -19.074 217 HD2 ARG 28 HD2 ARG 28 22.682 -22.558 -20.785 218 HD3 ARG 28 HD3 ARG 28 21.511 -21.604 -19.875 219 HE ARG 28 HE ARG 28 23.513 -19.845 -20.380 220 HH11 ARG 28 HH11 ARG 28 21.604 -21.969 -22.372 221 HH12 ARG 28 HH12 ARG 28 21.684 -20.944 -23.768 222 HH21 ARG 28 HH21 ARG 28 23.624 -18.488 -22.209 223 HH22 ARG 28 HH22 ARG 28 22.834 -18.965 -23.673 224 H HIS 29 H HIS 29 24.465 -20.090 -16.971 225 HA HIS 29 HA HIS 29 26.218 -21.550 -15.218 226 HB2 HIS 29 HB2 HIS 29 27.957 -20.155 -16.036 227 HB3 HIS 29 HB3 HIS 29 26.900 -20.464 -17.410 228 HD1 HIS 29 HD1 HIS 29 26.010 -18.465 -18.610 229 HD2 HIS 29 HD2 HIS 29 27.567 -17.503 -14.879 230 HE1 HIS 29 HE1 HIS 29 25.982 -15.953 -18.496 231 H SER 30 H SER 30 24.263 -18.698 -15.032 232 HA SER 30 HA SER 30 25.109 -18.336 -12.250 233 HB2 SER 30 HB2 SER 30 25.290 -16.329 -14.441 234 HB3 SER 30 HB3 SER 30 24.739 -15.757 -12.866 235 HG SER 30 HG SER 30 26.703 -15.927 -12.157 236 H PHE 31 H PHE 31 23.571 -16.766 -11.113 237 HA PHE 31 HA PHE 31 20.935 -17.773 -11.374 238 HB2 PHE 31 HB2 PHE 31 20.364 -16.195 -9.588 239 HB3 PHE 31 HB3 PHE 31 21.860 -17.046 -9.217 240 HD1 PHE 31 HD1 PHE 31 23.989 -15.886 -9.230 241 HD2 PHE 31 HD2 PHE 31 20.354 -13.834 -10.066 242 HE1 PHE 31 HE1 PHE 31 25.133 -13.733 -8.901 243 HE2 PHE 31 HE2 PHE 31 21.493 -11.678 -9.740 244 HZ PHE 31 HZ PHE 31 23.885 -11.625 -9.157 245 H GLU 32 H GLU 32 19.215 -17.031 -12.459 246 HA GLU 32 HA GLU 32 19.555 -14.957 -14.390 247 HB2 GLU 32 HB2 GLU 32 17.133 -15.390 -14.881 248 HB3 GLU 32 HB3 GLU 32 18.165 -16.809 -14.980 249 HG2 GLU 32 HG2 GLU 32 17.322 -17.714 -13.009 250 HG3 GLU 32 HG3 GLU 32 16.657 -16.171 -12.476 251 H VAL 33 H VAL 33 18.458 -12.975 -14.538 252 HA VAL 33 HA VAL 33 17.107 -12.022 -12.116 253 HB VAL 33 HB VAL 33 18.361 -9.987 -12.024 254 HG11 VAL 33 HG11 VAL 33 19.374 -12.394 -11.316 255 HG12 VAL 33 HG12 VAL 33 20.667 -11.783 -12.349 256 HG13 VAL 33 HG13 VAL 33 20.140 -10.849 -10.948 257 HG21 VAL 33 HG21 VAL 33 18.922 -9.289 -14.121 258 HG22 VAL 33 HG22 VAL 33 20.475 -9.959 -13.627 259 HG23 VAL 33 HG23 VAL 33 19.395 -10.902 -14.653 260 H CYS 34 H CYS 34 16.298 -9.659 -12.587 261 HA CYS 34 HA CYS 34 14.529 -9.866 -14.822 262 HB2 CYS 34 HB2 CYS 34 15.026 -7.536 -12.956 263 HB3 CYS 34 HB3 CYS 34 13.671 -7.689 -14.071 264 H VAL 35 H VAL 35 14.453 -8.629 -16.685 265 HA VAL 35 HA VAL 35 16.730 -6.861 -17.231 266 HB VAL 35 HB VAL 35 16.941 -7.825 -19.510 267 HG11 VAL 35 HG11 VAL 35 18.487 -8.466 -17.729 268 HG12 VAL 35 HG12 VAL 35 17.410 -9.781 -17.261 269 HG13 VAL 35 HG13 VAL 35 18.200 -9.805 -18.839 270 HG21 VAL 35 HG21 VAL 35 14.548 -8.978 -19.076 271 HG22 VAL 35 HG22 VAL 35 15.700 -9.548 -20.282 272 HG23 VAL 35 HG23 VAL 35 15.614 -10.333 -18.705 273 HA PRO 36 HA PRO 36 13.743 -4.181 -19.016 274 HB2 PRO 36 HB2 PRO 36 15.248 -2.917 -20.889 275 HB3 PRO 36 HB3 PRO 36 15.417 -2.614 -19.156 276 HG2 PRO 36 HG2 PRO 36 17.073 -4.350 -20.946 277 HG3 PRO 36 HG3 PRO 36 17.598 -3.232 -19.675 278 HD2 PRO 36 HD2 PRO 36 17.450 -5.908 -19.291 279 HD3 PRO 36 HD3 PRO 36 17.150 -4.739 -17.990 280 H ILE 37 H ILE 37 12.148 -4.522 -20.425 281 HA ILE 37 HA ILE 37 12.493 -6.403 -22.585 282 HB ILE 37 HB ILE 37 10.067 -4.805 -21.760 283 HG12 ILE 37 HG12 ILE 37 10.346 -7.755 -21.384 284 HG13 ILE 37 HG13 ILE 37 11.171 -6.684 -20.257 285 HG21 ILE 37 HG21 ILE 37 8.794 -6.332 -23.165 286 HG22 ILE 37 HG22 ILE 37 9.994 -5.461 -24.117 287 HG23 ILE 37 HG23 ILE 37 10.283 -7.138 -23.657 288 HD11 ILE 37 HD11 ILE 37 9.292 -6.435 -19.129 289 HD12 ILE 37 HD12 ILE 37 8.514 -5.755 -20.558 290 HD13 ILE 37 HD13 ILE 37 8.463 -7.494 -20.271 291 HA PRO 38 HA PRO 38 13.407 -3.364 -25.671 292 HB2 PRO 38 HB2 PRO 38 13.060 -4.965 -27.835 293 HB3 PRO 38 HB3 PRO 38 14.480 -5.060 -26.788 294 HG2 PRO 38 HG2 PRO 38 12.027 -6.775 -26.813 295 HG3 PRO 38 HG3 PRO 38 13.726 -7.256 -26.648 296 HD2 PRO 38 HD2 PRO 38 12.055 -7.061 -24.526 297 HD3 PRO 38 HD3 PRO 38 13.793 -6.715 -24.409 298 H GLY 39 H GLY 39 12.209 -1.872 -26.700 299 HA2 GLY 39 HA2 GLY 39 10.430 -0.859 -27.749 300 HA3 GLY 39 HA3 GLY 39 9.829 -2.463 -28.140 301 H PHE 40 H PHE 40 10.376 -2.140 -24.839 302 HA PHE 40 HA PHE 40 7.688 -2.479 -24.141 303 HB2 PHE 40 HB2 PHE 40 9.241 -3.205 -22.543 304 HB3 PHE 40 HB3 PHE 40 10.136 -1.689 -22.588 305 HD1 PHE 40 HD1 PHE 40 6.858 -3.126 -21.591 306 HD2 PHE 40 HD2 PHE 40 9.747 -0.061 -20.987 307 HE1 PHE 40 HE1 PHE 40 5.601 -2.334 -19.630 308 HE2 PHE 40 HE2 PHE 40 8.496 0.736 -19.023 309 HZ PHE 40 HZ PHE 40 6.421 -0.401 -18.342 310 H CYS 41 H CYS 41 6.140 -1.099 -23.290 311 HA CYS 41 HA CYS 41 6.679 1.735 -23.061 312 HB2 CYS 41 HB2 CYS 41 5.077 2.459 -24.707 313 HB3 CYS 41 HB3 CYS 41 6.223 1.378 -25.495 314 H LEU 42 H LEU 42 4.160 2.738 -22.974 315 HA LEU 42 HA LEU 42 2.785 1.092 -20.956 316 HB2 LEU 42 HB2 LEU 42 2.924 4.093 -20.870 317 HB3 LEU 42 HB3 LEU 42 2.363 2.993 -19.612 318 HG LEU 42 HG LEU 42 5.227 3.243 -20.530 319 HD11 LEU 42 HD11 LEU 42 4.973 4.066 -17.877 320 HD12 LEU 42 HD12 LEU 42 3.657 4.862 -18.740 321 HD13 LEU 42 HD13 LEU 42 5.322 5.075 -19.281 322 HD21 LEU 42 HD21 LEU 42 4.253 1.058 -19.478 323 HD22 LEU 42 HD22 LEU 42 4.328 1.983 -17.978 324 HD23 LEU 42 HD23 LEU 42 5.796 1.705 -18.917 325 H VAL 43 H VAL 43 0.502 2.051 -20.534 326 HA VAL 43 HA VAL 43 -0.714 2.662 -23.150 327 HB VAL 43 HB VAL 43 -2.773 1.563 -22.274 328 HG11 VAL 43 HG11 VAL 43 -1.725 0.134 -23.702 329 HG12 VAL 43 HG12 VAL 43 -0.218 0.144 -22.784 330 HG13 VAL 43 HG13 VAL 43 -1.589 -0.811 -22.220 331 HG21 VAL 43 HG21 VAL 43 -1.550 1.756 -19.833 332 HG22 VAL 43 HG22 VAL 43 -2.955 0.754 -20.192 333 HG23 VAL 43 HG23 VAL 43 -1.338 0.050 -20.228 334 H LYS 44 H LYS 44 -3.175 3.407 -22.560 335 HA LYS 44 HA LYS 44 -2.803 5.971 -21.286 336 HB2 LYS 44 HB2 LYS 44 -4.979 6.522 -22.123 337 HB3 LYS 44 HB3 LYS 44 -4.120 5.660 -23.392 338 HG2 LYS 44 HG2 LYS 44 -5.504 3.720 -21.894 339 HG3 LYS 44 HG3 LYS 44 -6.628 5.050 -22.179 340 HD2 LYS 44 HD2 LYS 44 -6.974 3.955 -24.128 341 HD3 LYS 44 HD3 LYS 44 -5.535 4.847 -24.626 342 HE2 LYS 44 HE2 LYS 44 -5.034 2.287 -23.259 343 HE3 LYS 44 HE3 LYS 44 -5.817 2.163 -24.833 344 HZ1 LYS 44 HZ1 LYS 44 -3.890 2.558 -25.818 345 HZ2 LYS 44 HZ2 LYS 44 -3.123 2.560 -24.311 346 HZ3 LYS 44 HZ3 LYS 44 -3.691 4.010 -24.972 347 H TRP 45 H TRP 45 -3.297 3.035 -20.037 348 HA TRP 45 HA TRP 45 -4.963 4.077 -17.842 349 HB2 TRP 45 HB2 TRP 45 -4.894 1.269 -18.966 350 HB3 TRP 45 HB3 TRP 45 -5.728 1.723 -17.482 351 HD1 TRP 45 HD1 TRP 45 -6.303 1.367 -21.104 352 HE1 TRP 45 HE1 TRP 45 -8.549 2.426 -21.779 353 HE3 TRP 45 HE3 TRP 45 -7.277 3.995 -16.829 354 HZ2 TRP 45 HZ2 TRP 45 -10.480 4.147 -20.648 355 HZ3 TRP 45 HZ3 TRP 45 -9.345 5.323 -16.706 356 HH2 TRP 45 HH2 TRP 45 -10.911 5.396 -18.578 357 H LYS 46 H LYS 46 -1.970 3.839 -18.377 358 HA LYS 46 HA LYS 46 -1.293 2.338 -15.933 359 HB2 LYS 46 HB2 LYS 46 0.174 2.659 -18.530 360 HB3 LYS 46 HB3 LYS 46 1.066 2.329 -17.050 361 HG2 LYS 46 HG2 LYS 46 -1.207 0.550 -17.432 362 HG3 LYS 46 HG3 LYS 46 -0.016 0.455 -18.732 363 HD2 LYS 46 HD2 LYS 46 1.607 0.468 -16.569 364 HD3 LYS 46 HD3 LYS 46 0.190 -0.349 -15.904 365 HE2 LYS 46 HE2 LYS 46 0.276 -1.840 -17.961 366 HE3 LYS 46 HE3 LYS 46 1.871 -1.152 -18.268 367 HZ1 LYS 46 HZ1 LYS 46 2.257 -3.104 -17.069 368 HZ2 LYS 46 HZ2 LYS 46 1.004 -2.805 -15.974 369 HZ3 LYS 46 HZ3 LYS 46 2.415 -1.874 -15.918 370 H GLN 47 H GLN 47 0.264 3.233 -14.530 371 HA GLN 47 HA GLN 47 0.079 5.978 -14.094 372 HB2 GLN 47 HB2 GLN 47 1.586 3.740 -12.963 373 HB3 GLN 47 HB3 GLN 47 2.438 5.274 -12.851 374 HG2 GLN 47 HG2 GLN 47 0.927 6.172 -11.408 375 HG3 GLN 47 HG3 GLN 47 -0.412 5.213 -12.037 376 HE21 GLN 47 HE21 GLN 47 -1.095 4.524 -10.038 377 HE22 GLN 47 HE22 GLN 47 -0.200 3.403 -9.075 378 H CYS 48 H CYS 48 1.327 7.718 -14.606 379 HA CYS 48 HA CYS 48 3.339 7.284 -16.699 380 HB2 CYS 48 HB2 CYS 48 2.872 9.434 -17.505 381 HB3 CYS 48 HB3 CYS 48 1.294 8.824 -17.017 382 H ASP 49 H ASP 49 2.946 8.316 -13.450 383 HA ASP 49 HA ASP 49 5.025 10.076 -13.043 384 HB2 ASP 49 HB2 ASP 49 3.522 9.565 -11.244 385 HB3 ASP 49 HB3 ASP 49 3.994 7.868 -11.258 386 H GLY 50 H GLY 50 7.108 9.946 -13.532 387 HA2 GLY 50 HA2 GLY 50 9.274 9.060 -13.349 388 HA3 GLY 50 HA3 GLY 50 8.578 7.502 -12.929 389 H ARG 51 H ARG 51 6.741 7.501 -15.204 390 HA ARG 51 HA ARG 51 8.707 6.919 -17.319 391 HB2 ARG 51 HB2 ARG 51 5.987 5.681 -16.853 392 HB3 ARG 51 HB3 ARG 51 7.079 5.276 -18.171 393 HG2 ARG 51 HG2 ARG 51 7.681 4.898 -15.245 394 HG3 ARG 51 HG3 ARG 51 7.139 3.634 -16.350 395 HD2 ARG 51 HD2 ARG 51 9.376 3.278 -16.505 396 HD3 ARG 51 HD3 ARG 51 9.222 4.519 -17.748 397 HE ARG 51 HE ARG 51 10.479 5.906 -16.445 398 HH11 ARG 51 HH11 ARG 51 9.194 3.360 -14.449 399 HH12 ARG 51 HH12 ARG 51 10.083 3.837 -13.040 400 HH21 ARG 51 HH21 ARG 51 11.655 6.544 -14.598 401 HH22 ARG 51 HH22 ARG 51 11.483 5.650 -13.125 402 H GLU 52 H GLU 52 7.654 9.524 -16.941 403 HA GLU 52 HA GLU 52 5.438 10.087 -18.581 404 HB2 GLU 52 HB2 GLU 52 6.131 12.390 -18.472 405 HB3 GLU 52 HB3 GLU 52 6.405 11.649 -16.901 406 HG2 GLU 52 HG2 GLU 52 8.809 11.275 -17.743 407 HG3 GLU 52 HG3 GLU 52 8.401 12.480 -18.964 408 H ARG 53 H ARG 53 8.615 9.153 -19.355 409 HA ARG 53 HA ARG 53 8.174 9.920 -22.166 410 HB2 ARG 53 HB2 ARG 53 10.885 9.653 -20.866 411 HB3 ARG 53 HB3 ARG 53 10.515 10.300 -22.459 412 HG2 ARG 53 HG2 ARG 53 9.219 12.120 -21.264 413 HG3 ARG 53 HG3 ARG 53 9.978 11.540 -19.780 414 HD2 ARG 53 HD2 ARG 53 12.122 12.121 -20.514 415 HD3 ARG 53 HD3 ARG 53 11.608 12.243 -22.196 416 HE ARG 53 HE ARG 53 10.236 14.148 -20.632 417 HH11 ARG 53 HH11 ARG 53 13.387 13.474 -21.951 418 HH12 ARG 53 HH12 ARG 53 13.848 15.141 -22.043 419 HH21 ARG 53 HH21 ARG 53 10.832 16.347 -20.750 420 HH22 ARG 53 HH22 ARG 53 12.395 16.775 -21.359 421 H ASP 54 H ASP 54 7.530 7.446 -20.647 422 HA ASP 54 HA ASP 54 9.174 5.552 -22.195 423 HB2 ASP 54 HB2 ASP 54 8.899 5.615 -19.467 424 HB3 ASP 54 HB3 ASP 54 7.666 4.445 -19.931 425 H CYS 55 H CYS 55 6.009 6.700 -21.464 426 HA CYS 55 HA CYS 55 4.374 4.590 -22.146 427 HB2 CYS 55 HB2 CYS 55 3.931 7.489 -22.892 428 HB3 CYS 55 HB3 CYS 55 2.689 6.248 -22.746 429 H CYS 56 H CYS 56 3.058 4.372 -24.180 430 HA CYS 56 HA CYS 56 4.779 3.836 -26.362 431 HB2 CYS 56 HB2 CYS 56 1.892 3.571 -25.786 432 HB3 CYS 56 HB3 CYS 56 2.314 3.720 -27.488 433 H ALA 57 H ALA 57 3.853 4.587 -28.662 434 HA ALA 57 HA ALA 57 4.482 7.359 -28.837 435 HB1 ALA 57 HB1 ALA 57 3.691 5.257 -30.812 436 HB2 ALA 57 HB2 ALA 57 3.760 6.954 -31.293 437 HB3 ALA 57 HB3 ALA 57 5.204 6.153 -30.675 438 H GLY 58 H GLY 58 3.178 9.077 -28.797 439 HA2 GLY 58 HA2 GLY 58 1.198 10.256 -29.396 440 HA3 GLY 58 HA3 GLY 58 0.334 8.727 -29.433 441 H LEU 59 H LEU 59 1.748 8.073 -26.795 442 HA LEU 59 HA LEU 59 -0.354 9.110 -25.118 443 HB2 LEU 59 HB2 LEU 59 1.921 7.202 -24.710 444 HB3 LEU 59 HB3 LEU 59 0.980 7.797 -23.344 445 HG LEU 59 HG LEU 59 -0.092 6.212 -25.676 446 HD11 LEU 59 HD11 LEU 59 -0.524 4.541 -23.815 447 HD12 LEU 59 HD12 LEU 59 0.599 5.491 -22.844 448 HD13 LEU 59 HD13 LEU 59 1.148 4.733 -24.339 449 HD21 LEU 59 HD21 LEU 59 -2.069 6.083 -23.966 450 HD22 LEU 59 HD22 LEU 59 -1.914 7.465 -25.050 451 HD23 LEU 59 HD23 LEU 59 -1.385 7.596 -23.373 452 H GLU 60 H GLU 60 0.340 9.841 -22.827 453 HA GLU 60 HA GLU 60 2.788 11.327 -22.645 454 HB2 GLU 60 HB2 GLU 60 1.903 13.534 -22.590 455 HB3 GLU 60 HB3 GLU 60 1.292 12.787 -24.059 456 HG2 GLU 60 HG2 GLU 60 -0.734 12.190 -22.456 457 HG3 GLU 60 HG3 GLU 60 -0.146 13.620 -21.611 458 H CYS 61 H CYS 61 2.837 12.634 -20.570 459 HA CYS 61 HA CYS 61 1.866 10.961 -18.444 460 HB2 CYS 61 HB2 CYS 61 4.117 12.244 -18.586 461 HB3 CYS 61 HB3 CYS 61 3.183 13.632 -18.039 462 H TRP 62 H TRP 62 -0.328 11.108 -18.258 463 HA TRP 62 HA TRP 62 -1.641 13.686 -18.187 464 HB2 TRP 62 HB2 TRP 62 -2.571 11.455 -19.152 465 HB3 TRP 62 HB3 TRP 62 -2.965 11.084 -17.476 466 HD1 TRP 62 HD1 TRP 62 -3.365 14.710 -18.039 467 HE1 TRP 62 HE1 TRP 62 -5.848 15.309 -18.358 468 HE3 TRP 62 HE3 TRP 62 -5.256 10.006 -18.702 469 HZ2 TRP 62 HZ2 TRP 62 -8.285 13.965 -18.827 470 HZ3 TRP 62 HZ3 TRP 62 -7.673 9.751 -19.079 471 HH2 TRP 62 HH2 TRP 62 -9.155 11.690 -19.139 472 H LYS 63 H LYS 63 -2.088 14.833 -16.422 473 HA LYS 63 HA LYS 63 -1.485 13.651 -13.809 474 HB2 LYS 63 HB2 LYS 63 -0.404 15.817 -14.579 475 HB3 LYS 63 HB3 LYS 63 -1.989 16.563 -14.419 476 HG2 LYS 63 HG2 LYS 63 -0.951 15.063 -12.085 477 HG3 LYS 63 HG3 LYS 