NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
610081 | 2n8b | 25844 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 1.811 -0.001 0.854 2 HA2 GLY 1 HA2 GLY 1 2.749 0.842 -1.250 3 HA3 GLY 1 HA3 GLY 1 2.646 -0.911 -1.312 4 H CYS 2 H CYS 2 -0.171 -1.117 -1.600 5 HA CYS 2 HA CYS 2 -0.700 0.266 -4.132 6 HB2 CYS 2 HB2 CYS 2 -1.748 -2.111 -4.760 7 HB3 CYS 2 HB3 CYS 2 -0.079 -1.692 -5.132 8 H ILE 3 H ILE 3 -3.048 -0.304 -4.856 9 HA ILE 3 HA ILE 3 -5.027 -1.114 -3.111 10 HB ILE 3 HB ILE 3 -4.522 0.594 -1.559 11 HG12 ILE 3 HG12 ILE 3 -6.533 1.964 -1.553 12 HG13 ILE 3 HG13 ILE 3 -6.772 1.671 -3.272 13 HG21 ILE 3 HG21 ILE 3 -4.241 2.934 -2.135 14 HG22 ILE 3 HG22 ILE 3 -3.101 1.940 -3.041 15 HG23 ILE 3 HG23 ILE 3 -4.544 2.573 -3.834 16 HD11 ILE 3 HD11 ILE 3 -6.598 -0.783 -1.731 17 HD12 ILE 3 HD12 ILE 3 -7.918 0.268 -1.216 18 HD13 ILE 3 HD13 ILE 3 -7.811 -0.255 -2.897 19 H LEU 4 H LEU 4 -6.467 -1.658 -4.604 20 HA LEU 4 HA LEU 4 -7.899 0.215 -6.120 21 HB2 LEU 4 HB2 LEU 4 -5.522 -0.085 -7.277 22 HB3 LEU 4 HB3 LEU 4 -6.336 -1.475 -7.992 23 HG LEU 4 HG LEU 4 -8.008 0.833 -8.252 24 HD11 LEU 4 HD11 LEU 4 -6.358 2.395 -8.303 25 HD12 LEU 4 HD12 LEU 4 -6.276 1.856 -9.979 26 HD13 LEU 4 HD13 LEU 4 -5.121 1.239 -8.798 27 HD21 LEU 4 HD21 LEU 4 -6.513 -0.494 -10.479 28 HD22 LEU 4 HD22 LEU 4 -8.163 0.131 -10.454 29 HD23 LEU 4 HD23 LEU 4 -7.773 -1.364 -9.604 30 H ASN 5 H ASN 5 -8.764 -1.728 -4.498 31 HA ASN 5 HA ASN 5 -10.378 -3.337 -4.407 32 HB2 ASN 5 HB2 ASN 5 -11.005 -2.199 -6.689 33 HB3 ASN 5 HB3 ASN 5 -10.352 -3.680 -7.383 34 HD21 ASN 5 HD21 ASN 5 -12.702 -2.453 -5.059 35 HD22 ASN 5 HD22 ASN 5 -13.824 -3.756 -5.235 36 H GLY 6 H GLY 6 -8.695 -4.636 -3.451 37 HA2 GLY 6 HA2 GLY 6 -8.488 -7.200 -4.528 38 HA3 GLY 6 HA3 GLY 6 -7.016 -6.341 -4.959 39 H ARG 7 H ARG 7 -6.199 -8.228 -3.610 40 HA ARG 7 HA ARG 7 -6.351 -7.649 -0.737 41 HB2 ARG 7 HB2 ARG 7 -5.179 -10.081 -2.095 42 HB3 ARG 7 HB3 ARG 7 -5.493 -9.880 -0.377 43 HG2 ARG 7 HG2 ARG 7 -7.960 -9.505 -1.209 44 HG3 ARG 7 HG3 ARG 7 -7.384 -10.421 -2.603 45 HD2 ARG 7 HD2 ARG 7 -6.735 -12.258 -1.191 46 HD3 ARG 7 HD3 ARG 7 -7.118 -11.330 0.259 47 HE ARG 7 HE ARG 7 -9.396 -11.542 -1.402 48 HH11 ARG 7 HH11 ARG 7 -7.409 -13.405 0.766 49 HH12 ARG 7 HH12 ARG 7 -8.687 -14.481 1.222 50 HH21 ARG 7 HH21 ARG 7 -11.088 -12.952 -0.809 51 HH22 ARG 7 HH22 ARG 7 -10.780 -14.223 0.325 52 H THR 8 H THR 8 -4.959 -5.730 -1.289 53 HA THR 8 HA THR 8 -2.275 -6.065 -2.111 54 HB THR 8 HB THR 8 -1.904 -3.792 -1.224 55 HG1 THR 8 HG1 THR 8 -3.283 -2.902 0.143 56 HG21 THR 8 HG21 THR 8 -3.512 -2.630 -2.651 57 HG22 THR 8 HG22 THR 8 -4.514 -4.080 -2.718 58 HG23 THR 8 HG23 THR 8 -2.908 -4.083 -3.445 59 H ASP 9 H ASP 9 -0.822 -7.231 -1.041 60 HA ASP 9 HA ASP 9 0.273 -8.280 0.678 61 HB2 ASP 9 HB2 ASP 9 1.097 -5.852 0.639 62 HB3 ASP 9 HB3 ASP 9 0.088 -5.609 2.062 63 H LEU 10 H LEU 10 -1.583 -9.605 1.222 64 HA LEU 10 HA LEU 10 -2.807 -8.846 3.793 65 HB2 LEU 10 HB2 LEU 10 -4.064 -9.502 1.421 66 HB3 LEU 10 HB3 LEU 10 -4.136 -10.995 2.355 67 HG LEU 10 HG LEU 10 -4.966 -9.115 4.174 68 HD11 LEU 10 HD11 LEU 10 -6.831 -7.980 2.802 69 HD12 LEU 10 HD12 LEU 10 -5.777 -8.272 1.419 70 HD13 LEU 10 HD13 LEU 10 -5.209 -7.287 2.767 71 HD21 LEU 10 HD21 LEU 10 -6.195 -11.187 2.486 72 HD22 LEU 10 HD22 LEU 10 -7.313 -10.002 3.163 73 HD23 LEU 10 HD23 LEU 10 -6.274 -10.946 4.232 74 H GLY 11 H GLY 11 -3.780 -11.151 4.711 75 HA2 GLY 11 HA2 GLY 11 -1.618 -12.446 5.867 76 HA3 GLY 11 HA3 GLY 11 -3.240 -13.116 5.770 77 H THR 12 H THR 12 -3.808 -14.163 3.663 78 HA THR 12 HA THR 12 -1.946 -16.185 3.064 79 HB THR 12 HB THR 12 -3.545 -16.484 0.991 80 HG1 THR 12 HG1 THR 12 -5.474 -15.431 1.196 81 HG21 THR 12 HG21 THR 12 -5.049 -16.896 3.494 82 HG22 THR 12 HG22 THR 12 -3.426 -17.584 3.458 83 HG23 THR 12 HG23 THR 12 -4.608 -18.046 2.233 84 H LEU 13 H LEU 13 -2.876 -13.253 1.302 85 HA LEU 13 HA LEU 13 -1.250 -13.755 -0.965 86 HB2 LEU 13 HB2 LEU 13 -3.133 -12.220 -1.037 87 HB3 LEU 13 HB3 LEU 13 -2.339 -11.165 0.130 88 HG LEU 13 HG LEU 13 -2.326 -10.546 -2.391 89 HD11 LEU 13 HD11 LEU 13 -0.408 -10.191 -0.253 90 HD12 LEU 13 HD12 LEU 13 -1.021 -9.026 -1.426 91 HD13 LEU 13 HD13 LEU 13 0.345 -10.061 -1.843 92 HD21 LEU 13 HD21 LEU 13 -0.248 -12.709 -2.239 93 HD22 LEU 13 HD22 LEU 13 -0.175 -11.421 -3.442 94 HD23 LEU 13 HD23 LEU 13 -1.557 -12.517 -3.405 95 H LEU 14 H LEU 14 -0.435 -13.003 2.183 96 HA LEU 14 HA LEU 14 1.564 -11.160 2.154 97 HB2 LEU 14 HB2 LEU 14 0.907 -12.282 4.176 98 HB3 LEU 14 HB3 LEU 14 1.517 -13.820 3.568 99 HG LEU 14 HG LEU 14 3.797 -12.453 3.511 100 HD11 LEU 14 HD11 LEU 14 1.985 -10.885 5.232 101 HD12 LEU 14 HD12 LEU 14 3.411 -10.384 4.324 102 HD13 LEU 14 HD13 LEU 14 3.596 -11.203 5.874 103 HD21 LEU 14 HD21 LEU 14 4.324 -14.013 4.998 104 HD22 LEU 14 HD22 LEU 14 2.607 -14.382 5.163 105 HD23 LEU 14 HD23 LEU 14 3.367 -13.212 6.244 106 H PHE 15 H PHE 15 1.618 -14.338 0.733 107 HA PHE 15 HA PHE 15 3.967 -13.695 -0.779 108 HB2 PHE 15 HB2 PHE 15 4.103 -15.727 1.438 109 HB3 PHE 15 HB3 PHE 15 5.163 -15.828 0.036 110 HD1 PHE 15 HD2 PHE 15 6.182 -13.338 -0.543 111 HD2 PHE 15 HD1 PHE 15 5.086 -14.827 3.290 112 HE1 PHE 15 HE2 PHE 15 7.733 -11.748 0.514 113 HE2 PHE 15 HE1 PHE 15 6.635 -13.239 4.354 114 HZ PHE 15 HZ PHE 15 7.962 -11.697 2.966 115 H ARG 16 H ARG 16 4.701 -15.899 -1.937 116 HA ARG 16 HA ARG 16 4.103 -17.301 -3.636 117 HB2 ARG 16 HB2 ARG 16 3.744 -18.711 -1.608 118 HB3 ARG 16 HB3 ARG 16 2.051 -18.238 -1.625 119 HG2 ARG 16 HG2 ARG 16 2.662 -19.193 -4.207 120 HG3 ARG 16 HG3 ARG 16 3.341 -20.339 -3.048 121 HD2 ARG 16 HD2 ARG 16 0.978 -20.003 -1.899 122 HD3 ARG 16 HD3 ARG 16 0.512 -19.580 -3.546 123 HE ARG 16 HE ARG 16 0.761 -21.781 -4.155 124 HH11 ARG 16 HH11 ARG 16 2.159 -21.273 -1.007 125 HH12 ARG 16 HH12 ARG 16 2.391 -22.962 -0.694 126 HH21 ARG 16 HH21 ARG 16 1.061 -24.006 -3.754 127 HH22 ARG 16 HH22 ARG 16 1.766 -24.515 -2.258 128 H CYS 17 H CYS 17 2.651 -14.699 -3.394 129 HA CYS 17 HA CYS 17 0.224 -14.181 -3.828 130 HB2 CYS 17 HB2 CYS 17 0.606 -13.218 -6.128 131 HB3 CYS 17 HB3 CYS 17 1.786 -12.736 -4.913 132 H ARG 18 H ARG 18 -1.380 -15.637 -3.983 133 HA ARG 18 HA ARG 18 -1.391 -17.956 -5.532 134 HB2 ARG 18 HB2 ARG 18 -4.035 -17.414 -5.355 135 HB3 ARG 18 HB3 ARG 18 -3.090 -18.112 -4.047 136 HG2 ARG 18 HG2 ARG 18 -3.119 -15.171 -4.175 137 HG3 ARG 18 HG3 ARG 18 -4.653 -15.947 -3.777 138 HD2 ARG 18 HD2 ARG 18 -2.025 -16.166 -2.330 139 HD3 ARG 18 HD3 ARG 18 -3.552 -15.528 -1.721 140 HE ARG 18 HE ARG 18 -4.231 -18.044 -2.242 141 HH11 ARG 18 HH11 ARG 18 -1.422 -16.745 -0.648 142 HH12 ARG 18 HH12 ARG 18 -1.202 -18.126 0.375 143 HH21 ARG 18 HH21 ARG 18 -3.952 -19.868 -0.901 144 HH22 ARG 18 HH22 ARG 18 -2.642 -19.902 0.229 145 H ARG 19 H ARG 19 -1.740 -14.705 -6.480 146 HA ARG 19 HA ARG 19 -1.628 -15.095 -9.178 147 HB2 ARG 19 HB2 ARG 19 -3.716 -16.308 -9.105 148 HB3 ARG 19 HB3 ARG 19 -4.495 -14.996 -8.230 149 HG2 ARG 19 HG2 ARG 19 -4.942 -13.866 -10.099 150 HG3 ARG 19 HG3 ARG 19 -3.335 -14.159 -10.769 151 HD2 ARG 19 HD2 ARG 19 -4.099 -16.501 -11.283 152 HD3 ARG 19 HD3 ARG 19 -5.727 -15.986 -10.843 153 HE ARG 19 HE ARG 19 -5.883 -14.882 -12.843 154 HH11 ARG 19 HH11 ARG 19 -2.550 -15.682 -12.233 155 HH12 ARG 19 HH12 ARG 19 -2.011 -15.200 -13.807 156 HH21 ARG 19 HH21 ARG 19 -5.185 -14.245 -14.919 157 HH22 ARG 19 HH22 ARG 19 -3.510 -14.382 -15.334 158 H ASP 20 H ASP 20 -1.712 -13.167 -10.354 159 HA ASP 20 HA ASP 20 -1.091 -10.828 -9.050 160 HB2 ASP 20 HB2 ASP 20 -0.956 -11.483 -11.581 161 HB3 ASP 20 HB3 ASP 20 -2.534 -10.705 -11.675 162 H SER 21 H SER 21 -4.175 -12.252 -9.467 163 HA SER 21 HA SER 21 -5.875 -10.050 -9.443 164 HB2 SER 21 HB2 SER 21 -6.623 -12.388 -9.782 165 HB3 SER 21 HB3 SER 21 -6.326 -12.714 -8.075 166 HG SER 21 HG SER 21 -8.354 -11.231 -9.285 167 H ASP 22 H ASP 22 -3.984 -11.464 -6.890 168 HA ASP 22 HA ASP 22 -5.365 -10.098 -4.765 169 HB2 ASP 22 HB2 ASP 22 -2.619 -11.087 -4.287 170 HB3 ASP 22 HB3 ASP 22 -4.089 -11.338 -3.350 171 H CYS 23 H CYS 23 -3.495 -8.961 -7.159 172 HA CYS 23 HA CYS 23 -2.396 -6.809 -5.473 173 HB2 CYS 23 HB2 CYS 23 -1.076 -7.315 -8.070 174 HB3 CYS 23 HB3 CYS 23 -0.376 -6.871 -6.517 175 HA PRO 24 HA PRO 24 -5.398 -4.890 -8.364 176 HB2 PRO 24 HB2 PRO 24 -6.158 -2.957 -6.616 177 HB3 PRO 24 HB3 PRO 24 -6.860 -4.579 -6.619 178 HG2 PRO 24 HG2 PRO 24 -4.722 -3.445 -4.858 179 HG3 PRO 24 HG3 PRO 24 -6.102 -4.470 -4.424 180 HD2 PRO 24 HD2 PRO 24 -3.596 -5.451 -4.726 181 HD3 PRO 24 HD3 PRO 24 -5.046 -6.400 -5.113 182 H GLY 25 H GLY 25 -3.357 -3.036 -6.086 183 HA2 GLY 25 HA2 GLY 25 -3.048 -0.835 -7.873 184 HA3 GLY 25 HA3 GLY 25 -2.135 -1.109 -6.396 185 H ALA 26 H ALA 26 -0.272 -0.325 -7.529 186 HA ALA 26 HA ALA 26 0.789 -1.292 -9.881 187 HB1 ALA 26 HB1 ALA 26 1.675 0.616 -8.556 188 HB2 ALA 26 HB2 ALA 26 2.402 -0.548 -7.447 189 HB3 ALA 26 HB3 ALA 26 2.922 -0.492 -9.131 190 H CYS 27 H CYS 27 0.993 -2.677 -6.642 191 HA CYS 27 HA CYS 27 2.910 -4.612 -6.975 192 HB2 CYS 27 HB2 CYS 27 1.474 -5.987 -5.354 193 HB3 CYS 27 HB3 CYS 27 1.993 -4.392 -4.818 194 H ILE 28 H ILE 28 2.915 -6.782 -7.628 195 HA ILE 28 HA ILE 28 0.596 -7.907 -8.933 196 HB ILE 28 HB ILE 28 1.818 -8.321 -11.076 197 HG12 ILE 28 HG12 ILE 28 3.677 -6.176 -10.025 198 HG13 ILE 28 HG13 ILE 28 4.093 -7.878 -10.201 199 HG21 ILE 28 HG21 ILE 28 0.136 -6.425 -10.566 200 HG22 ILE 28 HG22 ILE 28 1.545 -5.370 -10.668 201 HG23 ILE 28 HG23 ILE 28 1.078 -6.354 -12.055 202 HD11 ILE 28 HD11 ILE 28 4.762 -7.463 -12.262 203 HD12 ILE 28 HD12 ILE 28 3.111 -7.014 -12.693 204 HD13 ILE 28 HD13 ILE 28 4.238 -5.785 -12.121 205 H CYS 29 H CYS 29 0.741 -10.131 -9.248 206 HA CYS 29 HA CYS 29 2.600 -11.484 -7.555 207 HB2 CYS 29 HB2 CYS 29 0.434 -12.430 -7.668 208 HB3 CYS 29 HB3 CYS 29 0.433 -12.417 -9.429 209 H ARG 30 H ARG 30 4.678 -11.494 -8.204 210 HA ARG 30 HA ARG 30 5.253 -12.385 -10.951 211 HB2 ARG 30 HB2 ARG 30 7.378 -11.240 -10.785 212 HB3 ARG 30 HB3 ARG 30 6.083 -10.122 -10.376 213 HG2 ARG 30 HG2 ARG 30 7.299 -11.567 -8.114 214 HG3 ARG 30 HG3 ARG 30 8.330 -10.396 -8.938 215 HD2 ARG 30 HD2 ARG 30 5.602 -9.863 -7.767 216 HD3 ARG 30 HD3 ARG 30 7.146 -9.355 -7.084 217 HE ARG 30 HE ARG 30 5.687 -8.053 -9.146 218 HH11 ARG 30 HH11 ARG 30 8.916 -8.764 -8.057 219 HH12 ARG 30 HH12 ARG 30 9.618 -7.373 -8.814 220 HH21 ARG 30 HH21 ARG 30 6.599 -6.218 -10.147 221 HH22 ARG 30 HH22 ARG 30 8.299 -5.924 -10.001 222 H GLY 31 H GLY 31 7.604 -13.396 -10.997 223 HA2 GLY 31 HA2 GLY 31 7.451 -15.890 -9.759 224 HA3 GLY 31 HA3 GLY 31 8.906 -15.210 -10.471 225 H ASN 32 H ASN 32 8.584 -12.893 -8.500 226 HA ASN 32 HA ASN 32 10.473 -13.672 -6.638 227 HB2 ASN 32 HB2 ASN 32 10.316 -11.546 -5.895 228 HB3 ASN 32 HB3 ASN 32 9.202 -11.325 -7.241 229 HD21 ASN 32 HD21 ASN 32 9.430 -12.010 -3.811 230 HD22 ASN 32 HD22 ASN 32 7.843 -11.462 -3.404 231 H GLY 33 H GLY 33 7.164 -14.476 -6.761 232 HA2 GLY 33 HA2 GLY 33 6.135 -16.111 -5.430 233 HA3 GLY 33 HA3 GLY 33 7.411 -15.913 -4.238 234 H TYR 34 H TYR 34 5.510 -13.299 -5.629 235 HA TYR 34 HA TYR 34 3.517 -13.074 -3.712 236 HB2 TYR 34 HB2 TYR 34 5.111 -12.770 -1.987 237 HB3 TYR 34 HB3 TYR 34 6.090 -11.688 -2.973 238 HD1 TYR 34 HD2 TYR 34 2.942 -11.971 -1.061 239 HD2 TYR 34 HD1 TYR 34 5.637 -9.353 -3.059 240 HE1 TYR 34 HE2 TYR 34 1.782 -10.037 -0.079 241 HE2 TYR 34 HE1 TYR 34 4.485 -7.412 -2.081 242 HH TYR 34 HH TYR 34 3.051 -6.820 -0.315 243 H CYS 35 H CYS 35 2.509 -10.886 -3.677 244 HA CYS 35 HA CYS 35 2.389 -9.838 -6.320 245 HB2 CYS 35 HB2 CYS 35 1.015 -9.339 -3.743 246 HB3 CYS 35 HB3 CYS 35 1.025 -8.002 -4.889 247 H GLY 36 H GLY 36 4.840 -9.414 -6.220 248 HA2 GLY 36 HA2 GLY 36 5.669 -7.040 -4.816 249 HA3 GLY 36 HA3 GLY 36 6.624 -7.958 -5.971 Start of MODEL 2 1 H1 GLY 1 H GLY 1 -1.640 -1.306 -0.154 2 HA2 GLY 1 HA2 GLY 1 -2.331 0.684 -1.136 3 HA3 GLY 1 HA3 GLY 1 -0.850 1.244 -0.374 4 H CYS 2 H CYS 2 -1.681 -0.659 -3.277 5 HA CYS 2 HA CYS 2 0.307 0.909 -4.765 6 HB2 CYS 2 HB2 CYS 2 -1.025 -1.568 -5.819 7 HB3 CYS 2 HB3 CYS 2 0.551 -0.897 -6.230 8 H ILE 3 H ILE 3 -2.148 2.133 -4.183 9 HA ILE 3 HA ILE 3 -3.753 3.388 -5.197 10 HB ILE 3 HB ILE 3 -2.576 2.500 -7.828 11 HG12 ILE 3 HG12 ILE 3 -1.561 5.006 -7.308 12 HG13 ILE 3 HG13 ILE 3 -1.490 4.234 -5.728 13 HG21 ILE 3 HG21 ILE 3 -4.432 4.662 -6.957 14 HG22 ILE 3 HG22 ILE 3 -3.363 4.950 -8.329 15 HG23 ILE 3 HG23 ILE 3 -4.510 3.611 -8.371 16 HD11 ILE 3 HD11 ILE 3 0.431 4.055 -7.617 17 HD12 ILE 3 HD12 ILE 3 0.173 2.868 -6.338 18 HD13 ILE 3 HD13 ILE 3 -0.500 2.594 -7.944 19 H LEU 4 H LEU 4 -5.740 2.611 -4.958 20 HA LEU 4 HA LEU 4 -7.673 1.473 -5.337 21 HB2 LEU 4 HB2 LEU 4 -6.383 1.646 -7.889 22 HB3 LEU 4 HB3 LEU 4 -7.209 0.096 -7.751 23 HG LEU 4 HG LEU 4 -8.585 1.827 -8.837 24 HD11 LEU 4 HD11 LEU 4 -9.336 0.332 -6.434 25 HD12 LEU 4 HD12 LEU 4 -10.099 0.392 -8.023 26 HD13 LEU 4 HD13 LEU 4 -10.426 1.659 -6.840 27 HD21 LEU 4 HD21 LEU 4 -9.450 3.691 -7.555 28 HD22 LEU 4 HD22 LEU 4 -7.689 3.761 -7.609 29 HD23 LEU 4 HD23 LEU 4 -8.505 3.196 -6.150 30 H ASN 5 H ASN 5 -7.447 -0.001 -3.680 31 HA ASN 5 HA ASN 5 -7.411 -2.715 -4.339 32 HB2 ASN 5 HB2 ASN 5 -5.275 -3.355 -3.136 33 HB3 ASN 5 HB3 ASN 5 -5.058 -2.586 -4.706 34 HD21 ASN 5 HD21 ASN 5 -4.255 -0.489 -4.809 35 HD22 ASN 5 HD22 ASN 5 -3.451 0.250 -3.469 36 H GLY 6 H GLY 6 -6.921 -4.060 -2.169 37 HA2 GLY 6 HA2 GLY 6 -7.472 -2.731 0.291 38 HA3 GLY 6 HA3 GLY 6 -8.931 -3.452 -0.372 39 H ARG 7 H ARG 7 -7.553 -5.707 -1.576 40 HA ARG 7 HA ARG 7 -7.359 -7.346 0.811 41 HB2 ARG 7 HB2 ARG 7 -7.738 -7.840 -2.096 42 HB3 ARG 7 HB3 ARG 7 -6.980 -9.118 -1.156 43 HG2 ARG 7 HG2 ARG 7 -9.072 -8.571 0.433 44 HG3 ARG 7 HG3 ARG 7 -9.758 -8.141 -1.135 45 HD2 ARG 7 HD2 ARG 7 -8.281 -10.716 -0.841 46 HD3 ARG 7 HD3 ARG 7 -9.928 -10.593 -0.224 47 HE ARG 7 HE ARG 7 -9.794 -9.624 -2.878 48 HH11 ARG 7 HH11 ARG 7 -9.737 -12.576 -1.034 49 HH12 ARG 7 HH12 ARG 7 -10.387 -13.544 -2.316 50 HH21 ARG 7 HH21 ARG 7 -10.650 -10.887 -4.574 51 HH22 ARG 7 HH22 ARG 7 -10.905 -12.582 -4.330 52 H THR 8 H THR 8 -5.251 -5.650 -1.173 53 HA THR 8 HA THR 8 -3.041 -7.198 -1.573 54 HB THR 8 HB THR 8 -1.660 -5.151 -1.242 55 HG1 THR 8 HG1 THR 8 -4.153 -4.041 -0.411 56 HG21 THR 8 HG21 THR 8 -4.038 -5.333 -2.973 57 HG22 THR 8 HG22 THR 8 -2.347 -5.057 -3.393 58 HG23 THR 8 HG23 THR 8 -3.341 -3.721 -2.813 59 H ASP 9 H ASP 9 -1.349 -7.976 -0.392 60 HA ASP 9 HA ASP 9 -0.268 -8.826 1.422 61 HB2 ASP 9 HB2 ASP 9 0.368 -6.451 1.668 62 HB3 ASP 9 HB3 ASP 9 -1.056 -6.185 2.671 63 H LEU 10 H LEU 10 -1.638 -10.537 1.887 64 HA LEU 10 HA LEU 10 -3.388 -10.115 4.212 65 HB2 LEU 10 HB2 LEU 10 -4.363 -10.612 1.735 66 HB3 LEU 10 HB3 LEU 10 -4.170 -12.253 2.347 67 HG LEU 10 HG LEU 10 -5.471 -11.007 4.413 68 HD11 LEU 10 HD11 LEU 10 -6.784 -10.029 1.891 69 HD12 LEU 10 HD12 LEU 10 -5.735 -9.018 2.885 70 HD13 LEU 10 HD13 LEU 10 -7.227 -9.673 3.560 71 HD21 LEU 10 HD21 LEU 10 -6.785 -12.407 2.089 72 HD22 LEU 10 HD22 LEU 10 -7.367 -12.317 3.752 73 HD23 LEU 10 HD23 LEU 10 -5.903 -13.228 3.377 74 H GLY 11 H GLY 11 -4.111 -12.565 4.894 75 HA2 GLY 11 HA2 GLY 11 -1.985 -13.672 6.230 76 HA3 GLY 11 HA3 GLY 11 -3.430 -14.570 5.793 77 H THR 12 H THR 12 -3.434 -15.842 3.911 78 HA THR 12 HA THR 12 -0.999 -17.130 3.335 79 HB THR 12 HB THR 12 -2.303 -18.162 1.407 80 HG1 THR 12 HG1 THR 12 -3.819 -16.466 1.134 81 HG21 THR 12 HG21 THR 12 -3.323 -18.285 4.241 82 HG22 THR 12 HG22 THR 12 -2.167 -19.363 3.457 83 HG23 THR 12 HG23 THR 12 -3.863 -19.384 2.972 84 H LEU 13 H LEU 13 -2.714 -14.513 1.759 85 HA LEU 13 HA LEU 13 -1.279 -14.536 -0.677 86 HB2 LEU 13 HB2 LEU 13 -3.469 -13.323 -0.043 87 HB3 LEU 13 HB3 LEU 13 -2.408 -12.051 0.559 88 HG LEU 13 HG LEU 13 -2.189 -13.038 -2.265 89 HD11 LEU 13 HD11 LEU 13 -3.613 -10.808 -2.594 90 HD12 LEU 13 HD12 LEU 13 -4.304 -11.352 -1.065 91 HD13 LEU 13 HD13 LEU 13 -4.353 -12.405 -2.479 92 HD21 LEU 13 HD21 LEU 13 -0.523 -11.567 -2.241 93 HD22 LEU 13 HD22 LEU 13 -0.970 -10.993 -0.634 94 HD23 LEU 13 HD23 LEU 13 -1.735 -10.297 -2.064 95 H LEU 14 H LEU 14 -0.352 -13.690 2.463 96 HA LEU 14 HA LEU 14 1.316 -11.551 2.289 97 HB2 LEU 14 HB2 LEU 14 0.958 -12.821 4.336 98 HB3 LEU 14 HB3 LEU 14 1.892 -14.164 3.680 99 HG LEU 14 HG LEU 14 3.789 -12.336 3.547 100 HD11 LEU 14 HD11 LEU 14 3.563 -10.928 5.676 101 HD12 LEU 14 HD12 LEU 14 1.834 -11.242 5.539 102 HD13 LEU 14 HD13 LEU 14 2.683 -10.404 4.240 103 HD21 LEU 14 HD21 LEU 14 3.810 -14.442 4.846 104 HD22 LEU 14 HD22 LEU 14 2.980 -13.607 6.160 105 HD23 LEU 14 HD23 LEU 14 4.602 -13.105 5.681 106 H PHE 15 H PHE 15 1.796 -14.709 0.888 107 HA PHE 15 HA PHE 15 3.915 -13.697 -0.775 108 HB2 PHE 15 HB2 PHE 15 4.476 -15.812 1.307 109 HB3 PHE 15 HB3 PHE 15 5.498 -15.560 -0.105 110 HD1 PHE 15 HD2 PHE 15 6.193 -12.999 -0.447 111 HD2 PHE 15 HD1 PHE 15 5.112 -14.799 3.256 112 HE1 PHE 15 HE2 PHE 15 7.430 -11.249 0.761 113 HE2 PHE 15 HE1 PHE 15 6.346 -13.051 4.470 114 HZ PHE 15 HZ PHE 15 7.508 -11.274 3.223 115 H ARG 16 H ARG 16 4.897 -15.813 -1.975 116 HA ARG 16 HA ARG 16 4.450 -17.343 -3.601 117 HB2 ARG 16 HB2 ARG 16 4.075 -18.727 -1.563 118 HB3 ARG 16 HB3 ARG 16 2.365 -18.324 -1.645 119 HG2 ARG 16 HG2 ARG 16 2.063 -19.539 -3.633 120 HG3 ARG 16 HG3 ARG 16 3.801 -19.656 -3.917 121 HD2 ARG 16 HD2 ARG 16 3.461 -20.802 -1.424 122 HD3 ARG 16 HD3 ARG 16 2.052 -21.350 -2.332 123 HE ARG 16 HE ARG 16 4.296 -21.712 -3.944 124 HH11 ARG 16 HH11 ARG 16 2.990 -22.926 -0.955 125 HH12 ARG 16 HH12 ARG 16 3.732 -24.484 -1.111 126 HH21 ARG 16 HH21 ARG 16 5.279 -23.759 -4.162 127 HH22 ARG 16 HH22 ARG 16 5.035 -24.956 -2.936 128 H CYS 17 H CYS 17 2.754 -14.814 -3.320 129 HA CYS 17 HA CYS 17 0.341 -14.477 -3.909 130 HB2 CYS 17 HB2 CYS 17 0.778 -13.427 -6.166 131 HB3 CYS 17 HB3 CYS 17 1.824 -12.873 -4.863 132 H ARG 18 H ARG 18 -1.154 -16.011 -4.226 133 HA ARG 18 HA ARG 18 -0.880 -18.290 -5.822 134 HB2 ARG 18 HB2 ARG 18 -3.635 -17.478 -5.687 135 HB3 ARG 18 HB3 ARG 18 -2.830 -18.811 -4.870 136 HG2 ARG 18 HG2 ARG 18 -2.792 -15.974 -3.872 137 HG3 ARG 18 HG3 ARG 18 -3.972 -17.184 -3.364 138 HD2 ARG 18 HD2 ARG 18 -1.275 -16.767 -2.458 139 HD3 ARG 18 HD3 ARG 18 -2.529 -17.813 -1.793 140 HE ARG 18 HE ARG 18 -0.415 -18.572 -3.643 141 HH11 ARG 18 HH11 ARG 18 -3.347 -19.442 -1.978 142 HH12 ARG 18 HH12 ARG 18 -3.115 -21.146 -2.188 143 HH21 ARG 18 HH21 ARG 18 -0.099 -20.813 -3.925 144 HH22 ARG 18 HH22 ARG 18 -1.266 -21.925 -3.295 145 H ARG 19 H ARG 19 -1.490 -15.041 -6.686 146 HA ARG 19 HA ARG 19 -1.185 -15.353 -9.395 147 HB2 ARG 19 HB2 ARG 19 -3.234 -16.705 -9.351 148 HB3 ARG 19 HB3 ARG 19 -4.112 -15.359 -8.639 149 HG2 ARG 19 HG2 ARG 19 -4.197 -14.191 -10.600 150 HG3 ARG 19 HG3 ARG 19 -2.721 -14.927 -11.229 151 HD2 ARG 19 HD2 ARG 19 -4.026 -17.091 -11.375 152 HD3 ARG 19 HD3 ARG 19 -5.472 -16.133 -11.058 153 HE ARG 19 HE ARG 19 -4.220 -14.894 -13.166 154 HH11 ARG 19 HH11 ARG 19 -5.501 -18.065 -12.516 155 HH12 ARG 19 HH12 ARG 19 -5.912 -18.381 -14.169 156 HH21 ARG 19 HH21 ARG 19 -4.755 -15.298 -15.346 157 HH22 ARG 19 HH22 ARG 19 -5.486 -16.807 -15.778 158 H ASP 20 H ASP 20 -1.693 -13.414 -10.631 159 HA ASP 20 HA ASP 20 -1.032 -11.063 -9.390 160 HB2 ASP 20 HB2 ASP 20 -2.871 -11.176 -11.781 161 HB3 ASP 20 HB3 ASP 20 -1.703 -9.921 -11.376 162 H SER 21 H SER 21 -4.233 -12.456 -9.810 163 HA SER 21 HA SER 21 -5.869 -10.342 -9.184 164 HB2 SER 21 HB2 SER 21 -6.724 -12.552 -9.815 165 HB3 SER 21 HB3 SER 21 -6.182 -13.214 -8.273 166 HG SER 21 HG SER 21 -8.307 -11.465 -8.817 167 H ASP 22 H ASP 22 -3.693 -12.058 -7.111 168 HA ASP 22 HA ASP 22 -4.660 -11.695 -4.591 169 HB2 ASP 22 HB2 ASP 22 -1.856 -11.438 -5.658 170 HB3 ASP 22 HB3 ASP 22 -2.204 -11.275 -3.939 171 H CYS 23 H CYS 23 -2.891 -9.272 -6.501 172 HA CYS 23 HA CYS 23 -4.009 -7.200 -4.729 173 HB2 CYS 23 HB2 CYS 23 -1.275 -7.254 -6.023 174 HB3 CYS 23 HB3 CYS 23 -1.947 -5.874 -5.161 175 HA PRO 24 HA PRO 24 -5.785 -5.943 -8.637 176 HB2 PRO 24 HB2 PRO 24 -7.278 -3.929 -7.595 177 HB3 PRO 24 HB3 PRO 24 -7.746 -5.630 -7.482 178 HG2 PRO 24 HG2 PRO 24 -6.418 -3.890 -5.439 179 HG3 PRO 24 HG3 PRO 24 -7.732 -5.062 -5.227 180 HD2 PRO 24 HD2 PRO 24 -5.160 -5.628 -4.599 181 HD3 PRO 24 HD3 PRO 24 -6.291 -6.861 -5.192 182 H GLY 25 H GLY 25 -4.326 -3.745 -6.271 183 HA2 GLY 25 HA2 GLY 25 -4.087 -1.476 -7.884 184 HA3 GLY 25 HA3 GLY 25 -3.029 -1.871 -6.537 185 H ALA 26 H ALA 26 -1.535 -0.695 -8.088 186 HA ALA 26 HA ALA 26 -0.662 -1.665 -10.507 187 HB1 ALA 26 HB1 ALA 26 0.288 0.172 -8.562 188 HB2 ALA 26 HB2 ALA 26 1.641 -0.838 -9.073 189 HB3 ALA 26 HB3 ALA 26 0.710 0.060 -10.271 190 H CYS 27 H CYS 27 0.626 -2.541 -7.298 191 HA CYS 27 HA CYS 27 2.565 -4.330 -7.993 192 HB2 CYS 27 HB2 CYS 27 1.788 -5.595 -5.847 193 HB3 CYS 27 HB3 CYS 27 2.401 -3.951 -5.707 194 H ILE 28 H ILE 28 2.639 -6.639 -8.166 195 HA ILE 28 HA ILE 28 0.181 -8.079 -8.670 196 HB ILE 28 HB ILE 28 1.052 -8.871 -10.930 197 HG12 ILE 28 HG12 ILE 28 2.728 -6.382 -10.565 198 HG13 ILE 28 HG13 ILE 28 3.302 -8.022 -10.848 199 HG21 ILE 28 HG21 ILE 28 0.294 -5.973 -10.973 200 HG22 ILE 28 HG22 ILE 28 -0.201 -7.269 -12.061 201 HG23 ILE 28 HG23 ILE 28 -0.841 -7.203 -10.419 202 HD11 ILE 28 HD11 ILE 28 1.993 -7.845 -13.063 203 HD12 ILE 28 HD12 ILE 28 2.041 -6.108 -12.759 204 HD13 ILE 28 HD13 ILE 28 3.544 -7.019 -12.910 205 H CYS 29 H CYS 29 0.657 -10.397 -9.271 206 HA CYS 29 HA CYS 29 2.572 -11.446 -7.437 207 HB2 CYS 29 HB2 CYS 29 0.615 -12.735 -7.692 208 HB3 CYS 29 HB3 CYS 29 0.710 -12.687 -9.449 209 H ARG 30 H ARG 30 4.633 -11.963 -7.763 210 HA ARG 30 HA ARG 30 5.563 -12.529 -10.483 211 HB2 ARG 30 HB2 ARG 30 7.520 -11.087 -10.189 212 HB3 ARG 30 HB3 ARG 30 6.030 -10.159 -10.095 213 HG2 ARG 30 HG2 ARG 30 7.196 -11.157 -7.558 214 HG3 ARG 30 HG3 ARG 30 8.008 -9.821 -8.377 215 HD2 ARG 30 HD2 ARG 30 5.125 -9.915 -7.497 216 HD3 ARG 30 HD3 ARG 30 6.417 -8.958 -6.772 217 HE ARG 30 HE ARG 30 4.872 -8.274 -9.054 218 HH11 ARG 30 HH11 ARG 30 8.067 -8.020 -7.695 219 HH12 ARG 30 HH12 ARG 30 8.459 -6.569 -8.556 220 HH21 ARG 30 HH21 ARG 30 5.377 -6.363 -10.193 221 HH22 ARG 30 HH22 ARG 30 6.928 -5.626 -9.975 222 H GLY 31 H GLY 31 8.044 -13.154 -10.287 223 HA2 GLY 31 HA2 GLY 31 8.165 -15.568 -8.890 224 HA3 GLY 31 HA3 GLY 31 9.554 -14.716 -9.548 225 H ASN 32 H ASN 32 8.655 -12.376 -7.745 226 HA ASN 32 HA ASN 32 10.507 -12.772 -5.699 227 HB2 ASN 32 HB2 ASN 32 10.045 -10.630 -5.161 228 HB3 ASN 32 HB3 ASN 32 9.028 -10.647 -6.599 229 HD21 ASN 32 HD21 ASN 32 9.055 -11.013 -3.116 230 HD22 ASN 32 HD22 ASN 32 7.384 -10.644 -2.875 231 H GLY 33 H GLY 33 7.440 -14.117 -6.058 232 HA2 GLY 33 HA2 GLY 33 6.429 -15.696 -4.681 233 HA3 GLY 33 HA3 GLY 33 7.587 -15.299 -3.421 234 H TYR 34 H TYR 34 5.484 -13.032 -5.118 235 HA TYR 34 HA TYR 34 3.383 -12.905 -3.308 236 HB2 TYR 34 HB2 TYR 34 4.974 -12.272 -1.605 237 HB3 TYR 34 HB3 TYR 34 5.654 -11.023 -2.642 238 HD1 TYR 34 HD2 TYR 34 2.413 -12.013 -1.072 239 HD2 TYR 34 HD1 TYR 34 4.927 -8.840 -2.382 240 HE1 TYR 34 HE2 TYR 34 0.834 -10.381 -0.129 241 HE2 TYR 34 HE1 TYR 34 3.355 -7.199 -1.441 242 HH TYR 34 HH TYR 34 1.524 -6.905 -0.198 243 H CYS 35 H CYS 35 2.064 -10.937 -3.557 244 HA CYS 35 HA CYS 35 2.052 -10.083 -6.284 245 HB2 CYS 35 HB2 CYS 35 0.036 -8.876 -5.711 246 HB3 CYS 35 HB3 CYS 35 -0.015 -10.464 -4.951 247 H GLY 36 H GLY 36 4.351 -9.199 -5.961 248 HA2 GLY 36 HA2 GLY 36 4.770 -6.788 -4.552 249 HA3 GLY 36 HA3 GLY 36 5.765 -7.393 -5.869 Start of MODEL 3 1 H1 GLY 1 H GLY 1 -5.700 0.007 -0.303 2 HA2 GLY 1 HA2 GLY 1 -3.389 -0.669 -0.104 3 HA3 GLY 1 HA3 GLY 1 -4.107 -1.654 -1.370 4 H CYS 2 H CYS 2 -3.609 -1.237 -3.534 5 HA CYS 2 HA CYS 2 -1.280 0.527 -3.918 6 HB2 CYS 2 HB2 CYS 2 -1.992 -1.941 -5.514 7 HB3 CYS 2 HB3 CYS 2 -0.527 -0.976 -5.665 8 H ILE 3 H ILE 3 -3.634 1.786 -4.082 9 HA ILE 3 HA ILE 3 -4.823 3.190 -5.423 10 HB ILE 3 HB ILE 3 -3.168 2.309 -7.773 11 HG12 ILE 3 HG12 ILE 3 -2.403 4.295 -5.622 12 HG13 ILE 3 HG13 ILE 3 -1.607 2.760 -5.951 13 HG21 ILE 3 HG21 ILE 3 -3.794 5.134 -7.407 14 HG22 ILE 3 HG22 ILE 3 -4.007 4.099 -8.817 15 HG23 ILE 3 HG23 ILE 3 -5.222 4.108 -7.540 16 HD11 ILE 3 HD11 ILE 3 -1.237 3.762 -8.314 17 HD12 ILE 3 HD12 ILE 3 -1.533 5.300 -7.503 18 HD13 ILE 3 HD13 ILE 3 -0.208 4.264 -6.973 19 H LEU 4 H LEU 4 -5.553 0.377 -5.083 20 HA LEU 4 HA LEU 4 -7.775 0.259 -6.766 21 HB2 LEU 4 HB2 LEU 4 -5.568 -0.394 -8.199 22 HB3 LEU 4 HB3 LEU 4 -6.061 -1.979 -7.604 23 HG LEU 4 HG LEU 4 -8.201 -0.358 -8.821 24 HD11 LEU 4 HD11 LEU 4 -5.913 -0.140 -10.162 25 HD12 LEU 4 HD12 LEU 4 -7.473 -0.309 -10.967 26 HD13 LEU 4 HD13 LEU 4 -6.429 -1.716 -10.765 27 HD21 LEU 4 HD21 LEU 4 -7.680 -3.033 -9.829 28 HD22 LEU 4 HD22 LEU 4 -9.131 -2.368 -9.079 29 HD23 LEU 4 HD23 LEU 4 -7.821 -2.985 -8.071 30 H ASN 5 H ASN 5 -8.009 -0.046 -4.286 31 HA ASN 5 HA ASN 5 -9.085 -1.481 -2.827 32 HB2 ASN 5 HB2 ASN 5 -9.197 -3.021 -4.994 33 HB3 ASN 5 HB3 ASN 5 -7.976 -3.934 -4.112 34 HD21 ASN 5 HD21 ASN 5 -9.875 -5.481 -4.383 35 HD22 ASN 5 HD22 ASN 5 -10.997 -5.536 -3.070 36 H GLY 6 H GLY 6 -8.358 -3.281 -1.231 37 HA2 GLY 6 HA2 GLY 6 -5.467 -2.933 -0.721 38 HA3 GLY 6 HA3 GLY 6 -6.670 -2.878 0.559 39 H ARG 7 H ARG 7 -5.371 -5.006 -1.969 40 HA ARG 7 HA ARG 7 -6.189 -7.330 -0.379 41 HB2 ARG 7 HB2 ARG 7 -5.004 -7.405 -3.147 42 HB3 ARG 7 HB3 ARG 7 -5.963 -8.638 -2.338 43 HG2 ARG 7 HG2 ARG 7 -7.857 -6.915 -2.368 44 HG3 ARG 7 HG3 ARG 7 -6.868 -6.054 -3.550 45 HD2 ARG 7 HD2 ARG 7 -8.004 -7.335 -5.020 46 HD3 ARG 7 HD3 ARG 7 -6.780 -8.530 -4.591 47 HE ARG 7 HE ARG 7 -8.802 -8.878 -2.769 48 HH11 ARG 7 HH11 ARG 7 -8.515 -8.961 -6.238 49 HH12 ARG 7 HH12 ARG 7 -9.782 -10.125 -6.445 50 HH21 ARG 7 HH21 ARG 7 -10.472 -10.410 -3.030 51 HH22 ARG 7 HH22 ARG 7 -10.895 -10.948 -4.620 52 H THR 8 H THR 8 -3.411 -5.564 -1.464 53 HA THR 8 HA THR 8 -1.387 -7.438 -1.258 54 HB THR 8 HB THR 8 -1.089 -5.086 -2.039 55 HG1 THR 8 HG1 THR 8 0.652 -6.589 -1.147 56 HG21 THR 8 HG21 THR 8 -0.769 -3.302 -0.477 57 HG22 THR 8 HG22 THR 8 -0.908 -4.403 0.894 58 HG23 THR 8 HG23 THR 8 -2.318 -4.059 -0.107 59 H ASP 9 H ASP 9 0.064 -8.001 0.416 60 HA ASP 9 HA ASP 9 0.547 -8.785 2.499 61 HB2 ASP 9 HB2 ASP 9 1.097 -6.474 2.938 62 HB3 ASP 9 HB3 ASP 9 -0.596 -6.083 3.229 63 H LEU 10 H LEU 10 -1.131 -10.425 2.153 64 HA LEU 10 HA LEU 10 -3.244 -10.177 4.178 65 HB2 LEU 10 HB2 LEU 10 -3.709 -10.178 1.449 66 HB3 LEU 10 HB3 LEU 10 -4.011 -11.846 1.929 67 HG LEU 10 HG LEU 10 -5.635 -11.011 3.613 68 HD11 LEU 10 HD11 LEU 10 -5.434 -8.866 4.189 69 HD12 LEU 10 HD12 LEU 10 -6.324 -8.515 2.708 70 HD13 LEU 10 HD13 LEU 10 -4.562 -8.457 2.711 71 HD21 LEU 10 HD21 LEU 10 -7.353 -10.304 1.921 72 HD22 LEU 10 HD22 LEU 10 -6.515 -11.812 1.557 73 HD23 LEU 10 HD23 LEU 10 -6.069 -10.329 0.713 74 H GLY 11 H GLY 11 -4.350 -12.585 4.200 75 HA2 GLY 11 HA2 GLY 11 -2.633 -14.215 5.597 76 HA3 GLY 11 HA3 GLY 11 -4.071 -14.796 4.770 77 H THR 12 H THR 12 -3.887 -15.751 2.739 78 HA THR 12 HA THR 12 -1.484 -17.166 2.271 79 HB THR 12 HB THR 12 -2.550 -18.049 0.282 80 HG1 THR 12 HG1 THR 12 -4.782 -17.119 -0.113 81 HG21 THR 12 HG21 THR 12 -4.950 -17.888 1.972 82 HG22 THR 12 HG22 THR 12 -3.482 -18.378 2.816 83 HG23 THR 12 HG23 THR 12 -4.045 -19.296 1.420 84 H LEU 13 H LEU 13 -2.732 -14.148 1.077 85 HA LEU 13 HA LEU 13 -1.059 -13.944 -1.214 86 HB2 LEU 13 HB2 LEU 13 -3.097 -12.645 -1.009 87 HB3 LEU 13 HB3 LEU 13 -2.454 -11.821 0.410 88 HG LEU 13 HG LEU 13 -2.468 -10.621 -1.896 89 HD11 LEU 13 HD11 LEU 13 -1.420 -9.267 -0.463 90 HD12 LEU 13 HD12 LEU 13 0.070 -9.910 -1.154 91 HD13 LEU 13 HD13 LEU 13 -0.584 -10.601 0.331 92 HD21 LEU 13 HD21 LEU 13 -0.947 -11.184 -3.463 93 HD22 LEU 13 HD22 LEU 13 -1.083 -12.777 -2.719 94 HD23 LEU 13 HD23 LEU 13 0.247 -11.706 -2.274 95 H LEU 14 H LEU 14 -0.482 -13.626 2.121 96 HA LEU 14 HA LEU 14 1.390 -11.671 2.424 97 HB2 LEU 14 HB2 LEU 14 0.846 -12.856 4.345 98 HB3 LEU 14 HB3 LEU 14 1.168 -14.416 3.591 99 HG LEU 14 HG LEU 14 3.555 -14.033 3.739 100 HD11 LEU 14 HD11 LEU 14 4.364 -11.972 3.790 101 HD12 LEU 14 HD12 LEU 14 3.742 -11.792 5.430 102 HD13 LEU 14 HD13 LEU 14 2.751 -11.309 4.054 103 HD21 LEU 14 HD21 LEU 14 3.703 -14.627 5.912 104 HD22 LEU 14 HD22 LEU 14 1.944 -14.676 5.792 105 HD23 LEU 14 HD23 LEU 14 2.743 -13.255 6.467 106 H PHE 15 H PHE 15 1.758 -14.708 0.740 107 HA PHE 15 HA PHE 15 4.102 -13.778 -0.602 108 HB2 PHE 15 HB2 PHE 15 4.355 -15.707 1.655 109 HB3 PHE 15 HB3 PHE 15 5.342 -15.986 0.224 110 HD1 PHE 15 HD2 PHE 15 6.434 -13.653 -0.672 111 HD2 PHE 15 HD1 PHE 15 5.391 -14.582 3.349 112 HE1 PHE 15 HE2 PHE 15 8.066 -11.996 0.131 113 HE2 PHE 15 HE1 PHE 15 7.020 -12.926 4.158 114 HZ PHE 15 HZ PHE 15 8.361 -11.631 2.548 115 H ARG 16 H ARG 16 5.104 -15.824 -1.832 116 HA ARG 16 HA ARG 16 4.715 -17.181 -3.628 117 HB2 ARG 16 HB2 ARG 16 4.477 -18.731 -1.683 118 HB3 ARG 16 HB3 ARG 16 2.740 -18.466 -1.737 119 HG2 ARG 16 HG2 ARG 16 3.514 -19.196 -4.339 120 HG3 ARG 16 HG3 ARG 16 4.336 -20.300 -3.234 121 HD2 ARG 16 HD2 ARG 16 1.484 -19.740 -2.683 122 HD3 ARG 16 HD3 ARG 16 1.839 -20.696 -4.122 123 HE ARG 16 HE ARG 16 2.123 -21.515 -1.380 124 HH11 ARG 16 HH11 ARG 16 3.171 -22.050 -4.657 125 HH12 ARG 16 HH12 ARG 16 3.656 -23.689 -4.372 126 HH21 ARG 16 HH21 ARG 16 2.757 -23.671 -0.993 127 HH22 ARG 16 HH22 ARG 16 3.419 -24.611 -2.288 128 H CYS 17 H CYS 17 2.961 -14.785 -3.303 129 HA CYS 17 HA CYS 17 0.495 -14.546 -3.779 130 HB2 CYS 17 HB2 CYS 17 0.812 -13.392 -5.995 131 HB3 CYS 17 HB3 CYS 17 1.901 -12.856 -4.720 132 H ARG 18 H ARG 18 -0.944 -16.128 -4.110 133 HA ARG 18 HA ARG 18 -0.602 -18.333 -5.810 134 HB2 ARG 18 HB2 ARG 18 -3.250 -18.295 -5.634 135 HB3 ARG 18 HB3 ARG 18 -2.240 -18.755 -4.271 136 HG2 ARG 18 HG2 ARG 18 -2.819 -15.885 -4.467 137 HG3 ARG 18 HG3 ARG 18 -4.218 -16.918 -4.166 138 HD2 ARG 18 HD2 ARG 18 -1.710 -16.657 -2.527 139 HD3 ARG 18 HD3 ARG 18 -3.368 -16.298 -2.044 140 HE ARG 18 HE ARG 18 -2.073 -18.835 -1.962 141 HH11 ARG 18 HH11 ARG 18 -5.151 -17.280 -2.433 142 HH12 ARG 18 HH12 ARG 18 -6.071 -18.649 -1.902 143 HH21 ARG 18 HH21 ARG 18 -3.272 -20.645 -1.261 144 HH22 ARG 18 HH22 ARG 18 -5.001 -20.562 -1.235 145 H ARG 19 H ARG 19 -1.312 -15.100 -6.529 146 HA ARG 19 HA ARG 19 -1.145 -15.236 -9.231 147 HB2 ARG 19 HB2 ARG 19 -3.008 -16.739 -9.368 148 HB3 ARG 19 HB3 ARG 19 -3.991 -15.702 -8.343 149 HG2 ARG 19 HG2 ARG 19 -4.637 -14.429 -10.057 150 HG3 ARG 19 HG3 ARG 19 -3.011 -14.362 -10.739 151 HD2 ARG 19 HD2 ARG 19 -3.366 -16.132 -12.104 152 HD3 ARG 19 HD3 ARG 19 -4.398 -16.959 -10.937 153 HE ARG 19 HE ARG 19 -5.233 -15.198 -13.040 154 HH11 ARG 19 HH11 ARG 19 -6.045 -16.464 -9.901 155 HH12 ARG 19 HH12 ARG 19 -7.747 -16.202 -10.091 156 HH21 ARG 19 HH21 ARG 19 -7.472 -14.848 -13.303 157 HH22 ARG 19 HH22 ARG 19 -8.557 -15.284 -12.027 158 H ASP 20 H ASP 20 -1.440 -13.244 -10.223 159 HA ASP 20 HA ASP 20 -1.211 -10.959 -8.743 160 HB2 ASP 20 HB2 ASP 20 -1.743 -9.707 -10.749 161 HB3 ASP 20 HB3 ASP 20 -0.794 -11.126 -11.186 162 H SER 21 H SER 21 -4.098 -12.722 -9.463 163 HA SER 21 HA SER 21 -6.045 -10.758 -9.139 164 HB2 SER 21 HB2 SER 21 -6.655 -12.952 -9.932 165 HB3 SER 21 HB3 SER 21 -6.110 -13.699 -8.431 166 HG SER 21 HG SER 21 -8.477 -12.442 -9.010 167 H ASP 22 H ASP 22 -4.034 -12.345 -6.801 168 HA ASP 22 HA ASP 22 -5.618 -11.612 -4.519 169 HB2 ASP 22 HB2 ASP 22 -3.615 -12.360 -3.224 170 HB3 ASP 22 HB3 ASP 22 -4.223 -13.570 -4.351 171 H CYS 23 H CYS 23 -3.955 -9.770 -6.607 172 HA CYS 23 HA CYS 23 -2.996 -7.903 -4.542 173 HB2 CYS 23 HB2 CYS 23 -1.915 -8.748 -7.102 174 HB3 CYS 23 HB3 CYS 23 -2.069 -6.996 -7.013 175 HA PRO 24 HA PRO 24 -6.218 -5.087 -5.557 176 HB2 PRO 24 HB2 PRO 24 -5.034 -2.760 -4.813 177 HB3 PRO 24 HB3 PRO 24 -5.627 -3.950 -3.649 178 HG2 PRO 24 HG2 PRO 24 -2.837 -3.488 -4.632 179 HG3 PRO 24 HG3 PRO 24 -3.404 -3.802 -2.981 180 HD2 PRO 24 HD2 PRO 24 -2.301 -5.727 -4.533 181 HD3 PRO 24 HD3 PRO 24 -3.562 -6.075 -3.333 182 H GLY 25 H GLY 25 -3.475 -2.966 -6.133 183 HA2 GLY 25 HA2 GLY 25 -4.205 -2.898 -8.997 184 HA3 GLY 25 HA3 GLY 25 -3.863 -1.438 -8.081 185 H ALA 26 H ALA 26 -1.819 -0.718 -7.980 186 HA ALA 26 HA ALA 26 0.150 -1.285 -9.680 187 HB1 ALA 26 HB1 ALA 26 0.003 0.077 -7.211 188 HB2 ALA 26 HB2 ALA 26 1.472 -0.900 -7.183 189 HB3 ALA 26 HB3 ALA 26 1.207 0.256 -8.487 190 H CYS 27 H CYS 27 0.727 -2.489 -6.399 191 HA CYS 27 HA CYS 27 2.574 -4.398 -6.960 192 HB2 CYS 27 HB2 CYS 27 1.517 -5.670 -4.947 193 HB3 CYS 27 HB3 CYS 27 2.200 -4.068 -4.689 194 H ILE 28 H ILE 28 2.632 -6.503 -7.631 195 HA ILE 28 HA ILE 28 0.156 -7.926 -8.172 196 HB ILE 28 HB ILE 28 0.959 -8.461 -10.523 197 HG12 ILE 28 HG12 ILE 28 2.631 -5.993 -10.002 198 HG13 ILE 28 HG13 ILE 28 3.240 -7.614 -10.316 199 HG21 ILE 28 HG21 ILE 28 -0.795 -6.645 -9.629 200 HG22 ILE 28 HG22 ILE 28 0.314 -5.579 -10.490 201 HG23 ILE 28 HG23 ILE 28 -0.470 -6.909 -11.342 202 HD11 ILE 28 HD11 ILE 28 1.870 -7.355 -12.533 203 HD12 ILE 28 HD12 ILE 28 2.055 -5.635 -12.186 204 HD13 ILE 28 HD13 ILE 28 3.481 -6.656 -12.370 205 H CYS 29 H CYS 29 0.554 -10.174 -8.869 206 HA CYS 29 HA CYS 29 2.613 -11.357 -7.289 207 HB2 CYS 29 HB2 CYS 29 0.591 -12.579 -7.444 208 HB3 CYS 29 HB3 CYS 29 0.566 -12.468 -9.201 209 H ARG 30 H ARG 30 4.666 -11.568 -7.852 210 HA ARG 30 HA ARG 30 5.310 -12.072 -10.679 211 HB2 ARG 30 HB2 ARG 30 7.302 -10.673 -10.469 212 HB3 ARG 30 HB3 ARG 30 5.848 -9.742 -10.137 213 HG2 ARG 30 HG2 ARG 30 7.277 -10.972 -7.843 214 HG3 ARG 30 HG3 ARG 30 7.990 -9.556 -8.619 215 HD2 ARG 30 HD2 ARG 30 5.213 -9.756 -7.460 216 HD3 ARG 30 HD3 ARG 30 6.579 -8.894 -6.753 217 HE ARG 30 HE ARG 30 4.840 -7.946 -8.791 218 HH11 ARG 30 HH11 ARG 30 8.143 -7.849 -7.694 219 HH12 ARG 30 HH12 ARG 30 8.472 -6.305 -8.407 220 HH21 ARG 30 HH21 ARG 30 5.261 -5.913 -9.736 221 HH22 ARG 30 HH22 ARG 30 6.831 -5.204 -9.568 222 H GLY 31 H GLY 31 7.784 -12.740 -10.770 223 HA2 GLY 31 HA2 GLY 31 7.995 -15.258 -9.588 224 HA3 GLY 31 HA3 GLY 31 9.333 -14.366 -10.296 225 H ASN 32 H ASN 32 8.674 -12.167 -8.252 226 HA ASN 32 HA ASN 32 10.686 -12.715 -6.427 227 HB2 ASN 32 HB2 ASN 32 10.245 -10.647 -5.637 228 HB3 ASN 32 HB3 ASN 32 9.099 -10.553 -6.971 229 HD21 ASN 32 HD21 ASN 32 9.445 -11.302 -3.560 230 HD22 ASN 32 HD22 ASN 32 7.804 -10.975 -3.131 231 H GLY 33 H GLY 33 7.558 -14.017 -6.572 232 HA2 GLY 33 HA2 GLY 33 6.767 -15.791 -5.265 233 HA3 GLY 33 HA3 GLY 33 8.007 -15.436 -4.072 234 H TYR 34 H TYR 34 5.788 -13.054 -5.386 235 HA TYR 34 HA TYR 34 3.764 -13.161 -3.491 236 HB2 TYR 34 HB2 TYR 34 5.234 -12.716 -1.712 237 HB3 TYR 34 HB3 TYR 34 6.158 -11.547 -2.648 238 HD1 TYR 34 HD2 TYR 34 3.047 -12.099 -0.763 239 HD2 TYR 34 HD1 TYR 34 5.463 -9.254 -2.805 240 HE1 TYR 34 HE2 TYR 34 1.709 -10.276 0.206 241 HE2 TYR 34 HE1 TYR 34 4.133 -7.423 -1.841 242 HH TYR 34 HH TYR 34 2.129 -7.770 0.741 243 H CYS 35 H CYS 35 2.489 -11.118 -3.383 244 HA CYS 35 HA CYS 35 2.291 -9.974 -5.990 245 HB2 CYS 35 HB2 CYS 35 0.280 -10.364 -4.700 246 HB3 CYS 35 HB3 CYS 35 0.864 -9.325 -3.404 247 H GLY 36 H GLY 36 4.579 -9.150 -5.918 248 HA2 GLY 36 HA2 GLY 36 5.294 -6.966 -4.268 249 HA3 GLY 36 HA3 GLY 36 6.075 -7.412 -5.778 Start of MODEL 4 1 H1 GLY 1 H GLY 1 0.943 2.687 -0.607 2 HA2 GLY 1 HA2 GLY 1 1.533 2.804 -2.873 3 HA3 GLY 1 HA3 GLY 1 1.986 1.152 -2.482 4 H CYS 2 H CYS 2 -0.430 -0.103 -2.284 5 HA CYS 2 HA CYS 2 -1.348 -0.001 -5.065 6 HB2 CYS 2 HB2 CYS 2 -1.488 -2.132 -2.935 7 HB3 CYS 2 HB3 CYS 2 -2.399 -2.245 -4.438 8 H ILE 3 H ILE 3 -3.647 -0.318 -5.506 9 HA ILE 3 HA ILE 3 -5.709 -0.161 -3.677 10 HB ILE 3 HB ILE 3 -4.976 1.940 -2.873 11 HG12 ILE 3 HG12 ILE 3 -6.946 2.985 -4.835 12 HG13 ILE 3 HG13 ILE 3 -7.451 1.607 -3.864 13 HG21 ILE 3 HG21 ILE 3 -4.167 2.345 -5.636 14 HG22 ILE 3 HG22 ILE 3 -4.951 3.761 -4.938 15 HG23 ILE 3 HG23 ILE 3 -3.535 3.062 -4.154 16 HD11 ILE 3 HD11 ILE 3 -6.216 3.561 -2.184 17 HD12 ILE 3 HD12 ILE 3 -7.479 4.315 -3.158 18 HD13 ILE 3 HD13 ILE 3 -7.860 2.925 -2.141 19 H LEU 4 H LEU 4 -6.876 -1.342 -5.108 20 HA LEU 4 HA LEU 4 -8.322 -0.015 -7.128 21 HB2 LEU 4 HB2 LEU 4 -5.861 -0.611 -8.039 22 HB3 LEU 4 HB3 LEU 4 -6.699 -2.112 -8.426 23 HG LEU 4 HG LEU 4 -8.431 -0.544 -9.569 24 HD11 LEU 4 HD11 LEU 4 -7.203 1.447 -10.563 25 HD12 LEU 4 HD12 LEU 4 -6.030 1.233 -9.264 26 HD13 LEU 4 HD13 LEU 4 -7.716 1.583 -8.881 27 HD21 LEU 4 HD21 LEU 4 -7.531 -1.238 -11.504 28 HD22 LEU 4 HD22 LEU 4 -6.378 -2.079 -10.468 29 HD23 LEU 4 HD23 LEU 4 -5.964 -0.508 -11.156 30 H ASN 5 H ASN 5 -8.866 -1.670 -4.898 31 HA ASN 5 HA ASN 5 -10.268 -3.352 -4.282 32 HB2 ASN 5 HB2 ASN 5 -11.543 -2.388 -6.301 33 HB3 ASN 5 HB3 ASN 5 -10.933 -3.782 -7.188 34 HD21 ASN 5 HD21 ASN 5 -12.536 -3.012 -4.119 35 HD22 ASN 5 HD22 ASN 5 -13.618 -4.359 -4.151 36 H GLY 6 H GLY 6 -8.494 -4.647 -3.630 37 HA2 GLY 6 HA2 GLY 6 -8.413 -7.203 -4.888 38 HA3 GLY 6 HA3 GLY 6 -6.938 -6.301 -5.204 39 H ARG 7 H ARG 7 -7.012 -4.934 -2.614 40 HA ARG 7 HA ARG 7 -6.286 -5.202 -0.473 41 HB2 ARG 7 HB2 ARG 7 -7.123 -8.091 -0.601 42 HB3 ARG 7 HB3 ARG 7 -7.025 -7.044 0.809 43 HG2 ARG 7 HG2 ARG 7 -8.894 -5.697 -0.173 44 HG3 ARG 7 HG3 ARG 7 -9.056 -6.950 -1.405 45 HD2 ARG 7 HD2 ARG 7 -9.188 -7.500 1.552 46 HD3 ARG 7 HD3 ARG 7 -10.608 -7.152 0.567 47 HE ARG 7 HE ARG 7 -9.348 -9.205 -0.727 48 HH11 ARG 7 HH11 ARG 7 -10.599 -8.694 2.482 49 HH12 ARG 7 HH12 ARG 7 -10.984 -10.363 2.738 50 HH21 ARG 7 HH21 ARG 7 -9.851 -11.406 -0.401 51 HH22 ARG 7 HH22 ARG 7 -10.557 -11.905 1.099 52 H THR 8 H THR 8 -4.123 -4.974 -0.695 53 HA THR 8 HA THR 8 -2.516 -7.235 -1.603 54 HB THR 8 HB THR 8 -1.843 -5.196 -2.610 55 HG1 THR 8 HG1 THR 8 0.301 -5.030 -1.841 56 HG21 THR 8 HG21 THR 8 -2.694 -3.433 -1.403 57 HG22 THR 8 HG22 THR 8 -0.993 -3.335 -0.950 58 HG23 THR 8 HG23 THR 8 -2.154 -4.090 0.141 59 H ASP 9 H ASP 9 -0.617 -7.900 -0.398 60 HA ASP 9 HA ASP 9 0.301 -8.811 1.480 61 HB2 ASP 9 HB2 ASP 9 0.829 -6.280 1.632 62 HB3 ASP 9 HB3 ASP 9 -0.385 -6.256 2.908 63 H LEU 10 H LEU 10 -1.361 -10.374 1.754 64 HA LEU 10 HA LEU 10 -3.034 -9.862 4.118 65 HB2 LEU 10 HB2 LEU 10 -3.886 -10.485 1.451 66 HB3 LEU 10 HB3 LEU 10 -4.343 -11.790 2.544 67 HG LEU 10 HG LEU 10 -6.147 -10.167 2.267 68 HD11 LEU 10 HD11 LEU 10 -4.921 -10.074 5.019 69 HD12 LEU 10 HD12 LEU 10 -5.918 -11.381 4.383 70 HD13 LEU 10 HD13 LEU 10 -6.612 -9.777 4.618 71 HD21 LEU 10 HD21 LEU 10 -5.042 -8.017 3.821 72 HD22 LEU 10 HD22 LEU 10 -5.806 -7.973 2.231 73 HD23 LEU 10 HD23 LEU 10 -4.075 -8.287 2.370 74 H GLY 11 H GLY 11 -4.082 -12.243 4.641 75 HA2 GLY 11 HA2 GLY 11 -2.145 -13.692 5.923 76 HA3 GLY 11 HA3 GLY 11 -3.672 -14.381 5.392 77 H THR 12 H THR 12 -3.769 -15.510 3.423 78 HA THR 12 HA THR 12 -1.478 -17.029 2.807 79 HB THR 12 HB THR 12 -3.557 -16.893 0.717 80 HG1 THR 12 HG1 THR 12 -5.020 -18.066 2.180 81 HG21 THR 12 HG21 THR 12 -3.063 -19.083 0.481 82 HG22 THR 12 HG22 THR 12 -3.049 -19.370 2.221 83 HG23 THR 12 HG23 THR 12 -1.635 -18.674 1.430 84 H LEU 13 H LEU 13 -2.832 -14.123 1.406 85 HA LEU 13 HA LEU 13 -1.365 -14.149 -1.012 86 HB2 LEU 13 HB2 LEU 13 -3.403 -12.707 -0.235 87 HB3 LEU 13 HB3 LEU 13 -2.154 -11.606 0.341 88 HG LEU 13 HG LEU 13 -2.209 -12.549 -2.509 89 HD11 LEU 13 HD11 LEU 13 -3.918 -11.239 -3.063 90 HD12 LEU 13 HD12 LEU 13 -3.307 -9.902 -2.089 91 HD13 LEU 13 HD13 LEU 13 -4.297 -11.156 -1.343 92 HD21 LEU 13 HD21 LEU 13 -0.331 -11.359 -2.533 93 HD22 LEU 13 HD22 LEU 13 -0.621 -10.742 -0.906 94 HD23 LEU 13 HD23 LEU 13 -1.326 -9.922 -2.300 95 H LEU 14 H LEU 14 -0.416 -13.621 2.197 96 HA LEU 14 HA LEU 14 1.510 -11.702 2.177 97 HB2 LEU 14 HB2 LEU 14 0.924 -13.049 4.133 98 HB3 LEU 14 HB3 LEU 14 1.748 -14.436 3.424 99 HG LEU 14 HG LEU 14 3.815 -12.795 3.464 100 HD11 LEU 14 HD11 LEU 14 1.862 -11.251 4.761 101 HD12 LEU 14 HD12 LEU 14 3.587 -10.917 4.617 102 HD13 LEU 14 HD13 LEU 14 2.975 -11.801 6.014 103 HD21 LEU 14 HD21 LEU 14 2.943 -13.985 6.074 104 HD22 LEU 14 HD22 LEU 14 4.561 -13.899 5.378 105 HD23 LEU 14 HD23 LEU 14 3.365 -15.002 4.697 106 H PHE 15 H PHE 15 1.647 -14.842 0.648 107 HA PHE 15 HA PHE 15 3.890 -14.016 -0.951 108 HB2 PHE 15 HB2 PHE 15 4.190 -16.235 1.075 109 HB3 PHE 15 HB3 PHE 15 5.252 -16.060 -0.318 110 HD1 PHE 15 HD2 PHE 15 6.255 -13.608 -0.586 111 HD2 PHE 15 HD1 PHE 15 4.878 -15.322 3.058 112 HE1 PHE 15 HE2 PHE 15 7.659 -12.033 0.681 113 HE2 PHE 15 HE1 PHE 15 6.279 -13.750 4.331 114 HZ PHE 15 HZ PHE 15 7.672 -12.104 3.143 115 H ARG 16 H ARG 16 4.663 -16.201 -2.193 116 HA ARG 16 HA ARG 16 4.084 -17.631 -3.867 117 HB2 ARG 16 HB2 ARG 16 3.512 -19.018 -1.881 118 HB3 ARG 16 HB3 ARG 16 1.862 -18.416 -1.975 119 HG2 ARG 16 HG2 ARG 16 1.450 -19.541 -3.991 120 HG3 ARG 16 HG3 ARG 16 3.167 -19.835 -4.273 121 HD2 ARG 16 HD2 ARG 16 2.871 -21.078 -1.909 122 HD3 ARG 16 HD3 ARG 16 1.243 -21.280 -2.557 123 HE ARG 16 HE ARG 16 2.073 -22.779 -4.074 124 HH11 ARG 16 HH11 ARG 16 4.711 -20.965 -2.705 125 HH12 ARG 16 HH12 ARG 16 5.937 -21.940 -3.445 126 HH21 ARG 16 HH21 ARG 16 3.678 -24.070 -5.053 127 HH22 ARG 16 HH22 ARG 16 5.348 -23.706 -4.781 128 H CYS 17 H CYS 17 2.681 -14.934 -3.555 129 HA CYS 17 HA CYS 17 0.340 -14.302 -4.180 130 HB2 CYS 17 HB2 CYS 17 0.946 -13.289 -6.426 131 HB3 CYS 17 HB3 CYS 17 1.998 -12.859 -5.082 132 H ARG 18 H ARG 18 -1.349 -15.576 -4.597 133 HA ARG 18 HA ARG 18 -1.337 -17.881 -6.175 134 HB2 ARG 18 HB2 ARG 18 -3.914 -16.489 -6.088 135 HB3 ARG 18 HB3 ARG 18 -3.480 -18.093 -5.513 136 HG2 ARG 18 HG2 ARG 18 -2.965 -15.505 -4.063 137 HG3 ARG 18 HG3 ARG 18 -4.242 -16.667 -3.695 138 HD2 ARG 18 HD2 ARG 18 -1.415 -16.701 -2.989 139 HD3 ARG 18 HD3 ARG 18 -2.774 -17.553 -2.258 140 HE ARG 18 HE ARG 18 -0.979 -18.551 -4.293 141 HH11 ARG 18 HH11 ARG 18 -4.032 -18.929 -2.663 142 HH12 ARG 18 HH12 ARG 18 -4.190 -20.606 -3.071 143 HH21 ARG 18 HH21 ARG 18 -1.176 -20.758 -4.837 144 HH22 ARG 18 HH22 ARG 18 -2.565 -21.645 -4.307 145 H ARG 19 H ARG 19 -1.441 -14.580 -7.074 146 HA ARG 19 HA ARG 19 -1.008 -14.927 -9.751 147 HB2 ARG 19 HB2 ARG 19 -3.360 -14.308 -10.627 148 HB3 ARG 19 HB3 ARG 19 -3.036 -15.983 -10.199 149 HG2 ARG 19 HG2 ARG 19 -4.333 -15.882 -8.286 150 HG3 ARG 19 HG3 ARG 19 -4.237 -14.122 -8.194 151 HD2 ARG 19 HD2 ARG 19 -5.631 -13.962 -10.215 152 HD3 ARG 19 HD3 ARG 19 -5.753 -15.720 -10.255 153 HE ARG 19 HE ARG 19 -6.612 -14.664 -7.755 154 HH11 ARG 19 HH11 ARG 19 -7.588 -15.147 -11.062 155 HH12 ARG 19 HH12 ARG 19 -9.281 -15.186 -10.693 156 HH21 ARG 19 HH21 ARG 19 -8.838 -14.713 -7.257 157 HH22 ARG 19 HH22 ARG 19 -9.990 -14.938 -8.529 158 H ASP 20 H ASP 20 -1.508 -12.933 -11.068 159 HA ASP 20 HA ASP 20 -0.555 -10.658 -9.842 160 HB2 ASP 20 HB2 ASP 20 -2.410 -10.738 -12.231 161 HB3 ASP 20 HB3 ASP 20 -1.316 -9.425 -11.804 162 H SER 21 H SER 21 -3.886 -11.734 -10.192 163 HA SER 21 HA SER 21 -5.250 -9.437 -9.474 164 HB2 SER 21 HB2 SER 21 -5.898 -12.325 -8.850 165 HB3 SER 21 HB3 SER 21 -7.025 -10.990 -8.612 166 HG SER 21 HG SER 21 -7.438 -11.032 -10.664 167 H ASP 22 H ASP 22 -3.279 -11.502 -7.539 168 HA ASP 22 HA ASP 22 -4.233 -11.170 -4.989 169 HB2 ASP 22 HB2 ASP 22 -1.409 -11.282 -6.033 170 HB3 ASP 22 HB3 ASP 22 -1.756 -11.190 -4.309 171 H CYS 23 H CYS 23 -2.382 -8.877 -6.926 172 HA CYS 23 HA CYS 23 -2.848 -6.845 -4.842 173 HB2 CYS 23 HB2 CYS 23 -0.468 -7.474 -6.484 174 HB3 CYS 23 HB3 CYS 23 -0.837 -5.763 -6.295 175 HA PRO 24 HA PRO 24 -5.435 -5.070 -8.017 176 HB2 PRO 24 HB2 PRO 24 -6.257 -2.953 -6.530 177 HB3 PRO 24 HB3 PRO 24 -6.913 -4.582 -6.328 178 HG2 PRO 24 HG2 PRO 24 -4.817 -3.171 -4.722 179 HG3 PRO 24 HG3 PRO 24 -6.169 -4.172 -4.163 180 HD2 PRO 24 HD2 PRO 24 -3.635 -5.111 -4.334 181 HD3 PRO 24 HD3 PRO 24 -5.056 -6.143 -4.599 182 H GLY 25 H GLY 25 -3.370 -2.955 -6.008 183 HA2 GLY 25 HA2 GLY 25 -3.180 -0.875 -7.908 184 HA3 GLY 25 HA3 GLY 25 -2.088 -1.131 -6.555 185 H ALA 26 H ALA 26 -0.335 -0.467 -7.879 186 HA ALA 26 HA ALA 26 0.361 -1.593 -10.337 187 HB1 ALA 26 HB1 ALA 26 2.660 -0.927 -8.682 188 HB2 ALA 26 HB2 ALA 26 2.117 -0.223 -10.205 189 HB3 ALA 26 HB3 ALA 26 1.423 0.329 -8.681 190 H CYS 27 H CYS 27 1.542 -2.455 -7.083 191 HA CYS 27 HA CYS 27 3.279 -4.442 -7.548 192 HB2 CYS 27 HB2 CYS 27 2.024 -5.658 -5.550 193 HB3 CYS 27 HB3 CYS 27 2.924 -4.166 -5.298 194 H ILE 28 H ILE 28 3.290 -6.611 -8.074 195 HA ILE 28 HA ILE 28 0.789 -7.941 -8.728 196 HB ILE 28 HB ILE 28 1.734 -8.629 -10.985 197 HG12 ILE 28 HG12 ILE 28 3.499 -6.240 -10.417 198 HG13 ILE 28 HG13 ILE 28 4.026 -7.897 -10.692 199 HG21 ILE 28 HG21 ILE 28 0.430 -7.070 -11.969 200 HG22 ILE 28 HG22 ILE 28 0.017 -6.682 -10.300 201 HG23 ILE 28 HG23 ILE 28 1.230 -5.728 -11.152 202 HD11 ILE 28 HD11 ILE 28 4.450 -6.846 -12.708 203 HD12 ILE 28 HD12 ILE 28 2.901 -7.641 -12.988 204 HD13 ILE 28 HD13 ILE 28 2.955 -5.911 -12.650 205 H CYS 29 H CYS 29 1.172 -10.238 -9.392 206 HA CYS 29 HA CYS 29 2.976 -11.465 -7.556 207 HB2 CYS 29 HB2 CYS 29 0.948 -12.621 -7.951 208 HB3 CYS 29 HB3 CYS 29 1.147 -12.536 -9.698 209 H ARG 30 H ARG 30 5.027 -12.029 -7.844 210 HA ARG 30 HA ARG 30 6.016 -12.511 -10.562 211 HB2 ARG 30 HB2 ARG 30 8.081 -11.233 -9.058 212 HB3 ARG 30 HB3 ARG 30 7.337 -10.714 -10.565 213 HG2 ARG 30 HG2 ARG 30 6.651 -8.933 -9.423 214 HG3 ARG 30 HG3 ARG 30 5.458 -10.011 -8.696 215 HD2 ARG 30 HD2 ARG 30 6.364 -9.587 -6.714 216 HD3 ARG 30 HD3 ARG 30 7.826 -10.410 -7.256 217 HE ARG 30 HE ARG 30 7.388 -7.541 -7.098 218 HH11 ARG 30 HH11 ARG 30 9.401 -10.163 -8.191 219 HH12 ARG 30 HH12 ARG 30 10.814 -9.177 -8.370 220 HH21 ARG 30 HH21 ARG 30 9.242 -6.232 -7.329 221 HH22 ARG 30 HH22 ARG 30 10.723 -6.941 -7.879 222 H GLY 31 H GLY 31 8.468 -13.265 -10.306 223 HA2 GLY 31 HA2 GLY 31 8.405 -15.772 -9.075 224 HA3 GLY 31 HA3 GLY 31 9.862 -14.953 -9.619 225 H ASN 32 H ASN 32 8.872 -12.720 -7.656 226 HA ASN 32 HA ASN 32 10.641 -13.385 -5.562 227 HB2 ASN 32 HB2 ASN 32 10.373 -11.231 -4.962 228 HB3 ASN 32 HB3 ASN 32 9.405 -11.082 -6.425 229 HD21 ASN 32 HD21 ASN 32 9.368 -11.329 -2.973 230 HD22 ASN 32 HD22 ASN 32 7.702 -10.925 -2.754 231 H GLY 33 H GLY 33 7.703 -14.683 -6.206 232 HA2 GLY 33 HA2 GLY 33 6.367 -16.101 -4.980 233 HA3 GLY 33 HA3 GLY 33 7.502 -15.926 -3.649 234 H TYR 34 H TYR 34 5.670 -13.369 -5.263 235 HA TYR 34 HA TYR 34 3.554 -13.152 -3.469 236 HB2 TYR 34 HB2 TYR 34 5.124 -12.708 -1.713 237 HB3 TYR 34 HB3 TYR 34 5.986 -11.533 -2.701 238 HD1 TYR 34 HD2 TYR 34 2.628 -12.152 -1.196 239 HD2 TYR 34 HD1 TYR 34 5.492 -9.276 -2.473 240 HE1 TYR 34 HE2 TYR 34 1.230 -10.355 -0.266 241 HE2 TYR 34 HE1 TYR 34 4.103 -7.471 -1.546 242 HH TYR 34 HH TYR 34 2.302 -7.316 0.335 243 H CYS 35 H CYS 35 2.389 -11.092 -3.663 244 HA CYS 35 HA CYS 35 2.472 -10.133 -6.349 245 HB2 CYS 35 HB2 CYS 35 0.518 -8.903 -5.814 246 HB3 CYS 35 HB3 CYS 35 0.403 -10.398 -4.891 247 H GLY 36 H GLY 36 4.819 -9.441 -6.037 248 HA2 GLY 36 HA2 GLY 36 5.170 -6.911 -4.651 249 HA3 GLY 36 HA3 GLY 36 6.414 -7.821 -5.496 Start of MODEL 5 1 H1 GLY 1 H GLY 1 -0.460 5.745 -6.621 2 HA2 GLY 1 HA2 GLY 1 0.912 4.235 -7.677 3 HA3 GLY 1 HA3 GLY 1 1.586 3.867 -6.096 4 H CYS 2 H CYS 2 0.798 2.123 -4.922 5 HA CYS 2 HA CYS 2 -0.881 0.273 -6.479 6 HB2 CYS 2 HB2 CYS 2 1.304 -0.655 -6.124 7 HB3 CYS 2 HB3 CYS 2 1.258 -0.252 -4.411 8 H ILE 3 H ILE 3 -2.923 0.568 -5.793 9 HA ILE 3 HA ILE 3 -3.843 -0.476 -3.409 10 HB ILE 3 HB ILE 3 -2.849 1.254 -2.140 11 HG12 ILE 3 HG12 ILE 3 -5.668 2.247 -2.547 12 HG13 ILE 3 HG13 ILE 3 -5.317 0.721 -1.741 13 HG21 ILE 3 HG21 ILE 3 -3.436 2.860 -4.480 14 HG22 ILE 3 HG22 ILE 3 -3.870 3.684 -2.983 15 HG23 ILE 3 HG23 ILE 3 -2.224 3.099 -3.221 16 HD11 ILE 3 HD11 ILE 3 -4.684 3.504 -0.852 17 HD12 ILE 3 HD12 ILE 3 -5.568 2.236 -0.003 18 HD13 ILE 3 HD13 ILE 3 -3.820 2.113 -0.198 19 H LEU 4 H LEU 4 -5.491 -1.253 -4.660 20 HA LEU 4 HA LEU 4 -7.558 0.686 -5.385 21 HB2 LEU 4 HB2 LEU 4 -5.946 -0.756 -7.250 22 HB3 LEU 4 HB3 LEU 4 -7.607 -1.337 -7.358 23 HG LEU 4 HG LEU 4 -7.993 1.351 -7.406 24 HD11 LEU 4 HD11 LEU 4 -5.427 0.833 -8.902 25 HD12 LEU 4 HD12 LEU 4 -5.584 1.794 -7.432 26 HD13 LEU 4 HD13 LEU 4 -6.364 2.327 -8.920 27 HD21 LEU 4 HD21 LEU 4 -7.357 -0.119 -9.935 28 HD22 LEU 4 HD22 LEU 4 -8.644 1.043 -9.610 29 HD23 LEU 4 HD23 LEU 4 -8.740 -0.589 -8.946 30 H ASN 5 H ASN 5 -6.927 -1.635 -3.420 31 HA ASN 5 HA ASN 5 -9.567 -2.459 -3.007 32 HB2 ASN 5 HB2 ASN 5 -8.745 -3.777 -5.156 33 HB3 ASN 5 HB3 ASN 5 -8.007 -4.825 -3.948 34 HD21 ASN 5 HD21 ASN 5 -9.675 -6.160 -5.292 35 HD22 ASN 5 HD22 ASN 5 -11.219 -6.340 -4.538 36 H GLY 6 H GLY 6 -9.530 -4.600 -1.557 37 HA2 GLY 6 HA2 GLY 6 -7.410 -4.112 0.429 38 HA3 GLY 6 HA3 GLY 6 -9.001 -4.767 0.786 39 H ARG 7 H ARG 7 -6.882 -5.780 -1.844 40 HA ARG 7 HA ARG 7 -6.871 -8.476 -0.690 41 HB2 ARG 7 HB2 ARG 7 -6.316 -7.494 -3.493 42 HB3 ARG 7 HB3 ARG 7 -6.135 -9.169 -2.986 43 HG2 ARG 7 HG2 ARG 7 -8.720 -8.277 -2.213 44 HG3 ARG 7 HG3 ARG 7 -8.457 -7.847 -3.905 45 HD2 ARG 7 HD2 ARG 7 -7.489 -10.350 -3.919 46 HD3 ARG 7 HD3 ARG 7 -8.677 -10.502 -2.625 47 HE ARG 7 HE ARG 7 -10.078 -9.295 -4.591 48 HH11 ARG 7 HH11 ARG 7 -8.077 -12.143 -4.500 49 HH12 ARG 7 HH12 ARG 7 -8.961 -12.963 -5.744 50 HH21 ARG 7 HH21 ARG 7 -11.250 -10.364 -6.230 51 HH22 ARG 7 HH22 ARG 7 -10.765 -11.950 -6.728 52 H THR 8 H THR 8 -4.732 -5.978 -1.969 53 HA THR 8 HA THR 8 -2.310 -7.291 -1.965 54 HB THR 8 HB THR 8 -2.292 -5.100 -2.817 55 HG1 THR 8 HG1 THR 8 -0.479 -4.437 -1.879 56 HG21 THR 8 HG21 THR 8 -3.463 -4.284 -0.166 57 HG22 THR 8 HG22 THR 8 -4.159 -4.089 -1.775 58 HG23 THR 8 HG23 THR 8 -2.766 -3.121 -1.293 59 H ASP 9 H ASP 9 -0.811 -7.872 -0.470 60 HA ASP 9 HA ASP 9 -0.028 -8.584 1.548 61 HB2 ASP 9 HB2 ASP 9 0.564 -6.250 1.788 62 HB3 ASP 9 HB3 ASP 9 -1.064 -5.853 2.332 63 H LEU 10 H LEU 10 -1.480 -10.312 1.809 64 HA LEU 10 HA LEU 10 -3.501 -9.849 3.893 65 HB2 LEU 10 HB2 LEU 10 -3.990 -10.633 1.220 66 HB3 LEU 10 HB3 LEU 10 -4.281 -12.041 2.238 67 HG LEU 10 HG LEU 10 -5.916 -10.786 3.535 68 HD11 LEU 10 HD11 LEU 10 -6.628 -8.539 2.474 69 HD12 LEU 10 HD12 LEU 10 -4.998 -8.528 1.801 70 HD13 LEU 10 HD13 LEU 10 -5.230 -8.575 3.549 71 HD21 LEU 10 HD21 LEU 10 -6.143 -11.288 0.667 72 HD22 LEU 10 HD22 LEU 10 -7.317 -10.123 1.279 73 HD23 LEU 10 HD23 LEU 10 -7.223 -11.735 1.988 74 H GLY 11 H GLY 11 -4.309 -12.235 4.582 75 HA2 GLY 11 HA2 GLY 11 -2.314 -13.360 6.107 76 HA3 GLY 11 HA3 GLY 11 -3.765 -14.218 5.611 77 H THR 12 H THR 12 -3.697 -15.592 3.817 78 HA THR 12 HA THR 12 -1.256 -16.947 3.423 79 HB THR 12 HB THR 12 -3.568 -17.934 3.156 80 HG1 THR 12 HG1 THR 12 -2.803 -19.407 1.666 81 HG21 THR 12 HG21 THR 12 -3.382 -16.649 0.428 82 HG22 THR 12 HG22 THR 12 -4.486 -16.157 1.713 83 HG23 THR 12 HG23 THR 12 -4.641 -17.753 0.981 84 H LEU 13 H LEU 13 -2.809 -14.338 1.716 85 HA LEU 13 