63 -0.185 16.605 -12.474 478 HD2 LYS 63 HD2 LYS 63 -3.164 16.263 -12.182 479 HD3 LYS 63 HD3 LYS 63 -2.105 16.727 -10.848 480 HE2 LYS 63 HE2 LYS 63 -1.922 18.268 -13.381 481 HE3 LYS 63 HE3 LYS 63 -3.335 18.524 -12.359 482 HZ1 LYS 63 HZ1 LYS 63 -1.354 18.646 -10.568 483 HZ2 LYS 63 HZ2 LYS 63 -2.005 19.998 -11.349 484 HZ3 LYS 63 HZ3 LYS 63 -0.580 19.293 -11.927 485 H ARG 64 H ARG 64 -3.283 12.604 -13.127 486 HA ARG 64 HA ARG 64 -5.781 14.165 -13.019 487 HB2 ARG 64 HB2 ARG 64 -5.237 11.382 -13.789 488 HB3 ARG 64 HB3 ARG 64 -6.572 11.568 -12.660 489 HG2 ARG 64 HG2 ARG 64 -7.854 12.750 -14.157 490 HG3 ARG 64 HG3 ARG 64 -6.454 13.304 -15.080 491 HD2 ARG 64 HD2 ARG 64 -7.251 11.728 -16.522 492 HD3 ARG 64 HD3 ARG 64 -6.191 10.715 -15.543 493 HE ARG 64 HE ARG 64 -8.037 9.630 -14.724 494 HH11 ARG 64 HH11 ARG 64 -9.034 12.563 -16.310 495 HH12 ARG 64 HH12 ARG 64 -10.723 12.188 -16.226 496 HH21 ARG 64 HH21 ARG 64 -10.258 9.124 -14.607 497 HH22 ARG 64 HH22 ARG 64 -11.418 10.233 -15.257 498 H SER 65 H SER 65 -6.653 14.543 -11.076 499 HA SER 65 HA SER 65 -5.718 12.960 -8.781 500 HB2 SER 65 HB2 SER 65 -5.579 15.007 -7.425 501 HB3 SER 65 HB3 SER 65 -4.481 15.085 -8.803 502 HG SER 65 HG SER 65 -6.530 16.716 -8.166 503 H GLY 66 H GLY 66 -7.227 12.522 -7.222 504 HA2 GLY 66 HA2 GLY 66 -9.308 13.108 -6.090 505 HA3 GLY 66 HA3 GLY 66 -9.925 13.643 -7.647 506 H ASN 67 H ASN 67 -8.728 11.273 -8.994 507 HA ASN 67 HA ASN 67 -10.737 9.304 -8.122 508 HB2 ASN 67 HB2 ASN 67 -9.825 10.204 -10.808 509 HB3 ASN 67 HB3 ASN 67 -10.246 8.503 -10.627 510 HD21 ASN 67 HD21 ASN 67 -11.451 11.184 -11.763 511 HD22 ASN 67 HD22 ASN 67 -13.119 11.027 -11.344 512 H LYS 68 H LYS 68 -7.408 9.814 -9.054 513 HA LYS 68 HA LYS 68 -6.427 7.649 -7.589 514 HB2 LYS 68 HB2 LYS 68 -5.624 6.281 -9.620 515 HB3 LYS 68 HB3 LYS 68 -7.293 6.087 -9.099 516 HG2 LYS 68 HG2 LYS 68 -8.137 7.042 -10.969 517 HG3 LYS 68 HG3 LYS 68 -6.770 8.143 -11.158 518 HD2 LYS 68 HD2 LYS 68 -6.747 6.546 -12.962 519 HD3 LYS 68 HD3 LYS 68 -5.383 6.220 -11.889 520 HE2 LYS 68 HE2 LYS 68 -6.437 4.334 -10.955 521 HE3 LYS 68 HE3 LYS 68 -8.010 4.786 -11.612 522 HZ1 LYS 68 HZ1 LYS 68 -5.667 3.968 -13.246 523 HZ2 LYS 68 HZ2 LYS 68 -7.224 4.301 -13.818 524 HZ3 LYS 68 HZ3 LYS 68 -6.956 2.953 -12.832 525 H SER 69 H SER 69 -4.100 7.007 -8.651 526 HA SER 69 HA SER 69 -2.576 9.380 -8.471 527 HB2 SER 69 HB2 SER 69 -1.973 6.512 -9.074 528 HB3 SER 69 HB3 SER 69 -0.736 7.725 -9.408 529 HG SER 69 HG SER 69 -0.524 8.116 -7.314 530 H SER 70 H SER 70 -0.741 9.679 -10.232 531 HA SER 70 HA SER 70 -2.047 10.692 -12.538 532 HB2 SER 70 HB2 SER 70 0.236 11.357 -11.329 533 HB3 SER 70 HB3 SER 70 0.907 10.287 -12.559 534 HG SER 70 HG SER 70 -0.190 11.576 -14.127 535 H VAL 71 H VAL 71 -2.310 9.863 -14.530 536 HA VAL 71 HA VAL 71 -1.023 7.282 -15.132 537 HB VAL 71 HB VAL 71 -3.104 6.683 -16.407 538 HG11 VAL 71 HG11 VAL 71 -3.906 7.029 -13.566 539 HG12 VAL 71 HG12 VAL 71 -3.997 5.604 -14.602 540 HG13 VAL 71 HG13 VAL 71 -2.449 6.099 -13.914 541 HG21 VAL 71 HG21 VAL 71 -4.055 8.911 -16.621 542 HG22 VAL 71 HG22 VAL 71 -5.185 7.837 -15.795 543 HG23 VAL 71 HG23 VAL 71 -4.251 9.013 -14.871 544 H CYS 72 H CYS 72 -1.493 6.798 -17.616 545 HA CYS 72 HA CYS 72 -0.480 9.145 -19.053 546 HB2 CYS 72 HB2 CYS 72 -0.019 6.252 -19.226 547 HB3 CYS 72 HB3 CYS 72 -0.245 7.028 -20.790 548 H ALA 73 H ALA 73 -1.289 9.668 -21.147 549 HA ALA 73 HA ALA 73 -3.823 8.469 -21.947 550 HB1 ALA 73 HB1 ALA 73 -3.913 10.682 -20.370 551 HB2 ALA 73 HB2 ALA 73 -3.934 11.397 -21.983 552 HB3 ALA 73 HB3 ALA 73 -5.162 10.218 -21.526 553 HA PRO 74 HA PRO 74 -2.318 9.169 -26.011 554 HB2 PRO 74 HB2 PRO 74 -4.637 9.491 -27.386 555 HB3 PRO 74 HB3 PRO 74 -4.102 7.928 -26.758 556 HG2 PRO 74 HG2 PRO 74 -6.088 9.851 -25.610 557 HG3 PRO 74 HG3 PRO 74 -6.183 8.085 -25.734 558 HD2 PRO 74 HD2 PRO 74 -5.503 9.349 -23.439 559 HD3 PRO 74 HD3 PRO 74 -4.854 7.756 -23.881 560 H ILE 75 H ILE 75 -2.548 10.698 -27.922 561 HA ILE 75 HA ILE 75 -1.977 13.304 -27.163 562 HB ILE 75 HB ILE 75 -2.457 13.898 -29.579 563 HG12 ILE 75 HG12 ILE 75 -2.762 10.929 -29.973 564 HG13 ILE 75 HG13 ILE 75 -4.164 11.969 -29.751 565 HG21 ILE 75 HG21 ILE 75 -0.265 13.052 -28.591 566 HG22 ILE 75 HG22 ILE 75 -0.671 11.499 -29.318 567 HG23 ILE 75 HG23 ILE 75 -0.462 12.921 -30.339 568 HD11 ILE 75 HD11 ILE 75 -3.040 13.336 -31.692 569 HD12 ILE 75 HD12 ILE 75 -2.281 11.781 -32.036 570 HD13 ILE 75 HD13 ILE 75 -4.039 11.921 -32.023 571 H THR 76 H THR 76 -3.125 15.272 -27.385 572 HA THR 76 HA THR 76 -4.927 16.543 -26.712 573 HB THR 76 HB THR 76 -5.065 16.438 -29.207 574 HG1 THR 76 HG1 THR 76 -6.704 17.743 -28.945 575 HG21 THR 76 HG21 THR 76 -5.605 14.096 -29.502 576 HG22 THR 76 HG22 THR 76 -6.895 15.084 -30.185 577 HG23 THR 76 HG23 THR 76 -7.118 14.302 -28.620 Start of MODEL 18 1 H1 SER 1 H SER 1 1.963 -3.246 -1.302 2 HA SER 1 HA SER 1 3.245 -1.417 0.619 3 HB2 SER 1 HB2 SER 1 2.258 -4.253 0.964 4 HB3 SER 1 HB3 SER 1 3.259 -3.423 2.155 5 HG SER 1 HG SER 1 0.608 -3.229 1.737 6 H ASN 2 H ASN 2 3.742 -4.774 -0.479 7 HA ASN 2 HA ASN 2 6.583 -4.557 -0.170 8 HB2 ASN 2 HB2 ASN 2 4.739 -6.700 -1.196 9 HB3 ASN 2 HB3 ASN 2 6.486 -6.857 -1.353 10 HD21 ASN 2 HD21 ASN 2 3.788 -6.930 0.778 11 HD22 ASN 2 HD22 ASN 2 4.640 -7.449 2.189 12 H GLU 3 H GLU 3 7.826 -3.499 -1.560 13 HA GLU 3 HA GLU 3 7.049 -2.700 -4.135 14 HB2 GLU 3 HB2 GLU 3 9.394 -2.044 -4.446 15 HB3 GLU 3 HB3 GLU 3 8.785 -1.535 -2.877 16 HG2 GLU 3 HG2 GLU 3 9.829 -3.819 -2.101 17 HG3 GLU 3 HG3 GLU 3 10.811 -3.599 -3.548 18 H CYS 4 H CYS 4 8.645 -3.219 -6.062 19 HA CYS 4 HA CYS 4 8.503 -6.125 -6.424 20 HB2 CYS 4 HB2 CYS 4 8.527 -5.701 -8.794 21 HB3 CYS 4 HB3 CYS 4 7.341 -4.629 -8.056 22 H ILE 5 H ILE 5 10.250 -6.987 -7.982 23 HA ILE 5 HA ILE 5 12.781 -6.591 -6.715 24 HB ILE 5 HB ILE 5 12.087 -8.189 -9.183 25 HG12 ILE 5 HG12 ILE 5 12.741 -9.487 -6.598 26 HG13 ILE 5 HG13 ILE 5 11.186 -8.667 -6.686 27 HG21 ILE 5 HG21 ILE 5 14.610 -7.481 -8.071 28 HG22 ILE 5 HG22 ILE 5 14.356 -9.210 -7.839 29 HG23 ILE 5 HG23 ILE 5 14.264 -8.514 -9.457 30 HD11 ILE 5 HD11 ILE 5 11.401 -11.187 -7.304 31 HD12 ILE 5 HD12 ILE 5 10.358 -10.123 -8.247 32 HD13 ILE 5 HD13 ILE 5 11.957 -10.554 -8.854 33 H ARG 6 H ARG 6 14.021 -4.887 -7.117 34 HA ARG 6 HA ARG 6 13.814 -3.110 -9.219 35 HB2 ARG 6 HB2 ARG 6 16.180 -3.830 -7.491 36 HB3 ARG 6 HB3 ARG 6 16.219 -2.513 -8.654 37 HG2 ARG 6 HG2 ARG 6 15.653 -1.353 -6.786 38 HG3 ARG 6 HG3 ARG 6 14.040 -1.772 -7.366 39 HD2 ARG 6 HD2 ARG 6 13.717 -3.357 -5.732 40 HD3 ARG 6 HD3 ARG 6 15.443 -3.648 -5.525 41 HE ARG 6 HE ARG 6 13.842 -1.660 -4.189 42 HH11 ARG 6 HH11 ARG 6 17.052 -2.614 -5.141 43 HH12 ARG 6 HH12 ARG 6 17.836 -1.680 -3.909 44 HH21 ARG 6 HH21 ARG 6 14.861 -0.429 -2.562 45 HH22 ARG 6 HH22 ARG 6 16.589 -0.439 -2.442 46 H LYS 7 H LYS 7 15.186 -2.716 -11.055 47 HA LYS 7 HA LYS 7 15.579 -5.024 -12.652 48 HB2 LYS 7 HB2 LYS 7 15.003 -2.735 -13.507 49 HB3 LYS 7 HB3 LYS 7 16.653 -2.243 -13.151 50 HG2 LYS 7 HG2 LYS 7 17.491 -3.918 -14.723 51 HG3 LYS 7 HG3 LYS 7 15.833 -4.404 -15.083 52 HD2 LYS 7 HD2 LYS 7 16.490 -2.933 -16.820 53 HD3 LYS 7 HD3 LYS 7 15.411 -2.010 -15.771 54 HE2 LYS 7 HE2 LYS 7 17.739 -1.412 -14.609 55 HE3 LYS 7 HE3 LYS 7 18.322 -1.719 -16.244 56 HZ1 LYS 7 HZ1 LYS 7 16.103 0.145 -15.606 57 HZ2 LYS 7 HZ2 LYS 7 16.869 -0.056 -17.100 58 HZ3 LYS 7 HZ3 LYS 7 17.713 0.628 -15.804 59 H TRP 8 H TRP 8 17.493 -5.929 -13.457 60 HA TRP 8 HA TRP 8 19.573 -6.831 -13.218 61 HB2 TRP 8 HB2 TRP 8 20.128 -3.901 -12.754 62 HB3 TRP 8 HB3 TRP 8 21.411 -5.104 -12.848 63 HD1 TRP 8 HD1 TRP 8 19.594 -2.761 -14.973 64 HE1 TRP 8 HE1 TRP 8 19.906 -3.326 -17.465 65 HE3 TRP 8 HE3 TRP 8 21.526 -7.470 -14.501 66 HZ2 TRP 8 HZ2 TRP 8 20.845 -5.484 -19.024 67 HZ3 TRP 8 HZ3 TRP 8 22.104 -8.718 -16.541 68 HH2 TRP 8 HH2 TRP 8 21.770 -7.744 -18.755 69 H LEU 9 H LEU 9 18.069 -7.293 -11.007 70 HA LEU 9 HA LEU 9 20.001 -6.956 -8.807 71 HB2 LEU 9 HB2 LEU 9 17.842 -5.691 -8.561 72 HB3 LEU 9 HB3 LEU 9 17.021 -7.249 -8.498 73 HG LEU 9 HG LEU 9 19.213 -6.716 -6.552 74 HD11 LEU 9 HD11 LEU 9 16.419 -5.606 -6.322 75 HD12 LEU 9 HD12 LEU 9 17.912 -4.676 -6.442 76 HD13 LEU 9 HD13 LEU 9 17.604 -5.668 -5.017 77 HD21 LEU 9 HD21 LEU 9 17.263 -7.926 -5.193 78 HD22 LEU 9 HD22 LEU 9 18.439 -8.812 -6.164 79 HD23 LEU 9 HD23 LEU 9 16.839 -8.463 -6.818 80 H SER 10 H SER 10 17.146 -8.963 -9.559 81 HA SER 10 HA SER 10 18.511 -11.390 -9.791 82 HB2 SER 10 HB2 SER 10 17.921 -10.541 -7.027 83 HB3 SER 10 HB3 SER 10 17.414 -12.182 -7.426 84 HG SER 10 HG SER 10 19.426 -12.687 -7.149 85 H CYS 11 H CYS 11 17.171 -12.849 -10.671 86 HA CYS 11 HA CYS 11 14.313 -12.207 -10.706 87 HB2 CYS 11 HB2 CYS 11 15.496 -12.465 -12.873 88 HB3 CYS 11 HB3 CYS 11 15.868 -14.132 -12.447 89 H VAL 12 H VAL 12 16.529 -14.395 -9.341 90 HA VAL 12 HA VAL 12 15.167 -16.782 -9.163 91 HB VAL 12 HB VAL 12 16.753 -15.531 -6.918 92 HG11 VAL 12 HG11 VAL 12 15.821 -18.307 -7.521 93 HG12 VAL 12 HG12 VAL 12 17.307 -18.050 -6.604 94 HG13 VAL 12 HG13 VAL 12 15.776 -17.414 -6.000 95 HG21 VAL 12 HG21 VAL 12 17.562 -16.694 -9.514 96 HG22 VAL 12 HG22 VAL 12 18.351 -15.465 -8.526 97 HG23 VAL 12 HG23 VAL 12 18.507 -17.170 -8.103 98 H ASP 13 H ASP 13 14.586 -13.793 -7.445 99 HA ASP 13 HA ASP 13 12.911 -14.806 -5.416 100 HB2 ASP 13 HB2 ASP 13 13.365 -12.114 -6.636 101 HB3 ASP 13 HB3 ASP 13 11.970 -12.344 -5.585 102 H ARG 14 H ARG 14 11.859 -12.859 -8.211 103 HA ARG 14 HA ARG 14 9.636 -14.706 -8.641 104 HB2 ARG 14 HB2 ARG 14 9.111 -11.747 -8.485 105 HB3 ARG 14 HB3 ARG 14 7.947 -13.066 -8.492 106 HG2 ARG 14 HG2 ARG 14 8.640 -13.725 -6.265 107 HG3 ARG 14 HG3 ARG 14 9.870 -12.458 -6.256 108 HD2 ARG 14 HD2 ARG 14 8.239 -10.746 -6.244 109 HD3 ARG 14 HD3 ARG 14 6.944 -11.877 -6.640 110 HE ARG 14 HE ARG 14 7.963 -11.281 -4.044 111 HH11 ARG 14 HH11 ARG 14 6.545 -13.795 -5.990 112 HH12 ARG 14 HH12 ARG 14 5.870 -14.641 -4.637 113 HH21 ARG 14 HH21 ARG 14 7.081 -12.385 -2.255 114 HH22 ARG 14 HH22 ARG 14 6.174 -13.838 -2.513 115 H LYS 15 H LYS 15 9.240 -15.031 -10.740 116 HA LYS 15 HA LYS 15 10.812 -13.588 -12.692 117 HB2 LYS 15 HB2 LYS 15 8.765 -15.702 -13.315 118 HB3 LYS 15 HB3 LYS 15 10.206 -15.272 -14.227 119 HG2 LYS 15 HG2 LYS 15 11.617 -16.230 -12.512 120 HG3 LYS 15 HG3 LYS 15 10.203 -16.586 -11.517 121 HD2 LYS 15 HD2 LYS 15 10.354 -18.613 -12.497 122 HD3 LYS 15 HD3 LYS 15 9.497 -17.812 -13.815 123 HE2 LYS 15 HE2 LYS 15 12.458 -17.616 -13.779 124 HE3 LYS 15 HE3 LYS 15 11.751 -19.177 -14.194 125 HZ1 LYS 15 HZ1 LYS 15 11.015 -16.631 -15.527 126 HZ2 LYS 15 HZ2 LYS 15 10.572 -18.194 -15.994 127 HZ3 LYS 15 HZ3 LYS 15 12.184 -17.699 -16.123 128 H ASN 16 H ASN 16 7.342 -14.298 -12.269 129 HA ASN 16 HA ASN 16 6.532 -12.447 -14.279 130 HB2 ASN 16 HB2 ASN 16 5.278 -14.524 -13.306 131 HB3 ASN 16 HB3 ASN 16 4.703 -13.385 -12.093 132 HD21 ASN 16 HD21 ASN 16 4.845 -14.019 -15.548 133 HD22 ASN 16 HD22 ASN 16 3.415 -13.138 -15.955 134 H ASP 17 H ASP 17 6.972 -12.289 -10.809 135 HA ASP 17 HA ASP 17 5.870 -9.584 -10.717 136 HB2 ASP 17 HB2 ASP 17 6.602 -11.629 -8.658 137 HB3 ASP 17 HB3 ASP 17 6.543 -9.930 -8.196 138 H CYS 18 H CYS 18 8.312 -10.077 -12.169 139 HA CYS 18 HA CYS 18 10.623 -9.432 -10.732 140 HB2 CYS 18 HB2 CYS 18 9.802 -9.464 -13.554 141 HB3 CYS 18 HB3 CYS 18 11.084 -8.313 -13.190 142 H CYS 19 H CYS 19 8.826 -7.212 -12.870 143 HA CYS 19 HA CYS 19 8.524 -5.140 -11.026 144 HB2 CYS 19 HB2 CYS 19 11.190 -5.391 -11.769 145 HB3 CYS 19 HB3 CYS 19 10.591 -4.086 -12.788 146 H GLU 20 H GLU 20 8.686 -2.883 -12.525 147 HA GLU 20 HA GLU 20 6.591 -3.333 -14.470 148 HB2 GLU 20 HB2 GLU 20 6.426 -1.451 -12.906 149 HB3 GLU 20 HB3 GLU 20 7.915 -0.773 -13.552 150 HG2 GLU 20 HG2 GLU 20 6.920 -0.138 -15.538 151 HG3 GLU 20 HG3 GLU 20 5.594 -1.284 -15.360 152 H GLY 21 H GLY 21 7.099 -3.904 -16.477 153 HA2 GLY 21 HA2 GLY 21 7.996 -3.704 -18.598 154 HA3 GLY 21 HA3 GLY 21 8.891 -2.297 -18.043 155 H LEU 22 H LEU 22 9.038 -5.473 -16.548 156 HA LEU 22 HA LEU 22 11.755 -5.815 -17.623 157 HB2 LEU 22 HB2 LEU 22 10.840 -6.159 -14.775 158 HB3 LEU 22 HB3 LEU 22 12.375 -6.772 -15.387 159 HG LEU 22 HG LEU 22 11.533 -3.888 -15.132 160 HD11 LEU 22 HD11 LEU 22 12.697 -5.634 -13.308 161 HD12 LEU 22 HD12 LEU 22 12.645 -3.874 -13.210 162 HD13 LEU 22 HD13 LEU 22 14.039 -4.675 -13.935 163 HD21 LEU 22 HD21 LEU 22 13.784 -5.175 -16.610 164 HD22 LEU 22 HD22 LEU 22 14.033 -3.609 -15.836 165 HD23 LEU 22 HD23 