HA LEU 13 -1.359 -14.539 -0.708 86 HB2 LEU 13 HB2 LEU 13 -3.492 -13.217 -0.209 87 HB3 LEU 13 HB3 LEU 13 -2.421 -11.979 0.446 88 HG LEU 13 HG LEU 13 -2.005 -12.965 -2.345 89 HD11 LEU 13 HD11 LEU 13 -3.936 -12.180 -3.089 90 HD12 LEU 13 HD12 LEU 13 -3.577 -10.602 -2.388 91 HD13 LEU 13 HD13 LEU 13 -4.432 -11.816 -1.436 92 HD21 LEU 13 HD21 LEU 13 -0.927 -10.947 -0.651 93 HD22 LEU 13 HD22 LEU 13 -1.730 -10.169 -2.015 94 HD23 LEU 13 HD23 LEU 13 -0.468 -11.368 -2.301 95 H LEU 14 H LEU 14 -0.383 -13.700 2.394 96 HA LEU 14 HA LEU 14 1.368 -11.622 2.190 97 HB2 LEU 14 HB2 LEU 14 0.913 -12.929 4.237 98 HB3 LEU 14 HB3 LEU 14 1.926 -14.225 3.605 99 HG LEU 14 HG LEU 14 3.783 -12.414 3.554 100 HD11 LEU 14 HD11 LEU 14 3.380 -10.851 5.570 101 HD12 LEU 14 HD12 LEU 14 1.671 -11.147 5.254 102 HD13 LEU 14 HD13 LEU 14 2.685 -10.423 4.006 103 HD21 LEU 14 HD21 LEU 14 4.281 -14.067 5.022 104 HD22 LEU 14 HD22 LEU 14 2.704 -13.997 5.811 105 HD23 LEU 14 HD23 LEU 14 3.936 -12.793 6.193 106 H PHE 15 H PHE 15 1.666 -14.775 0.766 107 HA PHE 15 HA PHE 15 3.861 -13.890 -0.863 108 HB2 PHE 15 HB2 PHE 15 4.275 -16.061 1.195 109 HB3 PHE 15 HB3 PHE 15 5.325 -15.845 -0.202 110 HD1 PHE 15 HD2 PHE 15 6.208 -13.354 -0.495 111 HD2 PHE 15 HD1 PHE 15 4.908 -15.089 3.168 112 HE1 PHE 15 HE2 PHE 15 7.530 -11.698 0.755 113 HE2 PHE 15 HE1 PHE 15 6.228 -13.435 4.424 114 HZ PHE 15 HZ PHE 15 7.542 -11.737 3.217 115 H ARG 16 H ARG 16 4.719 -16.062 -2.069 116 HA ARG 16 HA ARG 16 4.195 -17.565 -3.695 117 HB2 ARG 16 HB2 ARG 16 3.656 -18.914 -1.670 118 HB3 ARG 16 HB3 ARG 16 1.988 -18.373 -1.795 119 HG2 ARG 16 HG2 ARG 16 1.640 -19.561 -3.793 120 HG3 ARG 16 HG3 ARG 16 3.370 -19.819 -4.032 121 HD2 ARG 16 HD2 ARG 16 2.326 -20.864 -1.501 122 HD3 ARG 16 HD3 ARG 16 1.646 -21.628 -2.937 123 HE ARG 16 HE ARG 16 4.397 -21.532 -3.290 124 HH11 ARG 16 HH11 ARG 16 2.113 -23.009 -1.118 125 HH12 ARG 16 HH12 ARG 16 3.116 -24.382 -0.788 126 HH21 ARG 16 HH21 ARG 16 5.727 -23.335 -2.865 127 HH22 ARG 16 HH22 ARG 16 5.172 -24.566 -1.782 128 H CYS 17 H CYS 17 2.701 -14.907 -3.452 129 HA CYS 17 HA CYS 17 0.361 -14.344 -4.104 130 HB2 CYS 17 HB2 CYS 17 0.926 -13.416 -6.393 131 HB3 CYS 17 HB3 CYS 17 1.995 -12.919 -5.085 132 H ARG 18 H ARG 18 -1.229 -15.817 -4.332 133 HA ARG 18 HA ARG 18 -1.157 -18.103 -5.944 134 HB2 ARG 18 HB2 ARG 18 -3.806 -17.636 -5.810 135 HB3 ARG 18 HB3 ARG 18 -2.877 -18.318 -4.483 136 HG2 ARG 18 HG2 ARG 18 -2.999 -15.376 -4.591 137 HG3 ARG 18 HG3 ARG 18 -4.513 -16.209 -4.230 138 HD2 ARG 18 HD2 ARG 18 -1.915 -16.312 -2.723 139 HD3 ARG 18 HD3 ARG 18 -3.496 -15.789 -2.144 140 HE ARG 18 HE ARG 18 -4.007 -18.325 -2.705 141 HH11 ARG 18 HH11 ARG 18 -1.269 -16.907 -1.088 142 HH12 ARG 18 HH12 ARG 18 -0.967 -18.298 -0.100 143 HH21 ARG 18 HH21 ARG 18 -3.620 -20.162 -1.409 144 HH22 ARG 18 HH22 ARG 18 -2.305 -20.149 -0.284 145 H ARG 19 H ARG 19 -1.577 -14.819 -6.775 146 HA ARG 19 HA ARG 19 -1.456 -15.211 -9.516 147 HB2 ARG 19 HB2 ARG 19 -3.691 -16.233 -9.251 148 HB3 ARG 19 HB3 ARG 19 -4.286 -14.725 -8.570 149 HG2 ARG 19 HG2 ARG 19 -4.355 -13.677 -10.584 150 HG3 ARG 19 HG3 ARG 19 -3.007 -14.609 -11.240 151 HD2 ARG 19 HD2 ARG 19 -4.731 -15.528 -12.424 152 HD3 ARG 19 HD3 ARG 19 -4.724 -16.597 -11.021 153 HE ARG 19 HE ARG 19 -6.450 -14.369 -10.630 154 HH11 ARG 19 HH11 ARG 19 -6.205 -17.457 -12.219 155 HH12 ARG 19 HH12 ARG 19 -7.915 -17.729 -12.238 156 HH21 ARG 19 HH21 ARG 19 -8.704 -14.717 -10.649 157 HH22 ARG 19 HH22 ARG 19 -9.336 -16.170 -11.345 158 H ASP 20 H ASP 20 -1.735 -13.229 -10.745 159 HA ASP 20 HA ASP 20 -0.671 -10.990 -9.541 160 HB2 ASP 20 HB2 ASP 20 -2.200 -11.433 -12.072 161 HB3 ASP 20 HB3 ASP 20 -1.853 -9.781 -11.569 162 H SER 21 H SER 21 -4.053 -11.878 -9.944 163 HA SER 21 HA SER 21 -5.297 -9.498 -9.283 164 HB2 SER 21 HB2 SER 21 -6.075 -12.190 -9.601 165 HB3 SER 21 HB3 SER 21 -6.682 -11.690 -8.023 166 HG SER 21 HG SER 21 -7.978 -11.261 -10.061 167 H ASP 22 H ASP 22 -3.435 -11.593 -7.294 168 HA ASP 22 HA ASP 22 -4.383 -11.268 -4.762 169 HB2 ASP 22 HB2 ASP 22 -1.539 -11.242 -5.766 170 HB3 ASP 22 HB3 ASP 22 -1.931 -11.226 -4.049 171 H CYS 23 H CYS 23 -2.570 -8.907 -6.660 172 HA CYS 23 HA CYS 23 -3.141 -6.900 -4.578 173 HB2 CYS 23 HB2 CYS 23 -0.741 -7.375 -6.276 174 HB3 CYS 23 HB3 CYS 23 -1.162 -5.705 -5.911 175 HA PRO 24 HA PRO 24 -5.740 -5.094 -7.696 176 HB2 PRO 24 HB2 PRO 24 -6.393 -2.869 -6.284 177 HB3 PRO 24 HB3 PRO 24 -7.104 -4.455 -5.961 178 HG2 PRO 24 HG2 PRO 24 -4.867 -3.057 -4.545 179 HG3 PRO 24 HG3 PRO 24 -6.227 -3.967 -3.863 180 HD2 PRO 24 HD2 PRO 24 -3.746 -5.024 -4.116 181 HD3 PRO 24 HD3 PRO 24 -5.220 -6.004 -4.251 182 H GLY 25 H GLY 25 -3.524 -2.934 -5.905 183 HA2 GLY 25 HA2 GLY 25 -3.333 -1.013 -7.978 184 HA3 GLY 25 HA3 GLY 25 -2.236 -1.169 -6.614 185 H ALA 26 H ALA 26 -0.607 -0.543 -8.217 186 HA ALA 26 HA ALA 26 0.085 -1.906 -10.498 187 HB1 ALA 26 HB1 ALA 26 1.169 0.151 -9.184 188 HB2 ALA 26 HB2 ALA 26 2.333 -1.103 -8.752 189 HB3 ALA 26 HB3 ALA 26 2.024 -0.735 -10.449 190 H CYS 27 H CYS 27 1.359 -2.561 -7.228 191 HA CYS 27 HA CYS 27 3.019 -4.608 -7.536 192 HB2 CYS 27 HB2 CYS 27 1.568 -5.697 -5.528 193 HB3 CYS 27 HB3 CYS 27 2.671 -4.343 -5.311 194 H ILE 28 H ILE 28 3.066 -6.695 -8.186 195 HA ILE 28 HA ILE 28 0.562 -8.097 -8.721 196 HB ILE 28 HB ILE 28 1.508 -8.824 -10.974 197 HG12 ILE 28 HG12 ILE 28 3.215 -6.382 -10.459 198 HG13 ILE 28 HG13 ILE 28 3.777 -8.027 -10.740 199 HG21 ILE 28 HG21 ILE 28 0.936 -5.973 -11.300 200 HG22 ILE 28 HG22 ILE 28 0.078 -7.383 -11.920 201 HG23 ILE 28 HG23 ILE 28 -0.212 -6.830 -10.271 202 HD11 ILE 28 HD11 ILE 28 2.626 -6.071 -12.682 203 HD12 ILE 28 HD12 ILE 28 4.139 -6.973 -12.766 204 HD13 ILE 28 HD13 ILE 28 2.602 -7.802 -13.016 205 H CYS 29 H CYS 29 0.990 -10.402 -9.384 206 HA CYS 29 HA CYS 29 2.799 -11.581 -7.523 207 HB2 CYS 29 HB2 CYS 29 0.803 -12.785 -7.923 208 HB3 CYS 29 HB3 CYS 29 1.005 -12.697 -9.670 209 H ARG 30 H ARG 30 4.857 -12.138 -7.786 210 HA ARG 30 HA ARG 30 5.884 -12.641 -10.482 211 HB2 ARG 30 HB2 ARG 30 7.853 -11.249 -10.080 212 HB3 ARG 30 HB3 ARG 30 6.381 -10.290 -9.999 213 HG2 ARG 30 HG2 ARG 30 7.430 -11.399 -7.459 214 HG3 ARG 30 HG3 ARG 30 8.323 -10.074 -8.209 215 HD2 ARG 30 HD2 ARG 30 5.407 -10.077 -7.440 216 HD3 ARG 30 HD3 ARG 30 6.706 -9.198 -6.635 217 HE ARG 30 HE ARG 30 5.282 -8.380 -8.952 218 HH11 ARG 30 HH11 ARG 30 8.425 -8.297 -7.458 219 HH12 ARG 30 HH12 ARG 30 8.909 -6.836 -8.253 220 HH21 ARG 30 HH21 ARG 30 5.908 -6.455 -10.006 221 HH22 ARG 30 HH22 ARG 30 7.476 -5.789 -9.702 222 H GLY 31 H GLY 31 8.338 -13.332 -10.212 223 HA2 GLY 31 HA2 GLY 31 8.351 -15.784 -8.878 224 HA3 GLY 31 HA3 GLY 31 9.783 -14.948 -9.460 225 H ASN 32 H ASN 32 8.863 -12.638 -7.625 226 HA ASN 32 HA ASN 32 10.625 -13.147 -5.518 227 HB2 ASN 32 HB2 ASN 32 10.229 -10.998 -4.966 228 HB3 ASN 32 HB3 ASN 32 9.251 -10.950 -6.429 229 HD21 ASN 32 HD21 ASN 32 9.185 -11.340 -2.955 230 HD22 ASN 32 HD22 ASN 32 7.519 -10.932 -2.748 231 H GLY 33 H GLY 33 7.565 -14.413 -6.046 232 HA2 GLY 33 HA2 GLY 33 6.414 -15.957 -4.752 233 HA3 GLY 33 HA3 GLY 33 7.544 -15.652 -3.440 234 H TYR 34 H TYR 34 5.600 -13.245 -5.136 235 HA TYR 34 HA TYR 34 3.454 -13.081 -3.372 236 HB2 TYR 34 HB2 TYR 34 5.018 -12.527 -1.624 237 HB3 TYR 34 HB3 TYR 34 5.782 -11.302 -2.629 238 HD1 TYR 34 HD2 TYR 34 2.463 -12.155 -1.147 239 HD2 TYR 34 HD1 TYR 34 5.146 -9.089 -2.375 240 HE1 TYR 34 HE2 TYR 34 0.936 -10.459 -0.230 241 HE2 TYR 34 HE1 TYR 34 3.627 -7.385 -1.459 242 HH TYR 34 HH TYR 34 1.816 -7.046 -0.149 243 H CYS 35 H CYS 35 2.203 -11.075 -3.627 244 HA CYS 35 HA CYS 35 2.284 -10.178 -6.337 245 HB2 CYS 35 HB2 CYS 35 0.288 -8.937 -5.806 246 HB3 CYS 35 HB3 CYS 35 0.180 -10.515 -5.032 247 H GLY 36 H GLY 36 4.613 -9.384 -5.908 248 HA2 GLY 36 HA2 GLY 36 5.087 -7.019 -4.460 249 HA3 GLY 36 HA3 GLY 36 6.073 -7.618 -5.786 Start of MODEL 6 1 H1 GLY 1 H GLY 1 -1.174 -0.542 0.010 2 HA2 GLY 1 HA2 GLY 1 -1.518 1.653 -0.758 3 HA3 GLY 1 HA3 GLY 1 0.222 1.899 -0.769 4 H CYS 2 H CYS 2 -2.219 -0.133 -2.392 5 HA CYS 2 HA CYS 2 -0.739 0.293 -4.905 6 HB2 CYS 2 HB2 CYS 2 -2.479 -2.045 -4.092 7 HB3 CYS 2 HB3 CYS 2 -1.733 -1.846 -5.674 8 H ILE 3 H ILE 3 -1.870 2.212 -5.387 9 HA ILE 3 HA ILE 3 -4.216 3.190 -5.391 10 HB ILE 3 HB ILE 3 -3.033 2.489 -8.081 11 HG12 ILE 3 HG12 ILE 3 -1.432 3.659 -6.652 12 HG13 ILE 3 HG13 ILE 3 -1.987 4.719 -7.942 13 HG21 ILE 3 HG21 ILE 3 -5.070 3.282 -8.706 14 HG22 ILE 3 HG22 ILE 3 -5.281 4.223 -7.230 15 HG23 ILE 3 HG23 ILE 3 -4.231 4.821 -8.515 16 HD11 ILE 3 HD11 ILE 3 -2.842 4.762 -5.061 17 HD12 ILE 3 HD12 ILE 3 -1.882 5.970 -5.917 18 HD13 ILE 3 HD13 ILE 3 -3.580 5.736 -6.333 19 H LEU 4 H LEU 4 -6.115 2.253 -5.000 20 HA LEU 4 HA LEU 4 -8.025 1.056 -5.309 21 HB2 LEU 4 HB2 LEU 4 -7.397 1.846 -7.770 22 HB3 LEU 4 HB3 LEU 4 -7.196 0.110 -7.997 23 HG LEU 4 HG LEU 4 -9.393 0.738 -8.718 24 HD11 LEU 4 HD11 LEU 4 -9.052 -1.388 -7.408 25 HD12 LEU 4 HD12 LEU 4 -10.705 -0.777 -7.465 26 HD13 LEU 4 HD13 LEU 4 -9.728 -0.540 -6.016 27 HD21 LEU 4 HD21 LEU 4 -10.950 1.943 -7.439 28 HD22 LEU 4 HD22 LEU 4 -9.431 2.820 -7.252 29 HD23 LEU 4 HD23 LEU 4 -10.005 1.763 -5.961 30 H ASN 5 H ASN 5 -7.667 -0.544 -3.824 31 HA ASN 5 HA ASN 5 -7.487 -3.189 -4.721 32 HB2 ASN 5 HB2 ASN 5 -5.325 -3.896 -4.166 33 HB3 ASN 5 HB3 ASN 5 -5.051 -2.351 -4.967 34 HD21 ASN 5 HD21 ASN 5 -4.885 -4.115 -2.014 35 HD22 ASN 5 HD22 ASN 5 -4.072 -2.905 -1.087 36 H GLY 6 H GLY 6 -6.848 -4.676 -2.686 37 HA2 GLY 6 HA2 GLY 6 -7.427 -3.595 -0.112 38 HA3 GLY 6 HA3 GLY 6 -8.844 -4.371 -0.802 39 H ARG 7 H ARG 7 -7.337 -6.409 -2.215 40 HA ARG 7 HA ARG 7 -7.094 -8.284 -0.054 41 HB2 ARG 7 HB2 ARG 7 -8.041 -8.785 -2.352 42 HB3 ARG 7 HB3 ARG 7 -6.388 -8.749 -2.950 43 HG2 ARG 7 HG2 ARG 7 -6.249 -10.903 -2.459 44 HG3 ARG 7 HG3 ARG 7 -6.323 -10.460 -0.752 45 HD2 ARG 7 HD2 ARG 7 -8.743 -10.645 -0.784 46 HD3 ARG 7 HD3 ARG 7 -8.712 -11.002 -2.511 47 HE ARG 7 HE ARG 7 -7.125 -12.858 -1.076 48 HH11 ARG 7 HH11 ARG 7 -10.433 -12.020 -1.764 49 HH12 ARG 7 HH12 ARG 7 -11.024 -13.634 -1.548 50 HH21 ARG 7 HH21 ARG 7 -7.890 -14.988 -0.790 51 HH22 ARG 7 HH22 ARG 7 -9.577 -15.321 -0.993 52 H THR 8 H THR 8 -4.942 -6.303 -1.873 53 HA THR 8 HA THR 8 -2.555 -7.613 -1.888 54 HB THR 8 HB THR 8 -2.857 -4.731 -1.029 55 HG1 THR 8 HG1 THR 8 -3.248 -6.012 -3.473 56 HG21 THR 8 HG21 THR 8 -0.593 -5.616 -0.778 57 HG22 THR 8 HG22 THR 8 -0.666 -4.455 -2.104 58 HG23 THR 8 HG23 THR 8 -0.620 -6.184 -2.447 59 H ASP 9 H ASP 9 -0.795 -7.832 -0.467 60 HA ASP 9 HA ASP 9 0.033 -8.605 1.532 61 HB2 ASP 9 HB2 ASP 9 0.137 -6.795 3.262 62 HB3 ASP 9 HB3 ASP 9 0.672 -6.291 1.661 63 H LEU 10 H LEU 10 -1.597 -10.271 1.762 64 HA LEU 10 HA LEU 10 -3.326 -9.771 4.087 65 HB2 LEU 10 HB2 LEU 10 -4.133 -10.461 1.432 66 HB3 LEU 10 HB3 LEU 10 -4.524 -11.789 2.522 67 HG LEU 10 HG LEU 10 -5.788 -10.203 3.939 68 HD11 LEU 10 HD11 LEU 10 -5.647 -8.005 3.680 69 HD12 LEU 10 HD12 LEU 10 -6.102 -8.126 1.981 70 HD13 LEU 10 HD13 LEU 10 -4.409 -8.273 2.452 71 HD21 LEU 10 HD21 LEU 10 -6.684 -11.530 1.874 72 HD22 LEU 10 HD22 LEU 10 -6.864 -9.923 1.169 73 HD23 LEU 10 HD23 LEU 10 -7.701 -10.328 2.668 74 H GLY 11 H GLY 11 -4.286 -12.185 4.645 75 HA2 GLY 11 HA2 GLY 11 -2.312 -13.525 5.986 76 HA3 GLY 11 HA3 GLY 11 -3.798 -14.289 5.444 77 H THR 12 H THR 12 -3.816 -15.414 3.452 78 HA THR 12 HA THR 12 -1.476 -16.887 2.925 79 HB THR 12 HB THR 12 -3.113 -17.107 0.647 80 HG1 THR 12 HG1 THR 12 -4.822 -16.072 1.590 81 HG21 THR 12 HG21 THR 12 -3.212 -19.298 1.263 82 HG22 THR 12 HG22 THR 12 -3.568 -18.922 2.949 83 HG23 THR 12 HG23 THR 12 -1.916 -18.787 2.345 84 H LEU 13 H LEU 13 -2.859 -14.034 1.427 85 HA LEU 13 HA LEU 13 -1.284 -14.029 -0.916 86 HB2 LEU 13 HB2 LEU 13 -3.384 -12.621 -0.195 87 HB3 LEU 13 HB3 LEU 13 -2.160 -11.484 0.366 88 HG LEU 13 HG LEU 13 -2.210 -12.507 -2.461 89 HD11 LEU 13 HD11 LEU 13 -3.220 -9.836 -2.199 90 HD12 LEU 13 HD12 LEU 13 -4.217 -10.956 -1.271 91 HD13 LEU 13 HD13 LEU 13 -3.945 -11.235 -2.991 92 HD21 LEU 13 HD21 LEU 13 -0.631 -10.607 -0.905 93 HD22 LEU 13 HD22 LEU 13 -1.239 -9.945 -2.422 94 HD23 LEU 13 HD23 LEU 13 -0.260 -11.413 -2.429 95 H LEU 14 H LEU 14 -0.473 -13.477 2.323 96 HA LEU 14 HA LEU 14 1.414 -11.507 2.353 97 HB2 LEU 14 HB2 LEU 14 0.747 -12.841 4.304 98 HB3 LEU 14 HB3 LEU 14 1.658 -14.209 3.668 99 HG LEU 14 HG LEU 14 3.659 -12.492 3.787 100 HD11 LEU 14 HD11 LEU 14 2.037 -10.682 4.536 101 HD12 LEU 14 HD12 LEU 14 3.511 -10.879 5.484 102 HD13 LEU 14 HD13 LEU 14 1.984 -11.527 6.084 103 HD21 LEU 14 HD21 LEU 14 3.075 -13.389 6.489 104 HD22 LEU 14 HD22 LEU 14 4.376 -13.860 5.395 105 HD23 LEU 14 HD23 LEU 14 2.800 -14.644 5.281 106 H PHE 15 H PHE 15 1.627 -14.621 0.817 107 HA PHE 15 HA PHE 15 3.939 -13.811 -0.666 108 HB2 PHE 15 HB2 PHE 15 4.187 -15.844 1.528 109 HB3 PHE 15 HB3 PHE 15 5.202 -15.960 0.094 110 HD1 PHE 15 HD2 PHE 15 6.318 -13.608 -0.570 111 HD2 PHE 15 HD1 PHE 15 5.071 -14.757 3.334 112 HE1 PHE 15 HE2 PHE 15 7.883 -11.979 0.405 113 HE2 PHE 15 HE1 PHE 15 6.633 -13.129 4.316 114 HZ PHE 15 HZ PHE 15 8.042 -11.739 2.851 115 H ARG 16 H ARG 16 4.800 -15.998 -1.837 116 HA ARG 16 HA ARG 16 4.292 -17.407 -3.558 117 HB2 ARG 16 HB2 ARG 16 3.852 -18.835 -1.558 118 HB3 ARG 16 HB3 ARG 16 2.157 -18.377 -1.653 119 HG2 ARG 16 HG2 ARG 16 2.880 -19.302 -4.208 120 HG3 ARG 16 HG3 ARG 16 3.548 -20.445 -3.041 121 HD2 ARG 16 HD2 ARG 16 1.140 -20.173 -1.966 122 HD3 ARG 16 HD3 ARG 16 0.719 -19.748 -3.625 123 HE ARG 16 HE ARG 16 1.350 -22.348 -2.623 124 HH11 ARG 16 HH11 ARG 16 1.483 -20.306 -5.440 125 HH12 ARG 16 HH12 ARG 16 1.472 -21.628 -6.559 126 HH21 ARG 16 HH21 ARG 16 1.334 -24.097 -4.087 127 HH22 ARG 16 HH22 ARG 16 1.386 -23.784 -5.789 128 H CYS 17 H CYS 17 2.831 -14.818 -3.392 129 HA CYS 17 HA CYS 17 0.386 -14.362 -3.921 130 HB2 CYS 17 HB2 CYS 17 0.884 -13.263 -6.129 131 HB3 CYS 17 HB3 CYS 17 1.980 -12.820 -4.824 132 H ARG 18 H ARG 18 -1.307 -15.529 -4.515 133 HA ARG 18 HA ARG 18 -1.148 -17.924 -5.984 134 HB2 ARG 18 HB2 ARG 18 -3.768 -16.651 -6.084 135 HB3 ARG 18 HB3 ARG 18 -3.287 -18.177 -5.354 136 HG2 ARG 18 HG2 ARG 18 -2.945 -15.459 -4.102 137 HG3 ARG 18 HG3 ARG 18 -4.220 -16.617 -3.717 138 HD2 ARG 18 HD2 ARG 18 -1.449 -16.521 -2.830 139 HD3 ARG 18 HD3 ARG 18 -2.833 -17.357 -2.128 140 HE ARG 18 HE ARG 18 -0.884 -18.446 -3.970 141 HH11 ARG 18 HH11 ARG 18 -4.006 -18.806 -2.471 142 HH12 ARG 18 HH12 ARG 18 -4.086 -20.514 -2.747 143 HH21 ARG 18 HH21 ARG 18 -0.978 -20.695 -4.338 144 HH22 ARG 18 HH22 ARG 18 -2.363 -21.588 -3.808 145 H ARG 19 H ARG 19 -1.434 -14.627 -6.962 146 HA ARG 19 HA ARG 19 -0.787 -14.973 -9.593 147 HB2 ARG 19 HB2 ARG 19 -3.085 -14.647 -10.676 148 HB3 ARG 19 HB3 ARG 19 -2.683 -16.260 -10.102 149 HG2 ARG 19 HG2 ARG 19 -3.936 -14.880 -7.971 150 HG3 ARG 19 HG3 ARG 19 -4.906 -14.632 -9.425 151 HD2 ARG 19 HD2 ARG 19 -4.472 -17.231 -9.704 152 HD3 ARG 19 HD3 ARG 19 -4.279 -17.137 -7.954 153 HE ARG 19 HE ARG 19 -6.623 -15.797 -8.574 154 HH11 ARG 19 HH11 ARG 19 -5.349 -19.025 -8.846 155 HH12 ARG 19 HH12 ARG 19 -6.898 -19.789 -8.707 156 HH21 ARG 19 HH21 ARG 19 -8.668 -16.790 -8.390 157 HH22 ARG 19 HH22 ARG 19 -8.786 -18.516 -8.449 158 H ASP 20 H ASP 20 -1.465 -13.067 -11.001 159 HA ASP 20 HA ASP 20 -0.785 -10.684 -9.807 160 HB2 ASP 20 HB2 ASP 20 -2.452 -11.168 -12.281 161 HB3 ASP 20 HB3 ASP 20 -1.832 -9.586 -11.815 162 H SER 21 H SER 21 -3.945 -12.164 -10.091 163 HA SER 21 HA SER 21 -5.595 -10.012 -9.519 164 HB2 SER 21 HB2 SER 21 -5.913 -12.768 -9.783 165 HB3 SER 21 HB3 SER 21 -6.465 -12.425 -8.143 166 HG SER 21 HG SER 21 -7.611 -11.791 -10.544 167 H ASP 22 H ASP 22 -3.432 -11.752 -7.449 168 HA ASP 22 HA ASP 22 -4.434 -11.347 -4.932 169 HB2 ASP 22 HB2 ASP 22 -1.586 -11.186 -5.919 170 HB3 ASP 22 HB3 ASP 22 -2.007 -11.134 -4.210 171 H CYS 23 H CYS 23 -2.955 -8.996 -7.070 172 HA CYS 23 HA CYS 23 -3.829 -6.871 -5.253 173 HB2 CYS 23 HB2 CYS 23 -1.467 -5.893 -6.380 174 HB3 CYS 23 HB3 CYS 23 -1.719 -6.367 -4.703 175 HA PRO 24 HA PRO 24 -5.457 -5.785 -9.316 176 HB2 PRO 24 HB2 PRO 24 -7.248 -3.984 -8.357 177 HB3 PRO 24 HB3 PRO 24 -7.538 -5.728 -8.344 178 HG2 PRO 24 HG2 PRO 24 -6.598 -3.947 -6.129 179 HG3 PRO 24 HG3 PRO 24 -7.792 -5.257 -6.081 180 HD2 PRO 24 HD2 PRO 24 -5.242 -5.578 -5.228 181 HD3 PRO 24 HD3 PRO 24 -6.175 -6.896 -5.966 182 H GLY 25 H GLY 25 -4.338 -3.620 -6.765 183 HA2 GLY 25 HA2 GLY 25 -4.214 -1.266 -8.334 184 HA3 GLY 25 HA3 GLY 25 -3.340 -1.552 -6.837 185 H ALA 26 H ALA 26 -1.337 -0.851 -7.330 186 HA ALA 26 HA ALA 26 -0.089 -1.302 -9.853 187 HB1 ALA 26 HB1 ALA 26 1.679 -0.062 -9.054 188 HB2 ALA 26 HB2 ALA 26 0.351 0.544 -8.064 189 HB3 ALA 26 HB3 ALA 26 1.477 -0.640 -7.400 190 H CYS 27 H CYS 27 0.803 -2.483 -6.602 191 HA CYS 27 HA CYS 27 2.734 -4.278 -7.211 192 HB2 CYS 27 HB2 CYS 27 1.652 -5.715 -5.308 193 HB3 CYS 27 HB3 CYS 27 2.304 -4.121 -4.940 194 H ILE 28 H ILE 28 2.824 -6.526 -7.661 195 HA ILE 28 HA ILE 28 0.424 -7.879 -8.556 196 HB ILE 28 HB ILE 28 1.513 -8.443 -10.782 197 HG12 ILE 28 HG12 ILE 28 3.138 -5.990 -10.077 198 HG13 ILE 28 HG13 ILE 28 3.763 -7.625 -10.266 199 HG21 ILE 28 HG21 ILE 28 0.864 -5.535 -10.696 200 HG22 ILE 28 HG22 ILE 28 0.341 -6.772 -11.837 201 HG23 ILE 28 HG23 ILE 28 -0.364 -6.709 -10.222 202 HD11 ILE 28 HD11 ILE 28 4.296 -6.552 -12.261 203 HD12 ILE 28 HD12 ILE 28 2.857 -7.496 -12.649 204 HD13 ILE 28 HD13 ILE 28 2.723 -5.761 -12.364 205 H CYS 29 H CYS 29 0.856 -10.139 -9.178 206 HA CYS 29 HA CYS 29 2.735 -11.326 -7.368 207 HB2 CYS 29 HB2 CYS 29 0.703 -12.503 -7.608 208 HB3 CYS 29 HB3 CYS 29 0.771 -12.430 -9.365 209 H ARG 30 H ARG 30 4.832 -11.412 -7.815 210 HA ARG 30 HA ARG 30 5.648 -12.072 -10.569 211 HB2 ARG 30 HB2 ARG 30 7.784 -10.825 -9.132 212 HB3 ARG 30 HB3 ARG 30 6.979 -10.283 -10.599 213 HG2 ARG 30 HG2 ARG 30 6.342 -8.520 -9.403 214 HG3 ARG 30 HG3 ARG 30 5.179 -9.609 -8.644 215 HD2 ARG 30 HD2 ARG 30 6.172 -9.255 -6.691 216 HD3 ARG 30 HD3 ARG 30 7.634 -10.007 -7.328 217 HE ARG 30 HE ARG 30 7.113 -7.168 -7.032 218 HH11 ARG 30 HH11 ARG 30 9.132 -9.661 -8.385 219 HH12 ARG 30 HH12 ARG 30 10.494 -8.614 -8.615 220 HH21 ARG 30 HH21 ARG 30 8.898 -5.781 -7.330 221 HH22 ARG 30 HH22 ARG 30 10.360 -6.408 -8.014 222 H GLY 31 H GLY 31 8.055 -12.894 -10.511 223 HA2 GLY 31 HA2 GLY 31 8.057 -15.399 -9.281 224 HA3 GLY 31 HA3 GLY 31 9.478 -14.600 -9.938 225 H ASN 32 H ASN 32 8.761 -12.344 -7.927 226 HA ASN 32 HA ASN 32 10.683 -12.952 -6.010 227 HB2 ASN 32 HB2 ASN 32 10.295 -10.857 -5.264 228 HB3 ASN 32 HB3 ASN 32 9.220 -10.729 -6.653 229 HD21 ASN 32 HD21 ASN 32 9.388 -11.360 -3.217 230 HD22 ASN 32 HD22 ASN 32 7.735 -10.993 -2.875 231 H GLY 33 H GLY 33 7.570 -14.200 -6.324 232 HA2 GLY 33 HA2 GLY 33 6.629 -15.900 -5.031 233 HA3 GLY 33 HA3 GLY 33 7.814 -15.570 -3.777 234 H TYR 34 H TYR 34 5.762 -13.125 -5.234 235 HA TYR 34 HA TYR 34 3.644 -13.146 -3.425 236 HB2 TYR 34 HB2 TYR 34 5.091 -12.680 -1.618 237 HB3 TYR 34 HB3 TYR 34 6.025 -11.519 -2.555 238 HD1 TYR 34 HD2 TYR 34 2.790 -12.075 -0.852 239 HD2 TYR 34 HD1 TYR 34 5.394 -9.233 -2.653 240 HE1 TYR 34 HE2 TYR 34 1.410 -10.249 0.049 241 HE2 TYR 34 HE1 TYR 34 4.023 -7.399 -1.755 242 HH TYR 34 HH TYR 34 1.442 -7.220 -1.019 243 H CYS 35 H CYS 35 2.396 -11.093 -3.449 244 HA CYS 35 HA CYS 35 2.321 -10.032 -6.092 245 HB2 CYS 35 HB2 CYS 35 0.309 -10.385 -4.653 246 HB3 CYS 35 HB3 CYS 35 0.846 -9.047 -3.642 247 H GLY 36 H GLY 36 4.644 -9.274 -5.930 248 HA2 GLY 36 HA2 GLY 36 5.046 -6.811 -4.443 249 HA3 GLY 36 HA3 GLY 36 6.236 -7.638 -5.438 Start of MODEL 7 1 H1 GLY 1 H GLY 1 1.737 -2.129 1.069 2 HA2 GLY 1 HA2 GLY 1 0.256 -0.458 0.313 3 HA3 GLY 1 HA3 GLY 1 1.782 0.405 0.421 4 H CYS 2 H CYS 2 -0.590 -0.983 -1.691 5 HA CYS 2 HA CYS 2 0.364 0.641 -3.876 6 HB2 CYS 2 HB2 CYS 2 0.391 -1.365 -5.449 7 HB3 CYS 2 HB3 CYS 2 1.761 -1.209 -4.354 8 H ILE 3 H ILE 3 -1.718 1.573 -3.455 9 HA ILE 3 HA ILE 3 -3.948 1.882 -3.800 10 HB ILE 3 HB ILE 3 -4.075 -0.193 -5.914 11 HG12 ILE 3 HG12 ILE 3 -2.294 2.245 -6.091 12 HG13 ILE 3 HG13 ILE 3 -1.794 0.562 -6.216 13 HG21 ILE 3 HG21 ILE 3 -4.699 2.494 -6.706 14 HG22 ILE 3 HG22 ILE 3 -5.757 1.089 -6.588 15 HG23 ILE 3 HG23 ILE 3 -5.490 2.111 -5.176 16 HD11 ILE 3 HD11 ILE 3 -3.521 0.591 -8.220 17 HD12 ILE 3 HD12 ILE 3 -3.111 2.307 -8.208 18 HD13 ILE 3 HD13 ILE 3 -1.843 1.098 -8.414 19 H LEU 4 H LEU 4 -6.126 0.661 -4.089 20 HA LEU 4 HA LEU 4 -6.075 -1.964 -2.801 21 HB2 LEU 4 HB2 LEU 4 -6.552 0.322 -1.348 22 HB3 LEU 4 HB3 LEU 4 -8.175 -0.237 -1.746 23 HG LEU 4 HG LEU 4 -7.170 -2.534 -0.838 24 HD11 LEU 4 HD11 LEU 4 -4.994 -1.095 -0.409 25 HD12 LEU 4 HD12 LEU 4 -5.494 -2.375 0.697 26 HD13 LEU 4 HD13 LEU 4 -5.850 -0.690 1.079 27 HD21 LEU 4 HD21 LEU 4 -7.965 -1.608 1.498 28 HD22 LEU 4 HD22 LEU 4 -9.105 -1.864 0.177 29 HD23 LEU 4 HD23 LEU 4 -8.498 -0.243 0.517 30 H ASN 5 H ASN 5 -7.519 -3.330 -3.650 31 HA ASN 5 HA ASN 5 -10.099 -2.716 -4.502 32 HB2 ASN 5 HB2 ASN 5 -8.254 -1.734 -6.322 33 HB3 ASN 5 HB3 ASN 5 -8.740 -3.274 -7.025 34 HD21 ASN 5 HD21 ASN 5 -9.367 -0.123 -7.123 35 HD22 ASN 5 HD22 ASN 5 -11.045 -0.141 -7.532 36 H GLY 6 H GLY 6 -8.602 -4.764 -3.130 37 HA2 GLY 6 HA2 GLY 6 -9.849 -7.039 -3.467 38 HA3 GLY 6 HA3 GLY 6 -8.837 -7.088 -4.903 39 H ARG 7 H ARG 7 -8.847 -7.123 -1.394 40 HA ARG 7 HA ARG 7 -7.398 -8.012 0.118 41 HB2 ARG 7 HB2 ARG 7 -6.791 -9.466 -2.371 42 HB3 ARG 7 HB3 ARG 7 -5.495 -9.467 -1.182 43 HG2 ARG 7 HG2 ARG 7 -6.706 -11.386 -0.694 44 HG3 ARG 7 HG3 ARG 7 -7.288 -10.212 0.488 45 HD2 ARG 7 HD2 ARG 7 -8.973 -9.816 -1.643 46 HD3 ARG 7 HD3 ARG 7 -8.706 -11.559 -1.680 47 HE ARG 7 HE ARG 7 -9.290 -10.723 0.953 48 HH11 ARG 7 HH11 ARG 7 -10.795 -11.214 -2.148 49 HH12 ARG 7 HH12 ARG 7 -12.360 -11.544 -1.481 50 HH21 ARG 7 HH21 ARG 7 -11.345 -11.156 1.842 51 HH22 ARG 7 HH22 ARG 7 -12.672 -11.510 0.788 52 H THR 8 H THR 8 -4.964 -7.964 -2.415 53 HA THR 8 HA THR 8 -2.994 -6.842 -2.621 54 HB THR 8 HB THR 8 -3.710 -4.390 -1.241 55 HG1 THR 8 HG1 THR 8 -5.796 -4.555 -1.690 56 HG21 THR 8 HG21 THR 8 -2.685 -5.298 -3.842 57 HG22 THR 8 HG22 THR 8 -2.219 -3.908 -2.861 58 HG23 THR 8 HG23 THR 8 -3.640 -3.818 -3.900 59 H ASP 9 H ASP 9 -1.460 -7.720 -1.372 60 HA ASP 9 HA ASP 9 -0.158 -8.208 0.436 61 HB2 ASP 9 HB2 ASP 9 0.168 -5.672 0.017 62 HB3 ASP 9 HB3 ASP 9 -0.799 -5.460 1.474 63 H LEU 10 H LEU 10 -1.773 -9.737 1.197 64 HA LEU 10 HA LEU 10 -2.896 -8.902 3.784 65 HB2 LEU 10 HB2 LEU 10 -4.312 -9.815 1.468 66 HB3 LEU 10 HB3 LEU 10 -4.501 -10.985 2.772 67 HG LEU 10 HG LEU 10 -6.345 -9.414 2.763 68 HD11 LEU 10 HD11 LEU 10 -5.741 -10.251 4.911 69 HD12 LEU 10 HD12 LEU 10 -6.101 -8.533 5.088 70 HD13 LEU 10 HD13 LEU 10 -4.426 -9.085 5.060 71 HD21 LEU 10 HD21 LEU 10 -6.148 -7.201 2.495 72 HD22 LEU 10 HD22 LEU 10 -4.515 -7.561 1.935 73 HD23 LEU 10 HD23 LEU 10 -4.789 -7.090 3.613 74 H GLY 11 H GLY 11 -3.833 -11.234 4.743 75 HA2 GLY 11 HA2 GLY 11 -1.628 -12.541 5.757 76 HA3 GLY 11 HA3 GLY 11 -3.237 -13.246 5.681 77 H THR 12 H THR 12 -3.832 -14.132 3.460 78 HA THR 12 HA THR 12 -1.997 -16.154 2.779 79 HB THR 12 HB THR 12 -3.757 -15.844 0.595 80 HG1 THR 12 HG1 THR 12 -5.470 -14.923 1.409 81 HG21 THR 12 HG21 THR 12 -2.970 -17.929 1.781 82 HG22 THR 12 HG22 THR 12 -4.682 -17.900 1.360 83 HG23 THR 12 HG23 THR 12 -4.177 -17.585 3.019 84 H LEU 13 H LEU 13 -2.930 -13.176 1.075 85 HA LEU 13 HA LEU 13 -1.221 -13.576 -1.143 86 HB2 LEU 13 HB2 LEU 13 -3.227 -11.875 -0.615 87 HB3 LEU 13 HB3 LEU 13 -1.856 -10.810 -0.311 88 HG LEU 13 HG LEU 13 -2.630 -12.158 -2.887 89 HD11 LEU 13 HD11 LEU 13 -2.459 -9.345 -1.888 90 HD12 LEU 13 HD12 LEU 13 -3.774 -10.153 -2.740 91 HD13 LEU 13 HD13 LEU 13 -2.311 -9.694 -3.611 92 HD21 LEU 13 HD21 LEU 13 -0.219 -12.422 -2.576 93 HD22 LEU 13 HD22 LEU 13 -0.066 -10.692 -2.266 94 HD23 LEU 13 HD23 LEU 13 -0.579 -11.262 -3.855 95 H LEU 14 H LEU 14 -0.495 -12.936 2.043 96 HA LEU 14 HA LEU 14 1.466 -11.054 2.140 97 HB2 LEU 14 HB2 LEU 14 0.755 -12.305 4.085 98 HB3 LEU 14 HB3 LEU 14 1.482 -13.774 3.437 99 HG LEU 14 HG LEU 14 3.662 -12.215 3.532 100 HD11 LEU 14 HD11 LEU 14 3.620 -10.950 5.648 101 HD12 LEU 14 HD12 LEU 14 1.885 -11.241 5.764 102 HD13 LEU 14 HD13 LEU 14 2.530 -10.282 4.432 103 HD21 LEU 14 HD21 LEU 14 4.296 -13.422 5.465 104 HD22 LEU 14 HD22 LEU 14 3.209 -14.476 4.560 105 HD23 LEU 14 HD23 LEU 14 2.621 -13.615 5.984 106 H PHE 15 H PHE 15 1.632 -14.195 0.628 107 HA PHE 15 HA PHE 15 3.959 -13.448 -0.855 108 HB2 PHE 15 HB2 PHE 15 4.199 -15.413 1.405 109 HB3 PHE 15 HB3 PHE 15 5.230 -15.555 -0.015 110 HD1 PHE 15 HD2 PHE 15 6.383 -13.262 -0.722 111 HD2 PHE 15 HD1 PHE 15 5.000 -14.220 3.187 112 HE1 PHE 15 HE2 PHE 15 7.922 -11.593 0.228 113 HE2 PHE 15 HE1 PHE 15 6.535 -12.553 4.143 114 HZ PHE 15 HZ PHE 15 8.000 -11.237 2.663 115 H ARG 16 H ARG 16 4.818 -15.634 -1.983 116 HA ARG 16 HA ARG 16 4.308 -17.087 -3.667 117 HB2 ARG 16 HB2 ARG 16 3.972 -18.497 -1.647 118 HB3 ARG 16 HB3 ARG 16 2.267 -18.067 -1.665 119 HG2 ARG 16 HG2 ARG 16 2.963 -19.040 -4.241 120 HG3 ARG 16 HG3 ARG 16 3.572 -20.171 -3.031 121 HD2 ARG 16 HD2 ARG 16 0.931 -19.300 -2.324 122 HD3 ARG 16 HD3 ARG 16 0.940 -19.910 -3.978 123 HE ARG 16 HE ARG 16 2.288 -21.818 -2.632 124 HH11 ARG 16 HH11 ARG 16 -0.773 -20.251 -2.089 125 HH12 ARG 16 HH12 ARG 16 -1.488 -21.626 -1.314 126 HH21 ARG 16 HH21 ARG 16 1.359 -23.635 -1.613 127 HH22 ARG 16 HH22 ARG 16 -0.274 -23.550 -1.043 128 H CYS 17 H CYS 17 2.748 -14.538 -3.479 129 HA CYS 17 HA CYS 17 0.314 -14.121 -3.970 130 HB2 CYS 17 HB2 CYS 17 0.720 -13.200 -6.303 131 HB3 CYS 17 HB3 CYS 17 1.795 -12.607 -5.042 132 H ARG 18 H ARG 18 -1.231 -15.635 -4.146 133 HA ARG 18 HA ARG 18 -1.173 -17.999 -5.557 134 HB2 ARG 18 HB2 ARG 18 -3.809 -17.410 -5.706 135 HB3 ARG 18 HB3 ARG 18 -3.021 -18.014 -4.254 136 HG2 ARG 18 HG2 ARG 18 -2.967 -15.093 -4.610 137 HG3 ARG 18 HG3 ARG 18 -4.555 -15.808 -4.329 138 HD2 ARG 18 HD2 ARG 18 -2.111 -15.962 -2.583 139 HD3 ARG 18 HD3 ARG 18 -3.678 -15.248 -2.200 140 HE ARG 18 HE ARG 18 -4.371 -17.779 -2.595 141 HH11 ARG 18 HH11 ARG 18 -1.696 -16.432 -0.821 142 HH12 ARG 18 HH12 ARG 18 -1.624 -17.737 0.317 143 HH21 ARG 18 HH21 ARG 18 -4.287 -19.502 -1.103 144 HH22 ARG 18 HH22 ARG 18 -3.098 -19.483 0.155 145 H ARG 19 H ARG 19 -1.514 -14.798 -6.763 146 HA ARG 19 HA ARG 19 -1.007 -15.296 -9.380 147 HB2 ARG 19 HB2 ARG 19 -2.923 -16.735 -9.559 148 HB3 ARG 19 HB3 ARG 19 -3.969 -15.519 -8.837 149 HG2 ARG 19 HG2 ARG 19 -4.281 -14.462 -10.781 150 HG3 ARG 19 HG3 ARG 19 -2.584 -14.610 -11.244 151 HD2 ARG 19 HD2 ARG 19 -4.596 -16.852 -11.379 152 HD3 ARG 19 HD3 ARG 19 -4.152 -15.828 -12.744 153 HE ARG 19 HE ARG 19 -2.620 -17.987 -11.624 154 HH11 ARG 19 HH11 ARG 19 -2.490 -15.034 -13.463 155 HH12 ARG 19 HH12 ARG 19 -1.006 -15.442 -14.259 156 HH21 ARG 19 HH21 ARG 19 -0.666 -18.535 -12.665 157 HH22 ARG 19 HH22 ARG 19 0.030 -17.434 -13.805 158 H ASP 20 H ASP 20 -1.140 -13.452 -10.686 159 HA ASP 20 HA ASP 20 -0.928 -10.998 -9.501 160 HB2 ASP 20 HB2 ASP 20 -1.980 -11.520 -12.289 161 HB3 ASP 20 HB3 ASP 20 -1.274 -10.011 -11.715 162 H SER 21 H SER 21 -3.817 -12.737 -10.245 163 HA SER 21 HA SER 21 -5.693 -10.688 -10.398 164 HB2 SER 21 HB2 SER 21 -7.351 -12.334 -9.878 165 HB3 SER 21 HB3 SER 21 -6.090 -13.155 -10.798 166 HG SER 21 HG SER 21 -6.831 -14.265 -8.859 167 H ASP 22 H ASP 22 -4.083 -12.086 -7.628 168 HA ASP 22 HA ASP 22 -5.792 -10.892 -5.669 169 HB2 ASP 22 HB2 ASP 22 -4.106 -11.618 -4.051 170 HB3 ASP 22 HB3 ASP 22 -4.478 -12.915 -5.183 171 H CYS 23 H CYS 23 -3.558 -9.599 -7.755 172 HA CYS 23 HA CYS 23 -2.849 -7.419 -5.910 173 HB2 CYS 23 HB2 CYS 23 -1.390 -8.816 -7.986 174 HB3 CYS 23 HB3 CYS 23 -1.402 -7.081 -8.282 175 HA PRO 24 HA PRO 24 -6.081 -5.476 -8.500 176 HB2 PRO 24 HB2 PRO 24 -6.850 -3.719 -6.579 177 HB3 PRO 24 HB3 PRO 24 -7.452 -5.379 -6.659 178 HG2 PRO 24 HG2 PRO 24 -5.285 -4.231 -4.942 179 HG3 PRO 24 HG3 PRO 24 -6.571 -5.371 -4.507 180 HD2 PRO 24 HD2 PRO 24 -4.033 -6.165 -5.017 181 HD3 PRO 24 HD3 PRO 24 -5.444 -7.177 -5.390 182 H GLY 25 H GLY 25 -3.957 -3.701 -6.239 183 HA2 GLY 25 HA2 GLY 25 -3.935 -1.306 -7.748 184 HA3 GLY 25 HA3 GLY 25 -2.788 -1.739 -6.488 185 H ALA 26 H ALA 26 -1.193 -0.679 -7.832 186 HA ALA 26 HA ALA 26 -0.533 -1.502 -10.431 187 HB1 ALA 26 HB1 ALA 26 0.412 0.383 -8.617 188 HB2 ALA 26 HB2 ALA 26 1.790 -0.672 -8.931 189 HB3 ALA 26 HB3 ALA 26 0.970 0.128 -10.271 190 H CYS 27 H CYS 27 0.706 -2.565 -7.277 191 HA CYS 27 HA CYS 27 2.735 -4.235 -7.993 192 HB2 CYS 27 HB2 CYS 27 1.913 -5.704 -6.030 193 HB3 CYS 27 HB3 CYS 27 2.359 -4.034 -5.692 194 H ILE 28 H ILE 28 2.831 -6.594 -8.205 195 HA ILE 28 HA ILE 28 0.464 -7.969 -9.128 196 HB ILE 28 HB ILE 28 1.613 -8.629 -11.301 197 HG12 ILE 28 HG12 ILE 28 3.201 -6.132 -10.668 198 HG13 ILE 28 HG13 ILE 28 3.844 -7.768 -10.762 199 HG21 ILE 28 HG21 ILE 28 0.893 -5.722 -11.262 200 HG22 ILE 28 HG22 ILE 28 0.530 -6.942 -12.482 201 HG23 ILE 28 HG23 ILE 28 -0.316 -6.964 -10.934 202 HD11 ILE 28 HD11 ILE 28 4.424 -6.916 -12.807 203 HD12 ILE 28 HD12 ILE 28 2.888 -7.697 -13.182 204 HD13 ILE 28 HD13 ILE 28 2.956 -5.951 -12.944 205 H CYS 29 H CYS 29 0.861 -10.251 -9.561 206 HA CYS 29 HA CYS 29 2.753 -11.342 -7.704 207 HB2 CYS 29 HB2 CYS 29 0.691 -12.491 -7.836 208 HB3 CYS 29 HB3 CYS 29 0.747 -12.557 -9.595 209 H ARG 30 H ARG 30 4.810 -11.766 -8.117 210 HA ARG 30 HA ARG 30 5.573 -12.550 -10.849 211 HB2 ARG 30 HB2 ARG 30 7.645 -11.265 -10.629 212 HB3 ARG 30 HB3 ARG 30 6.237 -10.221 -10.484 213 HG2 ARG 30 HG2 ARG 30 7.455 -11.317 -8.003 214 HG3 ARG 30 HG3 ARG 30 8.276 -10.003 -8.848 215 HD2 ARG 30 HD2 ARG 30 5.433 -9.990 -7.841 216 HD3 ARG 30 HD3 ARG 30 6.796 -9.120 -7.137 217 HE ARG 30 HE ARG 30 5.230 -8.328 -9.393 218 HH11 ARG 30 HH11 ARG 30 8.391 -8.136 -7.947 219 HH12 ARG 30 HH12 ARG 30 8.803 -6.648 -8.733 220 HH21 ARG 30 HH21 ARG 30 5.761 -6.368 -10.433 221 HH22 ARG 30 HH22 ARG 30 7.306 -5.643 -10.146 222 H GLY 31 H GLY 31 7.974 -13.402 -10.756 223 HA2 GLY 31 HA2 GLY 31 7.952 -15.797 -9.323 224 HA3 GLY 31 HA3 GLY 31 9.376 -15.081 -10.063 225 H ASN 32 H ASN 32 8.793 -12.645 -8.266 226 HA ASN 32 HA ASN 32 10.712 -13.125 -6.327 227 HB2 ASN 32 HB2 ASN 32 10.363 -10.972 -5.742 228 HB3 ASN 32 HB3 ASN 32 9.274 -10.941 -7.126 229 HD21 ASN 32 HD21 ASN 32 9.450 -11.384 -3.649 230 HD22 ASN 32 HD22 ASN 32 7.815 -10.929 -3.321 231 H GLY 33 H GLY 33 7.521 -14.267 -6.460 232 HA2 GLY 33 HA2 GLY 33 6.593 -15.864 -5.022 233 HA3 GLY 33 HA3 GLY 33 7.815 -15.464 -3.824 234 H TYR 34 H TYR 34 5.766 -13.109 -5.434 235 HA TYR 34 HA TYR 34 3.691 -12.928 -3.599 236 HB2 TYR 34 HB2 TYR 34 5.186 -12.390 -1.847 237 HB3 TYR 34 HB3 TYR 34 6.124 -11.307 -2.869 238 HD1 TYR 34 HD2 TYR 34 2.929 -11.694 -1.056 239 HD2 TYR 34 HD1 TYR 34 5.514 -9.021 -3.123 240 HE1 TYR 34 HE2 TYR 34 1.598 -9.791 -0.246 241 HE2 TYR 34 HE1 TYR 34 4.191 -7.110 -2.319 242 HH TYR 34 HH TYR 34 1.934 -6.647 -1.500 243 H CYS 35 H CYS 35 2.514 -10.831 -3.738 244 HA CYS 35 HA CYS 35 2.455 -9.942 -6.452 245 HB2 CYS 35 HB2 CYS 35 0.386 -10.132 -5.202 246 HB3 CYS 35 HB3 CYS 35 0.966 -8.983 -4.001 247 H GLY 36 H GLY 36 4.763 -9.197 -6.385 248 HA2 GLY 36 HA2 GLY 36 5.745 -7.076 -4.932 249 HA3 GLY 36 HA3 GLY 36 6.206 -7.418 -6.593 Start of MODEL 8 1 H1 GLY 1 H GLY 1 -0.003 0.385 1.985 2 HA2 GLY 1 HA2 GLY 1 1.879 -0.699 0.657 3 HA3 GLY 1 HA3 GLY 1 0.283 -1.373 0.366 4 H CYS 2 H CYS 2 -0.766 -0.969 -1.574 5 HA CYS 2 HA CYS 2 0.387 0.797 -3.537 6 HB2 CYS 2 HB2 CYS 2 0.650 -1.105 -5.214 7 HB3 CYS 2 HB3 CYS 2 1.884 -0.986 -3.963 8 H ILE 3 H ILE 3 -1.858 1.515 -3.033 9 HA ILE 3 HA ILE 3 -4.033 1.801 -3.636 10 HB ILE 3 HB ILE 3 -3.662 0.015 -6.007 11 HG12 ILE 3 HG12 ILE 3 -1.578 1.257 -5.919 12 HG13 ILE 3 HG13 ILE 3 -2.587 1.908 -7.206 13 HG21 ILE 3 HG21 ILE 3 -4.825 2.253 -6.912 14 HG22 ILE 3 HG22 ILE 3 -5.727 0.911 -6.210 15 HG23 ILE 3 HG23 ILE 3 -5.333 2.320 -5.225 16 HD11 ILE 3 HD11 ILE 3 -1.585 3.174 -4.777 17 HD12 ILE 3 HD12 ILE 3 -2.083 3.886 -6.313 18 HD13 ILE 3 HD13 ILE 3 -3.292 3.476 -5.097 19 H LEU 4 H LEU 4 -6.120 0.631 -4.096 20 HA LEU 4 HA LEU 4 -6.058 -2.189 -3.312 21 HB2 LEU 4 HB2 LEU 4 -7.500 0.025 -1.892 22 HB3 LEU 4 HB3 LEU 4 -8.063 -1.642 -1.803 23 HG LEU 4 HG LEU 4 -5.435 -1.899 -1.103 24 HD11 LEU 4 HD11 LEU 4 -5.275 -0.094 0.736 25 HD12 LEU 4 HD12 LEU 4 -6.401 0.809 -0.277 26 HD13 LEU 4 HD13 LEU 4 -4.829 0.330 -0.917 27 HD21 LEU 4 HD21 LEU 4 -7.095 -3.027 0.101 28 HD22 LEU 4 HD22 LEU 4 -7.936 -1.533 0.516 29 HD23 LEU 4 HD23 LEU 4 -6.386 -1.911 1.268 30 H ASN 5 H ASN 5 -7.620 -3.425 -4.239 31 HA ASN 5 HA ASN 5 -10.103 -2.593 -5.169 32 HB2 ASN 5 HB2 ASN 5 -8.112 -1.559 -6.800 33 HB3 ASN 5 HB3 ASN 5 -8.646 -2.997 -7.665 34 HD21 ASN 5 HD21 ASN 5 -9.050 0.140 -7.658 35 HD22 ASN 5 HD22 ASN 5 -10.720 0.276 -8.081 36 H GLY 6 H GLY 6 -8.828 -4.835 -3.910 37 HA2 GLY 6 HA2 GLY 6 -10.213 -6.977 -4.723 38 HA3 GLY 6 HA3 GLY 6 -8.869 -6.992 -5.856 39 H ARG 7 H ARG 7 -8.767 -6.034 -2.458 40 HA ARG 7 HA ARG 7 -7.669 -6.895 -0.659 41 HB2 ARG 7 HB2 ARG 7 -7.445 -9.512 -2.133 42 HB3 ARG 7 HB3 ARG 7 -7.493 -9.241 -0.396 43 HG2 ARG 7 HG2 ARG 7 -9.871 -8.238 -0.997 44 HG3 ARG 7 HG3 ARG 7 -9.702 -9.338 -2.366 45 HD2 ARG 7 HD2 ARG 7 -9.835 -11.192 -1.067 46 HD3 ARG 7 HD3 ARG 7 -9.022 -10.425 0.297 47 HE ARG 7 HE ARG 7 -11.577 -9.282 -0.074 48 HH11 ARG 7 HH11 ARG 7 -10.032 -12.193 1.050 49 HH12 ARG 7 HH12 ARG 7 -11.313 -12.606 2.142 50 HH21 ARG 7 HH21 ARG 7 -13.269 -9.816 1.360 51 HH22 ARG 7 HH22 ARG 7 -13.154 -11.254 2.316 52 H THR 8 H THR 8 -5.891 -5.529 -1.100 53 HA THR 8 HA THR 8 -3.635 -6.748 -2.525 54 HB THR 8 HB THR 8 -3.409 -3.975 -1.498 55 HG1 THR 8 HG1 THR 8 -5.480 -3.821 -2.287 56 HG21 THR 8 HG21 THR 8 -2.500 -5.587 -3.826 57 HG22 THR 8 HG22 THR 8 -1.593 -4.481 -2.793 58 HG23 THR 8 HG23 THR 8 -2.662 -3.845 -4.042 59 H ASP 9 H ASP 9 -1.792 -7.328 -1.520 60 HA ASP 9 HA ASP 9 -0.497 -8.050 0.223 61 HB2 ASP 9 HB2 ASP 9 -0.832 -5.435 1.599 62 HB3 ASP 9 HB3 ASP 9 0.638 -6.325 1.214 63 H LEU 10 H LEU 10 -2.172 -9.516 0.973 64 HA LEU 10 HA LEU 10 -3.295 -8.683 3.567 65 HB2 LEU 10 HB2 LEU 10 -4.578 -9.801 1.261 66 HB3 LEU 10 HB3 LEU 10 -4.727 -10.913 2.620 67 HG LEU 10 HG LEU 10 -5.594 -8.022 2.637 68 HD11 LEU 10 HD11 LEU 10 -7.433 -8.705 1.607 69 HD12 LEU 10 HD12 LEU 10 -7.770 -9.757 2.981 70 HD13 LEU 10 HD13 LEU 10 -6.863 -10.374 1.600 71 HD21 LEU 10 HD21 LEU 10 -4.974 -8.742 4.841 72 HD22 LEU 10 HD22 LEU 10 -5.883 -10.242 4.656 73 HD23 LEU 10 HD23 LEU 10 -6.734 -8.699 4.737 74 H GLY 11 H GLY 11 -4.078 -11.009 4.634 75 HA2 GLY 11 HA2 GLY 11 -1.737 -12.138 5.644 76 HA3 GLY 11 HA3 GLY 11 -3.334 -12.861 5.766 77 H THR 12 H THR 12 -4.076 -13.810 3.534 78 HA THR 12 HA THR 12 -2.370 -15.975 2.970 79 HB THR 12 HB THR 12 -4.501 -15.103 1.045 80 HG1 THR 12 HG1 THR 12 -5.871 -15.117 2.655 81 HG21 THR 12 HG21 THR 12 -4.189 -17.875 2.064 82 HG22 THR 12 HG22 THR 12 -2.928 -17.254 0.999 83 HG23 THR 12 HG23 THR 12 -4.603 -17.303 0.449 84 H LEU 13 H LEU 13 -2.992 -12.951 1.246 85 HA LEU 13 HA LEU 13 -1.265 -13.648 -0.949 86 HB2 LEU 13 HB2 LEU 13 -3.214 -12.197 -1.257 87 HB3 LEU 13 HB3 LEU 13 -2.491 -11.002 -0.181 88 HG LEU 13 HG LEU 13 -2.378 -10.695 -2.771 89 HD11 LEU 13 HD11 LEU 13 -0.762 -9.873 -0.582 90 HD12 LEU 13 HD12 LEU 13 -1.110 -9.015 -2.083 91 HD13 LEU 13 HD13 LEU 13 0.276 -10.101 -1.990 92 HD21 LEU 13 HD21 LEU 13 -0.160 -12.657 -2.232 93 HD22 LEU 13 HD22 LEU 13 -0.186 -11.585 -3.632 94 HD23 LEU 13 HD23 LEU 13 -1.461 -12.786 -3.416 95 H LEU 14 H LEU 14 -0.633 -12.847 2.156 96 HA LEU 14 HA LEU 14 1.237 -10.843 2.200 97 HB2 LEU 14 HB2 LEU 14 0.503 -11.971 4.204 98 HB3 LEU 14 HB3 LEU 14 1.276 -13.467 3.682 99 HG LEU 14 HG LEU 14 3.479 -12.323 3.878 100 HD11 LEU 14 HD11 LEU 14 3.686 -10.152 4.319 101 HD12 LEU 14 HD12 LEU 14 2.503 -10.221 5.624 102 HD13 LEU 14 HD13 LEU 14 1.966 -10.018 3.957 103 HD21 LEU 14 HD21 LEU 14 1.970 -12.177 6.471 104 HD22 LEU 14 HD22 LEU 14 3.652 -12.632 6.200 105 HD23 LEU 14 HD23 LEU 14 2.352 -13.712 5.692 106 H PHE 15 H PHE 15 1.502 -13.978 0.762 107 HA PHE 15 HA PHE 15 3.887 -13.274 -0.615 108 HB2 PHE 15 HB2 PHE 15 4.366 -14.260 1.917 109 HB3 PHE 15 HB3 PHE 15 4.511 -15.695 0.907 110 HD1 PHE 15 HD2 PHE 15 5.494 -12.114 0.511 111 HD2 PHE 15 HD1 PHE 15 6.697 -16.197 0.459 112 HE1 PHE 15 HE2 PHE 15 7.771 -11.431 -0.124 113 HE2 PHE 15 HE1 PHE 15 8.976 -15.520 -0.175 114 HZ PHE 15 HZ PHE 15 9.515 -13.135 -0.469 115 H ARG 16 H ARG 16 4.835 -15.475 -1.622 116 HA ARG 16 HA ARG 16 4.411 -16.989 -3.279 117 HB2 ARG 16 HB2 ARG 16 4.073 -18.298 -1.153 118 HB3 ARG 16 HB3 ARG 16 2.346 -18.026 -1.336 119 HG2 ARG 16 HG2 ARG 16 3.107 -19.032 -3.791 120 HG3 ARG 16 HG3 ARG 16 4.071 -19.955 -2.636 121 HD2 ARG 16 HD2 ARG 16 1.957 -20.386 -1.359 122 HD3 ARG 16 HD3 ARG 16 1.075 -19.651 -2.698 123 HE ARG 16 HE ARG 16 1.313 -21.606 -3.843 124 HH11 ARG 16 HH11 ARG 16 3.758 -21.470 -1.368 125 HH12 ARG 16 HH12 ARG 16 4.347 -23.069 -1.679 126 HH21 ARG 16 HH21 ARG 16 2.080 -23.713 -4.262 127 HH22 ARG 16 HH22 ARG 16 3.392 -24.344 -3.326 128 H CYS 17 H CYS 17 2.765 -14.512 -3.245 129 HA CYS 17 HA CYS 17 0.277 -14.289 -3.759 130 HB2 CYS 17 HB2 CYS 17 0.670 -13.249 -6.014 131 HB3 CYS 17 HB3 CYS 17 1.732 -12.659 -4.739 132 H ARG 18 H ARG 18 -1.305 -15.637 -4.273 133 HA ARG 18 HA ARG 18 -0.907 -18.039 -5.722 134 HB2 ARG 18 HB2 ARG 18 -3.674 -17.237 -5.687 135 HB3 ARG 18 HB3 ARG 18 -2.889 -18.562 -4.837 136 HG2 ARG 18 HG2 ARG 18 -2.933 -15.711 -3.872 137 HG3 ARG 18 HG3 ARG 18 -4.057 -16.967 -3.349 138 HD2 ARG 18 HD2 ARG 18 -1.320 -16.453 -2.523 139 HD3 ARG 18 HD3 ARG 18 -2.579 -17.401 -1.733 140 HE ARG 18 HE ARG 18 -0.523 -18.376 -3.533 141 HH11 ARG 18 HH11 ARG 18 -3.515 -19.016 -1.871 142 HH12 ARG 18 HH12 ARG 18 -3.359 -20.738 -1.980 143 HH21 ARG 18 HH21 ARG 18 -0.306 -20.642 -3.683 144 HH22 ARG 18 HH22 ARG 18 -1.533 -21.662 -3.010 145 H ARG 19 H ARG 19 -1.455 -14.828 -6.703 146 HA ARG 19 HA ARG 19 -1.066 -15.174 -9.375 147 HB2 ARG 19 HB2 ARG 19 -3.029 -16.604 -9.464 148 HB3 ARG 19 HB3 ARG 19 -4.012 -15.348 -8.722 149 HG2 ARG 19 HG2 ARG 19 -4.270 -14.224 -10.651 150 HG3 ARG 19 HG3 ARG 19 -2.627 -14.568 -11.195 151 HD2 ARG 19 HD2 ARG 19 -4.816 -16.634 -11.143 152 HD3 ARG 19 HD3 ARG 19 -4.479 -15.621 -12.546 153 HE ARG 19 HE ARG 19 -2.099 -16.861 -11.734 154 HH11 ARG 19 HH11 ARG 19 -5.177 -17.655 -13.153 155 HH12 ARG 19 HH12 ARG 19 -4.570 -19.026 -14.022 156 HH21 ARG 19 HH21 ARG 19 -1.288 -18.664 -12.873 157 HH22 ARG 19 HH22 ARG 19 -2.358 -19.599 -13.861 158 H ASP 20 H ASP 20 -1.421 -13.267 -10.624 159 HA ASP 20 HA ASP 20 -1.039 -10.878 -9.327 160 HB2 ASP 20 HB2 ASP 20 -1.947 -9.838 -11.508 161 HB3 ASP 20 HB3 ASP 20 -0.536 -10.888 -11.617 162 H SER 21 H SER 21 -3.991 -12.588 -9.805 163 HA SER 21 HA SER 21 -5.874 -10.544 -9.677 164 HB2 SER 21 HB2 SER 21 -6.379 -12.945 -10.139 165 HB3 SER 21 HB3 SER 21 -6.130 -13.289 -8.428 166 HG SER 21 HG SER 21 -8.201 -11.884 -9.685 167 H ASP 22 H ASP 22 -3.865 -11.913 -7.197 168 HA ASP 22 HA ASP 22 -5.369 -10.819 -5.002 169 HB2 ASP 22 HB2 ASP 22 -2.501 -11.675 -4.788 170 HB3 ASP 22 HB3 ASP 22 -3.794 -11.816 -3.600 171 H CYS 23 H CYS 23 -3.617 -9.366 -7.322 172 HA CYS 23 HA CYS 23 -2.862 -7.155 -5.536 173 HB2 CYS 23 HB2 CYS 23 -1.206 -7.371 -7.939 174 HB3 CYS 23 HB3 CYS 23 -0.733 -7.083 -6.268 175 HA PRO 24 HA PRO 24 -5.734 -5.509 -8.689 176 HB2 PRO 24 HB2 PRO 24 -6.738 -3.582 -7.061 177 HB3 PRO 24 HB3 PRO 24 -7.326 -5.249 -7.053 178 HG2 PRO 24 HG2 PRO 24 -5.391 -3.914 -5.199 179 HG3 PRO 24 HG3 PRO 24 -6.723 -5.021 -4.819 180 HD2 PRO 24 HD2 PRO 24 -4.141 -5.830 -4.927 181 HD3 PRO 24 HD3 PRO 24 -5.494 -6.890 -5.372 182 H GLY 25 H GLY 25 -3.945 -3.471 -6.358 183 HA2 GLY 25 HA2 GLY 25 -3.736 -1.219 -8.025 184 HA3 GLY 25 HA3 GLY 25 -2.690 -1.574 -6.658 185 H ALA 26 H ALA 26 -1.100 -0.500 -8.108 186 HA ALA 26 HA ALA 26 -0.220 -1.469 -10.536 187 HB1 ALA 26 HB1 ALA 26 0.816 0.253 -8.472 188 HB2 ALA 26 HB2 ALA 26 2.104 -0.716 -9.188 189 HB3 ALA 26 HB3 ALA 26 1.089 0.297 -10.214 190 H CYS 27 H CYS 27 0.832 -2.471 -7.288 191 HA CYS 27 HA CYS 27 2.803 -4.262 -7.893 192 HB2 CYS 27 HB2 CYS 27 1.858 -5.592 -5.870 193 HB3 CYS 27 HB3 CYS 27 2.436 -3.949 -5.613 194 H ILE 28 H ILE 28 2.850 -6.571 -8.135 195 HA ILE 28 HA ILE 28 0.416 -7.924 -8.931 196 HB ILE 28 HB ILE 28 1.470 -8.676 -11.109 197 HG12 ILE 28 HG12 ILE 28 3.207 -6.254 -10.583 198 HG13 ILE 28 HG13 ILE 28 3.757 -7.924 -10.650 199 HG21 ILE 28 HG21 ILE 28 0.859 -5.734 -11.045 200 HG22 ILE 28 HG22 ILE 28 0.523 -6.894 -12.329 201 HG23 ILE 28 HG23 ILE 28 -0.380 -6.968 -10.817 202 HD11 ILE 28 HD11 ILE 28 4.331 -6.977 -12.714 203 HD12 ILE 28 HD12 ILE 28 2.897 -7.955 -13.032 204 HD13 ILE 28 HD13 ILE 28 2.756 -6.203 -12.890 205 H CYS 29 H CYS 29 0.768 -10.232 -9.345 206 HA CYS 29 HA CYS 29 2.661 -11.316 -7.479 207 HB2 CYS 29 HB2 CYS 29 0.583 -12.432 -7.534 208 HB3 CYS 29 HB3 CYS 29 0.581 -12.521 -9.292 209 H ARG 30 H ARG 30 4.745 -11.354 -8.047 210 HA ARG 30 HA ARG 30 5.430 -12.342 -10.737 211 HB2 ARG 30 HB2 ARG 30 7.665 -11.078 -9.483 212 HB3 ARG 30 HB3 ARG 30 6.818 -10.610 -10.952 213 HG2 ARG 30 HG2 ARG 30 6.343 -8.734 -9.844 214 HG3 ARG 30 HG3 ARG 30 5.120 -9.706 -9.022 215 HD2 ARG 30 HD2 ARG 30 6.147 -9.305 -7.095 216 HD3 ARG 30 HD3 ARG 30 7.555 -10.182 -7.693 217 HE ARG 30 HE ARG 30 7.213 -7.303 -7.560 218 HH11 ARG 30 HH11 ARG 30 9.068 -9.992 -8.763 219 HH12 ARG 30 HH12 ARG 30 10.492 -9.048 -9.053 220 HH21 ARG 30 HH21 ARG 30 9.081 -6.049 -7.937 221 HH22 ARG 30 HH22 ARG 30 10.498 -6.806 -8.582 222 H GLY 31 H GLY 31 7.825 -13.231 -10.679 223 HA2 GLY 31 HA2 GLY 31 7.778 -15.645 -9.284 224 HA3 GLY 31 HA3 GLY 31 9.210 -14.936 -10.014 225 H ASN 32 H ASN 32 8.629 -12.527 -8.160 226 HA ASN 32 HA ASN 32 10.556 -13.068 -6.235 227 HB2 ASN 32 HB2 ASN 32 10.246 -10.917 -5.627 228 HB3 ASN 32 HB3 ASN 32 9.144 -10.849 -6.999 229 HD21 ASN 32 HD21 ASN 32 9.369 -11.276 -3.531 230 HD22 ASN 32 HD22 ASN 32 7.738 -10.828 -3.179 231 H GLY 33 H GLY 33 7.377 -14.201 -6.401 232 HA2 GLY 33 HA2 GLY 33 6.402 -15.781 -4.986 233 HA3 GLY 33 HA3 GLY 33 7.640 -15.437 -3.788 234 H TYR 34 H TYR 34 5.573 -13.052 -5.352 235 HA TYR 34 HA TYR 34 3.540 -12.853 -3.485 236 HB2 TYR 34 HB2 TYR 34 5.057 -12.366 -1.738 237 HB3 TYR 34 HB3 TYR 34 6.007 -11.286 -2.753 238 HD1 TYR 34 HD2 TYR 34 2.836 -11.636 -0.897 239 HD2 TYR 34 HD1 TYR 34 5.425 -8.987 -2.991 240 HE1 TYR 34 HE2 TYR 34 1.550 -9.719 -0.050 241 HE2 TYR 34 HE1 TYR 34 4.147 -7.062 -2.148 242 HH TYR 34 HH TYR 34 2.615 -6.666 -0.006 243 H CYS 35 H CYS 35 2.382 -10.752 -3.588 244 HA CYS 35 HA CYS 35 2.261 -9.833 -6.274 245 HB2 CYS 35 HB2 CYS 35 0.790 -9.343 -3.762 246 HB3 CYS 35 HB3 CYS 35 0.781 -8.006 -4.907 247 H GLY 36 H GLY 36 4.629 -9.216 -6.270 248 HA2 GLY 36 HA2 GLY 36 5.242 -6.687 -4.970 249 HA3 GLY 36 HA3 GLY 36 6.343 -7.659 -5.936 Start of MODEL 9 1 H1 GLY 1 H GLY 1 -4.227 1.356 0.888 2 HA2 GLY 1 HA2 GLY 1 -1.956 0.534 0.929 3 HA3 GLY 1 HA3 GLY 1 -2.988 -0.818 0.488 4 H CYS 2 H CYS 2 -3.276 -1.251 -1.824 5 HA CYS 2 HA CYS 2 -0.830 -0.573 -3.315 6 HB2 CYS 2 HB2 CYS 2 -1.936 -3.064 -2.710 7 HB3 CYS 2 HB3 CYS 2 -2.342 -2.799 -4.402 8 H ILE 3 H ILE 3 -3.010 1.211 -3.283 9 HA ILE 3 HA ILE 3 -4.401 2.396 -4.645 10 HB ILE 3 HB ILE 3 -2.651 1.216 -6.806 11 HG12 ILE 3 HG12 ILE 3 -2.410 3.840 -5.318 12 HG13 ILE 3 HG13 ILE 3 -1.406 2.423 -5.033 13 HG21 ILE 3 HG21 ILE 3 -4.950 2.922 -6.925 14 HG22 ILE 3 HG22 ILE 3 -3.525 3.793 -7.490 15 HG23 ILE 3 HG23 ILE 3 -3.979 2.264 -8.242 16 HD11 ILE 3 HD11 ILE 3 -1.482 4.203 -7.440 17 HD12 ILE 3 HD12 ILE 3 -0.121 3.828 -6.383 18 HD13 ILE 3 HD13 ILE 3 -0.749 2.600 -7.481 19 H LEU 4 H LEU 4 -6.308 1.251 -4.249 20 HA LEU 4 HA LEU 4 -8.188 0.102 -4.810 21 HB2 LEU 4 HB2 LEU 4 -7.070 1.029 -7.259 22 HB3 LEU 4 HB3 LEU 4 -7.727 -0.584 -7.523 23 HG LEU 4 HG LEU 4 -9.858 0.379 -6.386 24 HD11 LEU 4 HD11 LEU 4 -10.194 2.726 -6.613 25 HD12 LEU 4 HD12 LEU 4 -8.636 2.932 -7.413 26 HD13 LEU 4 HD13 LEU 4 -8.699 2.487 -5.708 27 HD21 LEU 4 HD21 LEU 4 -8.851 0.544 -9.137 28 HD22 LEU 4 HD22 LEU 4 -10.216 1.604 -8.785 29 HD23 LEU 4 HD23 LEU 4 -10.355 -0.133 -8.514 30 H ASN 5 H ASN 5 -8.077 -1.788 -3.732 31 HA ASN 5 HA ASN 5 -7.713 -4.196 -5.110 32 HB2 ASN 5 HB2 ASN 5 -5.670 -4.981 -3.756 33 HB3 ASN 5 HB3 ASN 5 -5.378 -3.919 -5.130 34 HD21 ASN 5 HD21 ASN 5 -4.982 -4.385 -1.805 35 HD22 ASN 5 HD22 ASN 5 -4.288 -2.849 -1.425 36 H GLY 6 H GLY 6 -7.616 -6.111 -3.528 37 HA2 GLY 6 HA2 GLY 6 -9.516 -5.526 -1.395 38 HA3 GLY 6 HA3 GLY 6 -9.084 -7.119 -1.999 39 H ARG 7 H ARG 7 -7.263 -4.404 -0.570 40 HA ARG 7 HA ARG 7 -5.830 -4.305 1.194 41 HB2 ARG 7 HB2 ARG 7 -7.887 -5.542 2.243 42 HB3 ARG 7 HB3 ARG 7 -6.820 -6.939 2.217 43 HG2 ARG 7 HG2 ARG 7 -5.722 -6.236 4.012 44 HG3 ARG 7 HG3 ARG 7 -5.496 -4.626 3.327 45 HD2 ARG 7 HD2 ARG 7 -7.725 -3.983 4.058 46 HD3 ARG 7 HD3 ARG 7 -8.002 -5.605 4.689 47 HE ARG 7 HE ARG 7 -6.604 -3.491 5.979 48 HH11 ARG 7 HH11 ARG 7 -6.675 -6.950 5.593 49 HH12 ARG 7 HH12 ARG 7 -5.936 -7.267 7.128 50 HH21 ARG 7 HH21 ARG 7 -5.632 -3.895 8.002 51 HH22 ARG 7 HH22 ARG 7 -5.344 -5.529 8.498 52 H THR 8 H THR 8 -3.983 -4.577 -0.057 53 HA THR 8 HA THR 8 -2.948 -6.902 -1.113 54 HB THR 8 HB THR 8 -1.980 -4.696 -1.568 55 HG1 THR 8 HG1 THR 8 0.259 -5.390 -1.364 56 HG21 THR 8 HG21 THR 8 -0.166 -4.367 0.557 57 HG22 THR 8 HG22 THR 8 -1.750 -4.612 1.292 58 HG23 THR 8 HG23 THR 8 -1.512 -3.318 0.118 59 H ASP 9 H ASP 9 -0.874 -7.995 -0.345 60 HA ASP 9 HA ASP 9 -0.078 -9.601 1.083 61 HB2 ASP 9 HB2 ASP 9 0.119 -8.152 3.493 62 HB3 ASP 9 HB3 ASP 9 1.373 -8.393 2.280 63 H LEU 10 H LEU 10 -2.094 -10.797 1.066 64 HA LEU 10 HA LEU 10 -3.350 -10.822 3.725 65 HB2 LEU 10 HB2 LEU 10 -4.778 -9.764 1.917 66 HB3 LEU 10 HB3 LEU 10 -4.854 -11.362 1.177 67 HG LEU 10 HG LEU 10 -5.733 -12.036 3.582 68 HD11 LEU 10 HD11 LEU 10 -5.624 -10.047 4.767 69 HD12 LEU 10 HD12 LEU 10 -7.312 -10.111 4.261 70 HD13 LEU 10 HD13 LEU 10 -6.171 -9.081 3.396 71 HD21 LEU 10 HD21 LEU 10 -8.039 -10.989 2.483 72 HD22 LEU 10 HD22 LEU 10 -7.344 -12.573 2.139 73 HD23 LEU 10 HD23 LEU 10 -6.974 -11.201 1.093 74 H GLY 11 H GLY 11 -3.240 -12.744 4.681 75 HA2 GLY 11 HA2 GLY 11 -2.238 -14.916 4.761 76 HA3 GLY 11 HA3 GLY 11 -3.881 -15.179 4.196 77 H THR 12 H THR 12 -4.252 -15.732 2.058 78 HA THR 12 HA THR 12 -2.364 -17.296 0.773 79 HB THR 12 HB THR 12 -3.821 -16.967 -1.299 80 HG1 THR 12 HG1 THR 12 -5.156 -15.339 -1.203 81 HG21 THR 12 HG21 THR 12 -5.191 -18.611 -0.553 82 HG22 THR 12 HG22 THR 12 -5.652 -17.715 0.894 83 HG23 THR 12 HG23 THR 12 -4.115 -18.578 0.843 84 H LEU 13 H LEU 13 -3.512 -14.127 -0.409 85 HA LEU 13 HA LEU 13 -1.467 -13.815 -2.310 86 HB2 LEU 13 HB2 LEU 13 -3.538 -12.576 -2.445 87 HB3 LEU 13 HB3 LEU 13 -3.179 -11.756 -0.927 88 HG LEU 13 HG LEU 13 -2.845 -10.495 -3.159 89 HD11 LEU 13 HD11 LEU 13 -1.415 -10.469 -0.652 90 HD12 LEU 13 HD12 LEU 13 -1.985 -9.124 -1.639 91 HD13 LEU 13 HD13 LEU 13 -0.416 -9.857 -1.970 92 HD21 LEU 13 HD21 LEU 13 -0.077 -11.460 -3.190 93 HD22 LEU 13 HD22 LEU 13 -1.149 -11.036 -4.525 94 HD23 LEU 13 HD23 LEU 13 -1.267 -12.626 -3.768 95 H LEU 14 H LEU 14 -1.436 -13.480 1.076 96 HA LEU 14 HA LEU 14 0.334 -11.471 1.631 97 HB2 LEU 14 HB2 LEU 14 -0.808 -13.229 3.165 98 HB3 LEU 14 HB3 LEU 14 0.680 -14.144 2.931 99 HG LEU 14 HG LEU 14 1.670 -11.734 3.694 100 HD11 LEU 14 HD11 LEU 14 0.253 -10.493 4.870 101 HD12 LEU 14 HD12 LEU 14 -0.303 -11.887 5.795 102 HD13 LEU 14 HD13 LEU 14 -1.046 -11.507 4.242 103 HD21 LEU 14 HD21 LEU 14 0.802 -13.974 5.519 104 HD22 LEU 14 HD22 LEU 14 2.044 -12.770 5.863 105 HD23 LEU 14 HD23 LEU 14 2.286 -13.941 4.566 106 H PHE 15 H PHE 15 1.005 -14.573 0.162 107 HA PHE 15 HA PHE 15 3.545 -13.651 -0.788 108 HB2 PHE 15 HB2 PHE 15 3.412 -15.718 1.396 109 HB3 PHE 15 HB3 PHE 15 4.751 -15.682 0.253 110 HD1 PHE 15 HD2 PHE 15 5.611 -13.088 -0.089 111 HD2 PHE 15 HD1 PHE 15 3.887 -14.774 3.418 112 HE1 PHE 15 HE2 PHE 15 6.734 -11.380 1.280 113 HE2 PHE 15 HE1 PHE 15 5.007 -13.068 4.793 114 HZ PHE 15 HZ PHE 15 6.434 -11.369 3.724 115 H ARG 16 H ARG 16 4.739 -15.689 -1.814 116 HA ARG 16 HA ARG 16 4.660 -17.067 -3.636 117 HB2 ARG 16 HB2 ARG 16 4.151 -18.603 -1.735 118 HB3 ARG 16 HB3 ARG 16 2.438 -18.370 -2.055 119 HG2 ARG 16 HG2 ARG 16 3.624 -19.111 -4.498 120 HG3 ARG 16 HG3 ARG 16 4.265 -20.196 -3.263 121 HD2 ARG 16 HD2 ARG 16 1.686 -20.215 -2.556 122 HD3 ARG 16 HD3 ARG 16 1.501 -19.883 -4.277 123 HE ARG 16 HE ARG 16 2.119 -22.038 -4.715 124 HH11 ARG 16 HH11 ARG 16 3.074 -21.229 -1.466 125 HH12 ARG 16 HH12 ARG 16 3.568 -22.841 -1.071 126 HH21 ARG 16 HH21 ARG 16 2.767 -24.165 -4.206 127 HH22 ARG 16 HH22 ARG 16 3.394 -24.511 -2.630 128 H CYS 17 H CYS 17 2.847 -14.701 -3.635 129 HA CYS 17 HA CYS 17 0.481 -14.505 -4.489 130 HB2 CYS 17 HB2 CYS 17 1.115 -13.381 -6.644 131 HB3 CYS 17 HB3 CYS 17 2.014 -12.820 -5.238 132 H ARG 18 H ARG 18 -0.856 -16.139 -4.977 133 HA ARG 18 HA ARG 18 -0.275 -18.388 -6.507 134 HB2 ARG 18 HB2 ARG 18 -2.912 -18.266 -6.874 135 HB3 ARG 18 HB3 ARG 18 -2.200 -18.718 -5.331 136 HG2 ARG 18 HG2 ARG 18 -2.624 -15.837 -5.705 137 HG3 ARG 18 HG3 ARG 18 -4.092 -16.816 -5.649 138 HD2 ARG 18 HD2 ARG 18 -1.937 -16.559 -3.569 139 HD3 ARG 18 HD3 ARG 18 -3.651 -16.173 -3.420 140 HE ARG 18 HE ARG 18 -2.422 -18.761 -3.141 141 HH11 ARG 18 HH11 ARG 18 -5.366 -17.034 -3.823 142 HH12 ARG 18 HH12 ARG 18 -6.398 -18.343 -3.349 143 HH21 ARG 18 HH21 ARG 18 -3.769 -20.492 -2.515 144 HH22 ARG 18 HH22 ARG 18 -5.488 -20.309 -2.605 145 H ARG 19 H ARG 19 -0.881 -15.173 -7.500 146 HA ARG 19 HA ARG 19 -0.106 -15.382 -10.084 147 HB2 ARG 19 HB2 ARG 19 -2.383 -15.398 -11.284 148 HB3 ARG 19 HB3 ARG 19 -1.732 -16.935 -10.729 149 HG2 ARG 19 HG2 ARG 19 -3.299 -17.157 -9.066 150 HG3 ARG 19 HG3 ARG 19 -3.585 -15.418 -8.958 151 HD2 ARG 19 HD2 ARG 19 -5.509 -16.186 -9.995 152 HD3 ARG 19 HD3 ARG 19 -4.518 -15.666 -11.357 153 HE ARG 19 HE ARG 19 -4.037 -18.388 -10.849 154 HH11 ARG 19 HH11 ARG 19 -6.526 -16.277 -12.063 155 HH12 ARG 19 HH12 ARG 19 -7.232 -17.483 -13.086 156 HH21 ARG 19 HH21 ARG 19 -4.958 -19.985 -12.192 157 HH22 ARG 19 HH22 ARG 19 -6.340 -19.592 -13.158 158 H ASP 20 H ASP 20 -0.538 -13.496 -11.364 159 HA ASP 20 HA ASP 20 -0.590 -11.115 -10.015 160 HB2 ASP 20 HB2 ASP 20 0.139 -11.011 -12.240 161 HB3 ASP 20 HB3 ASP 20 -1.307 -11.814 -12.848 162 H SER 21 H SER 21 -3.261 -13.136 -10.831 163 HA SER 21 HA SER 21 -5.370 -11.323 -10.862 164 HB2 SER 21 HB2 SER 21 -5.458 -13.810 -11.373 165 HB3 SER 21 HB3 SER 21 -5.520 -14.078 -9.631 166 HG SER 21 HG SER 21 -7.546 -13.645 -11.165 167 H ASP 22 H ASP 22 -3.536 -12.616 -8.191 168 HA ASP 22 HA ASP 22 -5.359 -11.715 -6.163 169 HB2 ASP 22 HB2 ASP 22 -3.483 -12.284 -4.606 170 HB3 ASP 22 HB3 ASP 22 -3.963 -13.610 -5.662 171 H CYS 23 H CYS 23 -3.485 -10.042 -8.230 172 HA CYS 23 HA CYS 23 -3.045 -7.870 -6.288 173 HB2 CYS 23 HB2 CYS 23 -1.157 -9.154 -8.055 174 HB3 CYS 23 HB3 CYS 23 -1.303 -7.445 -8.455 175 HA PRO 24 HA PRO 24 -5.976 -6.455 -9.591 176 HB2 PRO 24 HB2 PRO 24 -7.666 -5.206 -7.873 177 HB3 PRO 24 HB3 PRO 24 -7.793 -6.925 -8.266 178 HG2 PRO 24 HG2 PRO 24 -6.554 -5.613 -5.877 179 HG3 PRO 24 HG3 PRO 24 -7.590 -7.051 -5.953 180 HD2 PRO 24 HD2 PRO 24 -4.897 -7.206 -5.709 181 HD3 PRO 24 HD3 PRO 24 -5.849 -8.426 -6.579 182 H GLY 25 H GLY 25 -4.273 -4.922 -6.964 183 HA2 GLY 25 HA2 GLY 25 -4.745 -2.237 -7.932 184 HA3 GLY 25 HA3 GLY 25 -3.703 -2.698 -6.594 185 H ALA 26 H ALA 26 -1.995 -1.402 -7.248 186 HA ALA 26 HA ALA 26 -0.918 -1.449 -9.878 187 HB1 ALA 26 HB1 ALA 26 0.506 -0.606 -7.362 188 HB2 ALA 26 HB2 ALA 26 0.848 -0.099 -9.017 189 HB3 ALA 26 HB3 ALA 26 -0.644 0.414 -8.228 190 H CYS 27 H CYS 27 0.253 -2.836 -6.807 191 HA CYS 27 HA CYS 27 2.508 -4.119 -7.701 192 HB2 CYS 27 HB2 CYS 27 1.934 -5.858 -5.882 193 HB3 CYS 27 HB3 CYS 27 2.149 -4.182 -5.387 194 H ILE 28 H ILE 28 2.838 -6.503 -7.996 195 HA ILE 28 HA ILE 28 0.634 -7.967 -9.172 196 HB ILE 28 HB ILE 28 1.938 -8.421 -11.280 197 HG12 ILE 28 HG12 ILE 28 3.460 -5.963 -10.384 198 HG13 ILE 28 HG13 ILE 28 4.117 -7.594 -10.485 199 HG21 ILE 28 HG21 ILE 28 0.958 -6.642 -12.425 200 HG22 ILE 28 HG22 ILE 28 -0.017 -6.788 -10.964 201 HG23 ILE 28 HG23 ILE 28 1.204 -5.522 -11.086 202 HD11 ILE 28 HD11 ILE 28 3.168 -5.879 -12.765 203 HD12 ILE 28 HD12 ILE 28 4.829 -6.342 -12.392 204 HD13 ILE 28 HD13 ILE 28 3.670 -7.563 -12.920 205 H CYS 29 H CYS 29 1.190 -10.194 -9.668 206 HA CYS 29 HA CYS 29 2.979 -11.288 -7.721 207 HB2 CYS 29 HB2 CYS 29 1.029 -12.558 -8.107 208 HB3 CYS 29 HB3 CYS 29 1.224 -12.483 -9.855 209 H ARG 30 H ARG 30 5.103 -11.375 -7.982 210 HA ARG 30 HA ARG 30 6.163 -11.981 -10.664 211 HB2 ARG 30 HB2 ARG 30 8.123 -10.642 -9.063 212 HB3 ARG 30 HB3 ARG 30 7.431 -10.148 -10.603 213 HG2 ARG 30 HG2 ARG 30 6.586 -8.408 -9.515 214 HG3 ARG 30 HG3 ARG 30 5.449 -9.543 -8.782 215 HD2 ARG 30 HD2 ARG 30 6.311 -9.066 -6.793 216 HD3 ARG 30 HD3 ARG 30 7.845 -9.754 -7.324 217 HE ARG 30 HE ARG 30 7.156 -6.943 -7.147 218 HH11 ARG 30 HH11 ARG 30 9.370 -9.352 -8.336 219 HH12 ARG 30 HH12 ARG 30 10.680 -8.236 -8.538 220 HH21 ARG 30 HH21 ARG 30 8.873 -5.464 -7.409 221 HH22 ARG 30 HH22 ARG 30 10.397 -6.025 -8.009 222 H GLY 31 H GLY 31 8.582 -12.716 -10.414 223 HA2 GLY 31 HA2 GLY 31 8.580 -15.209 -9.160 224 HA3 GLY 31 HA3 GLY 31 10.017 -14.364 -9.716 225 H ASN 32 H ASN 32 9.075 -12.118 -7.791 226 HA ASN 32 HA ASN 32 10.864 -12.635 -5.730 227 HB2 ASN 32 HB2 ASN 32 10.326 -10.559 -5.014 228 HB3 ASN 32 HB3 ASN 32 9.387 -10.474 -6.501 229 HD21 ASN 32 HD21 ASN 32 9.236 -11.141 -3.064 230 HD22 ASN 32 HD22 ASN 32 7.549 -10.815 -2.883 231 H GLY 33 H GLY 33 7.822 -13.994 -6.257 232 HA2 GLY 33 HA2 GLY 33 6.866 -15.733 -5.022 233 HA3 GLY 33 HA3 GLY 33 7.936 -15.339 -3.684 234 H TYR 34 H TYR 34 5.892 -13.008 -5.331 235 HA TYR 34 HA TYR 34 3.631 -13.094 -3.733 236 HB2 TYR 34 HB2 TYR 34 4.823 -12.625 -1.768 237 HB3 TYR 34 HB3 TYR 34 5.884 -11.476 -2.575 238 HD1 TYR 34 HD2 TYR 34 2.497 -11.980 -1.208 239 HD2 TYR 34 HD1 TYR 34 5.271 -9.179 -2.807 240 HE1 TYR 34 HE2 TYR 34 1.050 -10.134 -0.468 241 HE2 TYR 34 HE1 TYR 34 3.833 -7.325 -2.070 242 HH TYR 34 HH TYR 34 1.916 -7.189 -0.016 243 H CYS 35 H CYS 35 2.344 -11.063 -3.835 244 HA CYS 35 HA CYS 35 2.497 -9.951 -6.451 245 HB2 CYS 35 HB2 CYS 35 0.334 -10.292 -5.444 246 HB3 CYS 35 HB3 CYS 35 0.759 -9.271 -4.074 247 H GLY 36 H GLY 36 4.695 -9.068 -6.268 248 HA2 GLY 36 HA2 GLY 36 4.978 -6.676 -4.621 249 HA3 GLY 36 HA3 GLY 36 6.240 -7.437 -5.579 Start of MODEL 10 1 H1 GLY 1 H GLY 1 1.138 1.924 0.363 2 HA2 GLY 1 HA2 GLY 1 2.459 2.186 -1.536 3 HA3 GLY 1 HA3 GLY 1 2.533 0.439 -1.365 4 H CYS 2 H CYS 2 -0.019 -0.299 -2.095 5 HA CYS 2 HA CYS 2 0.147 0.004 -4.954 6 HB2 CYS 2 HB2 CYS 2 -2.067 -1.392 -3.463 7 HB3 CYS 2 HB3 CYS 2 -1.469 -1.717 -5.086 8 H ILE 3 H ILE 3 -2.796 -0.308 -5.260 9 HA ILE 3 HA ILE 3 -4.179 1.916 -4.274 10 HB ILE 3 HB ILE 3 -4.190 2.998 -6.746 11 HG12 ILE 3 HG12 ILE 3 -1.267 2.467 -6.315 12 HG13 ILE 3 HG13 ILE 3 -2.245 1.328 -7.234 13 HG21 ILE 3 HG21 ILE 3 -2.060 4.259 -5.370 14 HG22 ILE 3 HG22 ILE 3 -3.754 4.742 -5.449 15 HG23 ILE 3 HG23 ILE 3 -3.203 3.665 -4.166 16 HD11 ILE 3 HD11 ILE 3 -0.932 3.269 -8.410 17 HD12 ILE 3 HD12 ILE 3 -2.526 2.769 -8.977 18 HD13 ILE 3 HD13 ILE 3 -2.360 4.203 -7.965 19 H LEU 4 H LEU 4 -6.253 1.413 -4.500 20 HA LEU 4 HA LEU 4 -8.204 0.570 -5.312 21 HB2 LEU 4 HB2 LEU 4 -7.136 1.732 -7.439 22 HB3 LEU 4 HB3 LEU 4 -7.034 0.064 -7.997 23 HG LEU 4 HG LEU 4 -9.644 1.111 -6.995 24 HD11 LEU 4 HD11 LEU 4 -9.325 1.367 -9.866 25 HD12 LEU 4 HD12 LEU 4 -8.268 2.459 -8.972 26 HD13 LEU 4 HD13 LEU 4 -10.010 2.496 -8.697 27 HD21 LEU 4 HD21 LEU 4 -8.757 -0.949 -9.002 28 HD22 LEU 4 HD22 LEU 4 -10.435 -0.440 -8.813 29 HD23 LEU 4 HD23 LEU 4 -9.590 -1.213 -7.471 30 H ASN 5 H ASN 5 -8.407 -1.331 -4.257 31 HA ASN 5 HA ASN 5 -8.207 -3.748 -5.668 32 HB2 ASN 5 HB2 ASN 5 -6.433 -4.802 -4.135 33 HB3 ASN 5 HB3 ASN 5 -5.864 -3.751 -5.429 34 HD21 ASN 5 HD21 ASN 5 -6.642 -3.843 -1.995 35 HD22 ASN 5 HD22 ASN 5 -5.530 -2.606 -1.525 36 H GLY 6 H GLY 6 -8.243 -5.678 -3.920 37 HA2 GLY 6 HA2 GLY 6 -10.224 -4.825 -1.902 38 HA3 GLY 6 HA3 GLY 6 -10.244 -6.386 -2.710 39 H ARG 7 H ARG 7 -7.570 -7.107 -2.489 40 HA ARG 7 HA ARG 7 -7.404 -7.596 0.399 41 HB2 ARG 7 HB2 ARG 7 -6.393 -9.079 -2.009 42 HB3 ARG 7 HB3 ARG 7 -5.707 -9.377 -0.418 43 HG2 ARG 7 HG2 ARG 7 -7.546 -10.459 0.326 44 HG3 ARG 7 HG3 ARG 7 -8.651 -9.459 -0.620 45 HD2 ARG 7 HD2 ARG 7 -7.981 -10.655 -2.651 46 HD3 ARG 7 HD3 ARG 7 -6.887 -11.656 -1.697 47 HE ARG 7 HE ARG 7 -9.389 -11.930 -0.557 48 HH11 ARG 7 HH11 ARG 7 -7.898 -12.565 -3.638 49 HH12 ARG 7 HH12 ARG 7 -8.939 -13.898 -4.014 50 HH21 ARG 7 HH21 ARG 7 -10.766 -13.683 -1.040 51 HH22 ARG 7 HH22 ARG 7 -10.570 -14.533 -2.536 52 H THR 8 H THR 8 -4.755 -7.857 -1.893 53 HA THR 8 HA THR 8 -2.679 -6.925 -1.953 54 HB THR 8 HB THR 8 -4.231 -4.578 -0.867 55 HG1 THR 8 HG1 THR 8 -3.420 -3.917 -3.140 56 HG21 THR 8 HG21 THR 8 -2.148 -3.275 -1.605 57 HG22 THR 8 HG22 THR 8 -1.302 -4.819 -1.497 58 HG23 THR 8 HG23 THR 8 -2.070 -4.132 -0.066 59 H ASP 9 H ASP 9 -1.104 -7.636 -0.690 60 HA ASP 9 HA ASP 9 0.057 -8.271 1.171 61 HB2 ASP 9 HB2 ASP 9 -0.783 -5.779 2.578 62 HB3 ASP 9 HB3 ASP 9 0.818 -6.497 2.424 63 H LEU 10 H LEU 10 -1.505 -9.962 1.623 64 HA LEU 10 HA LEU 10 -2.931 -9.466 4.149 65 HB2 LEU 10 HB2 LEU 10 -4.190 -9.924 1.779 66 HB3 LEU 10 HB3 LEU 10 -4.049 -11.559 2.422 67 HG LEU 10 HG LEU 10 -5.043 -10.235 4.576 68 HD11 LEU 10 HD11 LEU 10 -5.239 -8.264 2.827 69 HD12 LEU 10 HD12 LEU 10 -6.480 -8.550 4.046 70 HD13 LEU 10 HD13 LEU 10 -6.720 -9.120 2.395 71 HD21 LEU 10 HD21 LEU 10 -6.616 -11.497 2.333 72 HD22 LEU 10 HD22 LEU 10 -7.183 -11.254 3.985 73 HD23 LEU 10 HD23 LEU 10 -5.840 -12.354 3.665 74 H GLY 11 H GLY 11 -3.724 -11.912 4.858 75 HA2 GLY 11 HA2 GLY 11 -1.369 -13.143 5.790 76 HA3 GLY 11 HA3 GLY 11 -2.983 -13.833 5.873 77 H THR 12 H THR 12 -3.793 -14.634 3.644 78 HA THR 12 HA THR 12 -2.121 -16.742 2.837 79 HB THR 12 HB THR 12 -4.526 -16.920 2.593 80 HG1 THR 12 HG1 THR 12 -4.483 -17.415 0.187 81 HG21 THR 12 HG21 THR 12 -4.351 -14.862 0.393 82 HG22 THR 12 HG22 THR 12 -4.881 -14.496 2.035 83 HG23 THR 12 HG23 THR 12 -5.803 -15.624 1.042 84 H LEU 13 H LEU 13 -2.735 -13.564 1.436 85 HA LEU 13 HA LEU 13 -1.130 -14.091 -0.900 86 HB2 LEU 13 HB2 LEU 13 -3.041 -12.584 -1.016 87 HB3 LEU 13 HB3 LEU 13 -2.288 -11.522 0.172 88 HG LEU 13 HG LEU 13 -2.217 -10.905 -2.350 89 HD11 LEU 13 HD11 LEU 13 -0.380 -10.509 -0.156 90 HD12 LEU 13 HD12 LEU 13 -0.955 -9.364 -1.367 91 HD13 LEU 13 HD13 LEU 13 0.435 -10.391 -1.715 92 HD21 LEU 13 HD21 LEU 13 -1.393 -12.894 -3.312 93 HD22 LEU 13 HD22 LEU 13 -0.085 -13.014 -2.135 94 HD23 LEU 13 HD23 LEU 13 -0.053 -11.748 -3.363 95 H LEU 14 H LEU 14 -0.410 -13.456 2.268 96 HA LEU 14 HA LEU 14 1.519 -11.549 2.405 97 HB2 LEU 14 HB2 LEU 14 0.836 -12.885 4.312 98 HB3 LEU 14 HB3 LEU 14 1.618 -14.306 3.622 99 HG LEU 14 HG LEU 14 3.772 -12.816 3.775 100 HD11 LEU 14 HD11 LEU 14 3.660 -11.404 5.844 101 HD12 LEU 14 HD12 LEU 14 1.904 -11.535 5.757 102 HD13 LEU 14 HD13 LEU 14 2.796 -10.758 4.449 103 HD21 LEU 14 HD21 LEU 14 4.036 -13.628 6.171 104 HD22 LEU 14 HD22 LEU 14 3.676 -14.850 4.950 105 HD23 LEU 14 HD23 LEU 14 2.399 -14.267 6.020 106 H PHE 15 H PHE 15 1.756 -14.665 0.837 107 HA PHE 15 HA PHE 15 4.071 -13.819 -0.630 108 HB2 PHE 15 HB2 PHE 15 4.312 -15.944 1.490 109 HB3 PHE 15 HB3 PHE 15 5.396 -15.894 0.104 110 HD1 PHE 15 HD2 PHE 15 6.281 -13.338 -0.323 111 HD2 PHE 15 HD1 PHE 15 5.168 -15.055 3.410 112 HE1 PHE 15 HE2 PHE 15 7.701 -11.706 0.848 113 HE2 PHE 15 HE1 PHE 15 6.586 -13.424 4.586 114 HZ PHE 15 HZ PHE 15 7.856 -11.748 3.305 115 H ARG 16 H ARG 16 4.941 -15.919 -1.877 116 HA ARG 16 HA ARG 16 4.425 -17.258 -3.655 117 HB2 ARG 16 HB2 ARG 16 4.162 -18.741 -1.608 118 HB3 ARG 16 HB3 ARG 16 2.428 -18.497 -1.766 119 HG2 ARG 16 HG2 ARG 16 2.667 -19.381 -4.131 120 HG3 ARG 16 HG3 ARG 16 4.290 -19.890 -3.661 121 HD2 ARG 16 HD2 ARG 16 2.578 -21.677 -3.443 122 HD3 ARG 16 HD3 ARG 16 3.411 -21.303 -1.935 123 HE ARG 16 HE ARG 16 0.935 -19.878 -2.298 124 HH11 ARG 16 HH11 ARG 16 2.435 -22.790 -1.117 125 HH12 ARG 16 HH12 ARG 16 1.152 -23.157 -0.012 126 HH21 ARG 16 HH21 ARG 16 -0.760 -20.352 -0.848 127 HH22 ARG 16 HH22 ARG 16 -0.665 -21.771 0.140 128 H CYS 17 H CYS 17 2.810 -14.796 -3.327 129 HA CYS 17 HA CYS 17 0.300 -14.515 -3.681 130 HB2 CYS 17 HB2 CYS 17 0.588 -13.301 -5.874 131 HB3 CYS 17 HB3 CYS 17 1.697 -12.809 -4.598 132 H ARG 18 H ARG 18 -1.290 -15.866 -4.171 133 HA ARG 18 HA ARG 18 -1.014 -18.123 -5.837 134 HB2 ARG 18 HB2 ARG 18 -3.762 -17.251 -5.605 135 HB3 ARG 18 HB3 ARG 18 -2.985 -18.684 -4.944 136 HG2 ARG 18 HG2 ARG 18 -2.894 -15.951 -3.683 137 HG3 ARG 18 HG3 ARG 18 -4.012 -17.239 -3.228 138 HD2 ARG 18 HD2 ARG 18 -1.231 -16.849 -2.503 139 HD3 ARG 18 HD3 ARG 18 -2.455 -17.881 -1.765 140 HE ARG 18 HE ARG 18 -0.505 -18.642 -3.772 141 HH11 ARG 18 HH11 ARG 18 -3.413 -19.465 -2.045 142 HH12 ARG 18 HH12 ARG 18 -3.278 -21.163 -2.365 143 HH21 ARG 18 HH21 ARG 18 -0.317 -20.874 -4.201 144 HH22 ARG 18 HH22 ARG 18 -1.516 -21.963 -3.591 145 H ARG 19 H ARG 19 -1.441 -14.857 -6.587 146 HA ARG 19 HA ARG 19 -1.183 -14.971 -9.263 147 HB2 ARG 19 HB2 ARG 19 -3.077 -16.404 -9.534 148 HB3 ARG 19 HB3 ARG 19 -4.081 -15.369 -8.527 149 HG2 ARG 19 HG2 ARG 19 -4.593 -14.007 -10.224 150 HG3 ARG 19 HG3 ARG 19 -2.948 -14.025 -10.863 151 HD2 ARG 19 HD2 ARG 19 -3.490 -15.537 -12.402 152 HD3 ARG 19 HD3 ARG 19 -4.199 -16.599 -11.186 153 HE ARG 19 HE ARG 19 -6.256 -15.899 -11.869 154 HH11 ARG 19 HH11 ARG 19 -3.905 -13.515 -12.824 155 HH12 ARG 19 HH12 ARG 19 -5.048 -12.546 -13.693 156 HH21 ARG 19 HH21 ARG 19 -7.770 -14.631 -13.010 157 HH22 ARG 19 HH22 ARG 19 -7.247 -13.181 -13.797 158 H ASP 20 H ASP 20 -1.441 -12.968 -10.288 159 HA ASP 20 HA ASP 20 -1.154 -10.695 -8.808 160 HB2 ASP 20 HB2 ASP 20 -2.526 -10.764 -11.501 161 HB3 ASP 20 HB3 ASP 20 -1.613 -9.427 -10.806 162 H SER 21 H SER 21 -4.115 -12.322 -9.634 163 HA SER 21 HA SER 21 -6.005 -10.342 -9.293 164 HB2 SER 21 HB2 SER 21 -7.590 -12.073 -8.855 165 HB3 SER 21 HB3 SER 21 -6.396 -12.762 -9.956 166 HG SER 21 HG SER 21 -7.044 -14.023 -8.004 167 H ASP 22 H ASP 22 -4.135 -12.046 -6.878 168 HA ASP 22 HA ASP 22 -5.590 -11.444 -4.585 169 HB2 ASP 22 HB2 ASP 22 -2.574 -11.487 -4.727 170 HB3 ASP 22 HB3 ASP 22 -3.593 -11.888 -3.348 171 H CYS 23 H CYS 23 -3.479 -9.445 -6.514 172 HA CYS 23 HA CYS 23 -4.297 -7.121 -4.945 173 HB2 CYS 23 HB2 CYS 23 -1.449 -7.124 -5.762 174 HB3 CYS 23 HB3 CYS 23 -2.212 -6.434 -4.333 175 HA PRO 24 HA PRO 24 -4.740 -6.280 -9.415 176 HB2 PRO 24 HB2 PRO 24 -6.858 -4.612 -9.097 177 HB3 PRO 24 HB3 PRO 24 -7.022 -6.371 -9.166 178 HG2 PRO 24 HG2 PRO 24 -6.965 -4.567 -6.778 179 HG3 PRO 24 HG3 PRO 24 -8.022 -5.952 -7.109 180 HD2 PRO 24 HD2 PRO 24 -5.868 -6.121 -5.478 181 HD3 PRO 24 HD3 PRO 24 -6.425 -7.485 -6.468 182 H GLY 25 H GLY 25 -4.416 -4.197 -6.629 183 HA2 GLY 25 HA2 GLY 25 -4.148 -1.719 -7.926 184 HA3 GLY 25 HA3 GLY 25 -3.467 -2.125 -6.358 185 H ALA 26 H ALA 26 -1.698 -0.722 -7.049 186 HA ALA 26 HA ALA 26 -0.055 -1.002 -9.209 187 HB1 ALA 26 HB1 ALA 26 0.055 0.448 -6.928 188 HB2 ALA 26 HB2 ALA 26 1.400 -0.665 -6.677 189 HB3 ALA 26 HB3 ALA 26 1.360 0.359 -8.112 190 H CYS 27 H CYS 27 0.501 -2.644 -6.085 191 HA CYS 27 HA CYS 27 2.607 -4.254 -6.848 192 HB2 CYS 27 HB2 CYS 27 1.638 -5.869 -5.065 193 HB3 CYS 27 HB3 CYS 27 2.140 -4.259 -4.561 194 H ILE 28 H ILE 28 2.722 -6.508 -7.400 195 HA ILE 28 HA ILE 28 0.357 -7.790 -8.472 196 HB ILE 28 HB ILE 28 1.457 -8.196 -10.695 197 HG12 ILE 28 HG12 ILE 28 3.216 -5.899 -9.806 198 HG13 ILE 28 HG13 ILE 28 3.745 -7.563 -10.029 199 HG21 ILE 28 HG21 ILE 28 0.927 -5.275 -10.249 200 HG22 ILE 28 HG22 ILE 28 0.566 -6.255 -11.669 201 HG23 ILE 28 HG23 ILE 28 -0.356 -6.483 -10.183 202 HD11 ILE 28 HD11 ILE 28 4.289 -6.980 -12.095 203 HD12 ILE 28 HD12 ILE 28 2.561 -6.903 -12.439 204 HD13 ILE 28 HD13 ILE 28 3.432 -5.445 -11.964 205 H CYS 29 H CYS 29 0.664 -10.017 -8.946 206 HA CYS 29 HA CYS 29 2.660 -11.256 -7.302 207 HB2 CYS 29 HB2 CYS 29 0.562 -12.342 -7.318 208 HB3 CYS 29 HB3 CYS 29 0.466 -12.309 -9.076 209 H ARG 30 H ARG 30 4.691 -11.515 -7.936 210 HA ARG 30 HA ARG 30 5.201 -12.220 -10.751 211 HB2 ARG 30 HB2 ARG 30 7.315 -11.014 -10.622 212 HB3 ARG 30 HB3 ARG 30 5.973 -9.942 -10.245 213 HG2 ARG 30 HG2 ARG 30 7.324 -11.292 -7.979 214 HG3 ARG 30 HG3 ARG 30 8.194 -9.997 -8.805 215 HD2 ARG 30 HD2 ARG 30 5.445 -9.806 -7.578 216 HD3 ARG 30 HD3 ARG 30 6.931 -9.125 -6.916 217 HE ARG 30 HE ARG 30 5.288 -7.986 -8.938 218 HH11 ARG 30 HH11 ARG 30 8.595 -8.308 -7.898 219 HH12 ARG 30 HH12 ARG 30 9.110 -6.831 -8.644 220 HH21 ARG 30 HH21 ARG 30 5.954 -6.040 -9.924 221 HH22 ARG 30 HH22 ARG 30 7.607 -5.542 -9.795 222 H GLY 31 H GLY 31 7.614 -13.110 -10.871 223 HA2 GLY 31 HA2 GLY 31 7.604 -15.630 -9.681 224 HA3 GLY 31 HA3 GLY 31 9.015 -14.865 -10.397 225 H ASN 32 H ASN 32 8.621 -12.607 -8.379 226 HA ASN 32 HA ASN 32 10.565 -13.336 -6.556 227 HB2 ASN 32 HB2 ASN 32 10.321 -11.235 -5.765 228 HB3 ASN 32 HB3 ASN 32 9.185 -11.037 -7.096 229 HD21 ASN 32 HD21 ASN 32 9.459 -11.836 -3.687 230 HD22 ASN 32 HD22 ASN 32 7.860 -11.346 -3.253 231 H GLY 33 H GLY 33 7.282 -14.264 -6.644 232 HA2 GLY 33 HA2 GLY 33 6.345 -15.974 -5.336 233 HA3 GLY 33 HA3 GLY 33 7.631 -15.750 -4.160 234 H TYR 34 H TYR 34 5.606 -13.185 -5.462 235 HA TYR 34 HA TYR 34 3.624 -13.077 -3.534 236 HB2 TYR 34 HB2 TYR 34 5.225 -12.802 -1.803 237 HB3 TYR 34 HB3 TYR 34 6.150 -11.635 -2.740 238 HD1 TYR 34 HD2 TYR 34 2.995 -12.139 -0.876 239 HD2 TYR 34 HD1 TYR 34 5.632 -9.322 -2.669 240 HE1 TYR 34 HE2 TYR 34 1.760 -10.306 0.202 241 HE2 TYR 34 HE1 TYR 34 4.405 -7.481 -1.594 242 HH TYR 34 HH TYR 34 2.360 -6.973 -0.584 243 H CYS 35 H CYS 35 2.574 -10.902 -3.400 244 HA CYS 35 HA CYS 35 2.402 -9.766 -6.002 245 HB2 CYS 35 HB2 CYS 35 1.064 -9.362 -3.386 246 HB3 CYS 35 HB3 CYS 35 1.028 -8.000 -4.501 247 H GLY 36 H GLY 36 4.824 -9.285 -5.975 248 HA2 GLY 36 HA2 GLY 36 5.627 -6.932 -4.498 249 HA3 GLY 36 HA3 GLY 36 6.602 -7.823 -5.657 Start of MODEL 11 1 H1 GLY 1 H GLY 1 3.191 0.185 -1.843 2 HA2 GLY 1 HA2 GLY 1 0.889 1.869 -1.528 3 HA3 GLY 1 HA3 GLY 1 2.261 2.165 -2.585 4 H CYS 2 H CYS 2 -0.478 -0.105 -2.324 5 HA CYS 2 HA CYS 2 -1.428 0.599 -4.934 6 HB2 CYS 2 HB2 CYS 2 -1.223 -1.818 -5.770 7 HB3 CYS 2 HB3 CYS 2 0.233 -0.829 -5.798 8 H ILE 3 H ILE 3 -3.560 0.206 -5.090 9 HA ILE 3 HA ILE 3 -4.956 -1.956 -4.031 10 HB ILE 3 HB ILE 3 -6.194 -0.348 -2.259 11 HG12 ILE 3 HG12 ILE 3 -3.316 0.275 -1.699 12 HG13 ILE 3 HG13 ILE 3 -4.231 1.313 -2.787 13 HG21 ILE 3 HG21 ILE 3 -4.475 -2.602 -2.195 14 HG22 ILE 3 HG22 ILE 3 -4.047 -1.553 -0.845 15 HG23 ILE 3 HG23 ILE 3 -5.705 -2.125 -1.025 16 HD11 ILE 3 HD11 ILE 3 -5.663 0.770 -0.328 17 HD12 ILE 3 HD12 ILE 3 -4.094 1.527 -0.048 18 HD13 ILE 3 HD13 ILE 3 -5.274 2.307 -1.101 19 H LEU 4 H LEU 4 -6.452 -1.999 -5.574 20 HA LEU 4 HA LEU 4 -8.270 0.253 -5.840 21 HB2 LEU 4 HB2 LEU 4 -6.195 -0.243 -7.718 22 HB3 LEU 4 HB3 LEU 4 -7.733 -0.638 -8.483 23 HG LEU 4 HG LEU 4 -8.373 1.754 -7.478 24 HD11 LEU 4 HD11 LEU 4 -5.443 1.619 -7.410 25 HD12 LEU 4 HD12 LEU 4 -6.554 2.690 -6.558 26 HD13 LEU 4 HD13 LEU 4 -6.105 3.034 -8.228 27 HD21 LEU 4 HD21 LEU 4 -8.421 0.902 -9.856 28 HD22 LEU 4 HD22 LEU 4 -6.775 1.516 -10.017 29 HD23 LEU 4 HD23 LEU 4 -8.100 2.625 -9.659 30 H ASN 5 H ASN 5 -8.130 -2.700 -5.036 31 HA ASN 5 HA ASN 5 -10.731 -3.416 -5.700 32 HB2 ASN 5 HB2 ASN 5 -8.977 -3.839 -7.868 33 HB3 ASN 5 HB3 ASN 5 -9.314 -5.430 -7.192 34 HD21 ASN 5 HD21 ASN 5 -11.698 -5.774 -6.674 35 HD22 ASN 5 HD22 ASN 5 -12.816 -5.258 -7.886 36 H GLY 6 H GLY 6 -8.867 -3.472 -3.505 37 HA2 GLY 6 HA2 GLY 6 -9.567 -5.528 -1.986 38 HA3 GLY 6 HA3 GLY 6 -8.371 -6.305 -3.012 39 H ARG 7 H ARG 7 -7.909 -6.343 -0.373 40 HA ARG 7 HA ARG 7 -6.067 -4.137 0.205 41 HB2 ARG 7 HB2 ARG 7 -7.001 -6.339 2.052 42 HB3 ARG 7 HB3 ARG 7 -6.112 -4.891 2.504 43 HG2 ARG 7 HG2 ARG 7 -8.858 -4.831 1.281 44 HG3 ARG 7 HG3 ARG 7 -8.561 -4.858 3.020 45 HD2 ARG 7 HD2 ARG 7 -7.233 -2.792 2.795 46 HD3 ARG 7 HD3 ARG 7 -7.612 -2.758 1.073 47 HE ARG 7 HE ARG 7 -10.051 -2.827 2.215 48 HH11 ARG 7 HH11 ARG 7 -7.249 -0.830 2.744 49 HH12 ARG 7 HH12 ARG 7 -8.167 0.554 3.237 50 HH21 ARG 7 HH21 ARG 7 -11.271 -1.011 2.862 51 HH22 ARG 7 HH22 ARG 7 -10.454 0.450 3.305 52 H THR 8 H THR 8 -4.154 -4.545 -0.749 53 HA THR 8 HA THR 8 -3.007 -6.966 -1.369 54 HB THR 8 HB THR 8 -0.844 -5.832 -1.438 55 HG1 THR 8 HG1 THR 8 -0.508 -4.315 -0.012 56 HG21 THR 8 HG21 THR 8 -3.261 -4.411 -2.484 57 HG22 THR 8 HG22 THR 8 -2.032 -5.325 -3.360 58 HG23 THR 8 HG23 THR 8 -1.659 -3.719 -2.735 59 H ASP 9 H ASP 9 -0.901 -7.819 -0.387 60 HA ASP 9 HA ASP 9 -0.002 -9.068 1.298 61 HB2 ASP 9 HB2 ASP 9 0.615 -6.587 1.817 62 HB3 ASP 9 HB3 ASP 9 -0.521 -6.765 3.151 63 H LEU 10 H LEU 10 -1.874 -10.489 1.276 64 HA LEU 10 HA LEU 10 -3.536 -10.214 3.693 65 HB2 LEU 10 HB2 LEU 10 -4.420 -10.369 1.137 66 HB3 LEU 10 HB3 LEU 10 -4.416 -12.073 1.588 67 HG LEU 10 HG LEU 10 -5.691 -10.809 3.707 68 HD11 LEU 10 HD11 LEU 10 -7.350 -9.387 2.792 69 HD12 LEU 10 HD12 LEU 10 -6.836 -9.733 1.141 70 HD13 LEU 10 HD13 LEU 10 -5.796 -8.790 2.209 71 HD21 LEU 10 HD21 LEU 10 -7.649 -11.982 2.909 72 HD22 LEU 10 HD22 LEU 10 -6.219 -12.989 2.686 73 HD23 LEU 10 HD23 LEU 10 -6.931 -12.150 1.307 74 H GLY 11 H GLY 11 -4.543 -12.683 3.992 75 HA2 GLY 11 HA2 GLY 11 -2.663 -14.110 5.376 76 HA3 GLY 11 HA3 GLY 11 -4.094 -14.840 4.663 77 H THR 12 H THR 12 -3.944 -15.813 2.600 78 HA THR 12 HA THR 12 -1.562 -17.236 2.147 79 HB THR 12 HB THR 12 -2.634 -17.881 -0.047 80 HG1 THR 12 HG1 THR 12 -4.006 -16.320 -0.621 81 HG21 THR 12 HG21 THR 12 -4.671 -18.239 2.102 82 HG22 THR 12 HG22 THR 12 -3.050 -18.886 2.354 83 HG23 THR 12 HG23 THR 12 -4.007 -19.418 0.972 84 H LEU 13 H LEU 13 -2.902 -14.345 0.629 85 HA LEU 13 HA LEU 13 -1.072 -14.145 -1.494 86 HB2 LEU 13 HB2 LEU 13 -3.148 -12.876 -1.410 87 HB3 LEU 13 HB3 LEU 13 -2.554 -11.973 -0.018 88 HG LEU 13 HG LEU 13 -2.513 -10.918 -2.409 89 HD11 LEU 13 HD11 LEU 13 -0.614 -10.741 -0.155 90 HD12 LEU 13 HD12 LEU 13 -1.644 -9.505 -0.876 91 HD13 LEU 13 HD13 LEU 13 -0.130 -9.957 -1.659 92 HD21 LEU 13 HD21 LEU 13 -0.812 -11.462 -3.822 93 HD22 LEU 13 HD22 LEU 13 -1.084 -13.044 -3.092 94 HD23 LEU 13 HD23 LEU 13 0.240 -12.025 -2.523 95 H LEU 14 H LEU 14 -0.637 -13.740 1.843 96 HA LEU 14 HA LEU 14 1.158 -11.736 2.208 97 HB2 LEU 14 HB2 LEU 14 0.452 -13.117 4.034 98 HB3 LEU 14 HB3 LEU 14 1.235 -14.530 3.329 99 HG LEU 14 HG LEU 14 3.362 -12.887 3.629 100 HD11 LEU 14 HD11 LEU 14 1.550 -12.306 5.967 101 HD12 LEU 14 HD12 LEU 14 1.990 -11.155 4.706 102 HD13 LEU 14 HD13 LEU 14 3.228 -11.796 5.786 103 HD21 LEU 14 HD21 LEU 14 3.912 -14.217 5.583 104 HD22 LEU 14 HD22 LEU 14 3.161 -15.228 4.348 105 HD23 LEU 14 HD23 LEU 14 2.226 -14.706 5.751 106 H PHE 15 H PHE 15 1.707 -14.767 0.553 107 HA PHE 15 HA PHE 15 4.052 -13.736 -0.718 108 HB2 PHE 15 HB2 PHE 15 4.306 -15.796 1.451 109 HB3 PHE 15 HB3 PHE 15 5.437 -15.783 0.102 110 HD1 PHE 15 HD2 PHE 15 6.391 -13.329 -0.421 111 HD2 PHE 15 HD1 PHE 15 4.939 -14.683 3.344 112 HE1 PHE 15 HE2 PHE 15 7.721 -11.597 0.711 113 HE2 PHE 15 HE1 PHE 15 6.267 -12.952 4.482 114 HZ PHE 15 HZ PHE 15 7.661 -11.407 3.166 115 H ARG 16 H ARG 16 5.173 -15.754 -1.909 116 HA ARG 16 HA ARG 16 4.900 -17.121 -3.718 117 HB2 ARG 16 HB2 ARG 16 4.615 -18.679 -1.787 118 HB3 ARG 16 HB3 ARG 16 2.875 -18.457 -1.917 119 HG2 ARG 16 HG2 ARG 16 3.781 -19.163 -4.482 120 HG3 ARG 16 HG3 ARG 16 4.581 -20.249 -3.343 121 HD2 ARG 16 HD2 ARG 16 1.702 -19.768 -2.895 122 HD3 ARG 16 HD3 ARG 16 2.122 -20.683 -4.342 123 HE ARG 16 HE ARG 16 2.289 -21.576 -1.629 124 HH11 ARG 16 HH11 ARG 16 3.635 -21.944 -4.818 125 HH12 ARG 16 HH12 ARG 16 4.190 -23.562 -4.540 126 HH21 ARG 16 HH21 ARG 16 3.016 -23.705 -1.249 127 HH22 ARG 16 HH22 ARG 16 3.837 -24.562 -2.509 128 H CYS 17 H CYS 17 3.072 -14.770 -3.468 129 HA CYS 17 HA CYS 17 0.643 -14.551 -4.054 130 HB2 CYS 17 HB2 CYS 17 1.023 -13.475 -6.302 131 HB3 CYS 17 HB3 CYS 17 2.066 -12.887 -5.011 132 H ARG 18 H ARG 18 -0.768 -16.168 -4.356 133 HA ARG 18 HA ARG 18 -0.404 -18.443 -5.917 134 HB2 ARG 18 HB2 ARG 18 -3.061 -18.305 -5.950 135 HB3 ARG 18 HB3 ARG 18 -2.168 -18.729 -4.496 136 HG2 ARG 18 HG2 ARG 18 -2.610 -15.854 -4.870 137 HG3 ARG 18 HG3 ARG 18 -4.073 -16.812 -4.633 138 HD2 ARG 18 HD2 ARG 18 -1.678 -16.614 -2.819 139 HD3 ARG 18 HD3 ARG 18 -3.331 -16.097 -2.486 140 HE ARG 18 HE ARG 18 -2.261 -18.714 -2.156 141 HH11 ARG 18 HH11 ARG 18 -5.156 -16.970 -2.991 142 HH12 ARG 18 HH12 ARG 18 -6.223 -18.232 -2.472 143 HH21 ARG 18 HH21 ARG 18 -3.656 -20.384 -1.469 144 HH22 ARG 18 HH22 ARG 18 -5.369 -20.173 -1.606 145 H ARG 19 H ARG 19 -1.112 -15.231 -6.861 146 HA ARG 19 HA ARG 19 -0.680 -15.514 -9.533 147 HB2 ARG 19 HB2 ARG 19 -2.519 -17.061 -9.712 148 HB3 ARG 19 HB3 ARG 19 -3.597 -15.946 -8.884 149 HG2 ARG 19 HG2 ARG 19 -4.022 -14.777 -10.747 150 HG3 ARG 19 HG3 ARG 19 -2.348 -14.859 -11.300 151 HD2 ARG 19 HD2 ARG 19 -2.726 -17.192 -12.003 152 HD3 ARG 19 HD3 ARG 19 -4.411 -17.049 -11.506 153 HE ARG 19 HE ARG 19 -3.666 -15.024 -13.372 154 HH11 ARG 19 HH11 ARG 19 -4.613 -18.362 -13.080 155 HH12 ARG 19 HH12 ARG 19 -5.270 -18.451 -14.681 156 HH21 ARG 19 HH21 ARG 19 -4.527 -15.129 -15.482 157 HH22 ARG 19 HH22 ARG 19 -5.220 -16.612 -16.046 158 H ASP 20 H ASP 20 -1.046 -13.603 -10.719 159 HA ASP 20 HA ASP 20 -0.888 -11.223 -9.382 160 HB2 ASP 20 HB2 ASP 20 -0.510 -11.701 -11.871 161 HB3 ASP 20 HB3 ASP 20 -2.239 -11.427 -12.068 162 H SER 21 H SER 21 -3.706 -13.108 -9.990 163 HA SER 21 HA SER 21 -5.722 -11.195 -9.895 164 HB2 SER 21 HB2 SER 21 -5.920 -13.715 -10.332 165 HB3 SER 21 HB3 SER 21 -5.960 -13.899 -8.579 166 HG SER 21 HG SER 21 -7.719 -12.194 -8.799 167 H ASP 22 H ASP 22 -3.734 -12.502 -7.354 168 HA ASP 22 HA ASP 22 -5.370 -11.510 -5.208 169 HB2 ASP 22 HB2 ASP 22 -3.376 -12.113 -3.797 170 HB3 ASP 22 HB3 ASP 22 -4.031 -13.441 -4.750 171 H CYS 23 H CYS 23 -3.637 -9.927 -7.442 172 HA CYS 23 HA CYS 23 -2.885 -7.779 -5.568 173 HB2 CYS 23 HB2 CYS 23 -1.309 -9.113 -7.577 174 HB3 CYS 23 HB3 CYS 23 -1.462 -7.404 -7.973 175 HA PRO 24 HA PRO 24 -6.212 -6.067 -8.212 176 HB2 PRO 24 HB2 PRO 24 -7.164 -4.404 -6.289 177 HB3 PRO 24 HB3 PRO 24 -7.634 -6.104 -6.409 178 HG2 PRO 24 HG2 PRO 24 -5.608 -4.821 -4.617 179 HG3 PRO 24 HG3 PRO 24 -6.815 -6.063 -4.233 180 HD2 PRO 24 HD2 PRO 24 -4.211 -6.653 -4.684 181 HD3 PRO 24 HD3 PRO 24 -5.529 -7.763 -5.109 182 H GLY 25 H GLY 25 -4.086 -4.300 -5.966 183 HA2 GLY 25 HA2 GLY 25 -4.272 -1.836 -7.407 184 HA3 GLY 25 HA3 GLY 25 -3.129 -2.208 -6.125 185 H ALA 26 H ALA 26 -1.735 -0.894 -7.605 186 HA ALA 26 HA ALA 26 -0.917 -1.649 -10.128 187 HB1 ALA 26 HB1 ALA 26 1.363 -0.772 -8.627 188 HB2 ALA 26 HB2 ALA 26 0.442 0.085 -9.864 189 HB3 ALA 26 HB3 ALA 26 -0.057 0.172 -8.175 190 H CYS 27 H CYS 27 0.461 -2.693 -7.014 191 HA CYS 27 HA CYS 27 2.522 -4.273 -7.827 192 HB2 CYS 27 HB2 CYS 27 1.812 -5.795 -5.839 193 HB3 CYS 27 HB3 CYS 27 2.273 -4.126 -5.518 194 H ILE 28 H ILE 28 2.725 -6.608 -8.091 195 HA ILE 28 HA ILE 28 0.372 -8.080 -8.918 196 HB ILE 28 HB ILE 28 1.434 -8.693 -11.128 197 HG12 ILE 28 HG12 ILE 28 3.066 -6.214 -10.534 198 HG13 ILE 28 HG13 ILE 28 3.689 -7.855 -10.662 199 HG21 ILE 28 HG21 ILE 28 0.806 -5.787 -11.193 200 HG22 ILE 28 HG22 ILE 28 0.218 -7.094 -12.219 201 HG23 ILE 28 HG23 ILE 28 -0.421 -6.899 -10.586 202 HD11 ILE 28 HD11 ILE 28 4.150 -6.602 -12.676 203 HD12 ILE 28 HD12 ILE 28 3.017 -7.912 -13.015 204 HD13 ILE 28 HD13 ILE 28 2.433 -6.254 -12.877 205 H CYS 29 H CYS 29 0.853 -10.347 -9.397 206 HA CYS 29 HA CYS 29 2.774 -11.395 -7.561 207 HB2 CYS 29 HB2 CYS 29 0.814 -12.676 -7.755 208 HB3 CYS 29 