LEU 22 12.781 -3.797 -17.064 166 H GLU 23 H GLU 23 12.511 -7.996 -17.727 167 HA GLU 23 HA GLU 23 10.376 -10.019 -17.571 168 HB2 GLU 23 HB2 GLU 23 11.564 -9.081 -19.908 169 HB3 GLU 23 HB3 GLU 23 12.385 -10.603 -19.589 170 HG2 GLU 23 HG2 GLU 23 10.498 -11.850 -19.888 171 HG3 GLU 23 HG3 GLU 23 9.421 -10.538 -19.413 172 H CYS 24 H CYS 24 11.315 -12.294 -17.629 173 HA CYS 24 HA CYS 24 13.534 -12.386 -15.722 174 HB2 CYS 24 HB2 CYS 24 11.308 -13.531 -15.267 175 HB3 CYS 24 HB3 CYS 24 11.742 -14.674 -16.534 176 H TYR 25 H TYR 25 15.497 -12.737 -16.499 177 HA TYR 25 HA TYR 25 15.799 -14.172 -19.039 178 HB2 TYR 25 HB2 TYR 25 16.865 -11.832 -18.409 179 HB3 TYR 25 HB3 TYR 25 18.097 -12.845 -17.664 180 HD1 TYR 25 HD1 TYR 25 16.259 -12.444 -20.891 181 HD2 TYR 25 HD2 TYR 25 19.877 -13.571 -18.955 182 HE1 TYR 25 HE1 TYR 25 17.335 -12.738 -23.084 183 HE2 TYR 25 HE2 TYR 25 20.963 -13.865 -21.143 184 HH TYR 25 HH TYR 25 19.767 -12.661 -23.965 185 H LYS 26 H LYS 26 17.927 -15.470 -19.157 186 HA LYS 26 HA LYS 26 18.347 -16.981 -16.669 187 HB2 LYS 26 HB2 LYS 26 17.573 -18.017 -19.369 188 HB3 LYS 26 HB3 LYS 26 18.588 -19.005 -18.327 189 HG2 LYS 26 HG2 LYS 26 16.923 -19.196 -16.693 190 HG3 LYS 26 HG3 LYS 26 15.990 -17.858 -17.367 191 HD2 LYS 26 HD2 LYS 26 14.776 -19.631 -18.156 192 HD3 LYS 26 HD3 LYS 26 15.916 -19.424 -19.487 193 HE2 LYS 26 HE2 LYS 26 15.735 -21.768 -18.892 194 HE3 LYS 26 HE3 LYS 26 17.347 -21.165 -18.512 195 HZ1 LYS 26 HZ1 LYS 26 17.068 -21.764 -16.414 196 HZ2 LYS 26 HZ2 LYS 26 15.565 -22.435 -16.803 197 HZ3 LYS 26 HZ3 LYS 26 15.663 -20.830 -16.278 198 H ARG 27 H ARG 27 20.411 -17.724 -16.319 199 HA ARG 27 HA ARG 27 22.424 -16.963 -18.333 200 HB2 ARG 27 HB2 ARG 27 22.316 -16.488 -15.398 201 HB3 ARG 27 HB3 ARG 27 23.885 -16.856 -16.101 202 HG2 ARG 27 HG2 ARG 27 22.070 -14.639 -17.024 203 HG3 ARG 27 HG3 ARG 27 23.435 -14.439 -15.923 204 HD2 ARG 27 HD2 ARG 27 24.907 -15.390 -17.703 205 HD3 ARG 27 HD3 ARG 27 23.520 -15.354 -18.792 206 HE ARG 27 HE ARG 27 24.012 -12.812 -17.594 207 HH11 ARG 27 HH11 ARG 27 25.039 -14.966 -20.130 208 HH12 ARG 27 HH12 ARG 27 25.650 -13.696 -21.139 209 HH21 ARG 27 HH21 ARG 27 24.813 -11.133 -18.913 210 HH22 ARG 27 HH22 ARG 27 25.521 -11.517 -20.446 211 H ARG 28 H ARG 28 24.630 -18.096 -17.639 212 HA ARG 28 HA ARG 28 24.068 -20.935 -17.779 213 HB2 ARG 28 HB2 ARG 28 26.418 -19.190 -18.304 214 HB3 ARG 28 HB3 ARG 28 26.739 -20.859 -17.857 215 HG2 ARG 28 HG2 ARG 28 26.690 -20.704 -20.239 216 HG3 ARG 28 HG3 ARG 28 25.255 -21.585 -19.708 217 HD2 ARG 28 HD2 ARG 28 23.837 -19.796 -20.166 218 HD3 ARG 28 HD3 ARG 28 25.157 -18.626 -20.158 219 HE ARG 28 HE ARG 28 25.651 -20.377 -22.249 220 HH11 ARG 28 HH11 ARG 28 23.200 -18.078 -21.334 221 HH12 ARG 28 HH12 ARG 28 22.770 -17.691 -22.967 222 HH21 ARG 28 HH21 ARG 28 25.092 -19.876 -24.403 223 HH22 ARG 28 HH22 ARG 28 23.845 -18.715 -24.712 224 H HIS 29 H HIS 29 26.457 -19.056 -15.908 225 HA HIS 29 HA HIS 29 26.029 -20.930 -13.676 226 HB2 HIS 29 HB2 HIS 29 28.498 -19.512 -14.644 227 HB3 HIS 29 HB3 HIS 29 28.383 -20.099 -12.987 228 HD1 HIS 29 HD1 HIS 29 30.549 -21.353 -14.530 229 HD2 HIS 29 HD2 HIS 29 26.658 -22.801 -14.691 230 HE1 HIS 29 HE1 HIS 29 30.752 -23.743 -15.285 231 H SER 30 H SER 30 26.810 -17.555 -14.462 232 HA SER 30 HA SER 30 26.551 -16.552 -11.844 233 HB2 SER 30 HB2 SER 30 26.523 -15.338 -14.580 234 HB3 SER 30 HB3 SER 30 26.033 -14.351 -13.202 235 HG SER 30 HG SER 30 28.116 -15.186 -12.260 236 H PHE 31 H PHE 31 24.851 -15.753 -10.705 237 HA PHE 31 HA PHE 31 22.307 -16.754 -11.076 238 HB2 PHE 31 HB2 PHE 31 21.569 -15.201 -9.378 239 HB3 PHE 31 HB3 PHE 31 23.182 -15.770 -8.959 240 HD1 PHE 31 HD1 PHE 31 25.153 -14.279 -9.465 241 HD2 PHE 31 HD2 PHE 31 21.123 -12.922 -9.632 242 HE1 PHE 31 HE1 PHE 31 25.934 -11.951 -9.301 243 HE2 PHE 31 HE2 PHE 31 21.896 -10.593 -9.469 244 HZ PHE 31 HZ PHE 31 24.304 -10.104 -9.304 245 H GLU 32 H GLU 32 20.599 -16.235 -12.294 246 HA GLU 32 HA GLU 32 20.864 -14.114 -14.234 247 HB2 GLU 32 HB2 GLU 32 18.669 -14.969 -15.065 248 HB3 GLU 32 HB3 GLU 32 19.934 -16.187 -15.005 249 HG2 GLU 32 HG2 GLU 32 18.381 -16.074 -12.556 250 HG3 GLU 32 HG3 GLU 32 17.394 -16.417 -13.975 251 H VAL 33 H VAL 33 19.642 -12.269 -14.393 252 HA VAL 33 HA VAL 33 17.820 -11.683 -12.155 253 HB VAL 33 HB VAL 33 18.626 -9.427 -12.008 254 HG11 VAL 33 HG11 VAL 33 21.243 -10.790 -12.096 255 HG12 VAL 33 HG12 VAL 33 20.470 -9.894 -10.787 256 HG13 VAL 33 HG13 VAL 33 19.995 -11.561 -11.117 257 HG21 VAL 33 HG21 VAL 33 20.053 -10.143 -14.512 258 HG22 VAL 33 HG22 VAL 33 19.228 -8.649 -14.067 259 HG23 VAL 33 HG23 VAL 33 20.830 -8.997 -13.419 260 H CYS 34 H CYS 34 16.579 -9.540 -12.703 261 HA CYS 34 HA CYS 34 15.037 -10.086 -15.033 262 HB2 CYS 34 HB2 CYS 34 15.014 -7.705 -13.166 263 HB3 CYS 34 HB3 CYS 34 13.808 -8.016 -14.411 264 H VAL 35 H VAL 35 14.677 -8.677 -16.833 265 HA VAL 35 HA VAL 35 16.806 -6.730 -17.369 266 HB VAL 35 HB VAL 35 16.891 -7.606 -19.747 267 HG11 VAL 35 HG11 VAL 35 18.750 -8.802 -19.243 268 HG12 VAL 35 HG12 VAL 35 18.453 -8.128 -17.639 269 HG13 VAL 35 HG13 VAL 35 17.930 -9.770 -18.018 270 HG21 VAL 35 HG21 VAL 35 14.794 -8.998 -19.427 271 HG22 VAL 35 HG22 VAL 35 16.143 -9.790 -20.242 272 HG23 VAL 35 HG23 VAL 35 15.807 -10.143 -18.548 273 HA PRO 36 HA PRO 36 13.599 -4.201 -18.979 274 HB2 PRO 36 HB2 PRO 36 14.932 -2.817 -20.897 275 HB3 PRO 36 HB3 PRO 36 15.170 -2.535 -19.168 276 HG2 PRO 36 HG2 PRO 36 16.832 -4.139 -21.074 277 HG3 PRO 36 HG3 PRO 36 17.354 -3.014 -19.806 278 HD2 PRO 36 HD2 PRO 36 17.382 -5.701 -19.471 279 HD3 PRO 36 HD3 PRO 36 17.079 -4.574 -18.132 280 H ILE 37 H ILE 37 11.958 -4.895 -20.188 281 HA ILE 37 HA ILE 37 12.263 -6.657 -22.390 282 HB ILE 37 HB ILE 37 9.849 -5.053 -21.539 283 HG12 ILE 37 HG12 ILE 37 10.143 -7.991 -21.098 284 HG13 ILE 37 HG13 ILE 37 11.017 -6.898 -20.029 285 HG21 ILE 37 HG21 ILE 37 9.675 -5.748 -23.862 286 HG22 ILE 37 HG22 ILE 37 10.062 -7.408 -23.410 287 HG23 ILE 37 HG23 ILE 37 8.559 -6.672 -22.856 288 HD11 ILE 37 HD11 ILE 37 8.800 -7.629 -19.182 289 HD12 ILE 37 HD12 ILE 37 8.988 -5.880 -19.305 290 HD13 ILE 37 HD13 ILE 37 8.055 -6.755 -20.520 291 HA PRO 38 HA PRO 38 13.083 -3.675 -25.561 292 HB2 PRO 38 HB2 PRO 38 12.754 -5.346 -27.676 293 HB3 PRO 38 HB3 PRO 38 14.189 -5.374 -26.644 294 HG2 PRO 38 HG2 PRO 38 11.781 -7.152 -26.589 295 HG3 PRO 38 HG3 PRO 38 13.493 -7.583 -26.433 296 HD2 PRO 38 HD2 PRO 38 11.843 -7.372 -24.296 297 HD3 PRO 38 HD3 PRO 38 13.572 -6.977 -24.210 298 H GLY 39 H GLY 39 11.765 -2.191 -26.408 299 HA2 GLY 39 HA2 GLY 39 9.976 -1.291 -27.570 300 HA3 GLY 39 HA3 GLY 39 9.381 -2.921 -27.845 301 H PHE 40 H PHE 40 10.020 -2.484 -24.595 302 HA PHE 40 HA PHE 40 7.346 -2.747 -23.809 303 HB2 PHE 40 HB2 PHE 40 8.924 -3.468 -22.235 304 HB3 PHE 40 HB3 PHE 40 9.860 -1.982 -22.353 305 HD1 PHE 40 HD1 PHE 40 6.596 -3.315 -21.188 306 HD2 PHE 40 HD2 PHE 40 9.550 -0.274 -20.812 307 HE1 PHE 40 HE1 PHE 40 5.428 -2.430 -19.212 308 HE2 PHE 40 HE2 PHE 40 8.388 0.615 -18.834 309 HZ PHE 40 HZ PHE 40 6.323 -0.462 -18.033 310 H CYS 41 H CYS 41 5.861 -1.310 -22.933 311 HA CYS 41 HA CYS 41 6.454 1.506 -22.750 312 HB2 CYS 41 HB2 CYS 41 4.863 2.255 -24.411 313 HB3 CYS 41 HB3 CYS 41 6.031 1.187 -25.181 314 H LEU 42 H LEU 42 3.964 2.576 -22.695 315 HA LEU 42 HA LEU 42 2.518 0.970 -20.695 316 HB2 LEU 42 HB2 LEU 42 2.742 3.965 -20.607 317 HB3 LEU 42 HB3 LEU 42 2.130 2.883 -19.358 318 HG LEU 42 HG LEU 42 5.013 3.041 -20.233 319 HD11 LEU 42 HD11 LEU 42 3.450 4.652 -18.378 320 HD12 LEU 42 HD12 LEU 42 5.054 4.933 -19.053 321 HD13 LEU 42 HD13 LEU 42 4.863 3.906 -17.632 322 HD21 LEU 42 HD21 LEU 42 3.682 1.628 -17.924 323 HD22 LEU 42 HD22 LEU 42 5.421 1.731 -18.200 324 HD23 LEU 42 HD23 LEU 42 4.396 0.865 -19.345 325 H VAL 43 H VAL 43 0.257 1.999 -20.302 326 HA VAL 43 HA VAL 43 -0.912 2.601 -22.941 327 HB VAL 43 HB VAL 43 -3.022 1.624 -22.045 328 HG11 VAL 43 HG11 VAL 43 -1.798 0.217 -23.469 329 HG12 VAL 43 HG12 VAL 43 -0.547 -0.065 -22.257 330 HG13 VAL 43 HG13 VAL 43 -2.149 -0.774 -22.054 331 HG21 VAL 43 HG21 VAL 43 -1.748 1.820 -19.601 332 HG22 VAL 43 HG22 VAL 43 -3.260 0.970 -19.923 333 HG23 VAL 43 HG23 VAL 43 -1.733 0.089 -19.943 334 H LYS 44 H LYS 44 -3.338 3.479 -22.400 335 HA LYS 44 HA LYS 44 -2.858 6.060 -21.195 336 HB2 LYS 44 HB2 LYS 44 -5.080 6.635 -22.022 337 HB3 LYS 44 HB3 LYS 44 -4.128 5.875 -23.291 338 HG2 LYS 44 HG2 LYS 44 -5.680 3.942 -21.788 339 HG3 LYS 44 HG3 LYS 44 -6.688 5.192 -22.521 340 HD2 LYS 44 HD2 LYS 44 -5.295 4.733 -24.652 341 HD3 LYS 44 HD3 LYS 44 -4.848 3.229 -23.843 342 HE2 LYS 44 HE2 LYS 44 -7.252 2.703 -23.584 343 HE3 LYS 44 HE3 LYS 44 -7.642 4.163 -24.493 344 HZ1 LYS 44 HZ1 LYS 44 -7.131 1.654 -25.515 345 HZ2 LYS 44 HZ2 LYS 44 -5.767 2.574 -25.906 346 HZ3 LYS 44 HZ3 LYS 44 -7.303 3.093 -26.388 347 H TRP 45 H TRP 45 -3.515 3.188 -19.876 348 HA TRP 45 HA TRP 45 -5.160 4.373 -17.737 349 HB2 TRP 45 HB2 TRP 45 -5.217 1.516 -18.734 350 HB3 TRP 45 HB3 TRP 45 -6.109 2.121 -17.339 351 HD1 TRP 45 HD1 TRP 45 -6.537 1.486 -20.922 352 HE1 TRP 45 HE1 TRP 45 -8.645 2.659 -21.821 353 HE3 TRP 45 HE3 TRP 45 -7.468 4.616 -16.987 354 HZ2 TRP 45 HZ2 TRP 45 -10.461 4.647 -20.976 355 HZ3 TRP 45 HZ3 TRP 45 -9.410 6.122 -17.113 356 HH2 TRP 45 HH2 TRP 45 -10.873 6.137 -19.066 357 H LYS 46 H LYS 46 -2.169 3.895 -18.255 358 HA LYS 46 HA LYS 46 -1.614 2.430 -15.758 359 HB2 LYS 46 HB2 LYS 46 -0.113 2.621 -18.344 360 HB3 LYS 46 HB3 LYS 46 0.765 2.309 -16.852 361 HG2 LYS 46 HG2 LYS 46 -1.577 0.605 -17.203 362 HG3 LYS 46 HG3 LYS 46 -0.358 0.413 -18.465 363 HD2 LYS 46 HD2 LYS 46 1.230 0.430 -16.296 364 HD3 LYS 46 HD3 LYS 46 -0.238 -0.248 -15.586 365 HE2 LYS 46 HE2 LYS 46 -0.246 -1.862 -17.557 366 HE3 LYS 46 HE3 LYS 46 1.399 -1.312 -17.873 367 HZ1 LYS 46 HZ1 LYS 46 1.512 -3.266 -16.549 368 HZ2 LYS 46 HZ2 LYS 46 0.403 -2.659 -15.425 369 HZ3 LYS 46 HZ3 LYS 46 1.940 -1.966 -15.554 370 H GLN 47 H GLN 47 -0.061 3.272 -14.330 371 HA GLN 47 HA GLN 47 -0.102 6.030 -13.946 372 HB2 GLN 47 HB2 GLN 47 1.233 3.733 -12.732 373 HB3 GLN 47 HB3 GLN 47 2.190 5.206 -12.640 374 HG2 GLN 47 HG2 GLN 47 0.674 6.275 -11.295 375 HG3 GLN 47 HG3 GLN 47 -0.681 5.301 -11.865 376 HE21 GLN 47 HE21 GLN 47 -1.145 5.149 -9.558 377 HE22 GLN 47 HE22 GLN 47 -0.360 3.922 -8.628 378 H CYS 48 H CYS 48 1.223 7.691 -14.494 379 HA CYS 48 HA CYS 48 3.271 7.105 -16.512 380 HB2 CYS 48 HB2 CYS 48 2.969 9.298 -17.338 381 HB3 CYS 48 HB3 CYS 48 1.346 8.720 -16.971 382 H ASP 49 H ASP 49 2.879 8.133 -13.282 383 HA ASP 49 HA ASP 49 4.992 9.839 -12.828 384 HB2 ASP 49 HB2 ASP 49 3.382 9.239 -11.091 385 HB3 ASP 49 HB3 ASP 49 4.015 7.596 -11.048 386 H GLY 50 H GLY 50 7.075 9.670 -13.303 387 HA2 GLY 50 HA2 GLY 50 9.221 8.734 -13.116 388 HA3 GLY 50 HA3 GLY 50 8.487 7.186 -12.723 389 H ARG 51 H ARG 51 6.669 7.260 -15.014 390 HA ARG 51 HA ARG 51 8.640 6.651 -17.117 391 HB2 ARG 51 HB2 ARG 51 5.940 5.446 -16.515 392 HB3 ARG 51 HB3 ARG 51 6.789 5.168 -18.030 393 HG2 ARG 51 HG2 ARG 51 7.324 3.318 -16.730 394 HG3 ARG 51 HG3 ARG 51 8.735 4.365 -16.576 395 HD2 ARG 51 HD2 ARG 51 8.079 5.081 -14.415 396 HD3 ARG 51 HD3 ARG 51 6.474 4.373 -14.592 397 HE ARG 51 HE ARG 51 8.520 2.404 -14.792 398 HH11 ARG 51 HH11 ARG 51 6.726 4.341 -12.523 399 HH12 ARG 51 HH12 ARG 51 6.915 3.220 -11.216 400 HH21 ARG 51 HH21 ARG 51 8.776 0.919 -13.079 401 HH22 ARG 51 HH22 ARG 51 8.081 1.274 -11.534 402 H GLU 52 H GLU 52 7.719 9.284 -16.749 403 HA GLU 52 HA GLU 52 5.519 9.976 -18.352 404 HB2 GLU 52 HB2 GLU 52 6.383 12.233 -18.298 405 HB3 GLU 52 HB3 GLU 52 6.597 11.495 -16.717 406 HG2 GLU 52 HG2 GLU 52 8.970 10.906 -17.673 407 HG3 GLU 52 HG3 GLU 52 8.629 12.263 -18.744 408 H ARG 53 H ARG 53 8.625 8.854 -19.188 409 HA ARG 53 HA ARG 53 8.142 9.584 -22.000 410 HB2 ARG 53 HB2 ARG 53 10.859 9.317 -20.706 411 HB3 ARG 53 HB3 ARG 53 10.518 9.828 -22.354 412 HG2 ARG 53 HG2 ARG 53 9.163 11.724 -21.179 413 HG3 ARG 53 HG3 ARG 53 10.188 11.323 -19.800 414 HD2 ARG 53 HD2 ARG 53 12.171 11.611 -21.284 415 HD3 ARG 53 HD3 ARG 53 11.083 12.180 -22.548 416 HE ARG 53 HE ARG 53 10.698 13.668 -20.175 417 HH11 ARG 53 HH11 ARG 53 12.930 13.252 -22.814 418 HH12 ARG 53 HH12 ARG 53 13.535 14.873 -22.731 419 HH21 ARG 53 HH21 ARG 53 11.486 15.806 -20.055 420 HH22 ARG 53 HH22 ARG 53 12.713 16.325 -21.160 421 H ASP 54 H ASP 54 7.513 7.161 -20.360 422 HA ASP 54 HA ASP 54 9.073 5.184 -21.889 423 HB2 ASP 54 HB2 ASP 54 8.685 5.336 -19.143 424 HB3 ASP 54 HB3 ASP 54 7.539 4.102 -19.661 425 H CYS 55 H CYS 55 5.940 6.446 -21.213 426 HA CYS 55 HA CYS 55 4.244 4.373 -21.857 427 HB2 CYS 55 HB2 CYS 55 3.901 7.265 -22.679 428 HB3 CYS 55 HB3 CYS 55 2.619 6.068 -22.516 429 H CYS 56 H CYS 56 2.909 4.213 -23.913 430 HA CYS 56 HA CYS 56 4.621 3.510 -26.055 431 HB2 CYS 56 HB2 CYS 56 1.710 3.470 -25.530 432 HB3 CYS 56 HB3 CYS 56 2.181 3.529 -27.225 433 H ALA 57 H ALA 57 3.793 4.270 -28.385 434 HA ALA 57 HA ALA 57 4.596 7.002 -28.595 435 HB1 ALA 57 HB1 ALA 57 5.261 6.144 -30.539 436 HB2 ALA 57 HB2 ALA 57 4.170 4.767 -30.390 437 HB3 ALA 57 HB3 ALA 57 3.584 6.285 -31.069 438 H GLY 58 H GLY 58 3.371 8.766 -28.513 439 HA2 GLY 58 HA2 GLY 58 1.481 10.042 -29.254 440 HA3 GLY 58 HA3 GLY 58 0.537 8.559 -29.280 441 H LEU 59 H LEU 59 1.860 7.913 -26.585 442 HA LEU 59 HA LEU 59 -0.237 9.088 -24.992 443 HB2 LEU 59 HB2 LEU 59 1.938 7.093 -24.474 444 HB3 LEU 59 HB3 LEU 59 0.995 7.769 -23.149 445 HG LEU 59 HG LEU 59 -0.094 6.166 -25.462 446 HD11 LEU 59 HD11 LEU 59 1.012 4.650 -24.071 447 HD12 LEU 59 HD12 LEU 59 -0.664 4.595 -23.527 448 HD13 LEU 59 HD13 LEU 59 0.532 5.503 -22.604 449 HD21 LEU 59 HD21 LEU 59 -1.394 7.604 -23.177 450 HD22 LEU 59 HD22 LEU 59 -2.142 6.176 -23.893 451 HD23 LEU 59 HD23 LEU 59 -1.830 7.600 -24.886 452 H GLU 60 H GLU 60 0.452 9.829 -22.691 453 HA GLU 60 HA GLU 60 2.951 11.190 -22.449 454 HB2 GLU 60 HB2 GLU 60 2.175 13.463 -22.494 455 HB3 GLU 60 HB3 GLU 60 1.722 12.697 -24.010 456 HG2 GLU 60 HG2 GLU 60 -0.516 12.235 -22.665 457 HG3 GLU 60 HG3 GLU 60 0.025 13.663 -21.786 458 H CYS 61 H CYS 61 3.181 12.284 -20.393 459 HA CYS 61 HA CYS 61 1.916 10.887 -18.283 460 HB2 CYS 61 HB2 CYS 61 4.244 12.089 -18.392 461 HB3 CYS 61 HB3 CYS 61 3.332 13.491 -17.842 462 H TRP 62 H TRP 62 -0.279 11.170 -18.255 463 HA TRP 62 HA TRP 62 -1.471 13.785 -18.384 464 HB2 TRP 62 HB2 TRP 62 -2.477 11.511 -19.143 465 HB3 TRP 62 HB3 TRP 62 -2.908 11.319 -17.446 466 HD1 TRP 62 HD1 TRP 62 -3.159 14.886 -18.348 467 HE1 TRP 62 HE1 TRP 62 -5.610 15.546 -18.770 468 HE3 TRP 62 HE3 TRP 62 -5.221 10.215 -18.620 469 HZ2 TRP 62 HZ2 TRP 62 -8.090 14.257 -19.165 470 HZ3 TRP 62 HZ3 TRP 62 -7.640 10.017 -19.022 471 HH2 TRP 62 HH2 TRP 62 -9.043 11.997 -19.288 472 H LYS 63 H LYS 63 -2.069 15.080 -16.748 473 HA LYS 63 HA LYS 63 -1.463 14.175 -14.023 474 HB2 LYS 63 HB2 LYS 63 -0.568 16.380 -15.241 475 HB3 LYS 63 HB3 LYS 63 -2.076 17.027 -14.607 476 HG2 LYS 63 HG2 LYS 63 -0.170 15.548 -12.834 477 HG3 LYS 63 HG3 LYS 63 0.060 17.261 -13.199 478 HD2 LYS 63 HD2 LYS 63 -1.231 17.501 -11.349 479 HD3 LYS 63 HD3 LYS 63 -2.531 17.310 -12.529 480 HE2 LYS 63 HE2 LYS 63 -3.203 15.752 -11.016 481 HE3 LYS 63 HE3 LYS 63 -2.123 14.743 -11.976 482 HZ1 LYS 63 HZ1 LYS 63 -0.466 15.846 -10.143 483 HZ2 LYS 63 HZ2 LYS 63 -1.144 14.300 -10.039 484 HZ3 LYS 63 HZ3 LYS 63 -1.879 15.601 -9.245 485 H ARG 64 H ARG 64 -3.286 13.173 -13.312 486 HA ARG 64 HA ARG 64 -5.766 14.765 -13.338 487 HB2 ARG 64 HB2 ARG 64 -5.261 12.011 -14.090 488 HB3 ARG 64 HB3 ARG 64 -6.475 12.112 -12.822 489 HG2 ARG 64 HG2 ARG 64 -7.983 13.183 -14.154 490 HG3 ARG 64 HG3 ARG 64 -6.735 13.933 -15.151 491 HD2 ARG 64 HD2 ARG 64 -6.925 12.313 -16.657 492 HD3 ARG 64 HD3 ARG 64 -6.565 11.100 -15.429 493 HE ARG 64 HE ARG 64 -9.128 11.729 -16.527 494 HH11 ARG 64 HH11 ARG 64 -7.484 10.558 -13.690 495 HH12 ARG 64 HH12 ARG 64 -8.851 9.672 -13.103 496 HH21 ARG 64 HH21 ARG 64 -10.936 10.564 -15.765 497 HH22 ARG 64 HH22 ARG 64 -10.814 9.674 -14.285 498 H SER 65 H SER 65 -6.610 15.302 -11.427 499 HA SER 65 HA SER 65 -5.733 13.822 -9.037 500 HB2 SER 65 HB2 SER 65 -5.676 16.772 -9.556 501 HB3 SER 65 HB3 SER 65 -5.963 16.193 -7.915 502 HG SER 65 HG SER 65 -3.834 16.205 -7.932 503 H GLY 66 H GLY 66 -7.298 13.308 -7.610 504 HA2 GLY 66 HA2 GLY 66 -9.370 13.899 -6.468 505 HA3 GLY 66 HA3 GLY 66 -9.953 14.543 -7.996 506 H ASN 67 H ASN 67 -8.671 12.102 -9.321 507 HA ASN 67 HA ASN 67 -10.892 10.261 -8.730 508 HB2 ASN 67 HB2 ASN 67 -10.636 11.383 -11.060 509 HB3 ASN 67 HB3 ASN 67 -9.328 10.228 -11.296 510 HD21 ASN 67 HD21 ASN 67 -9.812 8.231 -11.928 511 HD22 ASN 67 HD22 ASN 67 -11.408 7.578 -12.032 512 H LYS 68 H LYS 68 -7.489 10.324 -9.767 513 HA LYS 68 HA LYS 68 -6.778 8.222 -7.975 514 HB2 LYS 68 HB2 LYS 68 -7.425 7.570 -10.782 515 HB3 LYS 68 HB3 LYS 68 -5.908 6.909 -10.187 516 HG2 LYS 68 HG2 LYS 68 -7.386 6.149 -8.164 517 HG3 LYS 68 HG3 LYS 68 -8.699 6.324 -9.332 518 HD2 LYS 68 HD2 LYS 68 -7.326 4.875 -10.890 519 HD3 LYS 68 HD3 LYS 68 -6.283 4.535 -9.506 520 HE2 LYS 68 HE2 LYS 68 -8.149 3.597 -8.287 521 HE3 LYS 68 HE3 LYS 68 -9.257 4.034 -9.587 522 HZ1 LYS 68 HZ1 LYS 68 -7.552 1.752 -9.347 523 HZ2 LYS 68 HZ2 LYS 68 -7.326 2.554 -10.819 524 HZ3 LYS 68 HZ3 LYS 68 -8.866 2.010 -10.381 525 H SER 69 H SER 69 -4.445 7.383 -8.697 526 HA SER 69 HA SER 69 -2.720 9.560 -8.490 527 HB2 SER 69 HB2 SER 69 -2.339 6.673 -9.204 528 HB3 SER 69 HB3 SER 69 -0.982 7.790 -9.346 529 HG SER 69 HG SER 69 -1.320 8.329 -7.136 530 H SER 70 H SER 70 -0.773 9.718 -10.152 531 HA SER 70 HA SER 70 -1.867 10.905 -12.492 532 HB2 SER 70 HB2 SER 70 0.268 11.708 -12.906 533 HB3 SER 70 HB3 SER 70 0.346 11.436 -11.165 534 HG SER 70 HG SER 70 2.154 10.538 -12.180 535 H VAL 71 H VAL 71 -2.382 9.977 -14.351 536 HA VAL 71 HA VAL 71 -1.128 7.396 -15.033 537 HB VAL 71 HB VAL 71 -3.224 6.923 -16.336 538 HG11 VAL 71 HG11 VAL 71 -4.117 5.816 -14.572 539 HG12 VAL 71 HG12 VAL 71 -2.620 6.335 -13.797 540 HG13 VAL 71 HG13 VAL 71 -4.110 7.241 -13.533 541 HG21 VAL 71 HG21 VAL 71 -3.799 9.597 -15.636 542 HG22 VAL 71 HG22 VAL 71 -4.794 8.477 -16.568 543 HG23 VAL 71 HG23 VAL 71 -4.984 8.578 -14.818 544 H CYS 72 H CYS 72 -1.577 6.967 -17.522 545 HA CYS 72 HA CYS 72 -0.504 9.315 -18.926 546 HB2 CYS 72 HB2 CYS 72 0.121 6.490 -18.976 547 HB3 CYS 72 HB3 CYS 72 -0.267 7.072 -20.592 548 H ALA 73 H ALA 73 -1.244 9.799 -21.060 549 HA ALA 73 HA ALA 73 -3.740 8.566 -21.924 550 HB1 ALA 73 HB1 ALA 73 -5.108 10.281 -21.508 551 HB2 ALA 73 HB2 ALA 73 -3.859 10.841 -20.397 552 HB3 ALA 73 HB3 ALA 73 -3.923 11.472 -22.042 553 HA PRO 74 HA PRO 74 -2.156 9.251 -25.959 554 HB2 PRO 74 HB2 PRO 74 -4.433 9.642 -27.386 555 HB3 PRO 74 HB3 PRO 74 -3.957 8.063 -26.749 556 HG2 PRO 74 HG2 PRO 74 -5.913 10.041 -25.644 557 HG3 PRO 74 HG3 PRO 74 -6.057 8.278 -25.774 558 HD2 PRO 74 HD2 PRO 74 -5.394 9.519 -23.461 559 HD3 PRO 74 HD3 PRO 74 -4.781 7.910 -23.890 560 H ILE 75 H ILE 75 -2.268 10.790 -27.860 561 HA ILE 75 HA ILE 75 -1.695 13.393 -27.048 562 HB ILE 75 HB ILE 75 -1.978 13.985 -29.497 563 HG12 ILE 75 HG12 ILE 75 -2.261 11.022 -29.928 564 HG13 ILE 75 HG13 ILE 75 -3.680 12.052 -29.780 565 HG21 ILE 75 HG21 ILE 75 -0.244 11.568 -29.233 566 HG22 ILE 75 HG22 ILE 75 0.088 13.108 -30.024 567 HG23 ILE 75 HG23 ILE 75 0.095 13.002 -28.264 568 HD11 ILE 75 HD11 ILE 75 -1.820 11.719 -32.001 569 HD12 ILE 75 HD12 ILE 75 -3.497 12.265 -31.991 570 HD13 ILE 75 HD13 ILE 75 -2.198 13.400 -31.624 571 H THR 76 H THR 76 -2.799 15.373 -27.366 572 HA THR 76 HA THR 76 -5.712 15.161 -27.715 573 HB THR 76 HB THR 76 -6.129 16.686 -25.892 574 HG1 THR 76 HG1 THR 76 -3.327 16.899 -25.903 575 HG21 THR 76 HG21 THR 76 -4.411 15.059 -24.271 576 HG22 THR 76 HG22 THR 76 -5.097 14.084 -25.571 577 HG23 THR 76 HG23 THR 76 -6.160 14.966 -24.475 Start of MODEL 19 1 H1 SER 1 H SER 1 2.815 -2.657 -2.190 2 HA SER 1 HA SER 1 2.824 -1.754 0.558 3 HB2 SER 1 HB2 SER 1 3.414 -4.496 -0.581 4 HB3 SER 1 HB3 SER 1 3.137 -4.117 1.118 5 HG SER 1 HG SER 1 1.025 -3.605 0.644 6 H ASN 2 H ASN 2 5.146 -2.764 -1.870 7 HA ASN 2 HA ASN 2 7.294 -1.566 -0.371 8 HB2 ASN 2 HB2 ASN 2 8.680 -3.732 -0.576 9 HB3 ASN 2 HB3 ASN 2 7.498 -3.632 0.725 10 HD21 ASN 2 HD21 ASN 2 8.185 -4.988 -2.422 11 HD22 ASN 2 HD22 ASN 2 7.032 -6.271 -2.333 12 H GLU 3 H GLU 3 9.408 -1.785 -1.604 13 HA GLU 3 HA GLU 3 8.990 -0.958 -4.277 14 HB2 GLU 3 HB2 GLU 3 11.374 -0.765 -4.431 15 HB3 GLU 3 HB3 GLU 3 10.893 -0.239 -2.824 16 HG2 GLU 3 HG2 GLU 3 11.428 -3.011 -2.687 17 HG3 GLU 3 HG3 GLU 3 12.757 -2.249 -3.560 18 H CYS 4 H CYS 4 10.275 -1.964 -6.127 19 HA CYS 4 HA CYS 4 9.653 -4.831 -6.188 20 HB2 CYS 4 HB2 CYS 4 9.657 -4.616 -8.620 21 HB3 CYS 4 HB3 CYS 4 8.579 -3.423 -7.902 22 H ILE 5 H ILE 5 11.141 -6.055 -7.810 23 HA ILE 5 HA ILE 5 13.775 -5.990 -6.705 24 HB ILE 5 HB ILE 5 12.703 -7.588 -9.032 25 HG12 ILE 5 HG12 ILE 5 13.297 -8.877 -6.443 26 HG13 ILE 5 HG13 ILE 5 11.924 -7.776 -6.435 27 HG21 ILE 5 HG21 ILE 5 14.773 -9.015 -7.970 28 HG22 ILE 5 HG22 ILE 5 14.871 -7.998 -9.407 29 HG23 ILE 5 HG23 ILE 5 15.362 -7.357 -7.839 30 HD11 ILE 5 HD11 ILE 5 10.973 -9.037 -8.341 31 HD12 ILE 5 HD12 ILE 5 12.300 -10.189 -8.187 32 HD13 ILE 5 HD13 ILE 5 11.146 -9.992 -6.869 33 H ARG 6 H ARG 6 15.629 -5.188 -7.527 34 HA ARG 6 HA ARG 6 15.543 -3.173 -9.488 35 HB2 ARG 6 HB2 ARG 6 17.874 -4.677 -8.293 36 HB3 ARG 6 HB3 ARG 6 18.051 -3.291 -9.361 37 HG2 ARG 6 HG2 ARG 6 18.199 -2.245 -7.351 38 HG3 ARG 6 HG3 ARG 6 16.453 -2.164 -7.590 39 HD2 ARG 6 HD2 ARG 6 16.027 -3.808 -6.031 40 HD3 ARG 6 HD3 ARG 6 17.630 -4.524 -6.198 41 HE ARG 6 HE ARG 6 17.955 -1.973 -5.132 42 HH11 ARG 6 HH11 ARG 6 16.520 -5.018 -4.241 43 HH12 ARG 6 HH12 ARG 6 16.761 -4.783 -2.542 44 HH21 ARG 6 HH21 ARG 6 18.277 -1.652 -2.896 45 HH22 ARG 6 HH22 ARG 6 17.759 -2.867 -1.778 46 H LYS 7 H LYS 7 17.011 -3.162 -11.442 47 HA LYS 7 HA LYS 7 16.298 -5.401 -13.117 48 HB2 LYS 7 HB2 LYS 7 16.125 -3.122 -13.986 49 HB3 LYS 7 HB3 LYS 7 17.849 -2.879 -13.730 50 HG2 LYS 7 HG2 LYS 7 18.221 -4.801 -15.332 51 HG3 LYS 7 HG3 LYS 7 16.504 -4.678 -15.724 52 HD2 LYS 7 HD2 LYS 7 18.481 -2.410 -15.947 53 HD3 LYS 7 HD3 LYS 7 17.974 -3.433 -17.293 54 HE2 LYS 7 HE2 LYS 7 15.731 -2.662 -17.139 55 HE3 LYS 7 HE3 LYS 7 16.044 -1.861 -15.600 56 HZ1 LYS 7 HZ1 LYS 7 15.983 -0.248 -17.359 57 HZ2 LYS 7 HZ2 LYS 7 17.153 -1.090 -18.244 58 HZ3 LYS 7 HZ3 LYS 7 17.569 -0.359 -16.777 59 H TRP 8 H TRP 8 17.683 -6.832 -14.120 60 HA TRP 8 HA TRP 8 19.470 -8.234 -14.265 61 HB2 TRP 8 HB2 TRP 8 20.746 -5.522 -14.155 62 HB3 TRP 8 HB3 TRP 8 21.754 -6.967 -14.187 63 HD1 TRP 8 HD1 TRP 8 19.917 -4.642 -16.430 64 HE1 TRP 8 HE1 TRP 8 19.963 -5.517 -18.850 65 HE3 TRP 8 HE3 TRP 8 21.646 -9.372 -15.550 66 HZ2 TRP 8 HZ2 TRP 8 20.643 -7.898 -20.207 67 HZ3 TRP 8 HZ3 TRP 8 21.967 -10.885 -17.463 68 HH2 TRP 8 HH2 TRP 8 21.475 -10.162 -19.742 69 H LEU 9 H LEU 9 18.388 -8.453 -11.853 70 HA LEU 9 HA LEU 9 20.705 -8.585 -10.040 71 HB2 LEU 9 HB2 LEU 9 19.195 -6.848 -9.286 72 HB3 LEU 9 HB3 LEU 9 17.838 -7.970 -9.344 73 HG LEU 9 HG LEU 9 18.849 -9.265 -7.515 74 HD11 LEU 9 HD11 LEU 9 20.862 -7.039 -7.293 75 HD12 LEU 9 HD12 LEU 9 21.203 -8.590 -8.061 76 HD13 LEU 9 HD13 LEU 9 20.781 -8.527 -6.350 77 HD21 LEU 9 HD21 LEU 9 18.881 -6.951 -5.982 78 HD22 LEU 9 HD22 LEU 9 17.481 -7.963 -6.339 79 HD23 LEU 9 HD23 LEU 9 17.836 -6.560 -7.349 80 H SER 10 H SER 10 17.358 -9.818 -10.110 81 HA SER 10 HA SER 10 17.992 -12.496 -10.579 82 HB2 SER 10 HB2 SER 10 18.796 -11.748 -8.023 83 HB3 SER 10 HB3 SER 10 17.245 -12.545 -7.764 84 HG SER 10 HG SER 10 19.108 -13.750 -9.470 85 H CYS 11 H CYS 11 16.166 -13.407 -11.245 86 HA CYS 11 HA CYS 11 13.624 -12.175 -10.461 87 HB2 CYS 11 HB2 CYS 11 12.684 -13.296 -12.429 88 HB3 CYS 11 HB3 CYS 11 14.081 -12.319 -12.867 89 H VAL 12 H VAL 12 15.527 -14.841 -9.749 90 HA VAL 12 HA VAL 12 13.814 -16.983 -9.507 91 HB VAL 12 HB VAL 12 15.927 -16.230 -7.485 92 HG11 VAL 12 HG11 VAL 12 14.608 -18.838 -8.205 93 HG12 VAL 12 HG12 VAL 12 16.096 -18.730 -7.261 94 HG13 VAL 12 HG13 VAL 12 14.605 -18.016 -6.646 95 HG21 VAL 12 HG21 VAL 12 17.158 -16.215 -9.422 96 HG22 VAL 12 HG22 VAL 12 17.239 -17.927 -9.004 97 HG23 VAL 12 HG23 VAL 12 16.102 -17.371 -10.233 98 H ASP 13 H ASP 13 14.020 -14.115 -7.526 99 HA ASP 13 HA ASP 13 12.045 -15.208 -5.654 100 HB2 ASP 13 HB2 ASP 13 14.245 -13.947 -4.978 101 HB3 ASP 13 HB3 ASP 13 13.298 -12.507 -5.337 102 H ARG 14 H ARG 14 10.082 -15.031 -6.606 103 HA ARG 14 HA ARG 14 8.163 -14.062 -7.350 104 HB2 ARG 14 HB2 ARG 14 9.390 -11.422 -6.551 105 HB3 ARG 14 HB3 ARG 14 7.681 -11.798 -6.721 106 HG2 ARG 14 HG2 ARG 14 7.710 -13.177 -4.785 107 HG3 ARG 14 HG3 ARG 14 9.470 -13.106 -4.690 108 HD2 ARG 14 HD2 ARG 14 9.473 -10.947 -3.887 109 HD3 ARG 14 HD3 ARG 14 7.905 -10.570 -4.600 110 HE ARG 14 HE ARG 14 7.641 -12.545 -2.586 111 HH11 ARG 14 HH11 ARG 14 8.175 -9.135 -3.040 112 HH12 ARG 14 HH12 ARG 14 7.476 -8.690 -1.518 113 HH21 ARG 14 HH21 ARG 14 6.718 -11.972 -0.580 114 HH22 ARG 14 HH22 ARG 14 6.650 -10.305 -0.119 115 H LYS 15 H LYS 15 9.507 -14.748 -9.399 116 HA LYS 15 HA LYS 15 10.615 -12.828 -11.100 117 HB2 LYS 15 HB2 LYS 15 10.095 -14.464 -12.925 118 HB3 LYS 15 HB3 LYS 15 10.962 -15.154 -11.558 119 HG2 LYS 15 HG2 LYS 15 8.047 -15.336 -11.350 120 HG3 LYS 15 HG3 LYS 15 8.745 -16.225 -12.705 121 HD2 LYS 15 HD2 LYS 15 10.456 -16.982 -10.810 122 HD3 LYS 15 HD3 LYS 15 9.059 -16.648 -9.785 123 HE2 LYS 15 HE2 LYS 15 9.027 -18.446 -12.205 124 HE3 LYS 15 HE3 LYS 15 9.192 -19.006 -10.542 125 HZ1 LYS 15 HZ1 LYS 15 7.027 -17.930 -10.074 126 HZ2 LYS 15 HZ2 LYS 15 6.921 -19.201 -11.185 127 HZ3 LYS 15 HZ3 LYS 15 6.864 -17.599 -11.726 128 H ASN 16 H ASN 16 7.298 -13.649 -10.429 129 HA ASN 16 HA ASN 16 6.212 -12.288 -12.711 130 HB2 ASN 16 HB2 ASN 16 5.099 -14.191 -11.452 131 HB3 ASN 16 HB3 ASN 16 4.742 -13.027 -10.179 132 HD21 ASN 16 HD21 ASN 16 4.330 -13.604 -13.640 133 HD22 ASN 16 HD22 ASN 16 2.800 -12.810 -13.769 134 H ASP 17 H ASP 17 7.675 -11.196 -9.961 135 HA ASP 17 HA ASP 17 6.266 -8.618 -10.136 136 HB2 ASP 17 HB2 ASP 17 7.297 -9.916 -7.604 137 HB3 ASP 17 HB3 ASP 17 6.581 -8.311 -7.714 138 H CYS 18 H CYS 18 8.660 -9.497 -11.489 139 HA CYS 18 HA CYS 18 11.052 -8.752 -10.334 140 HB2 CYS 18 HB2 CYS 18 10.018 -8.935 -13.097 141 HB3 CYS 18 HB3 CYS 18 11.436 -7.915 -12.887 142 H CYS 19 H CYS 19 9.307 -6.642 -12.615 143 HA CYS 19 HA CYS 19 9.154 -4.394 -10.964 144 HB2 CYS 19 HB2 CYS 19 11.781 -4.854 -11.655 145 HB3 CYS 19 HB3 CYS 19 11.265 -3.689 -12.870 146 H GLU 20 H GLU 20 9.351 -2.291 -12.625 147 HA GLU 20 HA GLU 20 7.239 -2.832 -14.533 148 HB2 GLU 20 HB2 GLU 20 7.292 -0.821 -12.994 149 HB3 GLU 20 HB3 GLU 20 8.594 -0.190 -13.992 150 HG2 GLU 20 HG2 GLU 20 6.693 0.855 -14.814 151 HG3 GLU 20 HG3 GLU 20 6.982 -0.458 -15.953 152 H GLY 21 H GLY 21 7.729 -3.528 -16.504 153 HA2 GLY 21 HA2 GLY 21 8.608 -3.400 -18.649 154 HA3 GLY 21 HA3 GLY 21 9.634 -2.076 -18.118 155 H LEU 22 H LEU 22 9.470 -5.224 -16.566 156 HA LEU 22 HA LEU 22 12.129 -5.866 -17.646 157 HB2 LEU 22 HB2 LEU 22 11.241 -6.026 -14.772 158 HB3 LEU 22 HB3 LEU 22 12.712 -6.775 -15.391 159 HG LEU 22 HG LEU 22 12.104 -3.826 -15.227 160 HD11 LEU 22 HD11 LEU 22 14.549 -4.760 -14.017 161 HD12 LEU 22 HD12 LEU 22 13.148 -5.595 -13.350 162 HD13 LEU 22 HD13 LEU 22 13.225 -3.834 -13.311 163 HD21 LEU 22 HD21 LEU 22 14.676 -3.897 -15.924 164 HD22 LEU 22 HD22 LEU 22 13.372 -3.786 -17.108 165 HD23 LEU 22 HD23 LEU 22 14.125 -5.345 -16.768 166 H GLU 23 H GLU 23 12.698 -8.156 -17.472 167 HA GLU 23 HA GLU 23 10.433 -9.973 -17.117 168 HB2 GLU 23 HB2 GLU 23 11.746 -9.329 -19.665 169 HB3 GLU 23 HB3 GLU 23 11.629 -11.051 -19.331 170 HG2 GLU 23 HG2 GLU 23 9.143 -9.693 -18.770 171 HG3 GLU 23 HG3 GLU 23 9.673 -9.427 -20.431 172 H CYS 24 H CYS 24 11.006 -12.118 -16.652 173 HA CYS 24 HA CYS 24 13.573 -12.392 -15.379 174 HB2 CYS 24 HB2 CYS 24 11.658 -13.347 -14.272 175 HB3 CYS 24 HB3 CYS 24 11.247 -14.297 -15.697 176 H TYR 25 H TYR 25 15.131 -12.399 -16.977 177 HA TYR 25 HA TYR 25 14.957 -14.463 -19.050 178 HB2 TYR 25 HB2 TYR 25 15.488 -12.219 -19.834 179 HB3 TYR 25 HB3 TYR 25 16.858 -12.131 -18.733 180 HD1 TYR 25 HD1 TYR 25 15.606 -14.526 -21.327 181 HD2 TYR 25 HD2 TYR 25 18.909 -12.362 -19.743 182 HE1 TYR 25 HE1 TYR 25 17.057 -15.480 -23.068 183 HE2 TYR 25 HE2 TYR 25 20.370 -13.309 -21.481 184 HH TYR 25 HH TYR 25 19.702 -14.357 -24.075 185 H LYS 26 H LYS 26 16.670 -15.928 -19.417 186 HA LYS 26 HA LYS 26 18.130 -16.614 -16.976 187 HB2 LYS 26 HB2 LYS 26 18.482 -18.799 -18.027 188 HB3 LYS 26 HB3 LYS 26 16.775 -18.378 -17.996 189 HG2 LYS 26 HG2 LYS 26 17.043 -17.587 -20.372 190 HG3 LYS 26 HG3 LYS 26 18.644 -18.328 -20.348 191 HD2 LYS 26 HD2 LYS 26 17.812 -20.450 -20.340 192 HD3 LYS 26 HD3 LYS 26 16.357 -19.991 -19.451 193 HE2 LYS 26 HE2 LYS 26 15.830 -20.648 -21.746 194 HE3 LYS 26 HE3 LYS 26 15.448 -18.950 -21.461 195 HZ1 LYS 26 HZ1 LYS 26 16.600 -19.425 -23.602 196 HZ2 LYS 26 HZ2 LYS 26 17.973 -19.865 -22.719 197 HZ3 LYS 26 HZ3 LYS 26 17.382 -18.281 -22.630 198 H ARG 27 H ARG 27 20.342 -16.823 -16.889 199 HA ARG 27 HA ARG 27 21.806 -15.483 -19.035 200 HB2 ARG 27 HB2 ARG 27 22.531 -16.175 -16.189 201 HB3 ARG 27 HB3 ARG 27 23.687 -15.515 -17.337 202 HG2 ARG 27 HG2 ARG 27 21.613 -13.753 -17.545 203 HG3 ARG 27 HG3 ARG 27 21.564 -14.191 -15.836 204 HD2 ARG 27 HD2 ARG 27 23.080 -12.509 -15.699 205 HD3 ARG 27 HD3 ARG 27 24.191 -13.822 -16.087 206 HE ARG 27 HE ARG 27 23.205 -12.568 -18.440 207 HH11 ARG 27 HH11 ARG 27 25.479 -12.185 -15.833 208 HH12 ARG 27 HH12 ARG 27 26.558 -11.183 -16.747 209 HH21 ARG 27 HH21 ARG 27 24.616 -11.250 -19.654 210 HH22 ARG 27 HH22 ARG 27 26.065 -10.651 -18.920 211 H ARG 28 H ARG 28 24.243 -16.400 -19.053 212 HA ARG 28 HA ARG 28 24.101 -18.860 -20.408 213 HB2 ARG 28 HB2 ARG 28 26.310 -17.098 -19.448 214 HB3 ARG 28 HB3 ARG 28 26.708 -18.733 -19.963 215 HG2 ARG 28 HG2 ARG 28 25.422 -18.166 -22.104 216 HG3 ARG 28 HG3 ARG 28 25.555 -16.488 -21.574 217 HD2 ARG 28 HD2 ARG 28 28.005 -18.181 -21.610 218 HD3 ARG 28 HD3 ARG 28 27.369 -17.579 -23.141 219 HE ARG 28 HE ARG 28 27.474 -15.387 -21.502 220 HH11 ARG 28 HH11 ARG 28 29.758 -17.753 -22.646 221 HH12 ARG 28 HH12 ARG 28 31.106 -16.664 -22.601 222 HH21 ARG 28 HH21 ARG 28 29.241 -13.945 -21.438 223 HH22 ARG 28 HH22 ARG 28 30.810 -14.499 -21.913 224 H HIS 29 H HIS 29 26.074 -18.269 -17.503 225 HA HIS 29 HA HIS 29 25.212 -20.894 -16.485 226 HB2 HIS 29 HB2 HIS 29 27.971 -19.785 -16.809 227 HB3 HIS 29 HB3 HIS 29 27.642 -20.870 -15.461 228 HD1 HIS 29 HD1 HIS 29 29.475 -21.451 -18.034 229 HD2 HIS 29 HD2 HIS 29 25.641 -22.884 -17.318 230 HE1 HIS 29 HE1 HIS 29 29.271 -23.543 -19.414 231 H SER 30 H SER 30 24.320 -18.135 -15.891 232 HA SER 30 HA SER 30 24.920 -18.141 -13.006 233 HB2 SER 30 HB2 SER 30 24.863 -15.861 -14.945 234 HB3 SER 30 HB3 SER 30 24.376 -15.575 -13.275 235 HG SER 30 HG SER 30 26.399 -16.329 -12.608 236 H PHE 31 H PHE 31 23.223 -17.378 -11.628 237 HA PHE 31 HA PHE 31 20.727 -18.437 -12.134 238 HB2 PHE 31 HB2 PHE 31 19.948 -16.851 -10.279 239 HB3 PHE 31 HB3 PHE 31 21.249 -17.970 -9.884 240 HD1 PHE 31 HD2 PHE 31 20.492 -14.465 -10.765 241 HD2 PHE 31 HD1 PHE 31 23.365 -17.193 -9.208 242 HE1 PHE 31 HE2 PHE 31 21.893 -12.574 -10.046 243 HE2 PHE 31 HE1 PHE 31 24.770 -15.306 -8.485 244 HZ PHE 31 HZ PHE 31 24.034 -12.993 -8.905 245 H GLU 32 H GLU 32 18.895 -17.768 -13.103 246 HA GLU 32 HA GLU 32 18.949 -15.715 -15.000 247 HB2 GLU 32 HB2 GLU 32 16.433 -16.026 -15.029 248 HB3 GLU 32 HB3 GLU 32 17.393 -17.466 -15.331 249 HG2 GLU 32 HG2 GLU 32 16.981 -18.310 -13.160 250 HG3 GLU 32 HG3 GLU 32 16.292 -16.778 -12.624 251 H VAL 33 H VAL 33 18.525 -13.595 -14.932 252 HA VAL 33 HA VAL 33 17.339 -12.493 -12.468 253 HB VAL 33 HB VAL 33 18.817 -10.627 -12.508 254 HG11 VAL 33 HG11 VAL 33 20.626 -12.951 -13.100 255 HG12 VAL 33 HG12 VAL 33 20.861 -11.636 -11.947 256 HG13 VAL 33 HG13 VAL 33 19.648 -12.878 -11.635 257 HG21 VAL 33 HG21 VAL 33 19.696 -11.698 -15.175 258 HG22 VAL 33 HG22 VAL 33 19.028 -10.110 -14.795 259 HG23 VAL 33 HG23 VAL 33 20.656 -10.532 -14.264 260 H CYS 34 H CYS 34 16.673 -10.109 -12.873 261 HA CYS 34 HA CYS 34 14.747 -10.138 -14.986 262 HB2 CYS 34 HB2 CYS 34 15.552 -7.928 -13.082 263 HB3 CYS 34 HB3 CYS 34 14.159 -7.876 -14.158 264 H VAL 35 H VAL 35 14.642 -8.857 -16.821 265 HA VAL 35 HA VAL 35 17.004 -7.253 -17.492 266 HB VAL 35 HB VAL 35 17.030 -8.197 -19.780 267 HG11 VAL 35 HG11 VAL 35 17.413 -10.307 -17.661 268 HG12 VAL 35 HG12 VAL 35 18.216 -10.215 -19.229 269 HG13 VAL 35 HG13 VAL 35 18.553 -9.003 -17.993 270 HG21 VAL 35 HG21 VAL 35 15.324 -10.441 -18.750 271 HG22 VAL 35 HG22 VAL 35 14.621 -9.043 -19.564 272 HG23 VAL 35 HG23 VAL 35 15.775 -10.070 -20.414 273 HA PRO 36 HA PRO 36 14.107 -4.350 -19.067 274 HB2 PRO 36 HB2 PRO 36 15.579 -3.170 -21.019 275 HB3 PRO 36 HB3 PRO 36 15.875 -2.902 -19.297 276 HG2 PRO 36 HG2 PRO 36 17.292 -4.725 -21.202 277 HG3 PRO 36 HG3 PRO 36 17.972 -3.661 -19.955 278 HD2 PRO 36 HD2 PRO 36 17.661 -6.326 -19.587 279 HD3 PRO 36 HD3 PRO 36 17.523 -5.155 -18.259 280 H ILE 37 H ILE 37 12.396 -4.636 -20.341 281 HA ILE 37 HA ILE 37 12.484 -6.483 -22.546 282 HB ILE 37 HB ILE 37 10.228 -4.742 -21.543 283 HG12 ILE 37 HG12 ILE 37 10.315 -7.710 -21.244 284 HG13 ILE 37 HG13 ILE 37 11.302 -6.736 -20.161 285 HG21 ILE 37 HG21 ILE 37 9.262 -6.989 -22.940 286 HG22 ILE 37 HG22 ILE 37 9.125 -5.290 -23.388 287 HG23 ILE 37 HG23 ILE 37 10.494 -6.243 -23.958 288 HD11 ILE 37 HD11 ILE 37 9.324 -5.542 -19.414 289 HD12 ILE 37 HD12 ILE 37 8.327 -6.483 -20.522 290 HD13 ILE 37 HD13 ILE 37 9.144 -7.280 -19.178 291 HA PRO 38 HA PRO 38 13.470 -3.387 -25.579 292 HB2 PRO 38 HB2 PRO 38 13.203 -5.002 -27.745 293 HB3 PRO 38 HB3 PRO 38 14.610 -5.054 -26.675 294 HG2 PRO 38 HG2 PRO 38 12.206 -6.839 -26.732 295 HG3 PRO 38 HG3 PRO 38 13.916 -7.270 -26.541 296 HD2 PRO 38 HD2 PRO 38 12.208 -7.118 -24.445 297 HD3 PRO 38 HD3 PRO 38 13.933 -6.722 -24.302 298 H GLY 39 H GLY 39 12.089 -1.861 -26.220 299 HA2 GLY 39 HA2 GLY 39 10.353 -0.939 -27.471 300 HA3 GLY 39 HA3 GLY 39 9.772 -2.562 -27.812 301 H PHE 40 H PHE 40 10.377 -2.071 -24.524 302 HA PHE 40 HA PHE 40 7.695 -2.452 -23.779 303 HB2 PHE 40 HB2 PHE 40 9.320 -3.122 -22.207 304 HB3 PHE 40 HB3 PHE 40 10.140 -1.565 -22.265 305 HD1 PHE 40 HD1 PHE 40 7.022 -3.232 -21.160 306 HD2 PHE 40 HD2 PHE 40 9.599 0.130 -20.753 307 HE1 PHE 40 HE1 PHE 40 5.738 -2.491 -19.196 308 HE2 PHE 40 HE2 PHE 40 8.321 0.876 -18.787 309 HZ PHE 40 HZ PHE 40 6.389 -0.435 -18.006 310 H CYS 41 H CYS 41 6.153 -1.063 -22.924 311 HA CYS 41 HA CYS 41 6.647 1.764 -22.709 312 HB2 CYS 41 HB2 CYS 41 5.150 2.507 -24.429 313 HB3 CYS 41 HB3 CYS 41 6.308 1.408 -25.170 314 H LEU 42 H LEU 42 4.126 2.759 -22.732 315 HA LEU 42 HA LEU 42 2.638 1.075 -20.830 316 HB2 LEU 42 HB2 LEU 42 2.806 4.066 -20.616 317 HB3 LEU 42 HB3 LEU 42 2.191 2.918 -19.427 318 HG LEU 42 HG LEU 42 5.091 3.154 -20.226 319 HD11 LEU 42 HD11 LEU 42 4.728 3.952 -17.570 320 HD12 LEU 42 HD12 LEU 42 3.493 4.801 -18.500 321 HD13 LEU 42 HD13 LEU 42 5.193 4.958 -18.942 322 HD21 LEU 42 HD21 LEU 42 5.288 1.927 -17.971 323 HD22 LEU 42 HD22 LEU 42 4.794 1.003 -19.390 324 HD23 LEU 42 HD23 LEU 42 3.588 1.522 -18.212 325 H VAL 43 H VAL 43 0.343 1.916 -20.530 326 HA VAL 43 HA VAL 43 -0.728 2.655 -23.172 327 HB VAL 43 HB VAL 43 -2.857 1.619 -22.391 328 HG11 VAL 43 HG11 VAL 43 -1.604 0.255 -23.807 329 HG12 VAL 43 HG12 VAL 43 -0.339 0.004 -22.602 330 HG13 VAL 43 HG13 VAL 43 -1.910 -0.773 -22.407 331 HG21 VAL 43 HG21 VAL 43 -1.635 1.725 -19.894 332 HG22 VAL 43 HG22 VAL 43 -3.166 0.943 -20.291 333 HG23 VAL 43 HG23 VAL 43 -1.669 0.010 -20.303 334 H LYS 44 H LYS 44 -3.188 3.479 -22.699 335 HA LYS 44 HA LYS 44 -2.795 6.027 -21.396 336 HB2 LYS 44 HB2 LYS 44 -4.998 6.590 -22.283 337 HB3 LYS 44 HB3 LYS 44 -3.983 5.894 -23.540 338 HG2 LYS 44 HG2 LYS 44 -5.556 3.884 -22.163 339 HG3 LYS 44 HG3 LYS 44 -6.556 5.137 -22.901 340 HD2 LYS 44 HD2 LYS 44 -5.094 4.774 -24.989 341 HD3 LYS 44 HD3 LYS 44 -4.603 3.270 -24.207 342 HE2 LYS 44 HE2 LYS 44 -6.965 2.602 -24.056 343 HE3 LYS 44 HE3 LYS 44 -7.429 4.092 -24.877 344 HZ1 LYS 44 HZ1 LYS 44 -6.594 3.364 -26.866 345 HZ2 LYS 44 HZ2 LYS 44 -7.138 1.901 -26.213 346 HZ3 LYS 44 HZ3 LYS 44 -5.493 2.292 -26.158 347 H TRP 45 H TRP 45 -3.450 3.107 -20.190 348 HA TRP 45 HA TRP 45 -5.193 4.198 -18.080 349 HB2 TRP 45 HB2 TRP 45 -5.159 1.365 -19.147 350 HB3 TRP 45 HB3 TRP 45 -6.126 1.929 -17.788 351 HD1 TRP 45 HD1 TRP 45 -6.376 1.353 -21.394 352 HE1 TRP 45 HE1 TRP 45 -8.453 2.515 -22.375 353 HE3 TRP 45 HE3 TRP 45 -7.533 4.406 -17.459 354 HZ2 TRP 45 HZ2 TRP 45 -10.333 4.467 -21.585 355 HZ3 TRP 45 HZ3 TRP 45 -9.486 5.890 -17.653 356 HH2 TRP 45 HH2 TRP 45 -10.855 5.919 -19.674 357 H LYS 46 H LYS 46 -2.186 3.835 -18.468 358 HA LYS 46 HA LYS 46 -1.695 2.288 -16.007 359 HB2 LYS 46 HB2 LYS 46 -0.087 2.593 -18.519 360 HB3 LYS 46 HB3 LYS 46 0.722 2.231 -17.000 361 HG2 LYS 46 HG2 LYS 46 -1.578 0.517 -17.527 362 HG3 LYS 46 HG3 LYS 46 -0.304 0.392 -18.742 363 HD2 LYS 46 HD2 LYS 46 1.160 0.358 -16.462 364 HD3 LYS 46 HD3 LYS 46 -0.320 -0.436 -15.917 365 HE2 LYS 46 HE2 LYS 46 -0.129 -1.962 -17.885 366 HE3 LYS 46 HE3 LYS 46 1.440 -1.238 -18.230 367 HZ1 LYS 46 HZ1 LYS 46 2.367 -2.578 -16.755 368 HZ2 LYS 46 HZ2 LYS 46 0.876 -3.327 -16.483 369 HZ3 LYS 46 HZ3 LYS 46 1.349 -2.014 -15.527 370 H GLN 47 H GLN 47 -0.230 3.121 -14.488 371 HA GLN 47 HA GLN 47 -0.346 5.846 -13.996 372 HB2 GLN 47 HB2 GLN 47 1.139 3.558 -12.902 373 HB3 GLN 47 HB3 GLN 47 1.932 5.110 -12.671 374 HG2 GLN 47 HG2 GLN 47 0.317 5.890 -11.269 375 HG3 GLN 47 HG3 GLN 47 -0.952 4.912 -12.006 376 HE21 GLN 47 HE21 GLN 47 -1.490 4.504 -9.738 377 HE22 GLN 47 HE22 GLN 47 -0.683 3.219 -8.914 378 H CYS 48 H CYS 48 0.990 7.573 -14.362 379 HA CYS 48 HA CYS 48 3.081 7.154 -16.388 380 HB2 CYS 48 HB2 CYS 48 2.668 9.327 -17.195 381 HB3 CYS 48 HB3 CYS 48 1.069 8.673 -16.857 382 H ASP 49 H ASP 49 2.503 8.154 -13.162 383 HA ASP 49 HA ASP 49 4.531 9.938 -12.624 384 HB2 ASP 49 HB2 ASP 49 2.808 9.178 -10.995 385 HB3 ASP 49 HB3 ASP 49 3.679 7.656 -10.830 386 H GLY 50 H GLY 50 6.634 9.842 -13.023 387 HA2 GLY 50 HA2 GLY 50 8.805 8.994 -12.754 388 HA3 GLY 50 HA3 GLY 50 8.120 7.428 -12.348 389 H ARG 51 H ARG 51 6.380 7.373 -14.698 390 HA ARG 51 HA ARG 51 8.441 6.808 -16.724 391 HB2 ARG 51 HB2 ARG 51 5.702 5.553 -16.579 392 HB3 ARG 51 HB3 ARG 51 7.073 5.037 -17.551 393 HG2 ARG 51 HG2 ARG 51 6.912 4.936 -14.546 394 HG3 ARG 51 HG3 ARG 51 6.717 3.567 -15.641 395 HD2 ARG 51 HD2 ARG 51 8.988 3.783 -16.399 396 HD3 ARG 51 HD3 ARG 51 9.198 5.270 -15.476 397 HE ARG 51 HE ARG 51 8.467 3.078 -13.808 398 HH11 ARG 51 HH11 ARG 51 11.139 4.540 -15.494 399 HH12 ARG 51 HH12 ARG 51 12.337 3.893 -14.424 400 HH21 ARG 51 HH21 ARG 51 10.036 2.220 -12.392 401 HH22 ARG 51 HH22 ARG 51 11.709 2.573 -12.660 402 H GLU 52 H GLU 52 7.575 9.389 -16.594 403 HA GLU 52 HA GLU 52 5.332 9.910 -18.272 404 HB2 GLU 52 HB2 GLU 52 6.000 12.217 -18.170 405 HB3 GLU 52 HB3 GLU 52 6.220 11.508 -16.576 406 HG2 GLU 52 HG2 GLU 52 8.171 12.649 -16.756 407 HG3 GLU 52 HG3 GLU 52 8.668 11.115 -17.469 408 H ARG 53 H ARG 53 8.558 9.004 -18.877 409 HA ARG 53 HA ARG 53 8.261 9.753 -21.713 410 HB2 ARG 53 HB2 ARG 53 10.933 9.404 -21.474 411 HB3 ARG 53 HB3 ARG 53 10.130 10.960 -21.308 412 HG2 ARG 53 HG2 ARG 53 10.345 10.982 -19.015 413 HG3 ARG 53 HG3 ARG 53 10.494 9.226 -18.909 414 HD2 ARG 53 HD2 ARG 53 12.665 9.878 -18.529 415 HD3 ARG 53 HD3 ARG 53 12.686 9.629 -20.274 416 HE ARG 53 HE ARG 53 12.019 12.296 -19.786 417 HH11 ARG 53 HH11 ARG 53 14.721 10.135 -19.399 418 HH12 ARG 53 HH12 ARG 53 15.911 11.385 -19.552 419 HH21 ARG 53 HH21 ARG 53 13.576 13.951 -19.989 420 HH22 ARG 53 HH22 ARG 53 15.258 13.556 -19.887 421 H ASP 54 H ASP 54 7.509 7.287 -20.160 422 HA ASP 54 HA ASP 54 9.134 5.341 -21.662 423 HB2 ASP 54 HB2 ASP 54 8.829 5.387 -18.980 424 HB3 ASP 54 HB3 ASP 54 7.449 4.384 -19.421 425 H CYS 55 H CYS 55 5.971 6.588 -21.071 426 HA CYS 55 HA CYS 55 4.307 4.538 -21.857 427 HB2 CYS 55 HB2 CYS 55 4.000 7.462 -22.568 428 HB3 CYS 55 HB3 CYS 55 2.712 6.263 -22.537 429 H CYS 56 H CYS 56 3.080 4.392 -23.955 430 HA CYS 56 HA CYS 56 4.884 3.815 -26.058 431 HB2 CYS 56 HB2 CYS 56 1.955 3.677 -25.643 432 HB3 CYS 56 HB3 CYS 56 2.494 3.786 -27.316 433 H ALA 57 H ALA 57 4.121 4.625 -28.389 434 HA ALA 57 HA ALA 57 4.844 7.382 -28.488 435 HB1 ALA 57 HB1 ALA 57 5.653 6.224 -30.304 436 HB2 ALA 57 HB2 ALA 57 4.163 5.302 -30.517 437 HB3 ALA 57 HB3 ALA 57 4.227 6.997 -30.997 438 H GLY 58 H GLY 58 3.577 9.122 -28.446 439 HA2 GLY 58 HA2 GLY 58 1.675 10.370 -29.171 440 HA3 GLY 58 HA3 GLY 58 0.775 8.866 -29.294 441 H LEU 59 H LEU 59 2.106 8.226 -26.555 442 HA LEU 59 HA LEU 59 -0.110 9.257 -25.001 443 HB2 LEU 59 HB2 LEU 59 2.081 7.278 -24.497 444 HB3 LEU 59 HB3 LEU 59 1.095 7.890 -23.170 445 HG LEU 59 HG LEU 59 0.090 6.362 -25.571 446 HD11 LEU 59 HD11 LEU 59 1.196 4.821 -24.195 447 HD12 LEU 59 HD12 LEU 59 -0.501 4.701 -23.732 448 HD13 LEU 59 HD13 LEU 59 0.627 5.598 -22.717 449 HD21 LEU 59 HD21 LEU 59 -1.288 7.704 -23.277 450 HD22 LEU 59 HD22 LEU 59 -1.996 6.284 -24.047 451 HD23 LEU 59 HD23 LEU 59 -1.686 7.740 -24.995 452 H GLU 60 H GLU 60 0.453 9.953 -22.671 453 HA GLU 60 HA GLU 60 2.926 11.327 -22.266 454 HB2 GLU 60 HB2 GLU 60 2.105 13.596 -22.261 455 HB3 GLU 60 HB3 GLU 60 1.783 12.878 -23.833 456 HG2 GLU 60 HG2 GLU 60 -0.544 12.335 -22.791 457 HG3 GLU 60 HG3 GLU 60 -0.119 13.621 -21.663 458 H CYS 61 H CYS 61 3.070 12.311 -20.165 459 HA CYS 61 HA CYS 61 1.719 10.853 -18.163 460 HB2 CYS 61 HB2 CYS 61 4.027 12.035 -18.085 461 HB3 CYS 61 HB3 CYS 61 3.107 13.467 -17.635 462 H TRP 62 H TRP 62 -0.473 11.093 -18.179 463 HA TRP 62 HA TRP 62 -1.705 13.696 -18.298 464 HB2 TRP 62 HB2 TRP 62 -2.640 11.442 -19.185 465 HB3 TRP 62 HB3 TRP 62 -3.135 11.169 -17.516 466 HD1 TRP 62 HD1 TRP 62 -3.422 14.767 -18.277 467 HE1 TRP 62 HE1 TRP 62 -5.868 15.398 -18.769 468 HE3 TRP 62 HE3 TRP 62 -5.376 10.074 -18.826 469 HZ2 TRP 62 HZ2 TRP 62 -8.303 14.081 -19.316 470 HZ3 TRP 62 HZ3 TRP 62 -7.773 9.848 -19.332 471 HH2 TRP 62 HH2 TRP 62 -9.205 11.811 -19.571 472 H LYS 63 H LYS 63 -2.384 14.929 -16.648 473 HA LYS 63 HA LYS 63 -1.864 13.955 -13.932 474 HB2 LYS 63 HB2 LYS 63 -0.992 16.213 -15.008 475 HB3 LYS 63 HB3 LYS 63 -2.574 16.797 -14.512 476 HG2 LYS 63 HG2 LYS 63 -0.905 15.340 -12.527 477 HG3 LYS 63 HG3 LYS 63 -0.490 17.006 -12.935 478 HD2 LYS 63 HD2 LYS 63 -3.262 16.166 -12.115 479 HD3 LYS 63 HD3 LYS 63 -2.039 16.691 -10.956 480 HE2 LYS 63 HE2 LYS 63 -1.835 18.759 -12.525 481 HE3 LYS 63 HE3 LYS 63 -3.426 18.256 -13.095 482 HZ1 LYS 63 HZ1 LYS 63 -2.902 18.572 -10.211 483 HZ2 LYS 63 HZ2 LYS 63 -4.376 18.636 -11.037 484 HZ3 LYS 63 HZ3 LYS 63 -3.279 19.917 -11.165 485 H ARG 64 H ARG 64 -3.667 12.840 -13.338 486 HA ARG 64 HA ARG 64 -6.210 14.328 -13.378 487 HB2 ARG 64 HB2 ARG 64 -5.567 11.632 -14.243 488 HB3 ARG 64 HB3 ARG 64 -6.845 11.635 -13.035 489 HG2 ARG 64 HG2 ARG 64 -8.316 12.737 -14.388 490 HG3 ARG 64 HG3 ARG 64 -7.041 13.548 -15.300 491 HD2 ARG 64 HD2 ARG 64 -7.311 12.022 -16.893 492 HD3 ARG 64 HD3 ARG 64 -6.666 10.823 -15.773 493 HE ARG 64 HE ARG 64 -8.764 9.952 -15.579 494 HH11 ARG 64 HH11 ARG 64 -9.013 13.197 -16.815 495 HH12 ARG 64 HH12 ARG 64 -10.723 13.102 -17.085 496 HH21 ARG 64 HH21 ARG 64 -11.014 9.814 -15.931 497 HH22 ARG 64 HH22 ARG 64 -11.859 11.178 -16.582 498 H SER 65 H SER 65 -7.092 14.769 -11.465 499 HA SER 65 HA SER 65 -6.319 13.141 -9.140 500 HB2 SER 65 HB2 SER 65 -6.496 16.164 -9.188 501 HB3 SER 65 HB3 SER 65 -6.155 15.174 -7.769 502 HG SER 65 HG SER 65 -4.550 15.635 -10.039 503 H GLY 66 H GLY 66 -7.925 12.695 -7.704 504 HA2 GLY 66 HA2 GLY 66 -10.022 13.336 -6.634 505 HA3 GLY 66 HA3 GLY 66 -10.544 13.971 -8.188 506 H ASN 67 H ASN 67 -9.346 11.562 -9.536 507 HA ASN 67 HA ASN 67 -11.531 9.695 -8.889 508 HB2 ASN 67 HB2 ASN 67 -11.534 10.842 -11.167 509 HB3 ASN 67 HB3 ASN 67 -10.110 9.876 -11.545 510 HD21 ASN 67 HD21 ASN 67 -10.563 8.156 -12.689 511 HD22 ASN 67 HD22 ASN 67 -12.000 7.202 -12.580 512 H LYS 68 H LYS 68 -8.200 9.815 -10.139 513 HA LYS 68 HA LYS 68 -7.471 7.545 -8.509 514 HB2 LYS 68 HB2 LYS 68 -7.969 7.302 -11.406 515 HB3 LYS 68 HB3 LYS 68 -6.441 6.624 -10.856 516 HG2 LYS 68 HG2 LYS 68 -8.752 5.897 -9.209 517 HG3 LYS 68 HG3 LYS 68 -8.814 5.308 -10.872 518 HD2 LYS 68 HD2 LYS 68 -6.360 4.569 -10.418 519 HD3 LYS 68 HD3 LYS 68 -6.823 4.710 -8.720 520 HE2 LYS 68 HE2 LYS 68 -8.256 3.039 -10.782 521 HE3 LYS 68 HE3 LYS 68 -7.101 2.422 -9.602 522 HZ1 LYS 68 HZ1 LYS 68 -8.957 2.073 -8.409 523 HZ2 LYS 68 HZ2 LYS 68 -9.862 3.236 -9.238 524 HZ3 LYS 68 HZ3 LYS 68 -8.799 3.709 -8.009 525 H SER 69 H SER 69 -5.074 6.892 -9.248 526 HA SER 69 HA SER 69 -3.485 9.165 -8.706 527 HB2 SER 69 HB2 SER 69 -3.015 6.292 -9.222 528 HB3 SER 69 HB3 SER 69 -1.666 7.360 -9.608 529 HG SER 69 HG SER 69 -2.146 6.450 -7.292 530 H SER 70 H SER 70 -1.390 9.431 -10.172 531 HA SER 70 HA SER 70 -2.284 10.666 -12.559 532 HB2 SER 70 HB2 SER 70 0.605 10.032 -12.241 533 HB3 SER 70 HB3 SER 70 -0.172 11.545 -12.708 534 HG SER 70 HG SER 70 -0.276 12.121 -10.678 535 H VAL 71 H VAL 71 -2.726 9.749 -14.440 536 HA VAL 71 HA VAL 71 -1.355 7.234 -15.142 537 HB VAL 71 HB VAL 71 -3.396 6.782 -16.581 538 HG11 VAL 71 HG11 VAL 71 -4.263 5.491 -14.934 539 HG12 VAL 71 HG12 VAL 71 -2.807 6.011 -14.083 540 HG13 VAL 71 HG13 VAL 71 -4.344 6.823 -13.782 541 HG21 VAL 71 HG21 VAL 71 -4.083 9.360 -15.780 542 HG22 VAL 71 HG22 VAL 71 -5.097 8.217 -16.660 543 HG23 VAL 71 HG23 VAL 71 -5.185 8.300 -14.901 544 H CYS 72 H CYS 72 -1.681 6.866 -17.659 545 HA CYS 72 HA CYS 72 -0.624 9.287 -18.945 546 HB2 CYS 72 HB2 CYS 72 0.100 6.494 -19.041 547 HB3 CYS 72 HB3 CYS 72 -0.273 7.082 -20.659 548 H ALA 73 H ALA 73 -1.292 9.822 -21.090 549 HA ALA 73 HA ALA 73 -3.717 8.551 -22.095 550 HB1 ALA 73 HB1 ALA 73 -3.950 10.780 -20.505 551 HB2 ALA 73 HB2 ALA 73 -3.982 11.452 -22.136 552 HB3 ALA 73 HB3 ALA 73 -5.146 10.211 -21.670 553 HA PRO 74 HA PRO 74 -1.996 9.412 -26.039 554 HB2 PRO 74 HB2 PRO 74 -4.223 9.800 -27.543 555 HB3 PRO 74 HB3 PRO 74 -3.736 8.212 -26.939 556 HG2 PRO 74 HG2 PRO 74 -5.780 10.107 -25.849 557 HG3 PRO 74 HG3 PRO 74 -5.878 8.348 -26.043 558 HD2 PRO 74 HD2 PRO 74 -5.335 9.522 -23.665 559 HD3 PRO 74 HD3 PRO 74 -4.668 7.943 -24.123 560 H ILE 75 H ILE 75 -2.134 11.010 -27.919 561 HA ILE 75 HA ILE 75 -1.588 13.584 -27.026 562 HB ILE 75 HB ILE 75 -1.917 14.265 -29.446 563 HG12 ILE 75 HG12 ILE 75 -2.194 11.313 -29.966 564 HG13 ILE 75 HG13 ILE 75 -3.610 12.345 -29.789 565 HG21 ILE 75 HG21 ILE 75 -0.150 11.855 -29.127 566 HG22 ILE 75 HG22 ILE 75 0.114 13.283 -30.127 567 HG23 ILE 75 HG23 ILE 75 0.214 13.406 -28.370 568 HD11 ILE 75 HD11 ILE 75 -2.246 13.765 -31.602 569 HD12 ILE 75 HD12 ILE 75 -1.672 12.144 -31.993 570 HD13 ILE 75 HD13 ILE 75 -3.399 12.498 -32.020 571 H THR 76 H THR 76 -2.714 15.560 -27.221 572 HA THR 76 HA THR 76 -5.618 15.364 -27.608 573 HB THR 76 HB THR 76 -5.980 16.870 -25.664 574 HG1 THR 76 HG1 THR 76 -3.387 16.209 -24.767 575 HG21 THR 76 HG21 THR 76 -4.528 14.411 -24.727 576 HG22 THR 76 HG22 THR 76 -6.067 14.305 -25.582 577 HG23 THR 76 HG23 THR 76 -5.968 15.170 -24.049 Start of MODEL 20 1 H1 SER 1 H SER 1 4.461 -0.736 3.629 2 HA SER 1 HA SER 1 4.040 -1.110 0.835 3 HB2 SER 1 HB2 SER 1 4.197 1.099 2.242 4 HB3 SER 1 HB3 SER 1 5.924 0.959 1.916 5 HG SER 1 HG SER 1 4.136 1.985 0.339 6 H ASN 2 H ASN 2 5.160 -2.722 -0.108 7 HA ASN 2 HA ASN 2 8.066 -2.838 0.333 8 HB2 ASN 2 HB2 ASN 2 6.535 -4.887 0.724 9 HB3 ASN 2 HB3 ASN 2 6.454 -4.981 -1.032 10 HD21 ASN 2 HD21 ASN 2 7.761 -6.482 -1.760 11 HD22 ASN 2 HD22 ASN 2 9.353 -6.821 -1.180 12 H GLU 3 H GLU 3 9.490 -2.811 -1.386 13 HA GLU 3 HA GLU 3 8.441 -1.625 -3.829 14 HB2 GLU 3 HB2 GLU 3 10.703 -1.024 -4.336 15 HB3 GLU 3 HB3 GLU 3 10.417 -0.653 -2.642 16 HG2 GLU 3 HG2 GLU 3 11.415 -3.311 -2.834 17 HG3 GLU 3 HG3 GLU 3 12.455 -2.243 -3.774 18 H CYS 4 H CYS 4 9.515 -2.331 -5.921 19 HA CYS 4 HA CYS 4 9.117 -5.184 -6.197 20 HB2 CYS 4 HB2 CYS 4 9.190 -4.791 -8.575 21 HB3 CYS 4 HB3 CYS 4 8.195 -3.541 -7.836 22 H ILE 5 H ILE 5 10.683 -6.310 -7.804 23 HA ILE 5 HA ILE 5 13.231 -6.416 -6.542 24 HB ILE 5 HB ILE 5 12.330 -7.692 -9.128 25 HG12 ILE 5 HG12 ILE 5 12.577 -9.027 -6.439 26 HG13 ILE 5 HG13 ILE 5 11.086 -8.234 -6.939 27 HG21 ILE 5 HG21 ILE 5 14.211 -9.330 -8.424 28 HG22 ILE 5 HG22 ILE 5 14.639 -7.815 -9.219 29 HG23 ILE 5 HG23 ILE 5 14.802 -7.969 -7.469 30 HD11 ILE 5 HD11 ILE 5 11.525 -10.812 -7.328 31 HD12 ILE 5 HD12 ILE 5 10.586 -9.838 -8.459 32 HD13 ILE 5 HD13 ILE 5 12.277 -10.201 -8.801 33 H ARG 6 H ARG 6 14.869 -5.079 -6.866 34 HA ARG 6 HA ARG 6 14.997 -3.060 -8.748 35 HB2 ARG 6 HB2 ARG 6 17.116 -4.470 -7.150 36 HB3 ARG 6 HB3 ARG 6 17.544 -3.199 -8.288 37 HG2 ARG 6 HG2 ARG 6 17.257 -1.820 -6.559 38 HG3 ARG 6 HG3 ARG 6 15.532 -2.026 -6.867 39 HD2 ARG 6 HD2 ARG 6 15.585 -2.559 -4.650 40 HD3 ARG 6 HD3 ARG 6 15.879 -4.154 -5.341 41 HE ARG 6 HE ARG 6 17.935 -4.127 -4.364 42 HH11 ARG 6 HH11 ARG 6 16.816 -0.845 -4.673 43 HH12 ARG 6 HH12 ARG 6 18.165 -0.167 -3.824 44 HH21 ARG 6 HH21 ARG 6 19.716 -3.248 -3.244 45 HH22 ARG 6 HH22 ARG 6 19.815 -1.534 -3.012 46 H LYS 7 H LYS 7 16.463 -2.770 -10.569 47 HA LYS 7 HA LYS 7 16.216 -4.871 -12.461 48 HB2 LYS 7 HB2 LYS 7 16.189 -2.514 -13.124 49 HB3 LYS 7 HB3 LYS 7 17.851 -2.328 -12.578 50 HG2 LYS 7 HG2 LYS 7 18.427 -2.749 -14.683 51 HG3 LYS 7 HG3 LYS 7 18.018 -4.431 -14.338 52 HD2 LYS 7 HD2 LYS 7 16.804 -3.965 -16.270 53 HD3 LYS 7 HD3 LYS 7 15.616 -3.750 -14.982 54 HE2 LYS 7 HE2 LYS 7 15.440 -1.936 -16.570 55 HE3 LYS 7 HE3 LYS 7 16.041 -1.324 -15.031 56 HZ1 LYS 7 HZ1 LYS 7 17.164 -0.677 -17.300 57 HZ2 LYS 7 HZ2 LYS 7 18.006 -2.122 -17.046 58 HZ3 LYS 7 HZ3 LYS 7 18.082 -0.885 -15.895 59 H TRP 8 H TRP 8 17.630 -6.391 -13.128 60 HA TRP 8 HA TRP 8 19.416 -7.798 -13.093 61 HB2 TRP 8 HB2 TRP 8 20.802 -5.146 -12.705 62 HB3 TRP 8 HB3 TRP 8 21.687 -6.659 -12.875 63 HD1 TRP 8 HD1 TRP 8 20.130 -3.946 -14.886 64 HE1 TRP 8 HE1 TRP 8 20.216 -4.535 -17.390 65 HE3 TRP 8 HE3 TRP 8 21.462 -8.868 -14.516 66 HZ2 TRP 8 HZ2 TRP 8 20.773 -6.788 -18.996 67 HZ3 TRP 8 HZ3 TRP 8 21.750 -10.169 -16.584 68 HH2 TRP 8 HH2 TRP 8 21.411 -9.150 -18.777 69 H LEU 9 H LEU 9 18.055 -8.002 -10.826 70 HA LEU 9 HA LEU 9 20.090 -7.997 -8.695 71 HB2 LEU 9 HB2 LEU 9 18.120 -6.545 -8.295 72 HB3 LEU 9 HB3 LEU 9 17.091 -7.973 -8.389 73 HG LEU 9 HG LEU 9 19.289 -7.958 -6.383 74 HD11 LEU 9 HD11 LEU 9 17.567 -6.894 -4.801 75 HD12 LEU 9 HD12 LEU 9 16.825 -6.257 -6.269 76 HD13 LEU 9 HD13 LEU 9 18.489 -5.834 -5.867 77 HD21 LEU 9 HD21 LEU 9 18.220 -9.830 -5.854 78 HD22 LEU 9 HD22 LEU 9 16.917 -9.465 -6.987 79 HD23 LEU 9 HD23 LEU 9 16.850 -8.846 -5.335 80 H SER 10 H SER 10 17.045 -9.718 -9.406 81 HA SER 10 HA SER 10 18.163 -12.244 -9.785 82 HB2 SER 10 HB2 SER 10 18.147 -11.442 -7.038 83 HB3 SER 10 HB3 SER 10 16.987 -12.753 -7.247 84 HG SER 10 HG SER 10 19.745 -12.764 -7.484 85 H CYS 11 H CYS 11 16.646 -13.545 -10.625 86 HA CYS 11 HA CYS 11 13.860 -12.650 -10.460 87 HB2 CYS 11 HB2 CYS 11 14.884 -12.922 -12.705 88 HB3 CYS 11 HB3 CYS 11 15.127 -14.632 -12.363 89 H VAL 12 H VAL 12 15.945 -15.067 -9.298 90 HA VAL 12 HA VAL 12 14.395 -17.339 -9.127 91 HB VAL 12 HB VAL 12 16.190 -16.316 -6.924 92 HG11 VAL 12 HG11 VAL 12 14.740 -18.251 -6.368 93 HG12 VAL 12 HG12 VAL 12 15.484 -19.143 -7.697 94 HG13 VAL 12 HG13 VAL 12 16.462 -18.627 -6.323 95 HG21 VAL 12 HG21 VAL 12 16.789 -17.577 -9.563 96 HG22 VAL 12 HG22 VAL 12 17.609 -16.249 -8.742 97 HG23 VAL 12 HG23 VAL 12 17.835 -17.906 -8.181 98 H ASP 13 H ASP 13 14.126 -14.365 -7.324 99 HA ASP 13 HA ASP 13 12.462 -15.339 -5.244 100 HB2 ASP 13 HB2 ASP 13 12.663 -12.527 -6.343 101 HB3 ASP 13 HB3 ASP 13 11.980 -12.987 -4.786 102 H ARG 14 H ARG 14 11.520 -13.098 -7.852 103 HA ARG 14 HA ARG 14 9.145 -14.687 -8.393 104 HB2 ARG 14 HB2 ARG 14 9.018 -11.832 -7.410 105 HB3 ARG 14 HB3 ARG 14 7.668 -12.681 -8.151 106 HG2 ARG 14 HG2 ARG 14 7.167 -13.054 -5.975 107 HG3 ARG 14 HG3 ARG 14 8.224 -14.441 -6.248 108 HD2 ARG 14 HD2 ARG 14 10.087 -12.715 -5.531 109 HD3 ARG 14 HD3 ARG 14 8.725 -11.931 -4.731 110 HE ARG 14 HE ARG 14 8.905 -14.739 -4.171 111 HH11 ARG 14 HH11 ARG 14 10.053 -11.577 -3.272 112 HH12 ARG 14 HH12 ARG 14 10.456 -12.041 -1.652 113 HH21 ARG 14 HH21 ARG 14 9.431 -15.361 -2.041 114 HH22 ARG 14 HH22 ARG 14 10.103 -14.194 -0.953 115 H LYS 15 H LYS 15 8.936 -14.816 -10.519 116 HA LYS 15 HA LYS 15 10.353 -12.982 -12.247 117 HB2 LYS 15 HB2 LYS 15 9.679 -14.466 -14.051 118 HB3 LYS 15 HB3 LYS 15 10.330 -15.402 -12.712 119 HG2 LYS 15 HG2 LYS 15 8.509 -16.666 -13.085 120 HG3 LYS 15 HG3 LYS 15 7.726 -15.453 -12.071 121 HD2 LYS 15 HD2 LYS 15 6.712 -14.414 -13.869 122 HD3 LYS 15 HD3 LYS 15 7.901 -15.023 -15.023 123 HE2 LYS 15 HE2 LYS 15 6.963 -17.331 -14.554 124 HE3 LYS 15 HE3 LYS 15 5.642 -16.519 -13.714 125 HZ1 LYS 15 HZ1 LYS 15 5.332 -15.233 -15.854 126 HZ2 LYS 15 HZ2 LYS 15 4.882 -16.863 -15.883 127 HZ3 LYS 15 HZ3 LYS 15 6.342 -16.378 -16.584 128 H ASN 16 H ASN 16 7.068 -13.590 -11.244 129 HA ASN 16 HA ASN 16 5.966 -11.820 -13.270 130 HB2 ASN 16 HB2 ASN 16 4.846 -13.668 -11.217 131 HB3 ASN 16 HB3 ASN 16 3.839 -12.325 -11.748 132 HD21 ASN 16 HD21 ASN 16 3.453 -15.169 -12.136 133 HD22 ASN 16 HD22 ASN 16 3.378 -15.422 -13.844 134 H ASP 17 H ASP 17 7.567 -11.340 -10.476 135 HA ASP 17 HA ASP 17 6.138 -8.823 -9.953 136 HB2 ASP 17 HB2 ASP 17 7.469 -10.456 -7.791 137 HB3 ASP 17 HB3 ASP 17 6.424 -9.052 -7.594 138 H CYS 18 H CYS 18 8.479 -9.437 -11.608 139 HA CYS 18 HA CYS 18 10.879 -8.726 -10.338 140 HB2 CYS 18 HB2 CYS 18 9.931 -9.084 -13.068 141 HB3 CYS 18 HB3 CYS 18 11.116 -7.788 -12.944 142 H CYS 19 H CYS 19 9.036 -6.665 -12.589 143 HA CYS 19 HA CYS 19 8.801 -4.448 -10.906 144 HB2 CYS 19 HB2 CYS 19 11.440 -4.784 -11.661 145 HB3 CYS 19 HB3 CYS 19 10.843 -3.598 -12.818 146 H GLU 20 H GLU 20 8.956 -2.322 -12.595 147 HA GLU 20 HA GLU 20 6.815 -2.922 -14.460 148 HB2 GLU 20 HB2 GLU 20 6.750 -0.931 -12.947 149 HB3 GLU 20 HB3 GLU 20 8.103 -0.258 -13.847 150 HG2 GLU 20 HG2 GLU 20 6.832 0.215 -15.683 151 HG3 GLU 20 HG3 GLU 20 5.671 -1.069 -15.348 152 H GLY 21 H GLY 21 7.301 -3.598 -16.439 153 HA2 GLY 21 HA2 GLY 21 8.144 -3.436 -18.596 154 HA3 GLY 21 HA3 GLY 21 9.129 -2.076 -18.077 155 H LEU 22 H LEU 22 9.104 -5.230 -16.527 156 HA LEU 22 HA LEU 22 11.779 -5.757 -17.631 157 HB2 LEU 22 HB2 LEU 22 10.895 -5.981 -14.762 158 HB3 LEU 22 HB3 LEU 22 12.381 -6.696 -15.384 159 HG LEU 22 HG LEU 22 11.716 -3.761 -15.203 160 HD11 LEU 22 HD11 LEU 22 14.161 -4.750 -13.977 161 HD12 LEU 22 HD12 LEU 22 12.704 -5.468 -13.289 162 HD13 LEU 22 HD13 LEU 22 12.896 -3.715 -13.313 163 HD21 LEU 22 HD21 LEU 22 13.984 -3.391 -16.070 164 HD22 LEU 22 HD22 LEU 22 12.944 -4.188 -17.251 165 HD23 LEU 22 HD23 LEU 22 14.146 -5.123 -16.360 166 H GLU 23 H GLU 23 12.439 -8.027 -17.491 167 HA GLU 23 HA GLU 23 10.290 -9.958 -17.107 168 HB2 GLU 23 HB2 GLU 23 11.542 -9.294 -19.731 169 HB3 GLU 23 HB3 GLU 23 11.162 -10.977 -19.398 170 HG2 GLU 23 HG2 GLU 23 9.075 -8.897 -18.964 171 HG3 GLU 23 HG3 GLU 23 9.439 -9.439 -20.601 172 H CYS 24 H CYS 24 11.155 -12.244 -17.436 173 HA CYS 24 HA CYS 24 13.575 -12.488 -15.896 174 HB2 CYS 24 HB2 CYS 24 11.287 -14.025 -16.201 175 HB3 CYS 24 HB3 CYS 24 12.529 -14.970 -17.017 176 H TYR 25 H TYR 25 15.547 -13.191 -16.556 177 HA TYR 25 HA TYR 25 15.993 -13.274 -19.441 178 HB2 TYR 25 HB2 TYR 25 17.409 -11.759 -18.168 179 HB3 TYR 25 HB3 TYR 25 17.934 -13.078 -17.128 180 HD1 TYR 25 HD1 TYR 25 17.748 -12.407 -20.808 181 HD2 TYR 25 HD2 TYR 25 20.061 -13.848 -17.541 182 HE1 TYR 25 HE1 TYR 25 19.620 -12.859 -22.339 183 HE2 TYR 25 HE2 TYR 25 21.939 -14.302 -19.062 184 HH TYR 25 HH TYR 25 22.703 -13.339 -21.382 185 H LYS 26 H LYS 26 17.176 -14.937 -20.451 186 HA LYS 26 HA LYS 26 16.903 -17.527 -19.113 187 HB2 LYS 26 HB2 LYS 26 17.003 -16.631 -21.958 188 HB3 LYS 26 HB3 LYS 26 17.542 -18.262 -21.579 189 HG2 LYS 26 HG2 LYS 26 15.332 -18.621 -22.058 190 HG3 LYS 26 HG3 LYS 26 15.268 -18.412 -20.307 191 HD2 LYS 26 HD2 LYS 26 14.737 -15.997 -20.699 192 HD3 LYS 26 HD3 LYS 26 14.610 -16.364 -22.420 193 HE2 LYS 26 HE2 LYS 26 12.808 -17.920 -21.990 194 HE3 LYS 26 HE3 LYS 26 12.980 -17.683 -20.252 195 HZ1 LYS 26 HZ1 LYS 26 12.358 -15.359 -20.558 196 HZ2 LYS 26 HZ2 LYS 26 11.143 -16.394 -21.115 197 HZ3 LYS 26 HZ3 LYS 26 12.160 -15.613 -22.219 198 H ARG 27 H ARG 27 18.598 -18.962 -18.880 199 HA ARG 27 HA ARG 27 21.188 -18.524 -19.960 200 HB2 ARG 27 HB2 ARG 27 22.390 -17.697 -18.160 201 HB3 ARG 27 HB3 ARG 27 20.894 -16.778 -18.049 202 HG2 ARG 27 HG2 ARG 27 21.648 -19.192 -16.417 203 HG3 ARG 27 HG3 ARG 27 21.557 -17.520 -15.860 204 HD2 ARG 27 HD2 ARG 27 19.158 -17.494 -16.321 205 HD3 ARG 27 HD3 ARG 27 19.247 -19.158 -16.898 206 HE ARG 27 HE ARG 27 20.187 -18.765 -14.198 207 HH11 ARG 27 HH11 ARG 27 17.461 -19.482 -16.241 208 HH12 ARG 27 HH12 ARG 27 16.562 -20.269 -14.985 209 HH21 ARG 27 HH21 ARG 27 19.014 -19.798 -12.538 210 HH22 ARG 27 HH22 ARG 27 17.446 -20.447 -12.879 211 H ARG 28 H ARG 28 22.835 -19.924 -18.511 212 HA ARG 28 HA ARG 28 21.444 -22.402 -17.747 213 HB2 ARG 28 HB2 ARG 28 24.029 -22.291 -19.304 214 HB3 ARG 28 HB3 ARG 28 23.112 -23.729 -18.876 215 HG2 ARG 28 HG2 ARG 28 21.220 -22.742 -20.260 216 HG3 ARG 28 HG3 ARG 28 22.421 -21.605 -20.876 217 HD2 ARG 28 HD2 ARG 28 22.748 -24.597 -20.974 218 HD3 ARG 28 HD3 ARG 28 22.055 -23.649 -22.289 219 HE ARG 28 HE ARG 28 24.827 -23.867 -21.590 220 HH11 ARG 28 HH11 ARG 28 22.419 -21.845 -23.083 221 HH12 ARG 28 HH12 ARG 28 23.559 -20.997 -24.076 222 HH21 ARG 28 HH21 ARG 28 26.337 -22.759 -22.891 223 HH22 ARG 28 HH22 ARG 28 25.787 -21.518 -23.967 224 H HIS 29 H HIS 29 24.726 -20.997 -17.769 225 HA HIS 29 HA HIS 29 25.203 -22.162 -15.131 226 HB2 HIS 29 HB2 HIS 29 27.091 -20.789 -17.055 227 HB3 HIS 29 HB3 HIS 29 27.561 -21.510 -15.518 228 HD1 HIS 29 HD1 HIS 29 26.692 -22.359 -19.028 229 HD2 HIS 29 HD2 HIS 29 27.572 -24.338 -15.483 230 HE1 HIS 29 HE1 HIS 29 27.125 -24.748 -19.682 231 H SER 30 H SER 30 23.440 -19.829 -15.578 232 HA SER 30 HA SER 30 24.753 -18.025 -13.676 233 HB2 SER 30 HB2 SER 30 24.177 -17.390 -16.407 234 HB3 SER 30 HB3 SER 30 23.134 -16.418 -15.370 235 HG SER 30 HG SER 30 24.870 -15.221 -15.240 236 H PHE 31 H PHE 31 22.858 -16.192 -13.244 237 HA PHE 31 HA PHE 31 20.492 -17.765 -12.464 238 HB2 PHE 31 HB2 PHE 31 20.296 -16.259 -10.506 239 HB3 PHE 31 HB3 PHE 31 21.800 -17.174 -10.504 240 HD1 PHE 31 HD1 PHE 31 23.914 -16.031 -11.238 241 HD2 PHE 31 HD2 PHE 31 20.299 -13.917 -10.476 242 HE1 PHE 31 HE1 PHE 31 25.187 -13.937 -11.023 243 HE2 PHE 31 HE2 PHE 31 21.567 -11.819 -10.261 244 HZ PHE 31 HZ PHE 31 24.015 -11.828 -10.535 245 H GLU 32 H GLU 32 18.691 -17.160 -13.449 246 HA GLU 32 HA GLU 32 18.471 -14.958 -15.151 247 HB2 GLU 32 HB2 GLU 32 15.981 -15.401 -14.991 248 HB3 GLU 32 HB3 GLU 32 16.977 -16.761 -15.492 249 HG2 GLU 32 HG2 GLU 32 16.795 -17.797 -13.376 250 HG3 GLU 32 HG3 GLU 32 16.097 -16.349 -12.651 251 H VAL 33 H VAL 33 17.710 -12.908 -14.929 252 HA VAL 33 HA VAL 33 16.645 -12.064 -12.336 253 HB VAL 33 HB VAL 33 18.131 -10.214 -12.104 254 HG11 VAL 33 HG11 VAL 33 18.895 -12.676 -11.590 255 HG12 VAL 33 HG12 VAL 33 20.083 -12.336 -12.850 256 HG13 VAL 33 HG13 VAL 33 20.012 -11.323 -11.407 257 HG21 VAL 33 HG21 VAL 33 20.126 -10.196 -13.846 258 HG22 VAL 33 HG22 VAL 33 18.894 -10.901 -14.893 259 HG23 VAL 33 HG23 VAL 33 18.623 -9.325 -14.149 260 H CYS 34 H CYS 34 16.085 -9.593 -12.521 261 HA CYS 34 HA CYS 34 14.151 -9.367 -14.589 262 HB2 CYS 34 HB2 CYS 34 15.163 -7.197 -12.742 263 HB3 CYS 34 HB3 CYS 34 13.645 -7.195 -13.633 264 H VAL 35 H VAL 35 14.456 -8.747 -16.615 265 HA VAL 35 HA VAL 35 16.714 -6.946 -17.213 266 HB VAL 35 HB VAL 35 16.661 -8.022 -19.523 267 HG11 VAL 35 HG11 VAL 35 17.525 -9.624 -17.119 268 HG12 VAL 35 HG12 VAL 35 18.033 -9.952 -18.777 269 HG13 VAL 35 HG13 VAL 35 18.478 -8.432 -18.002 270 HG21 VAL 35 HG21 VAL 35 14.399 -9.208 -18.706 271 HG22 VAL 35 HG22 VAL 35 15.444 -9.883 -19.955 272 HG23 VAL 35 HG23 VAL 35 15.557 -10.475 -18.298 273 HA PRO 36 HA PRO 36 13.853 -4.145 -19.020 274 HB2 PRO 36 HB2 PRO 36 15.413 -3.004 -20.927 275 HB3 PRO 36 HB3 PRO 36 15.609 -2.674 -19.202 276 HG2 PRO 36 HG2 PRO 36 17.157 -4.536 -20.963 277 HG3 PRO 36 HG3 PRO 36 17.750 -3.421 -19.719 278 HD2 PRO 36 HD2 PRO 36 17.459 -6.076 -19.276 279 HD3 PRO 36 HD3 PRO 36 17.231 -4.864 -17.999 280 H ILE 37 H ILE 37 12.221 -4.497 -20.378 281 HA ILE 37 HA ILE 37 12.482 -6.398 -22.532 282 HB ILE 37 HB ILE 37 10.107 -4.744 -21.669 283 HG12 ILE 37 HG12 ILE 37 10.333 -7.698 -21.276 284 HG13 ILE 37 HG13 ILE 37 11.204 -6.637 -20.175 285 HG21 ILE 37 HG21 ILE 37 8.774 -6.255 -23.037 286 HG22 ILE 37 HG22 ILE 37 9.974 -5.417 -24.020 287 HG23 ILE 37 HG23 ILE 37 10.235 -7.097 -23.551 288 HD11 ILE 37 HD11 ILE 37 8.569 -5.643 -20.418 289 HD12 ILE 37 HD12 ILE 37 8.474 -7.381 -20.135 290 HD13 ILE 37 HD13 ILE 37 9.355 -6.352 -19.008 291 HA PRO 38 HA PRO 38 13.393 -3.400 -25.657 292 HB2 PRO 38 HB2 PRO 38 12.961 -5.005 -27.804 293 HB3 PRO 38 HB3 PRO 38 14.403 -5.126 -26.788 294 HG2 PRO 38 HG2 PRO 38 11.911 -6.784 -26.746 295 HG3 PRO 38 HG3 PRO 38 13.602 -7.302 -26.617 296 HD2 PRO 38 HD2 PRO 38 11.985 -7.057 -24.459 297 HD3 PRO 38 HD3 PRO 38 13.732 -6.751 -24.383 298 H GLY 39 H GLY 39 12.196 -1.875 -26.633 299 HA2 GLY 39 HA2 GLY 39 10.419 -0.827 -27.652 300 HA3 GLY 39 HA3 GLY 39 9.779 -2.419 -28.035 301 H PHE 40 H PHE 40 10.411 -2.064 -24.739 302 HA PHE 40 HA PHE 40 7.726 -2.369 -23.989 303 HB2 PHE 40 HB2 PHE 40 9.282 -3.129 -22.415 304 HB3 PHE 40 HB3 PHE 40 10.227 -1.645 -22.492 305 HD1 PHE 40 HD1 PHE 40 6.902 -2.933 -21.435 306 HD2 PHE 40 HD2 PHE 40 9.957 -0.025 -20.865 307 HE1 PHE 40 HE1 PHE 40 5.721 -2.087 -19.449 308 HE2 PHE 40 HE2 PHE 40 8.781 0.825 -18.878 309 HZ PHE 40 HZ PHE 40 6.661 -0.206 -18.167 310 H CYS 41 H CYS 41 6.228 -0.956 -23.096 311 HA CYS 41 HA CYS 41 6.818 1.855 -22.834 312 HB2 CYS 41 HB2 CYS 41 5.210 2.632 -24.483 313 HB3 CYS 41 HB3 CYS 41 6.423 1.627 -25.268 314 H LEU 42 H LEU 42 4.353 2.939 -22.740 315 HA LEU 42 HA LEU 42 2.914 1.293 -20.765 316 HB2 LEU 42 HB2 LEU 42 3.058 4.296 -20.731 317 HB3 LEU 42 HB3 LEU 42 2.446 3.225 -19.472 318 HG LEU 42 HG LEU 42 5.340 3.423 -20.301 319 HD11 LEU 42 HD11 LEU 42 5.310 5.348 -19.171 320 HD12 LEU 42 HD12 LEU 42 5.145 4.346 -17.731 321 HD13 LEU 42 HD13 LEU 42 3.711 5.033 -18.493 322 HD21 LEU 42 HD21 LEU 42 3.849 1.839 -18.247 323 HD22 LEU 42 HD22 LEU 42 5.529 2.301 -17.971 324 HD23 LEU 42 HD23 LEU 42 5.103 1.317 -19.372 325 H VAL 43 H VAL 43 0.611 1.870 -20.507 326 HA VAL 43 HA VAL 43 -0.555 2.580 -23.113 327 HB VAL 43 HB VAL 43 -2.598 1.409 -22.294 328 HG11 VAL 43 HG11 VAL 43 -1.547 -0.910 -22.379 329 HG12 VAL 43 HG12 VAL 43 -1.229 0.163 -23.744 330 HG13 VAL 43 HG13 VAL 43 0.003 -0.080 -22.505 331 HG21 VAL 43 HG21 VAL 43 -1.469 1.649 -19.820 332 HG22 VAL 43 HG22 VAL 43 -2.806 0.571 -20.223 333 HG23 VAL 43 HG23 VAL 43 -1.153 -0.043 -20.203 334 H LYS 44 H LYS 44 -3.041 3.262 -22.615 335 HA LYS 44 HA LYS 44 -2.802 5.839 -21.364 336 HB2 LYS 44 HB2 LYS 44 -5.044 6.237 -22.163 337 HB3 LYS 44 HB3 LYS 44 -4.115 5.462 -23.439 338 HG2 LYS 44 HG2 LYS 44 -5.479 3.517 -21.793 339 HG3 LYS 44 HG3 LYS 44 -6.599 4.692 -22.486 340 HD2 LYS 44 HD2 LYS 44 -5.340 4.247 -24.696 341 HD3 LYS 44 HD3 LYS 44 -4.744 2.797 -23.886 342 HE2 LYS 44 HE2 LYS 44 -7.067 2.110 -23.457 343 HE3 LYS 44 HE3 LYS 44 -7.637 3.541 -24.315 344 HZ1 LYS 44 HZ1 LYS 44 -6.460 2.708 -26.300 345 HZ2 LYS 44 HZ2 LYS 44 -7.693 1.672 -25.784 346 HZ3 LYS 44 HZ3 LYS 44 -6.077 1.290 -25.461 347 H TRP 45 H TRP 45 -3.230 2.868 -20.091 348 HA TRP 45 HA TRP 45 -4.874 3.905 -17.875 349 HB2 TRP 45 HB2 TRP 45 -4.740 1.073 -18.933 350 HB3 TRP 45 HB3 TRP 45 -5.607 1.563 -17.480 351 HD1 TRP 45 HD1 TRP 45 -6.193 0.946 -21.028 352 HE1 TRP 45 HE1 TRP 45 -8.419 1.982 -21.800 353 HE3 TRP 45 HE3 TRP 45 -7.103 3.992 -17.023 354 HZ2 TRP 45 HZ2 TRP 45 -10.310 3.845 -20.839 355 HZ3 TRP 45 HZ3 TRP 45 -9.142 5.368 -17.029 356 HH2 TRP 45 HH2 TRP 45 -10.711 5.295 -18.898 357 H LYS 46 H LYS 46 -1.862 3.625 -18.513 358 HA LYS 46 HA LYS 46 -1.119 2.187 -16.052 359 HB2 LYS 46 HB2 LYS 46 0.281 2.555 -18.674 360 HB3 LYS 46 HB3 LYS 46 1.230 2.296 -17.216 361 HG2 LYS 46 HG2 LYS 46 -0.971 0.402 -17.552 362 HG3 LYS 46 HG3 LYS 46 0.246 0.333 -18.827 363 HD2 LYS 46 HD2 LYS 46 1.833 0.468 -16.646 364 HD3 LYS 46 HD3 LYS 46 0.440 -0.384 -15.973 365 HE2 LYS 46 HE2 LYS 46 0.625 -1.897 -18.041 366 HE3 LYS 46 HE3 LYS 46 2.231 -1.198 -18.241 367 HZ1 LYS 46 HZ1 LYS 46 1.770 -3.367 -16.800 368 HZ2 LYS 46 HZ2 LYS 46 1.579 -2.202 -15.590 369 HZ3 LYS 46 HZ3 LYS 46 3.030 -2.291 -16.456 370 H GLN 47 H GLN 47 0.314 3.143 -14.604 371 HA GLN 47 HA GLN 47 0.083 5.879 -14.189 372 HB2 GLN 47 HB2 GLN 47 1.670 3.686 -13.048 373 HB3 GLN 47 HB3 GLN 47 2.411 5.273 -12.882 374 HG2 GLN 47 HG2 GLN 47 0.779 6.047 -11.489 375 HG3 GLN 47 HG3 GLN 47 -0.451 4.975 -12.154 376 HE21 GLN 47 HE21 GLN 47 -0.850 4.742 -9.789 377 HE22 GLN 47 HE22 GLN 47 0.011 3.499 -8.954 378 H CYS 48 H CYS 48 1.361 7.644 -14.612 379 HA CYS 48 HA CYS 48 3.412 7.246 -16.681 380 HB2 CYS 48 HB2 CYS 48 2.920 9.394 -17.510 381 HB3 CYS 48 HB3 CYS 48 1.348 8.703 -17.119 382 H ASP 49 H ASP 49 2.915 8.232 -13.449 383 HA ASP 49 HA ASP 49 4.883 10.101 -12.979 384 HB2 ASP 49 HB2 ASP 49 3.253 9.262 -11.291 385 HB3 ASP 49 HB3 ASP 49 4.197 7.780 -11.163 386 H GLY 50 H GLY 50 6.978 10.099 -13.431 387 HA2 GLY 50 HA2 GLY 50 9.189 9.332 -13.221 388 HA3 GLY 50 HA3 GLY 50 8.574 7.728 -12.850 389 H ARG 51 H ARG 51 6.783 7.678 -15.162 390 HA ARG 51 HA ARG 51 8.819 7.252 -17.248 391 HB2 ARG 51 HB2 ARG 51 6.220 5.824 -16.691 392 HB3 ARG 51 HB3 ARG 51 7.114 5.627 -18.193 393 HG2 ARG 51 HG2 ARG 51 7.780 3.818 -16.898 394 HG3 ARG 51 HG3 ARG 51 9.096 4.979 -16.709 395 HD2 ARG 51 HD2 ARG 51 8.349 5.614 -14.555 396 HD3 ARG 51 HD3 ARG 51 6.806 4.787 -14.768 397 HE ARG 51 HE ARG 51 8.665 2.807 -14.982 398 HH11 ARG 51 HH11 ARG 51 7.929 5.230 -12.594 399 HH12 ARG 51 HH12 ARG 51 8.473 4.267 -11.260 400 HH21 ARG 51 HH21 ARG 51 9.384 1.529 -13.235 401 HH22 ARG 51 HH22 ARG 51 9.301 2.163 -11.626 402 H GLU 52 H GLU 52 7.690 9.796 -16.876 403 HA GLU 52 HA GLU 52 5.453 10.320 -18.494 404 HB2 GLU 52 HB2 GLU 52 6.084 12.629 -18.375 405 HB3 GLU 52 HB3 GLU 52 6.440 11.892 -16.819 406 HG2 GLU 52 HG2 GLU 52 8.818 11.613 -17.675 407 HG3 GLU 52 HG3 GLU 52 8.355 12.712 -18.973 408 H ARG 53 H ARG 53 8.641 9.451 -19.307 409 HA ARG 53 HA ARG 53 8.142 10.194 -22.114 410 HB2 ARG 53 HB2 ARG 53 10.830 10.100 -20.732 411 HB3 ARG 53 HB3 ARG 53 10.543 10.517 -22.417 412 HG2 ARG 53 HG2 ARG 53 8.997 12.359 -21.343 413 HG3 ARG 53 HG3 ARG 53 10.061 12.108 -19.958 414 HD2 ARG 53 HD2 ARG 53 12.006 12.546 -21.376 415 HD3 ARG 53 HD3 ARG 53 10.943 12.793 -22.759 416 HE ARG 53 HE ARG 53 10.022 14.586 -20.965 417 HH11 ARG 53 HH11 ARG 53 13.197 13.881 -22.206 418 HH12 ARG 53 HH12 ARG 53 13.767 15.509 -22.036 419 HH21 ARG 53 HH21 ARG 53 10.760 16.731 -20.737 420 HH22 ARG 53 HH22 ARG 53 12.380 17.129 -21.199 421 H ASP 54 H ASP 54 7.645 7.705 -20.516 422 HA ASP 54 HA ASP 54 9.309 5.855 -22.096 423 HB2 ASP 54 HB2 ASP 54 8.942 5.941 -19.331 424 HB3 ASP 54 HB3 ASP 54 7.917 4.613 -19.871 425 H CYS 55 H CYS 55 6.126 6.926 -21.360 426 HA CYS 55 HA CYS 55 4.532 4.766 -21.967 427 HB2 CYS 55 HB2 CYS 55 4.033 7.630 -22.806 428 HB3 CYS 55 HB3 CYS 55 2.815 6.372 -22.627 429 H CYS 56 H CYS 56 3.193 4.488 -23.995 430 HA CYS 56 HA CYS 56 4.925 3.903 -26.165 431 HB2 CYS 56 HB2 CYS 56 2.205 3.343 -25.417 432 HB3 CYS 56 HB3 CYS 56 2.260 3.859 -27.099 433 H ALA 57 H ALA 57 3.776 4.540 -28.474 434 HA ALA 57 HA ALA 57 4.417 7.310 -28.781 435 HB1 ALA 57 HB1 ALA 57 3.525 5.147 -30.649 436 HB2 ALA 57 HB2 ALA 57 3.611 6.826 -31.183 437 HB3 ALA 57 HB3 ALA 57 5.061 6.013 -30.595 438 H GLY 58 H GLY 58 3.102 9.038 -28.947 439 HA2 GLY 58 HA2 GLY 58 1.110 10.204 -29.366 440 HA3 GLY 58 HA3 GLY 58 0.252 8.671 -29.430 441 H LEU 59 H LEU 59 1.798 8.079 -26.791 442 HA LEU 59 HA LEU 59 -0.350 8.958 -25.080 443 HB2 LEU 59 HB2 LEU 59 1.491 6.839 -25.100 444 HB3 LEU 59 HB3 LEU 59 1.854 7.784 -23.657 445 HG LEU 59 HG LEU 59 -0.370 7.462 -22.814 446 HD11 LEU 59 HD11 LEU 59 -0.903 6.257 -25.512 447 HD12 LEU 59 HD12 LEU 59 -1.747 7.582 -24.711 448 HD13 LEU 59 HD13 LEU 59 -1.929 5.931 -24.115 449 HD21 LEU 59 HD21 LEU 59 1.395 5.274 -23.462 450 HD22 LEU 59 HD22 LEU 59 -0.279 4.731 -23.354 451 HD23 LEU 59 HD23 LEU 59 0.465 5.572 -21.994 452 H GLU 60 H GLU 60 0.247 9.820 -22.848 453 HA GLU 60 HA GLU 60 2.607 11.439 -22.649 454 HB2 GLU 60 HB2 GLU 60 1.581 13.603 -22.659 455 HB3 GLU 60 HB3 GLU 60 1.134 12.793 -24.154 456 HG2 GLU 60 HG2 GLU 60 -0.950 12.087 -22.627 457 HG3 GLU 60 HG3 GLU 60 -0.536 13.625 -21.873 458 H CYS 61 H CYS 61 2.859 12.402 -20.576 459 HA CYS 61 HA CYS 61 1.758 10.890 -18.462 460 HB2 CYS 61 HB2 CYS 61 3.993 12.241 -18.611 461 HB3 CYS 61 HB3 CYS 61 3.012 13.578 -18.016 462 H TRP 62 H TRP 62 -0.471 11.033 -18.447 463 HA TRP 62 HA TRP 62 -1.830 13.558 -18.428 464 HB2 TRP 62 HB2 TRP 62 -2.705 11.249 -19.236 465 HB3 TRP 62 HB3 TRP 62 -3.071 10.971 -17.535 466 HD1 TRP 62 HD1 TRP 62 -3.592 14.540 -18.275 467 HE1 TRP 62 HE1 TRP 62 -6.093 15.043 -18.620 468 HE3 TRP 62 HE3 TRP 62 -5.331 9.753 -18.725 469 HZ2 TRP 62 HZ2 TRP 62 -8.486 13.603 -19.026 470 HZ3 TRP 62 HZ3 TRP 62 -7.739 9.403 -19.090 471 HH2 TRP 62 HH2 TRP 62 -9.283 11.289 -19.237 472 H LYS 63 H LYS 63 -2.420 14.776 -16.738 473 HA LYS 63 HA LYS 63 -1.676 13.839 -14.063 474 HB2 LYS 63 HB2 LYS 63 -1.006 16.139 -15.228 475 HB3 LYS 63 HB3 LYS 63 -2.553 16.643 -14.561 476 HG2 LYS 63 HG2 LYS 63 -0.671 15.239 -12.752 477 HG3 LYS 63 HG3 LYS 63 -0.286 16.896 -13.222 478 HD2 LYS 63 HD2 LYS 63 -3.000 16.140 -12.178 479 HD3 LYS 63 HD3 LYS 63 -1.670 16.552 -11.093 480 HE2 LYS 63 HE2 LYS 63 -2.701 18.320 -13.309 481 HE3 LYS 63 HE3 LYS 63 -3.152 18.470 -11.611 482 HZ1 LYS 63 HZ1 LYS 63 -0.878 19.491 -12.927 483 HZ2 LYS 63 HZ2 LYS 63 -0.378 18.423 -11.713 484 HZ3 LYS 63 HZ3 LYS 63 -1.374 19.735 -11.328 485 H ARG 64 H ARG 64 -3.373 12.666 -13.310 486 HA ARG 64 HA ARG 64 -5.986 14.027 -13.211 487 HB2 ARG 64 HB2 ARG 64 -5.248 11.295 -13.959 488 HB3 ARG 64 HB3 ARG 64 -6.527 11.362 -12.754 489 HG2 ARG 64 HG2 ARG 64 -7.995 12.433 -14.175 490 HG3 ARG 64 HG3 ARG 64 -6.704 13.060 -15.202 491 HD2 ARG 64 HD2 ARG 64 -7.150 11.373 -16.587 492 HD3 ARG 64 HD3 ARG 64 -6.420 10.314 -15.380 493 HE ARG 64 HE ARG 64 -8.495 9.482 -14.931 494 HH11 ARG 64 HH11 ARG 64 -8.848 12.552 -16.534 495 HH12 ARG 64 HH12 ARG 64 -10.570 12.431 -16.670 496 HH21 ARG 64 HH21 ARG 64 -10.763 9.310 -15.105 497 HH22 ARG 64 HH22 ARG 64 -11.659 10.587 -15.856 498 H SER 65 H SER 65 -6.704 14.536 -11.253 499 HA SER 65 HA SER 65 -5.741 12.996 -8.940 500 HB2 SER 65 HB2 SER 65 -6.007 16.010 -9.007 501 HB3 SER 65 HB3 SER 65 -5.445 15.035 -7.650 502 HG SER 65 HG SER 65 -4.178 15.201 -10.186 503 H GLY 66 H GLY 66 -7.230 12.588 -7.369 504 HA2 GLY 66 HA2 GLY 66 -9.256 13.246 -6.176 505 HA3 GLY 66 HA3 GLY 66 -9.899 13.803 -7.714 506 H ASN 67 H ASN 67 -8.798 11.380 -9.076 507 HA ASN 67 HA ASN 67 -10.860 9.488 -8.159 508 HB2 ASN 67 HB2 ASN 67 -9.961 10.335 -10.871 509 HB3 ASN 67 HB3 ASN 67 -10.466 8.660 -10.664 510 HD21 ASN 67 HD21 ASN 67 -11.457 11.942 -10.834 511 HD22 ASN 67 HD22 ASN 67 -13.160 11.662 -10.755 512 H LYS 68 H LYS 68 -7.678 9.640 -9.747 513 HA LYS 68 HA LYS 68 -6.769 7.394 -8.154 514 HB2 LYS 68 HB2 LYS 68 -6.929 7.262 -11.169 515 HB3 LYS 68 HB3 LYS 68 -5.956 6.169 -10.194 516 HG2 LYS 68 HG2 LYS 68 -8.942 6.486 -9.969 517 HG3 LYS 68 HG3 LYS 68 -8.117 5.201 -10.855 518 HD2 LYS 68 HD2 LYS 68 -7.061 4.446 -8.784 519 HD3 LYS 68 HD3 LYS 68 -7.864 5.743 -7.896 520 HE2 LYS 68 HE2 LYS 68 -9.089 3.701 -7.570 521 HE3 LYS 68 HE3 LYS 68 -10.048 4.785 -8.577 522 HZ1 LYS 68 HZ1 LYS 68 -9.389 2.188 -9.145 523 HZ2 LYS 68 HZ2 LYS 68 -8.373 3.096 -10.146 524 HZ3 LYS 68 HZ3 LYS 68 -10.049 3.314 -10.222 525 H SER 69 H SER 69 -4.409 6.807 -9.195 526 HA SER 69 HA SER 69 -2.859 9.144 -8.690 527 HB2 SER 69 HB2 SER 69 -2.263 6.291 -9.360 528 HB3 SER 69 HB3 SER 69 -0.978 7.486 -9.539 529 HG SER 69 HG SER 69 -1.264 6.377 -7.410 530 H SER 70 H SER 70 -0.861 9.453 -10.277 531 HA SER 70 HA SER 70 -1.932 10.620 -12.627 532 HB2 SER 70 HB2 SER 70 0.212 11.460 -13.016 533 HB3 SER 70 HB3 SER 70 0.199 11.255 -11.265 534 HG SER 70 HG SER 70 2.063 10.390 -12.548 535 H VAL 71 H VAL 71 -2.439 9.661 -14.470 536 HA VAL 71 HA VAL 71 -1.018 7.185 -15.211 537 HB VAL 71 HB VAL 71 -3.096 6.581 -16.490 538 HG11 VAL 71 HG11 VAL 71 -2.420 6.074 -13.917 539 HG12 VAL 71 HG12 VAL 71 -4.031 6.763 -13.710 540 HG13 VAL 71 HG13 VAL 71 -3.801 5.352 -14.743 541 HG21 VAL 71 HG21 VAL 71 -3.849 9.199 -15.734 542 HG22 VAL 71 HG22 VAL 71 -4.769 8.029 -16.680 543 HG23 VAL 71 HG23 VAL 71 -4.949 8.081 -14.927 544 H CYS 72 H CYS 72 -1.479 6.763 -17.701 545 HA CYS 72 HA CYS 72 -0.595 9.202 -19.080 546 HB2 CYS 72 HB2 CYS 72 0.256 6.451 -19.165 547 HB3 CYS 72 HB3 CYS 72 -0.246 6.973 -20.770 548 H ALA 73 H ALA 73 -1.387 9.637 -21.219 549 HA ALA 73 HA ALA 73 -3.820 8.259 -22.041 550 HB1 ALA 73 HB1 ALA 73 -5.280 9.896 -21.612 551 HB2 ALA 73 HB2 ALA 73 -4.052 10.519 -20.509 552 HB3 ALA 73 HB3 ALA 73 -4.168 11.154 -22.150 553 HA PRO 74 HA PRO 74 -2.288 9.008 -26.087 554 HB2 PRO 74 HB2 PRO 74 -4.598 9.117 -27.508 555 HB3 PRO 74 HB3 PRO 74 -3.949 7.614 -26.843 556 HG2 PRO 74 HG2 PRO 74 -6.107 9.385 -25.764 557 HG3 PRO 74 HG3 PRO 74 -6.056 7.615 -25.859 558 HD2 PRO 74 HD2 PRO 74 -5.525 8.968 -23.574 559 HD3 PRO 74 HD3 PRO 74 -4.740 7.427 -23.977 560 H ILE 75 H ILE 75 -2.636 10.479 -28.039 561 HA ILE 75 HA ILE 75 -2.288 13.137 -27.312 562 HB ILE 75 HB ILE 75 -2.767 13.649 -29.747 563 HG12 ILE 75 HG12 ILE 75 -2.799 10.661 -30.107 564 HG13 ILE 75 HG13 ILE 75 -4.296 11.566 -29.905 565 HG21 ILE 75 HG21 ILE 75 -0.697 12.740 -30.486 566 HG22 ILE 75 HG22 ILE 75 -0.527 13.088 -28.767 567 HG23 ILE 75 HG23 ILE 75 -0.780 11.429 -29.310 568 HD11 ILE 75 HD11 ILE 75 -3.271 13.018 -31.847 569 HD12 ILE 75 HD12 ILE 75 -2.395 11.523 -32.177 570 HD13 ILE 75 HD13 ILE 75 -4.158 11.529 -32.170 571 H THR 76 H THR 76 -3.591 14.998 -27.587 572 HA THR 76 HA THR 76 -6.478 14.532 -27.836 573 HB THR 76 HB THR 76 -7.023 15.835 -25.917 574 HG1 THR 76 HG1 THR 76 -5.656 17.212 -25.044 575 HG21 THR 76 HG21 THR 76 -6.110 13.414 -25.641 576 HG22 THR 76 HG22 THR 76 -6.360 14.410 -24.208 577 HG23 THR 76 HG23 THR 76 -4.739 14.207 -24.868
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