HB3 CYS 29 0.847 -12.625 -9.515 209 H ARG 30 H ARG 30 4.860 -11.691 -7.934 210 HA ARG 30 HA ARG 30 5.732 -12.355 -10.664 211 HB2 ARG 30 HB2 ARG 30 7.803 -10.938 -9.287 212 HB3 ARG 30 HB3 ARG 30 7.002 -10.527 -10.797 213 HG2 ARG 30 HG2 ARG 30 6.224 -8.730 -9.755 214 HG3 ARG 30 HG3 ARG 30 5.163 -9.818 -8.859 215 HD2 ARG 30 HD2 ARG 30 6.189 -9.218 -6.984 216 HD3 ARG 30 HD3 ARG 30 7.678 -9.931 -7.602 217 HE ARG 30 HE ARG 30 6.984 -7.118 -7.530 218 HH11 ARG 30 HH11 ARG 30 9.095 -9.582 -8.791 219 HH12 ARG 30 HH12 ARG 30 10.369 -8.474 -9.183 220 HH21 ARG 30 HH21 ARG 30 8.653 -5.649 -8.040 221 HH22 ARG 30 HH22 ARG 30 10.116 -6.237 -8.754 222 H GLY 31 H GLY 31 8.135 -13.119 -10.570 223 HA2 GLY 31 HA2 GLY 31 8.220 -15.519 -9.146 224 HA3 GLY 31 HA3 GLY 31 9.609 -14.742 -9.891 225 H ASN 32 H ASN 32 8.870 -12.349 -8.054 226 HA ASN 32 HA ASN 32 10.844 -12.722 -6.145 227 HB2 ASN 32 HB2 ASN 32 10.344 -10.612 -5.498 228 HB3 ASN 32 HB3 ASN 32 9.276 -10.626 -6.898 229 HD21 ASN 32 HD21 ASN 32 9.432 -11.118 -3.428 230 HD22 ASN 32 HD22 ASN 32 7.766 -10.781 -3.117 231 H GLY 33 H GLY 33 7.746 -14.090 -6.263 232 HA2 GLY 33 HA2 GLY 33 6.966 -15.777 -4.836 233 HA3 GLY 33 HA3 GLY 33 8.149 -15.279 -3.636 234 H TYR 34 H TYR 34 5.918 -13.090 -5.233 235 HA TYR 34 HA TYR 34 3.812 -13.092 -3.438 236 HB2 TYR 34 HB2 TYR 34 5.246 -12.519 -1.638 237 HB3 TYR 34 HB3 TYR 34 6.102 -11.319 -2.600 238 HD1 TYR 34 HD2 TYR 34 2.904 -12.051 -0.892 239 HD2 TYR 34 HD1 TYR 34 5.327 -9.081 -2.739 240 HE1 TYR 34 HE2 TYR 34 1.406 -10.301 -0.030 241 HE2 TYR 34 HE1 TYR 34 3.836 -7.323 -1.882 242 HH TYR 34 HH TYR 34 2.120 -6.869 -0.514 243 H CYS 35 H CYS 35 2.510 -11.059 -3.528 244 HA CYS 35 HA CYS 35 2.402 -10.112 -6.211 245 HB2 CYS 35 HB2 CYS 35 0.335 -10.351 -5.047 246 HB3 CYS 35 HB3 CYS 35 0.897 -9.356 -3.707 247 H GLY 36 H GLY 36 4.599 -9.224 -6.313 248 HA2 GLY 36 HA2 GLY 36 5.039 -6.735 -4.854 249 HA3 GLY 36 HA3 GLY 36 6.204 -7.561 -5.878 Start of MODEL 12 1 H1 GLY 1 H GLY 1 0.179 4.621 -4.820 2 HA2 GLY 1 HA2 GLY 1 1.250 2.944 -6.070 3 HA3 GLY 1 HA3 GLY 1 1.617 2.454 -4.423 4 H CYS 2 H CYS 2 -0.576 1.343 -3.456 5 HA CYS 2 HA CYS 2 -1.480 -0.640 -5.427 6 HB2 CYS 2 HB2 CYS 2 -0.268 -1.190 -2.719 7 HB3 CYS 2 HB3 CYS 2 -1.252 -2.373 -3.574 8 H ILE 3 H ILE 3 -3.154 -2.153 -4.101 9 HA ILE 3 HA ILE 3 -5.226 -2.302 -3.170 10 HB ILE 3 HB ILE 3 -4.585 0.229 -1.661 11 HG12 ILE 3 HG12 ILE 3 -4.140 -1.991 -0.003 12 HG13 ILE 3 HG13 ILE 3 -3.330 -2.374 -1.518 13 HG21 ILE 3 HG21 ILE 3 -6.904 -0.447 -1.538 14 HG22 ILE 3 HG22 ILE 3 -6.431 -2.083 -1.082 15 HG23 ILE 3 HG23 ILE 3 -6.116 -0.737 0.012 16 HD11 ILE 3 HD11 ILE 3 -1.695 -0.925 -1.117 17 HD12 ILE 3 HD12 ILE 3 -2.820 0.342 -0.627 18 HD13 ILE 3 HD13 ILE 3 -2.303 -0.878 0.537 19 H LEU 4 H LEU 4 -5.946 -1.764 -5.368 20 HA LEU 4 HA LEU 4 -7.579 0.667 -5.329 21 HB2 LEU 4 HB2 LEU 4 -5.466 -0.035 -7.275 22 HB3 LEU 4 HB3 LEU 4 -6.966 0.611 -7.937 23 HG LEU 4 HG LEU 4 -5.268 2.001 -5.866 24 HD11 LEU 4 HD11 LEU 4 -4.159 1.740 -8.083 25 HD12 LEU 4 HD12 LEU 4 -4.469 3.413 -7.619 26 HD13 LEU 4 HD13 LEU 4 -5.507 2.620 -8.804 27 HD21 LEU 4 HD21 LEU 4 -7.878 2.545 -7.127 28 HD22 LEU 4 HD22 LEU 4 -6.766 3.911 -7.027 29 HD23 LEU 4 HD23 LEU 4 -7.242 3.051 -5.561 30 H ASN 5 H ASN 5 -7.677 -2.486 -5.316 31 HA ASN 5 HA ASN 5 -10.274 -2.744 -6.286 32 HB2 ASN 5 HB2 ASN 5 -8.570 -2.565 -8.421 33 HB3 ASN 5 HB3 ASN 5 -8.665 -4.309 -8.190 34 HD21 ASN 5 HD21 ASN 5 -9.649 -2.786 -10.404 35 HD22 ASN 5 HD22 ASN 5 -11.357 -3.037 -10.473 36 H GLY 6 H GLY 6 -8.959 -3.562 -4.015 37 HA2 GLY 6 HA2 GLY 6 -9.823 -6.131 -3.602 38 HA3 GLY 6 HA3 GLY 6 -8.170 -6.313 -4.170 39 H ARG 7 H ARG 7 -7.566 -7.215 -2.159 40 HA ARG 7 HA ARG 7 -7.668 -5.418 0.153 41 HB2 ARG 7 HB2 ARG 7 -8.028 -8.170 -0.103 42 HB3 ARG 7 HB3 ARG 7 -6.437 -8.006 0.627 43 HG2 ARG 7 HG2 ARG 7 -7.326 -6.775 2.466 44 HG3 ARG 7 HG3 ARG 7 -8.908 -6.662 1.691 45 HD2 ARG 7 HD2 ARG 7 -7.627 -9.290 2.398 46 HD3 ARG 7 HD3 ARG 7 -8.655 -8.402 3.523 47 HE ARG 7 HE ARG 7 -9.501 -9.945 1.272 48 HH11 ARG 7 HH11 ARG 7 -10.289 -7.202 3.266 49 HH12 ARG 7 HH12 ARG 7 -11.989 -7.288 2.940 50 HH21 ARG 7 HH21 ARG 7 -11.736 -10.068 0.834 51 HH22 ARG 7 HH22 ARG 7 -12.811 -8.919 1.557 52 H THR 8 H THR 8 -5.347 -7.399 -1.672 53 HA THR 8 HA THR 8 -3.119 -7.134 -2.074 54 HB THR 8 HB THR 8 -3.300 -4.396 -0.821 55 HG1 THR 8 HG1 THR 8 -4.764 -4.138 -2.370 56 HG21 THR 8 HG21 THR 8 -1.207 -4.134 -1.544 57 HG22 THR 8 HG22 THR 8 -1.655 -4.650 -3.170 58 HG23 THR 8 HG23 THR 8 -1.189 -5.847 -1.962 59 H ASP 9 H ASP 9 -1.492 -8.020 -0.973 60 HA ASP 9 HA ASP 9 -0.307 -8.875 0.777 61 HB2 ASP 9 HB2 ASP 9 0.172 -6.283 0.746 62 HB3 ASP 9 HB3 ASP 9 -0.697 -6.318 2.278 63 H LEU 10 H LEU 10 -1.935 -10.391 1.365 64 HA LEU 10 HA LEU 10 -3.191 -9.764 3.948 65 HB2 LEU 10 HB2 LEU 10 -5.226 -10.700 3.357 66 HB3 LEU 10 HB3 LEU 10 -4.766 -9.785 1.922 67 HG LEU 10 HG LEU 10 -3.760 -12.296 1.404 68 HD11 LEU 10 HD11 LEU 10 -4.777 -13.708 2.809 69 HD12 LEU 10 HD12 LEU 10 -6.204 -13.438 1.809 70 HD13 LEU 10 HD13 LEU 10 -5.981 -12.513 3.294 71 HD21 LEU 10 HD21 LEU 10 -5.339 -12.350 -0.326 72 HD22 LEU 10 HD22 LEU 10 -5.074 -10.633 -0.018 73 HD23 LEU 10 HD23 LEU 10 -6.521 -11.428 0.604 74 H GLY 11 H GLY 11 -4.251 -12.148 4.617 75 HA2 GLY 11 HA2 GLY 11 -2.289 -13.612 5.755 76 HA3 GLY 11 HA3 GLY 11 -3.798 -14.337 5.220 77 H THR 12 H THR 12 -3.881 -15.384 3.194 78 HA THR 12 HA THR 12 -1.613 -16.884 2.536 79 HB THR 12 HB THR 12 -3.333 -16.774 0.260 80 HG1 THR 12 HG1 THR 12 -4.835 -17.323 2.584 81 HG21 THR 12 HG21 THR 12 -3.698 -19.079 0.757 82 HG22 THR 12 HG22 THR 12 -3.267 -18.844 2.451 83 HG23 THR 12 HG23 THR 12 -2.031 -18.712 1.200 84 H LEU 13 H LEU 13 -3.109 -14.155 0.803 85 HA LEU 13 HA LEU 13 -1.396 -14.007 -1.357 86 HB2 LEU 13 HB2 LEU 13 -3.499 -12.645 -0.827 87 HB3 LEU 13 HB3 LEU 13 -2.421 -11.561 0.051 88 HG LEU 13 HG LEU 13 -1.956 -12.218 -2.841 89 HD11 LEU 13 HD11 LEU 13 -3.855 -11.196 -3.380 90 HD12 LEU 13 HD12 LEU 13 -3.134 -9.713 -2.757 91 HD13 LEU 13 HD13 LEU 13 -4.150 -10.705 -1.712 92 HD21 LEU 13 HD21 LEU 13 -1.289 -9.574 -2.156 93 HD22 LEU 13 HD22 LEU 13 -0.195 -10.910 -2.515 94 HD23 LEU 13 HD23 LEU 13 -0.690 -10.598 -0.851 95 H LEU 14 H LEU 14 -0.723 -13.391 1.936 96 HA LEU 14 HA LEU 14 1.181 -11.475 2.046 97 HB2 LEU 14 HB2 LEU 14 0.521 -12.772 3.978 98 HB3 LEU 14 HB3 LEU 14 1.303 -14.206 3.316 99 HG LEU 14 HG LEU 14 3.420 -12.558 3.427 100 HD11 LEU 14 HD11 LEU 14 1.391 -11.249 4.973 101 HD12 LEU 14 HD12 LEU 14 3.036 -10.725 4.612 102 HD13 LEU 14 HD13 LEU 14 2.724 -11.745 6.017 103 HD21 LEU 14 HD21 LEU 14 4.177 -13.970 5.027 104 HD22 LEU 14 HD22 LEU 14 2.726 -14.867 4.580 105 HD23 LEU 14 HD23 LEU 14 2.716 -13.826 6.005 106 H PHE 15 H PHE 15 1.497 -14.624 0.553 107 HA PHE 15 HA PHE 15 3.804 -13.756 -0.918 108 HB2 PHE 15 HB2 PHE 15 4.069 -15.866 1.220 109 HB3 PHE 15 HB3 PHE 15 5.181 -15.765 -0.141 110 HD1 PHE 15 HD2 PHE 15 6.141 -13.303 -0.533 111 HD2 PHE 15 HD1 PHE 15 4.686 -14.831 3.164 112 HE1 PHE 15 HE2 PHE 15 7.473 -11.628 0.680 113 HE2 PHE 15 HE1 PHE 15 6.016 -13.157 4.383 114 HZ PHE 15 HZ PHE 15 7.412 -11.553 3.141 115 H ARG 16 H ARG 16 4.739 -15.930 -2.056 116 HA ARG 16 HA ARG 16 4.318 -17.422 -3.723 117 HB2 ARG 16 HB2 ARG 16 3.701 -18.777 -1.717 118 HB3 ARG 16 HB3 ARG 16 2.030 -18.281 -1.946 119 HG2 ARG 16 HG2 ARG 16 1.849 -19.470 -3.973 120 HG3 ARG 16 HG3 ARG 16 3.595 -19.707 -4.075 121 HD2 ARG 16 HD2 ARG 16 2.245 -20.759 -1.662 122 HD3 ARG 16 HD3 ARG 16 1.903 -21.585 -3.182 123 HE ARG 16 HE ARG 16 4.673 -21.247 -2.957 124 HH11 ARG 16 HH11 ARG 16 2.078 -23.010 -1.447 125 HH12 ARG 16 HH12 ARG 16 3.085 -24.333 -0.962 126 HH21 ARG 16 HH21 ARG 16 6.009 -22.983 -2.323 127 HH22 ARG 16 HH22 ARG 16 5.322 -24.316 -1.459 128 H CYS 17 H CYS 17 2.787 -14.791 -3.571 129 HA CYS 17 HA CYS 17 0.462 -14.269 -4.325 130 HB2 CYS 17 HB2 CYS 17 1.119 -13.320 -6.577 131 HB3 CYS 17 HB3 CYS 17 2.125 -12.817 -5.222 132 H ARG 18 H ARG 18 -1.094 -15.760 -4.639 133 HA ARG 18 HA ARG 18 -0.929 -18.062 -6.194 134 HB2 ARG 18 HB2 ARG 18 -3.586 -17.495 -6.311 135 HB3 ARG 18 HB3 ARG 18 -2.792 -18.252 -4.936 136 HG2 ARG 18 HG2 ARG 18 -2.815 -15.298 -4.995 137 HG3 ARG 18 HG3 ARG 18 -4.358 -16.107 -4.716 138 HD2 ARG 18 HD2 ARG 18 -1.844 -16.226 -3.083 139 HD3 ARG 18 HD3 ARG 18 -3.472 -15.777 -2.575 140 HE ARG 18 HE ARG 18 -3.840 -18.320 -3.259 141 HH11 ARG 18 HH11 ARG 18 -1.319 -16.825 -1.380 142 HH12 ARG 18 HH12 ARG 18 -1.037 -18.227 -0.402 143 HH21 ARG 18 HH21 ARG 18 -3.478 -20.172 -1.978 144 HH22 ARG 18 HH22 ARG 18 -2.265 -20.130 -0.743 145 H ARG 19 H ARG 19 -1.229 -14.801 -7.157 146 HA ARG 19 HA ARG 19 -0.821 -15.209 -9.840 147 HB2 ARG 19 HB2 ARG 19 -3.206 -14.644 -10.671 148 HB3 ARG 19 HB3 ARG 19 -2.840 -16.305 -10.222 149 HG2 ARG 19 HG2 ARG 19 -4.094 -16.197 -8.284 150 HG3 ARG 19 HG3 ARG 19 -4.021 -14.435 -8.215 151 HD2 ARG 19 HD2 ARG 19 -5.467 -14.319 -10.202 152 HD3 ARG 19 HD3 ARG 19 -5.565 -16.080 -10.217 153 HE ARG 19 HE ARG 19 -6.374 -15.051 -7.704 154 HH11 ARG 19 HH11 ARG 19 -7.435 -15.415 -11.000 155 HH12 ARG 19 HH12 ARG 19 -9.119 -15.430 -10.594 156 HH21 ARG 19 HH21 ARG 19 -8.588 -15.071 -7.157 157 HH22 ARG 19 HH22 ARG 19 -9.774 -15.233 -8.408 158 H ASP 20 H ASP 20 -1.191 -13.262 -11.162 159 HA ASP 20 HA ASP 20 -0.352 -10.943 -9.944 160 HB2 ASP 20 HB2 ASP 20 -1.018 -9.770 -11.982 161 HB3 ASP 20 HB3 ASP 20 -0.281 -11.320 -12.377 162 H SER 21 H SER 21 -3.645 -12.064 -10.480 163 HA SER 21 HA SER 21 -5.105 -9.798 -9.943 164 HB2 SER 21 HB2 SER 21 -5.711 -12.635 -9.074 165 HB3 SER 21 HB3 SER 21 -6.883 -11.317 -9.103 166 HG SER 21 HG SER 21 -7.020 -11.479 -11.207 167 H ASP 22 H ASP 22 -3.174 -11.670 -7.775 168 HA ASP 22 HA ASP 22 -4.232 -11.197 -5.301 169 HB2 ASP 22 HB2 ASP 22 -1.351 -11.193 -6.197 170 HB3 ASP 22 HB3 ASP 22 -1.815 -11.081 -4.501 171 H CYS 23 H CYS 23 -2.160 -8.990 -7.162 172 HA CYS 23 HA CYS 23 -2.891 -6.838 -5.291 173 HB2 CYS 23 HB2 CYS 23 -0.432 -7.455 -6.827 174 HB3 CYS 23 HB3 CYS 23 -0.869 -5.753 -6.707 175 HA PRO 24 HA PRO 24 -5.414 -5.486 -8.751 176 HB2 PRO 24 HB2 PRO 24 -6.665 -3.513 -7.367 177 HB3 PRO 24 HB3 PRO 24 -7.119 -5.217 -7.234 178 HG2 PRO 24 HG2 PRO 24 -5.414 -3.563 -5.412 179 HG3 PRO 24 HG3 PRO 24 -6.675 -4.741 -5.002 180 HD2 PRO 24 HD2 PRO 24 -4.035 -5.336 -4.894 181 HD3 PRO 24 HD3 PRO 24 -5.270 -6.542 -5.311 182 H GLY 25 H GLY 25 -3.613 -3.317 -6.584 183 HA2 GLY 25 HA2 GLY 25 -3.605 -1.093 -8.342 184 HA3 GLY 25 HA3 GLY 25 -2.522 -1.334 -6.979 185 H ALA 26 H ALA 26 -0.639 -0.699 -7.935 186 HA ALA 26 HA ALA 26 0.162 -1.518 -10.538 187 HB1 ALA 26 HB1 ALA 26 1.658 -0.272 -8.245 188 HB2 ALA 26 HB2 ALA 26 2.414 -0.646 -9.795 189 HB3 ALA 26 HB3 ALA 26 1.078 0.502 -9.720 190 H CYS 27 H CYS 27 1.275 -2.477 -7.288 191 HA CYS 27 HA CYS 27 3.173 -4.318 -7.848 192 HB2 CYS 27 HB2 CYS 27 2.008 -5.664 -5.870 193 HB3 CYS 27 HB3 CYS 27 2.849 -4.143 -5.586 194 H ILE 28 H ILE 28 3.231 -6.594 -8.175 195 HA ILE 28 HA ILE 28 0.805 -7.959 -8.973 196 HB ILE 28 HB ILE 28 1.863 -8.647 -11.182 197 HG12 ILE 28 HG12 ILE 28 3.550 -6.220 -10.547 198 HG13 ILE 28 HG13 ILE 28 4.119 -7.863 -10.822 199 HG21 ILE 28 HG21 ILE 28 0.027 -6.821 -10.644 200 HG22 ILE 28 HG22 ILE 28 1.258 -5.742 -11.299 201 HG23 ILE 28 HG23 ILE 28 0.636 -7.068 -12.280 202 HD11 ILE 28 HD11 ILE 28 2.811 -7.387 -13.137 203 HD12 ILE 28 HD12 ILE 28 3.390 -5.769 -12.736 204 HD13 ILE 28 HD13 ILE 28 4.533 -7.103 -12.884 205 H CYS 29 H CYS 29 1.257 -10.253 -9.583 206 HA CYS 29 HA CYS 29 3.034 -11.413 -7.674 207 HB2 CYS 29 HB2 CYS 29 1.038 -12.614 -8.076 208 HB3 CYS 29 HB3 CYS 29 1.255 -12.551 -9.822 209 H ARG 30 H ARG 30 5.062 -12.118 -7.916 210 HA ARG 30 HA ARG 30 6.119 -12.605 -10.596 211 HB2 ARG 30 HB2 ARG 30 8.115 -11.249 -10.166 212 HB3 ARG 30 HB3 ARG 30 6.658 -10.265 -10.130 213 HG2 ARG 30 HG2 ARG 30 7.648 -11.361 -7.559 214 HG3 ARG 30 HG3 ARG 30 8.552 -10.041 -8.304 215 HD2 ARG 30 HD2 ARG 30 5.620 -10.038 -7.597 216 HD3 ARG 30 HD3 ARG 30 6.901 -9.167 -6.755 217 HE ARG 30 HE ARG 30 5.542 -8.337 -9.107 218 HH11 ARG 30 HH11 ARG 30 8.644 -8.270 -7.528 219 HH12 ARG 30 HH12 ARG 30 9.154 -6.808 -8.306 220 HH21 ARG 30 HH21 ARG 30 6.203 -6.412 -10.137 221 HH22 ARG 30 HH22 ARG 30 7.765 -5.752 -9.789 222 H GLY 31 H GLY 31 8.565 -13.328 -10.289 223 HA2 GLY 31 HA2 GLY 31 8.521 -15.777 -8.949 224 HA3 GLY 31 HA3 GLY 31 9.973 -14.965 -9.515 225 H ASN 32 H ASN 32 9.059 -12.636 -7.698 226 HA ASN 32 HA ASN 32 10.790 -13.160 -5.570 227 HB2 ASN 32 HB2 ASN 32 10.407 -11.007 -5.019 228 HB3 ASN 32 HB3 ASN 32 9.456 -10.949 -6.500 229 HD21 ASN 32 HD21 ASN 32 9.321 -11.341 -3.027 230 HD22 ASN 32 HD22 ASN 32 7.656 -10.913 -2.852 231 H GLY 33 H GLY 33 7.717 -14.386 -6.129 232 HA2 GLY 33 HA2 GLY 33 6.543 -15.923 -4.843 233 HA3 GLY 33 HA3 GLY 33 7.654 -15.617 -3.517 234 H TYR 34 H TYR 34 5.757 -13.204 -5.255 235 HA TYR 34 HA TYR 34 3.576 -13.013 -3.545 236 HB2 TYR 34 HB2 TYR 34 5.048 -12.488 -1.734 237 HB3 TYR 34 HB3 TYR 34 5.932 -11.320 -2.709 238 HD1 TYR 34 HD2 TYR 34 2.622 -11.972 -1.153 239 HD2 TYR 34 HD1 TYR 34 5.288 -9.064 -2.746 240 HE1 TYR 34 HE2 TYR 34 1.152 -10.181 -0.329 241 HE2 TYR 34 HE1 TYR 34 3.826 -7.264 -1.925 242 HH TYR 34 HH TYR 34 1.725 -6.815 -1.135 243 H CYS 35 H CYS 35 2.387 -10.951 -3.789 244 HA CYS 35 HA CYS 35 2.533 -10.050 -6.499 245 HB2 CYS 35 HB2 CYS 35 0.520 -8.897 -6.072 246 HB3 CYS 35 HB3 CYS 35 0.427 -10.345 -5.075 247 H GLY 36 H GLY 36 4.865 -9.308 -6.058 248 HA2 GLY 36 HA2 GLY 36 5.375 -6.964 -4.579 249 HA3 GLY 36 HA3 GLY 36 6.370 -7.583 -5.889 Start of MODEL 13 1 H1 GLY 1 H GLY 1 0.526 -4.051 -1.190 2 HA2 GLY 1 HA2 GLY 1 0.845 -1.235 -0.523 3 HA3 GLY 1 HA3 GLY 1 2.112 -2.333 -1.049 4 H CYS 2 H CYS 2 -0.911 -0.951 -2.347 5 HA CYS 2 HA CYS 2 0.402 0.340 -4.503 6 HB2 CYS 2 HB2 CYS 2 -0.833 -1.116 -6.272 7 HB3 CYS 2 HB3 CYS 2 0.696 -1.686 -5.611 8 H ILE 3 H ILE 3 -1.389 1.206 -2.604 9 HA ILE 3 HA ILE 3 -3.180 2.626 -2.509 10 HB ILE 3 HB ILE 3 -3.851 1.865 -5.347 11 HG12 ILE 3 HG12 ILE 3 -1.986 4.033 -4.357 12 HG13 ILE 3 HG13 ILE 3 -1.522 2.603 -5.273 13 HG21 ILE 3 HG21 ILE 3 -4.364 4.587 -4.647 14 HG22 ILE 3 HG22 ILE 3 -5.500 3.334 -5.145 15 HG23 ILE 3 HG23 ILE 3 -5.091 3.526 -3.441 16 HD11 ILE 3 HD11 ILE 3 -2.990 3.446 -7.125 17 HD12 ILE 3 HD12 ILE 3 -3.141 4.949 -6.214 18 HD13 ILE 3 HD13 ILE 3 -1.559 4.417 -6.783 19 H LEU 4 H LEU 4 -3.344 -0.648 -3.361 20 HA LEU 4 HA LEU 4 -4.845 -2.301 -2.936 21 HB2 LEU 4 HB2 LEU 4 -4.843 -1.139 -0.709 22 HB3 LEU 4 HB3 LEU 4 -6.283 -0.272 -1.238 23 HG LEU 4 HG LEU 4 -6.299 -3.255 -1.270 24 HD11 LEU 4 HD11 LEU 4 -7.089 -1.808 1.215 25 HD12 LEU 4 HD12 LEU 4 -5.402 -2.256 0.969 26 HD13 LEU 4 HD13 LEU 4 -6.651 -3.501 0.987 27 HD21 LEU 4 HD21 LEU 4 -8.366 -2.755 -1.930 28 HD22 LEU 4 HD22 LEU 4 -8.183 -1.059 -1.480 29 HD23 LEU 4 HD23 LEU 4 -8.671 -2.246 -0.269 30 H ASN 5 H ASN 5 -6.826 -3.108 -3.669 31 HA ASN 5 HA ASN 5 -9.053 -1.641 -4.438 32 HB2 ASN 5 HB2 ASN 5 -6.932 -1.109 -6.166 33 HB3 ASN 5 HB3 ASN 5 -7.912 -2.288 -7.033 34 HD21 ASN 5 HD21 ASN 5 -9.437 -1.465 -8.252 35 HD22 ASN 5 HD22 ASN 5 -10.230 0.051 -8.014 36 H GLY 6 H GLY 6 -8.269 -4.200 -3.341 37 HA2 GLY 6 HA2 GLY 6 -10.185 -5.906 -4.015 38 HA3 GLY 6 HA3 GLY 6 -9.076 -6.149 -5.356 39 H ARG 7 H ARG 7 -8.547 -5.668 -1.868 40 HA ARG 7 HA ARG 7 -7.526 -6.965 -0.298 41 HB2 ARG 7 HB2 ARG 7 -9.016 -8.752 -1.506 42 HB3 ARG 7 HB3 ARG 7 -7.481 -9.315 -2.153 43 HG2 ARG 7 HG2 ARG 7 -6.737 -10.056 -0.126 44 HG3 ARG 7 HG3 ARG 7 -7.699 -8.885 0.778 45 HD2 ARG 7 HD2 ARG 7 -8.911 -10.754 1.232 46 HD3 ARG 7 HD3 ARG 7 -9.691 -10.288 -0.280 47 HE ARG 7 HE ARG 7 -7.463 -12.045 -0.667 48 HH11 ARG 7 HH11 ARG 7 -10.853 -11.890 0.108 49 HH12 ARG 7 HH12 ARG 7 -11.188 -13.494 -0.455 50 HH21 ARG 7 HH21 ARG 7 -7.891 -14.158 -1.411 51 HH22 ARG 7 HH22 ARG 7 -9.503 -14.783 -1.318 52 H THR 8 H THR 8 -5.686 -5.576 -0.774 53 HA THR 8 HA THR 8 -3.561 -6.846 -2.348 54 HB THR 8 HB THR 8 -4.109 -4.454 -2.805 55 HG1 THR 8 HG1 THR 8 -1.957 -5.401 -3.108 56 HG21 THR 8 HG21 THR 8 -2.797 -3.845 -0.166 57 HG22 THR 8 HG22 THR 8 -4.549 -3.950 -0.343 58 HG23 THR 8 HG23 THR 8 -3.641 -2.742 -1.252 59 H ASP 9 H ASP 9 -1.700 -7.570 -1.457 60 HA ASP 9 HA ASP 9 -0.417 -8.515 0.188 61 HB2 ASP 9 HB2 ASP 9 0.173 -5.976 0.055 62 HB3 ASP 9 HB3 ASP 9 -0.611 -5.890 1.630 63 H LEU 10 H LEU 10 -2.291 -9.860 0.827 64 HA LEU 10 HA LEU 10 -2.985 -9.333 3.631 65 HB2 LEU 10 HB2 LEU 10 -4.868 -8.782 2.042 66 HB3 LEU 10 HB3 LEU 10 -4.920 -10.498 1.642 67 HG LEU 10 HG LEU 10 -5.232 -10.773 4.235 68 HD11 LEU 10 HD11 LEU 10 -6.585 -8.127 3.923 69 HD12 LEU 10 HD12 LEU 10 -4.900 -8.209 4.437 70 HD13 LEU 10 HD13 LEU 10 -6.152 -9.000 5.393 71 HD21 LEU 10 HD21 LEU 10 -7.596 -9.693 2.754 72 HD22 LEU 10 HD22 LEU 10 -7.499 -11.061 3.864 73 HD23 LEU 10 HD23 LEU 10 -6.829 -11.195 2.237 74 H GLY 11 H GLY 11 -2.643 -11.016 4.947 75 HA2 GLY 11 HA2 GLY 11 -1.321 -13.055 5.163 76 HA3 GLY 11 HA3 GLY 11 -3.025 -13.482 5.204 77 H THR 12 H THR 12 -4.019 -14.251 3.244 78 HA THR 12 HA THR 12 -2.730 -16.285 1.975 79 HB THR 12 HB THR 12 -4.974 -16.359 1.534 80 HG1 THR 12 HG1 THR 12 -5.267 -15.853 -0.735 81 HG21 THR 12 HG21 THR 12 -4.735 -13.438 1.505 82 HG22 THR 12 HG22 THR 12 -6.047 -14.461 2.089 83 HG23 THR 12 HG23 THR 12 -5.928 -14.073 0.373 84 H LEU 13 H LEU 13 -3.303 -13.109 0.443 85 HA LEU 13 HA LEU 13 -1.396 -13.650 -1.632 86 HB2 LEU 13 HB2 LEU 13 -3.380 -12.287 -2.040 87 HB3 LEU 13 HB3 LEU 13 -2.809 -11.096 -0.872 88 HG LEU 13 HG LEU 13 -2.525 -10.678 -3.430 89 HD11 LEU 13 HD11 LEU 13 0.047 -10.051 -2.319 90 HD12 LEU 13 HD12 LEU 13 -1.220 -9.785 -1.121 91 HD13 LEU 13 HD13 LEU 13 -1.306 -8.981 -2.689 92 HD21 LEU 13 HD21 LEU 13 -1.229 -13.012 -3.420 93 HD22 LEU 13 HD22 LEU 13 0.131 -11.938 -3.093 94 HD23 LEU 13 HD23 LEU 13 -0.844 -11.710 -4.545 95 H LEU 14 H LEU 14 -1.153 -12.573 1.544 96 HA LEU 14 HA LEU 14 0.705 -10.598 1.647 97 HB2 LEU 14 HB2 LEU 14 -0.323 -11.947 3.548 98 HB3 LEU 14 HB3 LEU 14 0.995 -13.091 3.301 99 HG LEU 14 HG LEU 14 2.290 -10.665 3.565 100 HD11 LEU 14 HD11 LEU 14 1.349 -9.400 5.228 101 HD12 LEU 14 HD12 LEU 14 0.383 -10.737 5.852 102 HD13 LEU 14 HD13 LEU 14 -0.094 -9.925 4.362 103 HD21 LEU 14 HD21 LEU 14 2.694 -13.023 4.534 104 HD22 LEU 14 HD22 LEU 14 1.743 -12.452 5.906 105 HD23 LEU 14 HD23 LEU 14 3.234 -11.621 5.460 106 H PHE 15 H PHE 15 1.201 -13.877 0.570 107 HA PHE 15 HA PHE 15 3.720 -13.162 -0.612 108 HB2 PHE 15 HB2 PHE 15 3.600 -15.005 1.762 109 HB3 PHE 15 HB3 PHE 15 4.866 -15.172 0.550 110 HD1 PHE 15 HD2 PHE 15 5.727 -12.577 -0.114 111 HD2 PHE 15 HD1 PHE 15 4.390 -14.013 3.663 112 HE1 PHE 15 HE2 PHE 15 7.034 -10.823 1.011 113 HE2 PHE 15 HE1 PHE 15 5.695 -12.260 4.795 114 HZ PHE 15 HZ PHE 15 7.020 -10.663 3.468 115 H ARG 16 H ARG 16 4.751 -15.302 -1.553 116 HA ARG 16 HA ARG 16 4.501 -16.820 -3.243 117 HB2 ARG 16 HB2 ARG 16 4.078 -18.174 -1.184 118 HB3 ARG 16 HB3 ARG 16 2.355 -17.914 -1.418 119 HG2 ARG 16 HG2 ARG 16 3.342 -18.890 -3.859 120 HG3 ARG 16 HG3 ARG 16 4.066 -19.881 -2.590 121 HD2 ARG 16 HD2 ARG 16 1.646 -19.949 -1.639 122 HD3 ARG 16 HD3 ARG 16 1.182 -19.480 -3.274 123 HE ARG 16 HE ARG 16 1.604 -21.618 -3.942 124 HH11 ARG 16 HH11 ARG 16 3.293 -21.036 -0.954 125 HH12 ARG 16 HH12 ARG 16 3.839 -22.672 -0.793 126 HH21 ARG 16 HH21 ARG 16 2.316 -23.775 -3.741 127 HH22 ARG 16 HH22 ARG 16 3.284 -24.229 -2.379 128 H CYS 17 H CYS 17 2.780 -14.399 -3.332 129 HA CYS 17 HA CYS 17 0.345 -14.221 -4.028 130 HB2 CYS 17 HB2 CYS 17 0.864 -13.226 -6.276 131 HB3 CYS 17 HB3 CYS 17 1.848 -12.600 -4.957 132 H ARG 18 H ARG 18 -1.156 -15.665 -4.538 133 HA ARG 18 HA ARG 18 -0.650 -18.074 -5.917 134 HB2 ARG 18 HB2 ARG 18 -3.427 -17.268 -6.056 135 HB3 ARG 18 HB3 ARG 18 -2.695 -18.609 -5.186 136 HG2 ARG 18 HG2 ARG 18 -2.791 -15.770 -4.190 137 HG3 ARG 18 HG3 ARG 18 -3.921 -17.044 -3.727 138 HD2 ARG 18 HD2 ARG 18 -1.212 -16.516 -2.799 139 HD3 ARG 18 HD3 ARG 18 -2.502 -17.457 -2.050 140 HE ARG 18 HE ARG 18 -0.386 -18.446 -3.768 141 HH11 ARG 18 HH11 ARG 18 -3.446 -19.069 -2.230 142 HH12 ARG 18 HH12 ARG 18 -3.295 -20.791 -2.332 143 HH21 ARG 18 HH21 ARG 18 -0.175 -20.713 -3.908 144 HH22 ARG 18 HH22 ARG 18 -1.434 -21.726 -3.286 145 H ARG 19 H ARG 19 -1.171 -14.902 -7.025 146 HA ARG 19 HA ARG 19 -0.609 -15.307 -9.653 147 HB2 ARG 19 HB2 ARG 19 -2.979 -15.155 -10.658 148 HB3 ARG 19 HB3 ARG 19 -2.414 -16.722 -10.094 149 HG2 ARG 19 HG2 ARG 19 -3.810 -16.708 -8.250 150 HG3 ARG 19 HG3 ARG 19 -4.000 -14.954 -8.282 151 HD2 ARG 19 HD2 ARG 19 -6.016 -15.546 -9.157 152 HD3 ARG 19 HD3 ARG 19 -5.073 -15.493 -10.646 153 HE ARG 19 HE ARG 19 -4.833 -18.068 -9.751 154 HH11 ARG 19 HH11 ARG 19 -7.479 -15.958 -10.568 155 HH12 ARG 19 HH12 ARG 19 -8.518 -17.245 -11.083 156 HH21 ARG 19 HH21 ARG 19 -6.191 -19.772 -10.427 157 HH22 ARG 19 HH22 ARG 19 -7.785 -19.414 -11.002 158 H ASP 20 H ASP 20 -0.965 -13.449 -10.991 159 HA ASP 20 HA ASP 20 -0.725 -11.013 -9.732 160 HB2 ASP 20 HB2 ASP 20 -1.475 -10.048 -11.991 161 HB3 ASP 20 HB3 ASP 20 -0.062 -11.100 -11.988 162 H SER 21 H SER 21 -3.594 -12.810 -10.414 163 HA SER 21 HA SER 21 -5.517 -10.788 -10.430 164 HB2 SER 21 HB2 SER 21 -6.962 -12.510 -10.551 165 HB3 SER 21 HB3 SER 21 -5.544 -13.558 -10.524 166 HG SER 21 HG SER 21 -7.448 -13.568 -8.795 167 H ASP 22 H ASP 22 -3.683 -12.151 -7.822 168 HA ASP 22 HA ASP 22 -5.392 -11.148 -5.735 169 HB2 ASP 22 HB2 ASP 22 -2.519 -12.026 -5.441 170 HB3 ASP 22 HB3 ASP 22 -3.778 -12.011 -4.210 171 H CYS 23 H CYS 23 -3.505 -9.598 -7.881 172 HA CYS 23 HA CYS 23 -2.688 -7.523 -5.955 173 HB2 CYS 23 HB2 CYS 23 -1.581 -7.749 -8.740 174 HB3 CYS 23 HB3 CYS 23 -0.880 -6.952 -7.336 175 HA PRO 24 HA PRO 24 -6.111 -5.474 -8.119 176 HB2 PRO 24 HB2 PRO 24 -6.519 -3.637 -6.161 177 HB3 PRO 24 HB3 PRO 24 -7.173 -5.278 -6.091 178 HG2 PRO 24 HG2 PRO 24 -4.731 -4.153 -4.773 179 HG3 PRO 24 HG3 PRO 24 -5.965 -5.237 -4.104 180 HD2 PRO 24 HD2 PRO 24 -3.562 -6.129 -4.977 181 HD3 PRO 24 HD3 PRO 24 -5.042 -7.104 -5.091 182 H GLY 25 H GLY 25 -3.685 -3.641 -6.235 183 HA2 GLY 25 HA2 GLY 25 -3.789 -1.412 -8.045 184 HA3 GLY 25 HA3 GLY 25 -2.683 -1.609 -6.694 185 H ALA 26 H ALA 26 -1.190 -0.619 -8.303 186 HA ALA 26 HA ALA 26 -0.361 -1.745 -10.668 187 HB1 ALA 26 HB1 ALA 26 1.946 -0.804 -9.998 188 HB2 ALA 26 HB2 ALA 26 0.590 0.312 -10.162 189 HB3 ALA 26 HB3 ALA 26 1.113 -0.211 -8.561 190 H CYS 27 H CYS 27 0.325 -2.793 -7.400 191 HA CYS 27 HA CYS 27 2.503 -4.412 -7.675 192 HB2 CYS 27 HB2 CYS 27 1.268 -5.949 -5.991 193 HB3 CYS 27 HB3 CYS 27 1.626 -4.292 -5.515 194 H ILE 28 H ILE 28 2.832 -6.632 -8.140 195 HA ILE 28 HA ILE 28 0.720 -8.101 -9.483 196 HB ILE 28 HB ILE 28 2.136 -8.550 -11.484 197 HG12 ILE 28 HG12 ILE 28 3.744 -6.186 -10.493 198 HG13 ILE 28 HG13 ILE 28 4.290 -7.858 -10.438 199 HG21 ILE 28 HG21 ILE 28 1.659 -5.605 -11.366 200 HG22 ILE 28 HG22 ILE 28 1.310 -6.748 -12.662 201 HG23 ILE 28 HG23 ILE 28 0.301 -6.720 -11.216 202 HD11 ILE 28 HD11 ILE 28 3.482 -7.322 -13.089 203 HD12 ILE 28 HD12 ILE 28 4.501 -5.984 -12.555 204 HD13 ILE 28 HD13 ILE 28 5.105 -7.639 -12.475 205 H CYS 29 H CYS 29 1.111 -10.321 -9.630 206 HA CYS 29 HA CYS 29 2.931 -11.352 -7.678 207 HB2 CYS 29 HB2 CYS 29 0.878 -12.509 -7.862 208 HB3 CYS 29 HB3 CYS 29 1.008 -12.627 -9.614 209 H ARG 30 H ARG 30 5.042 -11.449 -8.078 210 HA ARG 30 HA ARG 30 5.915 -12.404 -10.726 211 HB2 ARG 30 HB2 ARG 30 7.947 -11.098 -10.457 212 HB3 ARG 30 HB3 ARG 30 6.539 -10.057 -10.298 213 HG2 ARG 30 HG2 ARG 30 7.635 -11.194 -7.801 214 HG3 ARG 30 HG3 ARG 30 8.610 -9.974 -8.623 215 HD2 ARG 30 HD2 ARG 30 5.731 -9.674 -7.774 216 HD3 ARG 30 HD3 ARG 30 7.128 -8.957 -6.972 217 HE ARG 30 HE ARG 30 5.785 -7.957 -9.268 218 HH11 ARG 30 HH11 ARG 30 8.928 -8.242 -7.798 219 HH12 ARG 30 HH12 ARG 30 9.566 -6.834 -8.581 220 HH21 ARG 30 HH21 ARG 30 6.613 -6.102 -10.305 221 HH22 ARG 30 HH22 ARG 30 8.248 -5.617 -10.006 222 H GLY 31 H GLY 31 8.336 -13.218 -10.496 223 HA2 GLY 31 HA2 GLY 31 8.255 -15.625 -9.085 224 HA3 GLY 31 HA3 GLY 31 9.714 -14.883 -9.726 225 H ASN 32 H ASN 32 9.036 -12.465 -7.970 226 HA ASN 32 HA ASN 32 10.812 -12.946 -5.909 227 HB2 ASN 32 HB2 ASN 32 10.408 -10.800 -5.329 228 HB3 ASN 32 HB3 ASN 32 9.420 -10.765 -6.786 229 HD21 ASN 32 HD21 ASN 32 9.349 -11.241 -3.309 230 HD22 ASN 32 HD22 ASN 32 7.694 -10.794 -3.095 231 H GLY 33 H GLY 33 7.596 -14.034 -6.233 232 HA2 GLY 33 HA2 GLY 33 6.613 -15.678 -4.869 233 HA3 GLY 33 HA3 GLY 33 7.743 -15.261 -3.590 234 H TYR 34 H TYR 34 5.778 -12.940 -5.350 235 HA TYR 34 HA TYR 34 3.573 -12.775 -3.683 236 HB2 TYR 34 HB2 TYR 34 4.863 -12.233 -1.797 237 HB3 TYR 34 HB3 TYR 34 5.948 -11.201 -2.722 238 HD1 TYR 34 HD2 TYR 34 2.599 -11.432 -1.199 239 HD2 TYR 34 HD1 TYR 34 5.432 -8.899 -3.112 240 HE1 TYR 34 HE2 TYR 34 1.272 -9.467 -0.548 241 HE2 TYR 34 HE1 TYR 34 4.113 -6.926 -2.466 242 HH TYR 34 HH TYR 34 2.407 -6.185 -1.203 243 H CYS 35 H CYS 35 2.402 -10.679 -3.895 244 HA CYS 35 HA CYS 35 2.509 -9.784 -6.593 245 HB2 CYS 35 HB2 CYS 35 0.784 -9.362 -4.250 246 HB3 CYS 35 HB3 CYS 35 0.888 -7.973 -5.327 247 H GLY 36 H GLY 36 4.876 -9.142 -6.309 248 HA2 GLY 36 HA2 GLY 36 5.351 -6.625 -4.966 249 HA3 GLY 36 HA3 GLY 36 6.515 -7.543 -5.910 Start of MODEL 14 1 H1 GLY 1 H GLY 1 -5.027 0.838 -0.493 2 HA2 GLY 1 HA2 GLY 1 -2.454 1.978 0.219 3 HA3 GLY 1 HA3 GLY 1 -2.981 0.326 0.505 4 H CYS 2 H CYS 2 -3.708 -0.374 -2.115 5 HA CYS 2 HA CYS 2 -1.073 -0.346 -3.434 6 HB2 CYS 2 HB2 CYS 2 -2.554 -2.528 -2.552 7 HB3 CYS 2 HB3 CYS 2 -2.860 -2.481 -4.285 8 H ILE 3 H ILE 3 -2.939 1.713 -3.866 9 HA ILE 3 HA ILE 3 -4.093 2.824 -5.494 10 HB ILE 3 HB ILE 3 -2.355 1.195 -7.349 11 HG12 ILE 3 HG12 ILE 3 -1.767 3.829 -5.981 12 HG13 ILE 3 HG13 ILE 3 -1.028 2.283 -5.578 13 HG21 ILE 3 HG21 ILE 3 -2.791 3.897 -8.164 14 HG22 ILE 3 HG22 ILE 3 -3.220 2.403 -8.995 15 HG23 ILE 3 HG23 ILE 3 -4.345 3.126 -7.845 16 HD11 ILE 3 HD11 ILE 3 0.564 2.714 -7.044 17 HD12 ILE 3 HD12 ILE 3 -0.639 2.665 -8.333 18 HD13 ILE 3 HD13 ILE 3 -0.255 4.194 -7.544 19 H LEU 4 H LEU 4 -6.132 1.877 -5.119 20 HA LEU 4 HA LEU 4 -8.053 0.803 -5.690 21 HB2 LEU 4 HB2 LEU 4 -6.639 1.293 -8.197 22 HB3 LEU 4 HB3 LEU 4 -7.773 -0.054 -8.284 23 HG LEU 4 HG LEU 4 -8.764 2.061 -9.042 24 HD11 LEU 4 HD11 LEU 4 -9.824 0.238 -7.163 25 HD12 LEU 4 HD12 LEU 4 -10.689 1.212 -8.351 26 HD13 LEU 4 HD13 LEU 4 -10.410 1.844 -6.729 27 HD21 LEU 4 HD21 LEU 4 -8.728 3.982 -7.875 28 HD22 LEU 4 HD22 LEU 4 -7.349 3.244 -7.060 29 HD23 LEU 4 HD23 LEU 4 -8.952 3.169 -6.326 30 H ASN 5 H ASN 5 -7.708 -0.954 -4.299 31 HA ASN 5 HA ASN 5 -7.761 -3.493 -5.511 32 HB2 ASN 5 HB2 ASN 5 -5.623 -4.147 -5.565 33 HB3 ASN 5 HB3 ASN 5 -5.147 -2.513 -5.114 34 HD21 ASN 5 HD21 ASN 5 -5.128 -2.038 -2.779 35 HD22 ASN 5 HD22 ASN 5 -4.622 -3.288 -1.699 36 H GLY 6 H GLY 6 -7.844 -5.264 -3.893 37 HA2 GLY 6 HA2 GLY 6 -9.466 -4.511 -1.691 38 HA3 GLY 6 HA3 GLY 6 -8.838 -6.122 -2.006 39 H ARG 7 H ARG 7 -7.836 -6.837 -0.250 40 HA ARG 7 HA ARG 7 -6.292 -4.947 1.378 41 HB2 ARG 7 HB2 ARG 7 -7.010 -7.789 2.093 42 HB3 ARG 7 HB3 ARG 7 -6.467 -6.510 3.171 43 HG2 ARG 7 HG2 ARG 7 -8.571 -5.283 2.680 44 HG3 ARG 7 HG3 ARG 7 -9.114 -6.682 1.752 45 HD2 ARG 7 HD2 ARG 7 -10.042 -6.759 3.987 46 HD3 ARG 7 HD3 ARG 7 -8.893 -8.077 3.764 47 HE ARG 7 HE ARG 7 -7.543 -5.897 4.888 48 HH11 ARG 7 HH11 ARG 7 -9.993 -8.226 5.719 49 HH12 ARG 7 HH12 ARG 7 -9.625 -8.203 7.412 50 HH21 ARG 7 HH21 ARG 7 -7.049 -5.857 7.114 51 HH22 ARG 7 HH22 ARG 7 -7.951 -6.855 8.205 52 H THR 8 H THR 8 -4.503 -4.870 -0.079 53 HA THR 8 HA THR 8 -3.067 -6.964 -1.127 54 HB THR 8 HB THR 8 -2.458 -4.743 -1.747 55 HG1 THR 8 HG1 THR 8 -0.117 -4.809 -1.054 56 HG21 THR 8 HG21 THR 8 -1.276 -3.251 -0.079 57 HG22 THR 8 HG22 THR 8 -1.848 -4.349 1.177 58 HG23 THR 8 HG23 THR 8 -3.007 -3.469 0.181 59 H ASP 9 H ASP 9 -1.125 -8.035 -0.469 60 HA ASP 9 HA ASP 9 -0.023 -9.419 0.974 61 HB2 ASP 9 HB2 ASP 9 0.838 -6.976 1.434 62 HB3 ASP 9 HB3 ASP 9 0.032 -7.202 2.983 63 H LEU 10 H LEU 10 -1.988 -10.684 1.282 64 HA LEU 10 HA LEU 10 -2.895 -10.564 4.076 65 HB2 LEU 10 HB2 LEU 10 -4.477 -10.039 1.841 66 HB3 LEU 10 HB3 LEU 10 -4.890 -11.686 2.313 67 HG LEU 10 HG LEU 10 -6.404 -10.026 3.296 68 HD11 LEU 10 HD11 LEU 10 -5.255 -10.766 5.787 69 HD12 LEU 10 HD12 LEU 10 -5.007 -12.086 4.645 70 HD13 LEU 10 HD13 LEU 10 -6.635 -11.479 4.951 71 HD21 LEU 10 HD21 LEU 10 -4.481 -8.300 3.463 72 HD22 LEU 10 HD22 LEU 10 -4.161 -9.056 5.024 73 HD23 LEU 10 HD23 LEU 10 -5.731 -8.317 4.707 74 H GLY 11 H GLY 11 -2.531 -12.396 5.137 75 HA2 GLY 11 HA2 GLY 11 -1.373 -14.513 5.161 76 HA3 GLY 11 HA3 GLY 11 -3.086 -14.870 5.001 77 H THR 12 H THR 12 -3.911 -15.532 3.000 78 HA THR 12 HA THR 12 -2.441 -17.280 1.508 79 HB THR 12 HB THR 12 -4.684 -17.485 1.063 80 HG1 THR 12 HG1 THR 12 -4.948 -17.037 -1.123 81 HG21 THR 12 HG21 THR 12 -5.749 -15.121 0.098 82 HG22 THR 12 HG22 THR 12 -4.683 -14.595 1.401 83 HG23 THR 12 HG23 THR 12 -5.959 -15.769 1.725 84 H LEU 13 H LEU 13 -3.282 -13.986 0.413 85 HA LEU 13 HA LEU 13 -1.410 -14.074 -1.744 86 HB2 LEU 13 HB2 LEU 13 -3.454 -12.748 -1.861 87 HB3 LEU 13 HB3 LEU 13 -2.891 -11.748 -0.524 88 HG LEU 13 HG LEU 13 -2.712 -10.879 -2.968 89 HD11 LEU 13 HD11 LEU 13 -1.660 -9.319 -1.793 90 HD12 LEU 13 HD12 LEU 13 -0.162 -10.215 -2.041 91 HD13 LEU 13 HD13 LEU 13 -1.132 -10.502 -0.596 92 HD21 LEU 13 HD21 LEU 13 -1.350 -13.136 -3.414 93 HD22 LEU 13 HD22 LEU 13 -0.010 -12.081 -2.963 94 HD23 LEU 13 HD23 LEU 13 -1.060 -11.646 -4.313 95 H LEU 14 H LEU 14 -1.128 -13.456 1.569 96 HA LEU 14 HA LEU 14 0.695 -11.468 1.893 97 HB2 LEU 14 HB2 LEU 14 -0.293 -13.109 3.605 98 HB3 LEU 14 HB3 LEU 14 1.100 -14.122 3.232 99 HG LEU 14 HG LEU 14 2.250 -11.689 3.798 100 HD11 LEU 14 HD11 LEU 14 -0.140 -11.080 4.590 101 HD12 LEU 14 HD12 LEU 14 1.237 -10.688 5.619 102 HD13 LEU 14 HD13 LEU 14 0.245 -12.100 5.977 103 HD21 LEU 14 HD21 LEU 14 3.278 -12.831 5.488 104 HD22 LEU 14 HD22 LEU 14 2.623 -14.186 4.568 105 HD23 LEU 14 HD23 LEU 14 1.790 -13.617 6.015 106 H PHE 15 H PHE 15 1.241 -14.605 0.456 107 HA PHE 15 HA PHE 15 3.696 -13.711 -0.721 108 HB2 PHE 15 HB2 PHE 15 3.732 -15.735 1.503 109 HB3 PHE 15 HB3 PHE 15 4.966 -15.743 0.248 110 HD1 PHE 15 HD2 PHE 15 5.771 -13.128 -0.227 111 HD2 PHE 15 HD1 PHE 15 4.446 -14.797 3.458 112 HE1 PHE 15 HE2 PHE 15 7.030 -11.407 1.001 113 HE2 PHE 15 HE1 PHE 15 5.702 -13.079 4.692 114 HZ PHE 15 HZ PHE 15 6.997 -11.381 3.464 115 H ARG 16 H ARG 16 4.785 -15.749 -1.833 116 HA ARG 16 HA ARG 16 4.540 -17.143 -3.628 117 HB2 ARG 16 HB2 ARG 16 4.220 -18.648 -1.645 118 HB3 ARG 16 HB3 ARG 16 2.484 -18.461 -1.851 119 HG2 ARG 16 HG2 ARG 16 3.395 -19.214 -4.360 120 HG3 ARG 16 HG3 ARG 16 4.333 -20.195 -3.232 121 HD2 ARG 16 HD2 ARG 16 1.843 -20.375 -2.157 122 HD3 ARG 16 HD3 ARG 16 1.469 -20.266 -3.876 123 HE ARG 16 HE ARG 16 3.382 -22.149 -3.830 124 HH11 ARG 16 HH11 ARG 16 0.469 -21.731 -1.969 125 HH12 ARG 16 HH12 ARG 16 0.219 -23.429 -1.736 126 HH21 ARG 16 HH21 ARG 16 3.063 -24.388 -3.529 127 HH22 ARG 16 HH22 ARG 16 1.696 -24.939 -2.623 128 H CYS 17 H CYS 17 2.747 -14.791 -3.520 129 HA CYS 17 HA CYS 17 0.272 -14.679 -4.125 130 HB2 CYS 17 HB2 CYS 17 0.681 -13.462 -6.276 131 HB3 CYS 17 HB3 CYS 17 1.692 -12.918 -4.941 132 H ARG 18 H ARG 18 -1.207 -16.076 -4.789 133 HA ARG 18 HA ARG 18 -0.631 -18.374 -6.326 134 HB2 ARG 18 HB2 ARG 18 -3.425 -17.614 -6.431 135 HB3 ARG 18 HB3 ARG 18 -2.673 -19.007 -5.665 136 HG2 ARG 18 HG2 ARG 18 -2.843 -16.257 -4.450 137 HG3 ARG 18 HG3 ARG 18 -3.933 -17.597 -4.090 138 HD2 ARG 18 HD2 ARG 18 -1.232 -17.066 -3.130 139 HD3 ARG 18 HD3 ARG 18 -2.499 -18.080 -2.441 140 HE ARG 18 HE ARG 18 -0.365 -18.911 -4.212 141 HH11 ARG 18 HH11 ARG 18 -3.436 -19.691 -2.769 142 HH12 ARG 18 HH12 ARG 18 -3.259 -21.398 -3.001 143 HH21 ARG 18 HH21 ARG 18 -0.121 -21.158 -4.524 144 HH22 ARG 18 HH22 ARG 18 -1.373 -22.232 -3.999 145 H ARG 19 H ARG 19 -1.378 -15.137 -7.191 146 HA ARG 19 HA ARG 19 -0.722 -15.314 -9.838 147 HB2 ARG 19 HB2 ARG 19 -2.609 -16.900 -10.050 148 HB3 ARG 19 HB3 ARG 19 -3.709 -15.641 -9.503 149 HG2 ARG 19 HG2 ARG 19 -3.766 -15.906 -11.926 150 HG3 ARG 19 HG3 ARG 19 -3.188 -14.304 -11.462 151 HD2 ARG 19 HD2 ARG 19 -1.294 -14.624 -12.577 152 HD3 ARG 19 HD3 ARG 19 -0.968 -16.095 -11.662 153 HE ARG 19 HE ARG 19 -2.820 -16.809 -13.561 154 HH11 ARG 19 HH11 ARG 19 0.378 -15.433 -13.562 155 HH12 ARG 19 HH12 ARG 19 0.816 -16.125 -15.089 156 HH21 ARG 19 HH21 ARG 19 -2.255 -17.725 -15.571 157 HH22 ARG 19 HH22 ARG 19 -0.682 -17.428 -16.231 158 H ASP 20 H ASP 20 -1.240 -13.394 -11.071 159 HA ASP 20 HA ASP 20 -1.081 -11.039 -9.665 160 HB2 ASP 20 HB2 ASP 20 -1.336 -9.918 -11.698 161 HB3 ASP 20 HB3 ASP 20 -0.758 -11.506 -12.195 162 H SER 21 H SER 21 -3.875 -12.951 -10.318 163 HA SER 21 HA SER 21 -5.915 -11.066 -10.152 164 HB2 SER 21 HB2 SER 21 -5.743 -13.982 -9.462 165 HB3 SER 21 HB3 SER 21 -7.214 -13.078 -9.104 166 HG SER 21 HG SER 21 -5.997 -13.108 -11.662 167 H ASP 22 H ASP 22 -3.877 -12.401 -7.678 168 HA ASP 22 HA ASP 22 -5.516 -11.593 -5.470 169 HB2 ASP 22 HB2 ASP 22 -2.562 -12.231 -5.435 170 HB3 ASP 22 HB3 ASP 22 -3.680 -12.278 -4.074 171 H CYS 23 H CYS 23 -3.913 -9.810 -7.674 172 HA CYS 23 HA CYS 23 -3.569 -7.589 -5.785 173 HB2 CYS 23 HB2 CYS 23 -1.662 -7.735 -8.060 174 HB3 CYS 23 HB3 CYS 23 -1.435 -7.083 -6.441 175 HA PRO 24 HA PRO 24 -6.239 -6.407 -9.374 176 HB2 PRO 24 HB2 PRO 24 -8.053 -5.064 -7.865 177 HB3 PRO 24 HB3 PRO 24 -8.141 -6.806 -8.148 178 HG2 PRO 24 HG2 PRO 24 -7.079 -5.324 -5.774 179 HG3 PRO 24 HG3 PRO 24 -8.098 -6.774 -5.823 180 HD2 PRO 24 HD2 PRO 24 -5.428 -6.883 -5.385 181 HD3 PRO 24 HD3 PRO 24 -6.310 -8.169 -6.234 182 H GLY 25 H GLY 25 -4.250 -4.880 -7.146 183 HA2 GLY 25 HA2 GLY 25 -4.758 -2.225 -8.330 184 HA3 GLY 25 HA3 GLY 25 -4.023 -2.491 -6.756 185 H ALA 26 H ALA 26 -2.296 -1.109 -7.448 186 HA ALA 26 HA ALA 26 -0.695 -1.385 -9.664 187 HB1 ALA 26 HB1 ALA 26 0.991 -0.835 -7.428 188 HB2 ALA 26 HB2 ALA 26 0.390 0.270 -8.665 189 HB3 ALA 26 HB3 ALA 26 -0.555 -0.015 -7.203 190 H CYS 27 H CYS 27 -0.137 -2.927 -6.493 191 HA CYS 27 HA CYS 27 2.094 -4.411 -7.105 192 HB2 CYS 27 HB2 CYS 27 1.064 -6.106 -5.413 193 HB3 CYS 27 HB3 CYS 27 1.484 -4.487 -4.863 194 H ILE 28 H ILE 28 2.406 -6.628 -7.686 195 HA ILE 28 HA ILE 28 0.206 -8.047 -8.934 196 HB ILE 28 HB ILE 28 1.439 -8.356 -11.072 197 HG12 ILE 28 HG12 ILE 28 3.111 -6.013 -10.152 198 HG13 ILE 28 HG13 ILE 28 3.669 -7.682 -10.112 199 HG21 ILE 28 HG21 ILE 28 0.834 -6.178 -12.020 200 HG22 ILE 28 HG22 ILE 28 -0.407 -6.782 -10.923 201 HG23 ILE 28 HG23 ILE 28 0.697 -5.514 -10.393 202 HD11 ILE 28 HD11 ILE 28 4.510 -7.179 -12.123 203 HD12 ILE 28 HD12 ILE 28 2.864 -7.481 -12.681 204 HD13 ILE 28 HD13 ILE 28 3.400 -5.830 -12.366 205 H CYS 29 H CYS 29 0.661 -10.249 -9.356 206 HA CYS 29 HA CYS 29 2.597 -11.381 -7.572 207 HB2 CYS 29 HB2 CYS 29 0.567 -12.580 -7.751 208 HB3 CYS 29 HB3 CYS 29 0.611 -12.552 -9.510 209 H ARG 30 H ARG 30 4.687 -11.345 -8.091 210 HA ARG 30 HA ARG 30 5.447 -12.072 -10.845 211 HB2 ARG 30 HB2 ARG 30 7.599 -10.781 -9.476 212 HB3 ARG 30 HB3 ARG 30 6.747 -10.263 -10.925 213 HG2 ARG 30 HG2 ARG 30 6.135 -8.495 -9.717 214 HG3 ARG 30 HG3 ARG 30 4.988 -9.589 -8.942 215 HD2 ARG 30 HD2 ARG 30 6.004 -9.223 -7.003 216 HD3 ARG 30 HD3 ARG 30 7.458 -9.979 -7.656 217 HE ARG 30 HE ARG 30 6.940 -7.136 -7.371 218 HH11 ARG 30 HH11 ARG 30 8.951 -9.642 -8.712 219 HH12 ARG 30 HH12 ARG 30 10.313 -8.599 -8.956 220 HH21 ARG 30 HH21 ARG 30 8.726 -5.753 -7.688 221 HH22 ARG 30 HH22 ARG 30 10.184 -6.387 -8.372 222 H GLY 31 H GLY 31 7.893 -12.829 -10.808 223 HA2 GLY 31 HA2 GLY 31 7.957 -15.335 -9.582 224 HA3 GLY 31 HA3 GLY 31 9.357 -14.504 -10.245 225 H ASN 32 H ASN 32 8.635 -12.259 -8.242 226 HA ASN 32 HA ASN 32 10.569 -12.823 -6.335 227 HB2 ASN 32 HB2 ASN 32 10.128 -10.744 -5.571 228 HB3 ASN 32 HB3 ASN 32 9.052 -10.638 -6.961 229 HD21 ASN 32 HD21 ASN 32 9.221 -11.335 -3.530 230 HD22 ASN 32 HD22 ASN 32 7.564 -10.988 -3.187 231 H GLY 33 H GLY 33 7.440 -14.091 -6.604 232 HA2 GLY 33 HA2 GLY 33 6.574 -15.842 -5.314 233 HA3 GLY 33 HA3 GLY 33 7.758 -15.480 -4.067 234 H TYR 34 H TYR 34 5.624 -13.100 -5.519 235 HA TYR 34 HA TYR 34 3.505 -13.163 -3.734 236 HB2 TYR 34 HB2 TYR 34 4.886 -12.730 -1.881 237 HB3 TYR 34 HB3 TYR 34 5.867 -11.570 -2.770 238 HD1 TYR 34 HD2 TYR 34 2.604 -12.097 -1.128 239 HD2 TYR 34 HD1 TYR 34 5.251 -9.271 -2.890 240 HE1 TYR 34 HE2 TYR 34 1.230 -10.263 -0.234 241 HE2 TYR 34 HE1 TYR 34 3.886 -7.429 -2.000 242 HH TYR 34 HH TYR 34 1.224 -7.292 -1.281 243 H CYS 35 H CYS 35 2.254 -11.102 -3.706 244 HA CYS 35 HA CYS 35 2.170 -9.990 -6.321 245 HB2 CYS 35 HB2 CYS 35 0.492 -10.042 -4.003 246 HB3 CYS 35 HB3 CYS 35 0.658 -8.373 -4.541 247 H GLY 36 H GLY 36 4.480 -9.246 -6.238 248 HA2 GLY 36 HA2 GLY 36 4.971 -6.830 -4.699 249 HA3 GLY 36 HA3 GLY 36 6.113 -7.646 -5.756 Start of MODEL 15 1 H1 GLY 1 H GLY 1 -5.725 -0.400 -1.429 2 HA2 GLY 1 HA2 GLY 1 -3.369 -1.678 -0.364 3 HA3 GLY 1 HA3 GLY 1 -4.257 -2.155 -1.804 4 H CYS 2 H CYS 2 -3.804 -1.100 -3.796 5 HA CYS 2 HA CYS 2 -1.364 0.527 -3.849 6 HB2 CYS 2 HB2 CYS 2 -1.828 -1.845 -5.668 7 HB3 CYS 2 HB3 CYS 2 -0.416 -0.793 -5.653 8 H ILE 3 H ILE 3 -3.644 1.787 -4.086 9 HA ILE 3 HA ILE 3 -4.797 3.242 -5.404 10 HB ILE 3 HB ILE 3 -3.072 2.468 -7.740 11 HG12 ILE 3 HG12 ILE 3 -1.538 2.811 -5.888 12 HG13 ILE 3 HG13 ILE 3 -1.458 4.194 -6.975 13 HG21 ILE 3 HG21 ILE 3 -3.586 5.272 -7.361 14 HG22 ILE 3 HG22 ILE 3 -3.997 4.231 -8.723 15 HG23 ILE 3 HG23 ILE 3 -5.094 4.357 -7.347 16 HD11 ILE 3 HD11 ILE 3 -3.375 4.945 -5.159 17 HD12 ILE 3 HD12 ILE 3 -2.205 4.062 -4.176 18 HD13 ILE 3 HD13 ILE 3 -1.681 5.436 -5.150 19 H LEU 4 H LEU 4 -5.573 0.449 -5.192 20 HA LEU 4 HA LEU 4 -7.700 0.405 -7.007 21 HB2 LEU 4 HB2 LEU 4 -5.448 -0.265 -8.325 22 HB3 LEU 4 HB3 LEU 4 -5.945 -1.851 -7.739 23 HG LEU 4 HG LEU 4 -7.774 -0.056 -9.317 24 HD11 LEU 4 HD11 LEU 4 -5.558 -0.748 -10.463 25 HD12 LEU 4 HD12 LEU 4 -7.083 -0.998 -11.312 26 HD13 LEU 4 HD13 LEU 4 -6.285 -2.354 -10.517 27 HD21 LEU 4 HD21 LEU 4 -7.827 -2.876 -8.345 28 HD22 LEU 4 HD22 LEU 4 -8.662 -2.459 -9.842 29 HD23 LEU 4 HD23 LEU 4 -9.101 -1.656 -8.334 30 H ASN 5 H ASN 5 -8.125 0.090 -4.564 31 HA ASN 5 HA ASN 5 -9.251 -1.292 -3.117 32 HB2 ASN 5 HB2 ASN 5 -9.435 -2.748 -5.366 33 HB3 ASN 5 HB3 ASN 5 -8.383 -3.809 -4.434 34 HD21 ASN 5 HD21 ASN 5 -11.295 -1.843 -3.921 35 HD22 ASN 5 HD22 ASN 5 -12.154 -3.046 -3.026 36 H GLY 6 H GLY 6 -8.633 -3.492 -1.803 37 HA2 GLY 6 HA2 GLY 6 -5.905 -2.956 -0.845 38 HA3 GLY 6 HA3 GLY 6 -7.188 -3.709 0.091 39 H ARG 7 H ARG 7 -6.948 -5.808 0.418 40 HA ARG 7 HA ARG 7 -6.521 -8.021 0.025 41 HB2 ARG 7 HB2 ARG 7 -7.091 -7.156 -2.467 42 HB3 ARG 7 HB3 ARG 7 -5.409 -7.617 -2.689 43 HG2 ARG 7 HG2 ARG 7 -6.721 -9.491 -3.280 44 HG3 ARG 7 HG3 ARG 7 -5.996 -9.853 -1.713 45 HD2 ARG 7 HD2 ARG 7 -7.996 -9.674 -0.595 46 HD3 ARG 7 HD3 ARG 7 -8.690 -8.584 -1.794 47 HE ARG 7 HE ARG 7 -9.509 -10.405 -2.893 48 HH11 ARG 7 HH11 ARG 7 -6.918 -11.436 -0.810 49 HH12 ARG 7 HH12 ARG 7 -7.158 -13.122 -1.128 50 HH21 ARG 7 HH21 ARG 7 -9.836 -12.622 -3.320 51 HH22 ARG 7 HH22 ARG 7 -8.818 -13.796 -2.557 52 H THR 8 H THR 8 -4.118 -5.901 -1.525 53 HA THR 8 HA THR 8 -1.857 -7.383 -1.408 54 HB THR 8 HB THR 8 -1.685 -5.187 -2.287 55 HG1 THR 8 HG1 THR 8 -0.216 -5.047 0.143 56 HG21 THR 8 HG21 THR 8 -2.333 -4.141 0.472 57 HG22 THR 8 HG22 THR 8 -3.426 -4.133 -0.912 58 HG23 THR 8 HG23 THR 8 -1.953 -3.165 -0.946 59 H ASP 9 H ASP 9 -0.350 -8.016 0.082 60 HA ASP 9 HA ASP 9 0.439 -8.719 2.099 61 HB2 ASP 9 HB2 ASP 9 0.854 -6.254 2.282 62 HB3 ASP 9 HB3 ASP 9 -0.683 -6.107 3.130 63 H LEU 10 H LEU 10 -1.220 -10.393 2.060 64 HA LEU 10 HA LEU 10 -3.104 -10.066 4.294 65 HB2 LEU 10 HB2 LEU 10 -3.743 -10.492 1.559 66 HB3 LEU 10 HB3 LEU 10 -4.145 -11.960 2.447 67 HG LEU 10 HG LEU 10 -5.614 -10.703 3.914 68 HD11 LEU 10 HD11 LEU 10 -5.234 -8.543 4.245 69 HD12 LEU 10 HD12 LEU 10 -5.899 -8.233 2.642 70 HD13 LEU 10 HD13 LEU 10 -4.162 -8.462 2.847 71 HD21 LEU 10 HD21 LEU 10 -7.305 -10.013 2.243 72 HD22 LEU 10 HD22 LEU 10 -6.598 -11.593 1.903 73 HD23 LEU 10 HD23 LEU 10 -6.083 -10.179 0.982 74 H GLY 11 H GLY 11 -4.091 -12.501 4.622 75 HA2 GLY 11 HA2 GLY 11 -2.178 -13.947 5.961 76 HA3 GLY 11 HA3 GLY 11 -3.660 -14.648 5.326 77 H THR 12 H THR 12 -3.627 -15.725 3.337 78 HA THR 12 HA THR 12 -1.261 -17.141 2.766 79 HB THR 12 HB THR 12 -3.573 -16.860 0.852 80 HG1 THR 12 HG1 THR 12 -4.688 -17.541 2.548 81 HG21 THR 12 HG21 THR 12 -1.656 -19.118 1.445 82 HG22 THR 12 HG22 THR 12 -1.638 -18.085 0.016 83 HG23 THR 12 HG23 THR 12 -2.989 -19.184 0.293 84 H LEU 13 H LEU 13 -2.726 -14.295 1.310 85 HA LEU 13 HA LEU 13 -1.124 -14.179 -1.004 86 HB2 LEU 13 HB2 LEU 13 -3.179 -12.904 -0.772 87 HB3 LEU 13 HB3 LEU 13 -2.468 -11.965 0.539 88 HG LEU 13 HG LEU 13 -2.641 -10.944 -1.843 89 HD11 LEU 13 HD11 LEU 13 -0.053 -10.180 -1.295 90 HD12 LEU 13 HD12 LEU 13 -0.660 -10.716 0.272 91 HD13 LEU 13 HD13 LEU 13 -1.515 -9.459 -0.622 92 HD21 LEU 13 HD21 LEU 13 0.063 -12.036 -2.299 93 HD22 LEU 13 HD22 LEU 13 -1.196 -11.593 -3.453 94 HD23 LEU 13 HD23 LEU 13 -1.285 -13.134 -2.599 95 H LEU 14 H LEU 14 -0.357 -13.686 2.256 96 HA LEU 14 HA LEU 14 1.472 -11.665 2.356 97 HB2 LEU 14 HB2 LEU 14 1.018 -12.816 4.346 98 HB3 LEU 14 HB3 LEU 14 1.461 -14.372 3.647 99 HG LEU 14 HG LEU 14 3.824 -13.670 3.643 100 HD11 LEU 14 HD11 LEU 14 2.636 -11.111 4.263 101 HD12 LEU 14 HD12 LEU 14 4.270 -11.496 3.725 102 HD13 LEU 14 HD13 LEU 14 3.871 -11.556 5.441 103 HD21 LEU 14 HD21 LEU 14 2.209 -13.814 6.140 104 HD22 LEU 14 HD22 LEU 14 3.929 -13.441 6.261 105 HD23 LEU 14 HD23 LEU 14 3.403 -14.943 5.500 106 H PHE 15 H PHE 15 1.781 -14.715 0.719 107 HA PHE 15 HA PHE 15 4.060 -13.803 -0.740 108 HB2 PHE 15 HB2 PHE 15 4.421 -15.715 1.519 109 HB3 PHE 15 HB3 PHE 15 5.343 -15.999 0.046 110 HD1 PHE 15 HD2 PHE 15 6.394 -13.676 -0.911 111 HD2 PHE 15 HD1 PHE 15 5.518 -14.568 3.158 112 HE1 PHE 15 HE2 PHE 15 8.055 -12.010 -0.192 113 HE2 PHE 15 HE1 PHE 15 7.177 -12.902 3.884 114 HZ PHE 15 HZ PHE 15 8.449 -11.621 2.208 115 H ARG 16 H ARG 16 5.010 -15.892 -1.970 116 HA ARG 16 HA ARG 16 4.537 -17.266 -3.733 117 HB2 ARG 16 HB2 ARG 16 4.370 -18.787 -1.761 118 HB3 ARG 16 HB3 ARG 16 2.634 -18.507 -1.741 119 HG2 ARG 16 HG2 ARG 16 3.286 -19.280 -4.364 120 HG3 ARG 16 HG3 ARG 16 4.143 -20.378 -3.280 121 HD2 ARG 16 HD2 ARG 16 1.286 -19.749 -2.723 122 HD3 ARG 16 HD3 ARG 16 1.667 -20.858 -4.040 123 HE ARG 16 HE ARG 16 3.108 -21.715 -1.838 124 HH11 ARG 16 HH11 ARG 16 -0.233 -21.293 -2.719 125 HH12 ARG 16 HH12 ARG 16 -0.800 -22.574 -1.699 126 HH21 ARG 16 HH21 ARG 16 2.374 -23.404 -0.490 127 HH22 ARG 16 HH22 ARG 16 0.684 -23.773 -0.431 128 H CYS 17 H CYS 17 2.858 -14.847 -3.441 129 HA CYS 17 HA CYS 17 0.324 -14.675 -3.801 130 HB2 CYS 17 HB2 CYS 17 0.573 -13.373 -5.923 131 HB3 CYS 17 HB3 CYS 17 1.713 -12.908 -4.664 132 H ARG 18 H ARG 18 -1.255 -15.974 -4.432 133 HA ARG 18 HA ARG 18 -0.817 -18.205 -6.147 134 HB2 ARG 18 HB2 ARG 18 -3.516 -17.102 -5.394 135 HB3 ARG 18 HB3 ARG 18 -3.080 -18.768 -5.754 136 HG2 ARG 18 HG2 ARG 18 -3.232 -18.881 -3.487 137 HG3 ARG 18 HG3 ARG 18 -1.527 -18.458 -3.650 138 HD2 ARG 18 HD2 ARG 18 -1.843 -16.578 -2.511 139 HD3 ARG 18 HD3 ARG 18 -3.103 -16.072 -3.635 140 HE ARG 18 HE ARG 18 -3.465 -17.239 -1.030 141 HH11 ARG 18 HH11 ARG 18 -4.903 -16.674 -4.150 142 HH12 ARG 18 HH12 ARG 18 -6.530 -16.806 -3.569 143 HH21 ARG 18 HH21 ARG 18 -5.602 -17.415 -0.253 144 HH22 ARG 18 HH22 ARG 18 -6.926 -17.226 -1.352 145 H ARG 19 H ARG 19 -1.619 -14.933 -6.694 146 HA ARG 19 HA ARG 19 -1.365 -14.957 -9.416 147 HB2 ARG 19 HB2 ARG 19 -3.327 -16.477 -9.417 148 HB3 ARG 19 HB3 ARG 19 -4.284 -15.204 -8.670 149 HG2 ARG 19 HG2 ARG 19 -4.696 -15.341 -11.063 150 HG3 ARG 19 HG3 ARG 19 -3.965 -13.795 -10.628 151 HD2 ARG 19 HD2 ARG 19 -2.261 -14.162 -12.006 152 HD3 ARG 19 HD3 ARG 19 -1.912 -15.701 -11.220 153 HE ARG 19 HE ARG 19 -4.112 -15.970 -12.976 154 HH11 ARG 19 HH11 ARG 19 -0.650 -15.610 -12.962 155 HH12 ARG 19 HH12 ARG 19 -0.428 -16.431 -14.472 156 HH21 ARG 19 HH21 ARG 19 -3.833 -17.053 -14.964 157 HH22 ARG 19 HH22 ARG 19 -2.240 -17.250 -15.610 158 H ASP 20 H ASP 20 -1.923 -12.942 -10.425 159 HA ASP 20 HA ASP 20 -1.516 -10.696 -8.892 160 HB2 ASP 20 HB2 ASP 20 -1.218 -10.534 -11.247 161 HB3 ASP 20 HB3 ASP 20 -2.883 -11.014 -11.563 162 H SER 21 H SER 21 -4.448 -12.457 -9.382 163 HA SER 21 HA SER 21 -6.366 -10.512 -8.837 164 HB2 SER 21 HB2 SER 21 -6.241 -13.473 -8.624 165 HB3 SER 21 HB3 SER 21 -7.536 -12.666 -7.740 166 HG SER 21 HG SER 21 -7.056 -11.976 -10.417 167 H ASP 22 H ASP 22 -4.143 -12.142 -6.731 168 HA ASP 22 HA ASP 22 -5.512 -11.472 -4.296 169 HB2 ASP 22 HB2 ASP 22 -2.610 -12.254 -4.585 170 HB3 ASP 22 HB3 ASP 22 -3.637 -12.426 -3.164 171 H CYS 23 H CYS 23 -4.038 -9.578 -6.487 172 HA CYS 23 HA CYS 23 -3.062 -7.691 -4.443 173 HB2 CYS 23 HB2 CYS 23 -2.171 -7.488 -7.289 174 HB3 CYS 23 HB3 CYS 23 -1.332 -7.008 -5.817 175 HA PRO 24 HA PRO 24 -6.175 -4.875 -5.750 176 HB2 PRO 24 HB2 PRO 24 -4.990 -2.530 -5.068 177 HB3 PRO 24 HB3 PRO 24 -5.655 -3.653 -3.875 178 HG2 PRO 24 HG2 PRO 24 -2.816 -3.277 -4.748 179 HG3 PRO 24 HG3 PRO 24 -3.463 -3.501 -3.113 180 HD2 PRO 24 HD2 PRO 24 -2.320 -5.515 -4.515 181 HD3 PRO 24 HD3 PRO 24 -3.640 -5.786 -3.359 182 H GLY 25 H GLY 25 -3.504 -2.696 -6.279 183 HA2 GLY 25 HA2 GLY 25 -4.067 -2.794 -9.180 184 HA3 GLY 25 HA3 GLY 25 -3.725 -1.304 -8.312 185 H ALA 26 H ALA 26 -1.666 -0.631 -8.142 186 HA ALA 26 HA ALA 26 0.351 -1.277 -9.745 187 HB1 ALA 26 HB1 ALA 26 1.604 -0.899 -7.220 188 HB2 ALA 26 HB2 ALA 26 1.387 0.261 -8.530 189 HB3 ALA 26 HB3 ALA 26 0.153 0.102 -7.280 190 H CYS 27 H CYS 27 0.773 -2.457 -6.432 191 HA CYS 27 HA CYS 27 2.576 -4.440 -6.940 192 HB2 CYS 27 HB2 CYS 27 1.463 -5.614 -4.897 193 HB3 CYS 27 HB3 CYS 27 2.212 -4.035 -4.680 194 H ILE 28 H ILE 28 2.579 -6.393 -7.864 195 HA ILE 28 HA ILE 28 0.036 -7.786 -8.286 196 HB ILE 28 HB ILE 28 0.839 -8.391 -10.614 197 HG12 ILE 28 HG12 ILE 28 2.616 -5.987 -10.143 198 HG13 ILE 28 HG13 ILE 28 3.167 -7.647 -10.342 199 HG21 ILE 28 HG21 ILE 28 -0.694 -6.283 -9.683 200 HG22 ILE 28 HG22 ILE 28 0.382 -5.540 -10.865 201 HG23 ILE 28 HG23 ILE 28 -0.645 -6.894 -11.337 202 HD11 ILE 28 HD11 ILE 28 1.543 -7.000 -12.568 203 HD12 ILE 28 HD12 ILE 28 2.696 -5.688 -12.326 204 HD13 ILE 28 HD13 ILE 28 3.273 -7.342 -12.523 205 H CYS 29 H CYS 29 0.341 -10.060 -8.946 206 HA CYS 29 HA CYS 29 2.366 -11.292 -7.337 207 HB2 CYS 29 HB2 CYS 29 0.303 -12.430 -7.362 208 HB3 CYS 29 HB3 CYS 29 0.176 -12.340 -9.116 209 H ARG 30 H ARG 30 4.408 -11.177 -8.058 210 HA ARG 30 HA ARG 30 4.926 -11.942 -10.856 211 HB2 ARG 30 HB2 ARG 30 7.211 -10.717 -9.645 212 HB3 ARG 30 HB3 ARG 30 6.267 -10.168 -11.024 213 HG2 ARG 30 HG2 ARG 30 5.812 -8.392 -9.756 214 HG3 ARG 30 HG3 ARG 30 4.668 -9.455 -8.935 215 HD2 ARG 30 HD2 ARG 30 5.805 -9.190 -7.047 216 HD3 ARG 30 HD3 ARG 30 7.210 -9.939 -7.806 217 HE ARG 30 HE ARG 30 6.749 -7.106 -7.392 218 HH11 ARG 30 HH11 ARG 30 8.624 -9.573 -8.978 219 HH12 ARG 30 HH12 ARG 30 9.976 -8.533 -9.283 220 HH21 ARG 30 HH21 ARG 30 8.522 -5.727 -7.788 221 HH22 ARG 30 HH22 ARG 30 9.917 -6.346 -8.605 222 H GLY 31 H GLY 31 7.334 -12.771 -11.036 223 HA2 GLY 31 HA2 GLY 31 7.436 -15.286 -9.831 224 HA3 GLY 31 HA3 GLY 31 8.794 -14.489 -10.611 225 H ASN 32 H ASN 32 8.307 -12.242 -8.537 226 HA ASN 32 HA ASN 32 10.391 -12.853 -6.818 227 HB2 ASN 32 HB2 ASN 32 10.041 -10.782 -5.984 228 HB3 ASN 32 HB3 ASN 32 8.850 -10.644 -7.274 229 HD21 ASN 32 HD21 ASN 32 9.303 -11.412 -3.882 230 HD22 ASN 32 HD22 ASN 32 7.687 -11.047 -3.391 231 H GLY 33 H GLY 33 7.221 -14.065 -6.805 232 HA2 GLY 33 HA2 GLY 33 6.474 -15.842 -5.467 233 HA3 GLY 33 HA3 GLY 33 7.761 -15.493 -4.323 234 H TYR 34 H TYR 34 5.538 -13.079 -5.562 235 HA TYR 34 HA TYR 34 3.571 -13.155 -3.607 236 HB2 TYR 34 HB2 TYR 34 5.136 -12.752 -1.885 237 HB3 TYR 34 HB3 TYR 34 6.003 -11.554 -2.838 238 HD1 TYR 34 HD2 TYR 34 2.922 -12.184 -0.905 239 HD2 TYR 34 HD1 TYR 34 5.336 -9.267 -2.845 240 HE1 TYR 34 HE2 TYR 34 1.605 -10.398 0.155 241 HE2 TYR 34 HE1 TYR 34 4.026 -7.473 -1.789 242 HH TYR 34 HH TYR 34 2.150 -7.839 0.788 243 H CYS 35 H CYS 35 2.335 -11.092 -3.456 244 HA CYS 35 HA CYS 35 2.046 -9.950 -6.045 245 HB2 CYS 35 HB2 CYS 35 0.624 -9.885 -3.500 246 HB3 CYS 35 HB3 CYS 35 0.613 -8.323 -4.313 247 H GLY 36 H GLY 36 4.377 -9.224 -6.097 248 HA2 GLY 36 HA2 GLY 36 4.973 -6.818 -4.585 249 HA3 GLY 36 HA3 GLY 36 6.037 -7.625 -5.727 Start of MODEL 16 1 H1 GLY 1 H GLY 1 -2.683 -2.100 1.305 2 HA2 GLY 1 HA2 GLY 1 -3.798 -1.693 -0.834 3 HA3 GLY 1 HA3 GLY 1 -3.741 -0.193 0.080 4 H CYS 2 H CYS 2 -2.704 -1.853 -2.732 5 HA CYS 2 HA CYS 2 -0.789 0.231 -3.450 6 HB2 CYS 2 HB2 CYS 2 -1.585 -2.257 -4.978 7 HB3 CYS 2 HB3 CYS 2 -0.240 -1.186 -5.357 8 H ILE 3 H ILE 3 -3.463 1.070 -3.217 9 HA ILE 3 HA ILE 3 -4.978 2.369 -4.312 10 HB ILE 3 HB ILE 3 -3.182 2.187 -6.728 11 HG12 ILE 3 HG12 ILE 3 -3.049 4.136 -4.417 12 HG13 ILE 3 HG13 ILE 3 -1.876 2.868 -4.755 13 HG21 ILE 3 HG21 ILE 3 -4.436 3.802 -7.646 14 HG22 ILE 3 HG22 ILE 3 -5.654 3.304 -6.474 15 HG23 ILE 3 HG23 ILE 3 -4.601 4.674 -6.123 16 HD11 ILE 3 HD11 ILE 3 -0.780 4.560 -5.745 17 HD12 ILE 3 HD12 ILE 3 -1.836 4.163 -7.101 18 HD13 ILE 3 HD13 ILE 3 -2.249 5.496 -6.022 19 H LEU 4 H LEU 4 -6.861 1.441 -4.742 20 HA LEU 4 HA LEU 4 -8.503 0.269 -5.795 21 HB2 LEU 4 HB2 LEU 4 -7.250 1.358 -7.807 22 HB3 LEU 4 HB3 LEU 4 -6.687 -0.286 -8.102 23 HG LEU 4 HG LEU 4 -9.545 -0.251 -7.751 24 HD11 LEU 4 HD11 LEU 4 -8.463 1.515 -9.942 25 HD12 LEU 4 HD12 LEU 4 -9.375 2.060 -8.535 26 HD13 LEU 4 HD13 LEU 4 -10.144 1.021 -9.735 27 HD21 LEU 4 HD21 LEU 4 -9.480 -1.381 -9.905 28 HD22 LEU 4 HD22 LEU 4 -8.248 -2.030 -8.823 29 HD23 LEU 4 HD23 LEU 4 -7.792 -0.917 -10.114 30 H ASN 5 H ASN 5 -8.425 -1.420 -4.300 31 HA ASN 5 HA ASN 5 -8.028 -3.985 -5.327 32 HB2 ASN 5 HB2 ASN 5 -6.092 -4.686 -3.856 33 HB3 ASN 5 HB3 ASN 5 -5.667 -3.651 -5.217 34 HD21 ASN 5 HD21 ASN 5 -5.057 -1.518 -4.837 35 HD22 ASN 5 HD22 ASN 5 -4.573 -0.972 -3.271 36 H GLY 6 H GLY 6 -7.810 -5.628 -3.320 37 HA2 GLY 6 HA2 GLY 6 -9.556 -4.581 -1.179 38 HA3 GLY 6 HA3 GLY 6 -9.874 -6.126 -1.954 39 H ARG 7 H ARG 7 -7.065 -6.872 -2.115 40 HA ARG 7 HA ARG 7 -6.720 -7.665 0.686 41 HB2 ARG 7 HB2 ARG 7 -5.671 -8.816 -1.898 42 HB3 ARG 7 HB3 ARG 7 -5.109 -9.350 -0.320 43 HG2 ARG 7 HG2 ARG 7 -7.147 -10.312 0.224 44 HG3 ARG 7 HG3 ARG 7 -8.025 -9.365 -0.979 45 HD2 ARG 7 HD2 ARG 7 -6.053 -10.884 -2.336 46 HD3 ARG 7 HD3 ARG 7 -6.898 -11.966 -1.230 47 HE ARG 7 HE ARG 7 -8.782 -10.411 -2.618 48 HH11 ARG 7 HH11 ARG 7 -6.503 -12.987 -3.157 49 HH12 ARG 7 HH12 ARG 7 -7.401 -13.682 -4.467 50 HH21 ARG 7 HH21 ARG 7 -9.972 -11.316 -4.340 51 HH22 ARG 7 HH22 ARG 7 -9.373 -12.730 -5.139 52 H THR 8 H THR 8 -4.184 -7.605 -1.738 53 HA THR 8 HA THR 8 -2.094 -6.697 -1.724 54 HB THR 8 HB THR 8 -3.613 -4.362 -0.551 55 HG1 THR 8 HG1 THR 8 -4.018 -5.251 -2.794 56 HG21 THR 8 HG21 THR 8 -0.791 -4.573 -1.585 57 HG22 THR 8 HG22 THR 8 -1.333 -3.985 -0.013 58 HG23 THR 8 HG23 THR 8 -1.654 -3.041 -1.467 59 H ASP 9 H ASP 9 -0.869 -7.873 -0.344 60 HA ASP 9 HA ASP 9 0.341 -8.407 1.507 61 HB2 ASP 9 HB2 ASP 9 0.794 -5.887 1.329 62 HB3 ASP 9 HB3 ASP 9 -0.374 -5.706 2.635 63 H LEU 10 H LEU 10 -1.359 -9.956 1.986 64 HA LEU 10 HA LEU 10 -2.697 -9.313 4.523 65 HB2 LEU 10 HB2 LEU 10 -4.039 -9.617 2.153 66 HB3 LEU 10 HB3 LEU 10 -4.120 -11.237 2.844 67 HG LEU 10 HG LEU 10 -4.875 -9.707 4.967 68 HD11 LEU 10 HD11 LEU 10 -5.119 -7.624 4.063 69 HD12 LEU 10 HD12 LEU 10 -6.726 -8.281 3.755 70 HD13 LEU 10 HD13 LEU 10 -5.528 -8.242 2.462 71 HD21 LEU 10 HD21 LEU 10 -6.145 -11.574 4.537 72 HD22 LEU 10 HD22 LEU 10 -6.351 -11.176 2.830 73 HD23 LEU 10 HD23 LEU 10 -7.257 -10.291 4.058 74 H GLY 11 H GLY 11 -3.799 -11.694 5.152 75 HA2 GLY 11 HA2 GLY 11 -1.786 -13.172 6.276 76 HA3 GLY 11 HA3 GLY 11 -3.365 -13.835 5.881 77 H THR 12 H THR 12 -3.663 -14.817 3.796 78 HA THR 12 HA THR 12 -1.562 -16.529 3.065 79 HB THR 12 HB THR 12 -3.901 -15.851 1.284 80 HG1 THR 12 HG1 THR 12 -5.057 -17.409 2.474 81 HG21 THR 12 HG21 THR 12 -3.673 -18.157 0.549 82 HG22 THR 12 HG22 THR 12 -2.361 -18.416 1.699 83 HG23 THR 12 HG23 THR 12 -2.142 -17.306 0.347 84 H LEU 13 H LEU 13 -2.762 -13.541 1.597 85 HA LEU 13 HA LEU 13 -1.186 -13.594 -0.721 86 HB2 LEU 13 HB2 LEU 13 -3.144 -12.012 0.110 87 HB3 LEU 13 HB3 LEU 13 -1.787 -10.994 0.586 88 HG LEU 13 HG LEU 13 -2.221 -12.012 -2.219 89 HD11 LEU 13 HD11 LEU 13 -3.206 -9.564 -0.824 90 HD12 LEU 13 HD12 LEU 13 -4.032 -10.610 -1.979 91 HD13 LEU 13 HD13 LEU 13 -2.788 -9.492 -2.536 92 HD21 LEU 13 HD21 LEU 13 -0.724 -9.807 -2.456 93 HD22 LEU 13 HD22 LEU 13 -0.037 -11.419 -2.257 94 HD23 LEU 13 HD23 LEU 13 -0.188 -10.346 -0.864 95 H LEU 14 H LEU 14 -0.313 -13.134 2.528 96 HA LEU 14 HA LEU 14 1.746 -11.350 2.554 97 HB2 LEU 14 HB2 LEU 14 1.072 -12.506 4.543 98 HB3 LEU 14 HB3 LEU 14 1.594 -14.052 3.876 99 HG LEU 14 HG LEU 14 3.941 -13.202 3.937 100 HD11 LEU 14 HD11 LEU 14 2.715 -10.747 4.355 101 HD12 LEU 14 HD12 LEU 14 4.438 -11.103 4.467 102 HD13 LEU 14 HD13 LEU 14 3.430 -11.158 5.914 103 HD21 LEU 14 HD21 LEU 14 3.145 -14.667 5.678 104 HD22 LEU 14 HD22 LEU 14 2.415 -13.310 6.536 105 HD23 LEU 14 HD23 LEU 14 4.170 -13.421 6.391 106 H PHE 15 H PHE 15 1.671 -14.464 1.005 107 HA PHE 15 HA PHE 15 4.010 -13.859 -0.519 108 HB2 PHE 15 HB2 PHE 15 4.192 -15.730 1.793 109 HB3 PHE 15 HB3 PHE 15 5.038 -16.174 0.314 110 HD1 PHE 15 HD2 PHE 15 6.390 -14.096 -0.745 111 HD2 PHE 15 HD1 PHE 15 5.408 -14.604 3.365 112 HE1 PHE 15 HE2 PHE 15 8.257 -12.620 -0.120 113 HE2 PHE 15 HE1 PHE 15 7.272 -13.129 3.997 114 HZ PHE 15 HZ PHE 15 8.701 -12.135 2.254 115 H ARG 16 H ARG 16 4.690 -16.082 -1.697 116 HA ARG 16 HA ARG 16 4.050 -17.488 -3.374 117 HB2 ARG 16 HB2 ARG 16 3.577 -18.841 -1.310 118 HB3 ARG 16 HB3 ARG 16 1.901 -18.319 -1.421 119 HG2 ARG 16 HG2 ARG 16 2.469 -19.308 -3.946 120 HG3 ARG 16 HG3 ARG 16 3.284 -20.420 -2.844 121 HD2 ARG 16 HD2 ARG 16 1.086 -20.456 -1.542 122 HD3 ARG 16 HD3 ARG 16 0.371 -19.698 -2.964 123 HE ARG 16 HE ARG 16 1.598 -21.837 -4.021 124 HH11 ARG 16 HH11 ARG 16 -0.539 -21.482 -1.296 125 HH12 ARG 16 HH12 ARG 16 -1.215 -23.070 -1.453 126 HH21 ARG 16 HH21 ARG 16 0.716 -23.929 -4.239 127 HH22 ARG 16 HH22 ARG 16 -0.500 -24.461 -3.127 128 H CYS 17 H CYS 17 2.722 -14.816 -3.165 129 HA CYS 17 HA CYS 17 0.306 -14.220 -3.635 130 HB2 CYS 17 HB2 CYS 17 0.789 -13.208 -5.894 131 HB3 CYS 17 HB3 CYS 17 1.944 -12.792 -4.631 132 H ARG 18 H ARG 18 -1.362 -15.565 -3.922 133 HA ARG 18 HA ARG 18 -1.450 -17.900 -5.382 134 HB2 ARG 18 HB2 ARG 18 -3.961 -16.366 -5.429 135 HB3 ARG 18 HB3 ARG 18 -3.633 -17.975 -4.799 136 HG2 ARG 18 HG2 ARG 18 -3.002 -15.373 -3.421 137 HG3 ARG 18 HG3 ARG 18 -4.333 -16.464 -3.032 138 HD2 ARG 18 HD2 ARG 18 -1.507 -16.613 -2.312 139 HD3 ARG 18 HD3 ARG 18 -2.913 -17.349 -1.542 140 HE ARG 18 HE ARG 18 -1.179 -18.547 -3.517 141 HH11 ARG 18 HH11 ARG 18 -4.269 -18.656 -1.918 142 HH12 ARG 18 HH12 ARG 18 -4.533 -20.334 -2.259 143 HH21 ARG 18 HH21 ARG 18 -1.515 -20.757 -3.973 144 HH22 ARG 18 HH22 ARG 18 -2.965 -21.528 -3.427 145 H ARG 19 H ARG 19 -1.574 -14.638 -6.512 146 HA ARG 19 HA ARG 19 -0.987 -15.117 -9.127 147 HB2 ARG 19 HB2 ARG 19 -3.052 -16.425 -9.287 148 HB3 ARG 19 HB3 ARG 19 -3.986 -15.034 -8.755 149 HG2 ARG 19 HG2 ARG 19 -3.767 -13.943 -10.762 150 HG3 ARG 19 HG3 ARG 19 -2.274 -14.788 -11.179 151 HD2 ARG 19 HD2 ARG 19 -3.880 -15.707 -12.609 152 HD3 ARG 19 HD3 ARG 19 -3.717 -16.893 -11.315 153 HE ARG 19 HE ARG 19 -5.770 -15.311 -10.496 154 HH11 ARG 19 HH11 ARG 19 -5.099 -17.113 -13.398 155 HH12 ARG 19 HH12 ARG 19 -6.768 -17.420 -13.749 156 HH21 ARG 19 HH21 ARG 19 -7.970 -15.709 -10.948 157 HH22 ARG 19 HH22 ARG 19 -8.400 -16.620 -12.355 158 H ASP 20 H ASP 20 -1.323 -13.252 -10.548 159 HA ASP 20 HA ASP 20 -0.743 -10.839 -9.383 160 HB2 ASP 20 HB2 ASP 20 -2.278 -11.118 -11.971 161 HB3 ASP 20 HB3 ASP 20 -1.200 -9.805 -11.504 162 H SER 21 H SER 21 -3.869 -12.294 -9.881 163 HA SER 21 HA SER 21 -5.520 -10.062 -9.623 164 HB2 SER 21 HB2 SER 21 -6.045 -12.880 -8.648 165 HB3 SER 21 HB3 SER 21 -7.269 -11.641 -8.922 166 HG SER 21 HG SER 21 -7.309 -12.525 -10.841 167 H ASP 22 H ASP 22 -3.749 -11.872 -7.230 168 HA ASP 22 HA ASP 22 -5.047 -11.215 -4.890 169 HB2 ASP 22 HB2 ASP 22 -2.180 -11.715 -5.578 170 HB3 ASP 22 HB3 ASP 22 -2.578 -11.138 -3.962 171 H CYS 23 H CYS 23 -3.146 -9.184 -6.973 172 HA CYS 23 HA CYS 23 -3.837 -6.882 -5.301 173 HB2 CYS 23 HB2 CYS 23 -1.336 -6.193 -6.244 174 HB3 CYS 23 HB3 CYS 23 -1.707 -6.710 -4.602 175 HA PRO 24 HA PRO 24 -4.959 -6.030 -9.645 176 HB2 PRO 24 HB2 PRO 24 -7.038 -4.407 -9.001 177 HB3 PRO 24 HB3 PRO 24 -7.175 -6.169 -9.055 178 HG2 PRO 24 HG2 PRO 24 -6.794 -4.371 -6.692 179 HG3 PRO 24 HG3 PRO 24 -7.861 -5.776 -6.868 180 HD2 PRO 24 HD2 PRO 24 -5.482 -5.905 -5.582 181 HD3 PRO 24 HD3 PRO 24 -6.155 -7.278 -6.485 182 H GLY 25 H GLY 25 -4.304 -3.928 -6.923 183 HA2 GLY 25 HA2 GLY 25 -4.225 -1.473 -8.331 184 HA3 GLY 25 HA3 GLY 25 -3.453 -1.799 -6.786 185 H ALA 26 H ALA 26 -1.422 -1.102 -6.965 186 HA ALA 26 HA ALA 26 0.041 -1.206 -9.426 187 HB1 ALA 26 HB1 ALA 26 0.260 0.182 -6.997 188 HB2 ALA 26 HB2 ALA 26 1.740 -0.763 -7.160 189 HB3 ALA 26 HB3 ALA 26 1.264 0.358 -8.436 190 H CYS 27 H CYS 27 0.745 -2.644 -6.233 191 HA CYS 27 HA CYS 27 2.779 -4.331 -6.968 192 HB2 CYS 27 HB2 CYS 27 1.896 -5.830 -5.070 193 HB3 CYS 27 HB3 CYS 27 2.345 -4.176 -4.667 194 H ILE 28 H ILE 28 2.855 -6.623 -7.382 195 HA ILE 28 HA ILE 28 0.459 -7.949 -8.306 196 HB ILE 28 HB ILE 28 1.580 -8.479 -10.548 197 HG12 ILE 28 HG12 ILE 28 3.081 -5.958 -9.808 198 HG13 ILE 28 HG13 ILE 28 3.786 -7.556 -10.028 199 HG21 ILE 28 HG21 ILE 28 0.785 -5.609 -10.426 200 HG22 ILE 28 HG22 ILE 28 0.320 -6.858 -11.579 201 HG23 ILE 28 HG23 ILE 28 -0.382 -6.847 -9.962 202 HD11 ILE 28 HD11 ILE 28 2.686 -5.682 -12.078 203 HD12 ILE 28 HD12 ILE 28 4.262 -6.473 -12.015 204 HD13 ILE 28 HD13 ILE 28 2.820 -7.409 -12.407 205 H CYS 29 H CYS 29 0.942 -10.191 -9.067 206 HA CYS 29 HA CYS 29 2.864 -11.395 -7.283 207 HB2 CYS 29 HB2 CYS 29 0.794 -12.541 -7.433 208 HB3 CYS 29 HB3 CYS 29 0.813 -12.504 -9.193 209 H ARG 30 H ARG 30 4.932 -11.550 -7.826 210 HA ARG 30 HA ARG 30 5.604 -12.120 -10.639 211 HB2 ARG 30 HB2 ARG 30 7.512 -10.810 -8.724 212 HB3 ARG 30 HB3 ARG 30 7.527 -10.792 -10.483 213 HG2 ARG 30 HG2 ARG 30 6.747 -8.703 -10.158 214 HG3 ARG 30 HG3 ARG 30 5.201 -9.548 -10.069 215 HD2 ARG 30 HD2 ARG 30 5.219 -9.510 -7.697 216 HD3 ARG 30 HD3 ARG 30 6.902 -8.988 -7.652 217 HE ARG 30 HE ARG 30 4.617 -7.323 -7.876 218 HH11 ARG 30 HH11 ARG 30 7.909 -7.651 -8.962 219 HH12 ARG 30 HH12 ARG 30 8.137 -5.950 -9.199 220 HH21 ARG 30 HH21 ARG 30 4.906 -5.082 -8.184 221 HH22 ARG 30 HH22 ARG 30 6.429 -4.489 -8.755 222 H GLY 31 H GLY 31 8.148 -12.878 -10.529 223 HA2 GLY 31 HA2 GLY 31 8.048 -15.528 -9.618 224 HA3 GLY 31 HA3 GLY 31 9.506 -14.679 -10.111 225 H ASN 32 H ASN 32 8.912 -12.619 -7.964 226 HA ASN 32 HA ASN 32 10.634 -13.578 -6.003 227 HB2 ASN 32 HB2 ASN 32 9.088 -11.704 -4.674 228 HB3 ASN 32 HB3 ASN 32 10.530 -11.365 -5.626 229 HD21 ASN 32 HD21 ASN 32 10.330 -10.474 -7.656 230 HD22 ASN 32 HD22 ASN 32 8.846 -9.810 -8.241 231 H GLY 33 H GLY 33 7.489 -14.534 -6.606 232 HA2 GLY 33 HA2 GLY 33 6.210 -16.114 -5.502 233 HA3 GLY 33 HA3 GLY 33 7.414 -16.138 -4.222 234 H TYR 34 H TYR 34 5.753 -13.258 -5.366 235 HA TYR 34 HA TYR 34 3.667 -13.186 -3.512 236 HB2 TYR 34 HB2 TYR 34 5.150 -13.070 -1.697 237 HB3 TYR 34 HB3 TYR 34 6.269 -12.021 -2.560 238 HD1 TYR 34 HD2 TYR 34 3.043 -12.148 -0.781 239 HD2 TYR 34 HD1 TYR 34 5.992 -9.647 -2.556 240 HE1 TYR 34 HE2 TYR 34 2.003 -10.184 0.272 241 HE2 TYR 34 HE1 TYR 34 4.960 -7.676 -1.507 242 HH TYR 34 HH TYR 34 3.422 -6.953 -0.060 243 H CYS 35 H CYS 35 2.711 -10.986 -3.299 244 HA CYS 35 HA CYS 35 2.629 -9.706 -5.818 245 HB2 CYS 35 HB2 CYS 35 1.352 -9.331 -3.176 246 HB3 CYS 35 HB3 CYS 35 1.438 -7.897 -4.193 247 H GLY 36 H GLY 36 5.023 -9.351 -5.933 248 HA2 GLY 36 HA2 GLY 36 6.471 -7.602 -4.363 249 HA3 GLY 36 HA3 GLY 36 6.738 -7.829 -6.085 Start of MODEL 17 1 H1 GLY 1 H GLY 1 -3.628 -1.827 0.586 2 HA2 GLY 1 HA2 GLY 1 -1.173 -0.564 1.039 3 HA3 GLY 1 HA3 GLY 1 -1.371 -2.176 0.367 4 H CYS 2 H CYS 2 -2.270 -2.016 -2.031 5 HA CYS 2 HA CYS 2 -0.305 -0.381 -3.448 6 HB2 CYS 2 HB2 CYS 2 -2.037 -2.679 -4.378 7 HB3 CYS 2 HB3 CYS 2 -0.895 -1.815 -5.402 8 H ILE 3 H ILE 3 -2.510 0.992 -2.358 9 HA ILE 3 HA ILE 3 -4.187 2.447 -2.884 10 HB ILE 3 HB ILE 3 -3.050 2.568 -5.661 11 HG12 ILE 3 HG12 ILE 3 -1.866 3.781 -3.154 12 HG13 ILE 3 HG13 ILE 3 -1.133 2.526 -4.147 13 HG21 ILE 3 HG21 ILE 3 -4.183 4.480 -5.826 14 HG22 ILE 3 HG22 ILE 3 -5.020 3.992 -4.353 15 HG23 ILE 3 HG23 ILE 3 -3.609 5.047 -4.258 16 HD11 ILE 3 HD11 ILE 3 -0.048 4.516 -4.732 17 HD12 ILE 3 HD12 ILE 3 -1.189 4.208 -6.042 18 HD13 ILE 3 HD13 ILE 3 -1.562 5.416 -4.813 19 H LEU 4 H LEU 4 -4.592 -0.445 -3.497 20 HA LEU 4 HA LEU 4 -7.161 -0.333 -4.536 21 HB2 LEU 4 HB2 LEU 4 -5.279 -0.050 -6.565 22 HB3 LEU 4 HB3 LEU 4 -5.779 -1.737 -6.655 23 HG LEU 4 HG LEU 4 -8.132 -0.188 -6.430 24 HD11 LEU 4 HD11 LEU 4 -6.081 0.967 -8.286 25 HD12 LEU 4 HD12 LEU 4 -7.145 1.796 -7.149 26 HD13 LEU 4 HD13 LEU 4 -7.807 1.096 -8.626 27 HD21 LEU 4 HD21 LEU 4 -8.233 -0.991 -8.933 28 HD22 LEU 4 HD22 LEU 4 -8.348 -2.143 -7.602 29 HD23 LEU 4 HD23 LEU 4 -6.819 -1.931 -8.456 30 H ASN 5 H ASN 5 -7.468 -2.764 -5.778 31 HA ASN 5 HA ASN 5 -7.648 -4.995 -5.377 32 HB2 ASN 5 HB2 ASN 5 -5.638 -5.977 -5.325 33 HB3 ASN 5 HB3 ASN 5 -4.924 -4.397 -5.016 34 HD21 ASN 5 HD21 ASN 5 -5.810 -7.442 -3.693 35 HD22 ASN 5 HD22 ASN 5 -5.124 -7.206 -2.125 36 H GLY 6 H GLY 6 -7.993 -6.614 -3.628 37 HA2 GLY 6 HA2 GLY 6 -9.397 -5.370 -1.448 38 HA3 GLY 6 HA3 GLY 6 -9.270 -7.095 -1.760 39 H ARG 7 H ARG 7 -7.359 -4.329 -0.602 40 HA ARG 7 HA ARG 7 -5.839 -4.140 1.079 41 HB2 ARG 7 HB2 ARG 7 -7.772 -5.874 2.050 42 HB3 ARG 7 HB3 ARG 7 -6.264 -6.733 2.341 43 HG2 ARG 7 HG2 ARG 7 -5.710 -5.390 4.024 44 HG3 ARG 7 HG3 ARG 7 -6.103 -3.938 3.101 45 HD2 ARG 7 HD2 ARG 7 -8.374 -4.035 3.723 46 HD3 ARG 7 HD3 ARG 7 -8.223 -5.692 4.307 47 HE ARG 7 HE ARG 7 -6.577 -3.816 5.728 48 HH11 ARG 7 HH11 ARG 7 -9.741 -5.249 5.504 49 HH12 ARG 7 HH12 ARG 7 -10.137 -4.953 7.165 50 HH21 ARG 7 HH21 ARG 7 -7.086 -3.419 7.916 51 HH22 ARG 7 HH22 ARG 7 -8.626 -3.911 8.536 52 H THR 8 H THR 8 -3.910 -4.248 0.061 53 HA THR 8 HA THR 8 -2.796 -6.454 -1.218 54 HB THR 8 HB THR 8 -1.358 -4.155 0.120 55 HG1 THR 8 HG1 THR 8 -2.950 -3.823 -1.703 56 HG21 THR 8 HG21 THR 8 0.459 -4.712 -1.507 57 HG22 THR 8 HG22 THR 8 -0.406 -6.203 -1.881 58 HG23 THR 8 HG23 THR 8 0.215 -5.928 -0.254 59 H ASP 9 H ASP 9 -1.140 -7.909 -0.613 60 HA ASP 9 HA ASP 9 -0.187 -9.476 0.734 61 HB2 ASP 9 HB2 ASP 9 0.880 -7.252 1.552 62 HB3 ASP 9 HB3 ASP 9 -0.148 -7.466 2.966 63 H LEU 10 H LEU 10 -2.136 -10.707 0.786 64 HA LEU 10 HA LEU 10 -3.391 -10.727 3.446 65 HB2 LEU 10 HB2 LEU 10 -4.762 -9.794 1.416 66 HB3 LEU 10 HB3 LEU 10 -4.961 -11.502 1.030 67 HG LEU 10 HG LEU 10 -5.737 -11.559 3.588 68 HD11 LEU 10 HD11 LEU 10 -6.875 -9.630 4.281 69 HD12 LEU 10 HD12 LEU 10 -6.750 -8.879 2.690 70 HD13 LEU 10 HD13 LEU 10 -5.314 -9.051 3.699 71 HD21 LEU 10 HD21 LEU 10 -8.039 -11.432 2.765 72 HD22 LEU 10 HD22 LEU 10 -7.015 -12.377 1.683 73 HD23 LEU 10 HD23 LEU 10 -7.460 -10.724 1.256 74 H GLY 11 H GLY 11 -3.207 -12.626 4.435 75 HA2 GLY 11 HA2 GLY 11 -2.134 -14.769 4.527 76 HA3 GLY 11 HA3 GLY 11 -3.790 -15.081 4.027 77 H THR 12 H THR 12 -4.226 -15.652 1.896 78 HA THR 12 HA THR 12 -2.412 -17.254 0.585 79 HB THR 12 HB THR 12 -3.857 -16.961 -1.455 80 HG1 THR 12 HG1 THR 12 -5.248 -15.363 -1.508 81 HG21 THR 12 HG21 THR 12 -4.632 -18.726 -0.230 82 HG22 THR 12 HG22 THR 12 -6.021 -17.652 -0.068 83 HG23 THR 12 HG23 THR 12 -4.836 -17.763 1.233 84 H LEU 13 H LEU 13 -3.435 -14.046 -0.602 85 HA LEU 13 HA LEU 13 -1.343 -13.835 -2.485 86 HB2 LEU 13 HB2 LEU 13 -3.388 -12.571 -2.721 87 HB3 LEU 13 HB3 LEU 13 -3.070 -11.717 -1.213 88 HG LEU 13 HG LEU 13 -2.645 -10.519 -3.464 89 HD11 LEU 13 HD11 LEU 13 -1.321 -10.435 -0.907 90 HD12 LEU 13 HD12 LEU 13 -1.809 -9.112 -1.966 91 HD13 LEU 13 HD13 LEU 13 -0.245 -9.893 -2.196 92 HD21 LEU 13 HD21 LEU 13 -1.071 -12.683 -3.959 93 HD22 LEU 13 HD22 LEU 13 0.111 -11.511 -3.376 94 HD23 LEU 13 HD23 LEU 13 -0.914 -11.119 -4.757 95 H LEU 14 H LEU 14 -1.401 -13.412 0.889 96 HA LEU 14 HA LEU 14 0.355 -11.412 1.467 97 HB2 LEU 14 HB2 LEU 14 -0.802 -13.166 2.988 98 HB3 LEU 14 HB3 LEU 14 0.691 -14.080 2.780 99 HG LEU 14 HG LEU 14 1.430 -11.464 3.546 100 HD11 LEU 14 HD11 LEU 14 -0.788 -12.607 5.235 101 HD12 LEU 14 HD12 LEU 14 -0.800 -11.074 4.365 102 HD13 LEU 14 HD13 LEU 14 0.290 -11.303 5.732 103 HD21 LEU 14 HD21 LEU 14 2.677 -12.574 5.094 104 HD22 LEU 14 HD22 LEU 14 2.299 -13.923 4.022 105 HD23 LEU 14 HD23 LEU 14 1.376 -13.691 5.508 106 H PHE 15 H PHE 15 1.068 -14.495 -0.009 107 HA PHE 15 HA PHE 15 3.620 -13.563 -0.903 108 HB2 PHE 15 HB2 PHE 15 3.456 -15.593 1.306 109 HB3 PHE 15 HB3 PHE 15 4.795 -15.621 0.164 110 HD1 PHE 15 HD2 PHE 15 5.616 -12.981 -0.261 111 HD2 PHE 15 HD1 PHE 15 4.055 -14.683 3.314 112 HE1 PHE 15 HE2 PHE 15 6.781 -11.264 1.061 113 HE2 PHE 15 HE1 PHE 15 5.216 -12.968 4.642 114 HZ PHE 15 HZ PHE 15 6.582 -11.256 3.516 115 H ARG 16 H ARG 16 4.843 -15.573 -1.927 116 HA ARG 16 HA ARG 16 4.782 -16.908 -3.786 117 HB2 ARG 16 HB2 ARG 16 3.871 -19.052 -3.379 118 HB3 ARG 16 HB3 ARG 16 4.344 -18.435 -1.802 119 HG2 ARG 16 HG2 ARG 16 2.116 -18.013 -1.181 120 HG3 ARG 16 HG3 ARG 16 1.539 -18.191 -2.839 121 HD2 ARG 16 HD2 ARG 16 0.931 -20.181 -1.727 122 HD3 ARG 16 HD3 ARG 16 2.332 -20.590 -2.715 123 HE ARG 16 HE ARG 16 3.535 -20.988 -0.799 124 HH11 ARG 16 HH11 ARG 16 0.571 -19.346 0.002 125 HH12 ARG 16 HH12 ARG 16 0.756 -19.570 1.710 126 HH21 ARG 16 HH21 ARG 16 3.789 -21.290 1.447 127 HH22 ARG 16 HH22 ARG 16 2.587 -20.675 2.531 128 H CYS 17 H CYS 17 2.879 -14.644 -3.763 129 HA CYS 17 HA CYS 17 0.454 -14.612 -4.531 130 HB2 CYS 17 HB2 CYS 17 0.955 -13.375 -6.653 131 HB3 CYS 17 HB3 CYS 17 1.853 -12.798 -5.253 132 H ARG 18 H ARG 18 -0.839 -16.223 -5.137 133 HA ARG 18 HA ARG 18 -0.074 -18.397 -6.753 134 HB2 ARG 18 HB2 ARG 18 -2.715 -18.542 -6.984 135 HB3 ARG 18 HB3 ARG 18 -1.894 -18.953 -5.484 136 HG2 ARG 18 HG2 ARG 18 -2.647 -16.127 -5.767 137 HG3 ARG 18 HG3 ARG 18 -3.989 -17.268 -5.659 138 HD2 ARG 18 HD2 ARG 18 -1.768 -16.804 -3.687 139 HD3 ARG 18 HD3 ARG 18 -3.504 -16.612 -3.442 140 HE ARG 18 HE ARG 18 -1.995 -19.011 -3.166 141 HH11 ARG 18 HH11 ARG 18 -5.110 -17.762 -4.093 142 HH12 ARG 18 HH12 ARG 18 -5.958 -19.221 -3.699 143 HH21 ARG 18 HH21 ARG 18 -3.100 -20.938 -2.644 144 HH22 ARG 18 HH22 ARG 18 -4.814 -21.026 -2.874 145 H ARG 19 H ARG 19 -0.802 -15.214 -7.577 146 HA ARG 19 HA ARG 19 -0.235 -15.275 -10.202 147 HB2 ARG 19 HB2 ARG 19 -1.879 -16.926 -10.700 148 HB3 ARG 19 HB3 ARG 19 -3.116 -16.063 -9.796 149 HG2 ARG 19 HG2 ARG 19 -3.636 -14.750 -11.527 150 HG3 ARG 19 HG3 ARG 19 -1.947 -14.512 -11.978 151 HD2 ARG 19 HD2 ARG 19 -1.971 -16.209 -13.462 152 HD3 ARG 19 HD3 ARG 19 -3.003 -17.216 -12.447 153 HE ARG 19 HE ARG 19 -3.834 -15.474 -14.562 154 HH11 ARG 19 HH11 ARG 19 -4.799 -16.941 -11.555 155 HH12 ARG 19 HH12 ARG 19 -6.492 -16.864 -11.911 156 HH21 ARG 19 HH21 ARG 19 -6.062 -15.367 -15.041 157 HH22 ARG 19 HH22 ARG 19 -7.210 -15.970 -13.894 158 H ASP 20 H ASP 20 -0.576 -13.304 -11.237 159 HA ASP 20 HA ASP 20 -0.765 -11.028 -9.763 160 HB2 ASP 20 HB2 ASP 20 -1.041 -9.813 -11.784 161 HB3 ASP 20 HB3 ASP 20 -0.128 -11.257 -12.214 162 H SER 21 H SER 21 -3.386 -13.015 -10.884 163 HA SER 21 HA SER 21 -5.525 -11.250 -10.737 164 HB2 SER 21 HB2 SER 21 -6.939 -13.210 -10.432 165 HB3 SER 21 HB3 SER 21 -5.669 -13.576 -11.598 166 HG SER 21 HG SER 21 -6.170 -15.105 -9.732 167 H ASP 22 H ASP 22 -3.831 -12.967 -8.183 168 HA ASP 22 HA ASP 22 -5.681 -12.336 -6.113 169 HB2 ASP 22 HB2 ASP 22 -3.874 -13.053 -4.585 170 HB3 ASP 22 HB3 ASP 22 -4.147 -14.214 -5.882 171 H CYS 23 H CYS 23 -3.515 -10.449 -7.834 172 HA CYS 23 HA CYS 23 -3.415 -8.450 -5.670 173 HB2 CYS 23 HB2 CYS 23 -1.242 -9.572 -6.834 174 HB3 CYS 23 HB3 CYS 23 -1.492 -8.196 -7.903 175 HA PRO 24 HA PRO 24 -5.950 -6.851 -9.267 176 HB2 PRO 24 HB2 PRO 24 -8.121 -6.177 -7.784 177 HB3 PRO 24 HB3 PRO 24 -7.901 -7.782 -8.489 178 HG2 PRO 24 HG2 PRO 24 -7.381 -6.855 -5.690 179 HG3 PRO 24 HG3 PRO 24 -8.146 -8.354 -6.248 180 HD2 PRO 24 HD2 PRO 24 -5.566 -8.252 -5.435 181 HD3 PRO 24 HD3 PRO 24 -6.125 -9.368 -6.697 182 H GLY 25 H GLY 25 -3.886 -5.421 -8.439 183 HA2 GLY 25 HA2 GLY 25 -4.972 -2.767 -8.196 184 HA3 GLY 25 HA3 GLY 25 -4.089 -3.281 -6.767 185 H ALA 26 H ALA 26 -2.543 -1.638 -7.099 186 HA ALA 26 HA ALA 26 -1.104 -1.184 -9.442 187 HB1 ALA 26 HB1 ALA 26 0.290 0.156 -8.188 188 HB2 ALA 26 HB2 ALA 26 -1.161 0.115 -7.184 189 HB3 ALA 26 HB3 ALA 26 0.220 -0.905 -6.780 190 H CYS 27 H CYS 27 0.235 -2.838 -6.580 191 HA CYS 27 HA CYS 27 2.439 -3.953 -7.803 192 HB2 CYS 27 HB2 CYS 27 2.261 -5.731 -5.977 193 HB3 CYS 27 HB3 CYS 27 2.341 -4.055 -5.445 194 H ILE 28 H ILE 28 2.802 -6.387 -8.078 195 HA ILE 28 HA ILE 28 0.528 -7.861 -9.100 196 HB ILE 28 HB ILE 28 1.694 -8.306 -11.293 197 HG12 ILE 28 HG12 ILE 28 3.241 -5.827 -10.505 198 HG13 ILE 28 HG13 ILE 28 3.911 -7.449 -10.638 199 HG21 ILE 28 HG21 ILE 28 0.681 -6.469 -12.375 200 HG22 ILE 28 HG22 ILE 28 -0.269 -6.755 -10.918 201 HG23 ILE 28 HG23 ILE 28 0.891 -5.428 -10.967 202 HD11 ILE 28 HD11 ILE 28 2.803 -5.757 -12.861 203 HD12 ILE 28 HD12 ILE 28 4.486 -6.214 -12.596 204 HD13 ILE 28 HD13 ILE 28 3.298 -7.439 -13.040 205 H CYS 29 H CYS 29 1.044 -10.085 -9.610 206 HA CYS 29 HA CYS 29 2.958 -11.179 -7.797 207 HB2 CYS 29 HB2 CYS 29 0.988 -12.451 -8.092 208 HB3 CYS 29 HB3 CYS 29 1.108 -12.381 -9.847 209 H ARG 30 H ARG 30 5.059 -11.362 -8.159 210 HA ARG 30 HA ARG 30 5.974 -11.914 -10.903 211 HB2 ARG 30 HB2 ARG 30 7.937 -10.514 -10.507 212 HB3 ARG 30 HB3 ARG 30 6.458 -9.580 -10.324 213 HG2 ARG 30 HG2 ARG 30 7.645 -10.798 -7.891 214 HG3 ARG 30 HG3 ARG 30 8.449 -9.398 -8.604 215 HD2 ARG 30 HD2 ARG 30 5.562 -9.550 -7.743 216 HD3 ARG 30 HD3 ARG 30 6.858 -8.713 -6.889 217 HE ARG 30 HE ARG 30 5.385 -7.751 -9.133 218 HH11 ARG 30 HH11 ARG 30 8.497 -7.655 -7.575 219 HH12 ARG 30 HH12 ARG 30 8.918 -6.104 -8.221 220 HH21 ARG 30 HH21 ARG 30 5.929 -5.708 -9.991 221 HH22 ARG 30 HH22 ARG 30 7.456 -4.997 -9.594 222 H GLY 31 H GLY 31 8.456 -12.568 -10.734 223 HA2 GLY 31 HA2 GLY 31 8.552 -15.087 -9.549 224 HA3 GLY 31 HA3 GLY 31 9.956 -14.181 -10.092 225 H ASN 32 H ASN 32 9.080 -11.997 -8.130 226 HA ASN 32 HA ASN 32 10.863 -12.555 -6.087 227 HB2 ASN 32 HB2 ASN 32 10.327 -10.495 -5.333 228 HB3 ASN 32 HB3 ASN 32 9.355 -10.389 -6.798 229 HD21 ASN 32 HD21 ASN 32 9.265 -11.208 -3.382 230 HD22 ASN 32 HD22 ASN 32 7.587 -10.865 -3.155 231 H GLY 33 H GLY 33 7.757 -13.837 -6.590 232 HA2 GLY 33 HA2 GLY 33 6.824 -15.623 -5.395 233 HA3 GLY 33 HA3 GLY 33 7.926 -15.283 -4.069 234 H TYR 34 H TYR 34 5.871 -12.883 -5.602 235 HA TYR 34 HA TYR 34 3.641 -12.990 -3.968 236 HB2 TYR 34 HB2 TYR 34 4.872 -12.616 -2.005 237 HB3 TYR 34 HB3 TYR 34 5.937 -11.451 -2.784 238 HD1 TYR 34 HD2 TYR 34 2.572 -11.963 -1.370 239 HD2 TYR 34 HD1 TYR 34 5.345 -9.138 -2.928 240 HE1 TYR 34 HE2 TYR 34 1.163 -10.129 -0.534 241 HE2 TYR 34 HE1 TYR 34 3.945 -7.295 -2.095 242 HH TYR 34 HH TYR 34 2.241 -6.830 -0.552 243 H CYS 35 H CYS 35 2.394 -10.924 -3.958 244 HA CYS 35 HA CYS 35 2.516 -9.719 -6.536 245 HB2 CYS 35 HB2 CYS 35 0.356 -10.011 -5.582 246 HB3 CYS 35 HB3 CYS 35 0.824 -9.192 -4.095 247 H GLY 36 H GLY 36 4.737 -8.888 -6.362 248 HA2 GLY 36 HA2 GLY 36 5.261 -6.697 -4.569 249 HA3 GLY 36 HA3 GLY 36 6.310 -7.266 -5.859 Start of MODEL 18 1 H1 GLY 1 H GLY 1 1.548 -4.808 -1.941 2 HA2 GLY 1 HA2 GLY 1 -0.548 -3.541 -1.169 3 HA3 GLY 1 HA3 GLY 1 0.994 -2.840 -0.703 4 H CYS 2 H CYS 2 -1.633 -2.685 -3.040 5 HA CYS 2 HA CYS 2 -1.163 0.175 -3.322 6 HB2 CYS 2 HB2 CYS 2 -1.587 -0.215 -5.890 7 HB3 CYS 2 HB3 CYS 2 0.037 -0.352 -5.222 8 H ILE 3 H ILE 3 -3.188 -1.285 -1.981 9 HA ILE 3 HA ILE 3 -5.510 -1.999 -2.794 10 HB ILE 3 HB ILE 3 -5.312 0.594 -1.258 11 HG12 ILE 3 HG12 ILE 3 -5.867 -1.714 0.354 12 HG13 ILE 3 HG13 ILE 3 -4.413 -2.010 -0.594 13 HG21 ILE 3 HG21 ILE 3 -7.532 -1.422 -1.534 14 HG22 ILE 3 HG22 ILE 3 -7.492 -0.170 -0.294 15 HG23 ILE 3 HG23 ILE 3 -7.557 0.280 -1.998 16 HD11 ILE 3 HD11 ILE 3 -4.225 0.606 0.453 17 HD12 ILE 3 HD12 ILE 3 -4.718 -0.467 1.763 18 HD13 ILE 3 HD13 ILE 3 -3.251 -0.810 0.846 19 H LEU 4 H LEU 4 -6.282 -1.795 -4.814 20 HA LEU 4 HA LEU 4 -7.248 0.829 -5.631 21 HB2 LEU 4 HB2 LEU 4 -4.984 0.540 -6.621 22 HB3 LEU 4 HB3 LEU 4 -5.583 -0.887 -7.465 23 HG LEU 4 HG LEU 4 -7.302 1.298 -8.078 24 HD11 LEU 4 HD11 LEU 4 -5.534 2.809 -7.477 25 HD12 LEU 4 HD12 LEU 4 -5.663 2.751 -9.235 26 HD13 LEU 4 HD13 LEU 4 -4.365 1.882 -8.417 27 HD21 LEU 4 HD21 LEU 4 -6.501 -0.865 -9.339 28 HD22 LEU 4 HD22 LEU 4 -5.276 0.229 -9.983 29 HD23 LEU 4 HD23 LEU 4 -6.988 0.577 -10.229 30 H ASN 5 H ASN 5 -7.898 -2.265 -5.045 31 HA ASN 5 HA ASN 5 -10.438 -2.370 -5.988 32 HB2 ASN 5 HB2 ASN 5 -8.571 -2.666 -8.174 33 HB3 ASN 5 HB3 ASN 5 -9.556 -4.116 -8.005 34 HD21 ASN 5 HD21 ASN 5 -9.516 -2.024 -10.073 35 HD22 ASN 5 HD22 ASN 5 -11.136 -1.431 -10.162 36 H GLY 6 H GLY 6 -8.860 -3.358 -3.865 37 HA2 GLY 6 HA2 GLY 6 -9.992 -5.850 -3.411 38 HA3 GLY 6 HA3 GLY 6 -8.397 -6.152 -4.084 39 H ARG 7 H ARG 7 -7.632 -7.095 -2.185 40 HA ARG 7 HA ARG 7 -7.509 -5.376 0.188 41 HB2 ARG 7 HB2 ARG 7 -7.427 -8.304 -0.279 42 HB3 ARG 7 HB3 ARG 7 -6.440 -7.692 1.042 43 HG2 ARG 7 HG2 ARG 7 -8.211 -7.363 2.348 44 HG3 ARG 7 HG3 ARG 7 -9.128 -6.592 1.053 45 HD2 ARG 7 HD2 ARG 7 -9.332 -9.032 0.144 46 HD3 ARG 7 HD3 ARG 7 -8.962 -9.476 1.810 47 HE ARG 7 HE ARG 7 -11.038 -7.558 1.743 48 HH11 ARG 7 HH11 ARG 7 -10.398 -10.918 1.094 49 HH12 ARG 7 HH12 ARG 7 -12.024 -11.424 1.411 50 HH21 ARG 7 HH21 ARG 7 -13.182 -8.211 2.164 51 HH22 ARG 7 HH22 ARG 7 -13.607 -9.883 2.018 52 H THR 8 H THR 8 -5.329 -7.686 -1.442 53 HA THR 8 HA THR 8 -3.109 -7.571 -1.955 54 HB THR 8 HB THR 8 -3.123 -4.645 -1.241 55 HG1 THR 8 HG1 THR 8 -4.211 -5.965 -3.490 56 HG21 THR 8 HG21 THR 8 -1.500 -6.384 -3.089 57 HG22 THR 8 HG22 THR 8 -0.939 -5.436 -1.711 58 HG23 THR 8 HG23 THR 8 -1.485 -4.623 -3.177 59 H ASP 9 H ASP 9 -1.215 -7.917 -0.858 60 HA ASP 9 HA ASP 9 0.056 -8.431 0.965 61 HB2 ASP 9 HB2 ASP 9 0.211 -5.846 0.691 62 HB3 ASP 9 HB3 ASP 9 -0.770 -5.799 2.153 63 H LEU 10 H LEU 10 -1.411 -10.106 1.639 64 HA LEU 10 HA LEU 10 -2.724 -9.459 4.190 65 HB2 LEU 10 HB2 LEU 10 -4.097 -10.088 1.917 66 HB3 LEU 10 HB3 LEU 10 -3.915 -11.668 2.675 67 HG LEU 10 HG LEU 10 -4.797 -10.083 4.748 68 HD11 LEU 10 HD11 LEU 10 -6.663 -8.815 3.960 69 HD12 LEU 10 HD12 LEU 10 -6.390 -9.346 2.301 70 HD13 LEU 10 HD13 LEU 10 -5.228 -8.277 3.086 71 HD21 LEU 10 HD21 LEU 10 -6.609 -11.625 2.909 72 HD22 LEU 10 HD22 LEU 10 -6.754 -11.397 4.652 73 HD23 LEU 10 HD23 LEU 10 -5.465 -12.410 3.999 74 H GLY 11 H GLY 11 -3.457 -11.874 5.077 75 HA2 GLY 11 HA2 GLY 11 -1.175 -12.999 6.138 76 HA3 GLY 11 HA3 GLY 11 -2.710 -13.843 5.998 77 H THR 12 H THR 12 -3.143 -14.986 3.979 78 HA THR 12 HA THR 12 -0.996 -16.635 3.225 79 HB THR 12 HB THR 12 -2.603 -17.262 1.280 80 HG1 THR 12 HG1 THR 12 -4.366 -16.110 1.174 81 HG21 THR 12 HG21 THR 12 -2.916 -18.942 2.711 82 HG22 THR 12 HG22 THR 12 -4.216 -18.009 3.453 83 HG23 THR 12 HG23 THR 12 -2.574 -17.892 4.085 84 H LEU 13 H LEU 13 -2.465 -13.828 1.662 85 HA LEU 13 HA LEU 13 -1.036 -14.010 -0.767 86 HB2 LEU 13 HB2 LEU 13 -3.112 -12.589 -0.110 87 HB3 LEU 13 HB3 LEU 13 -1.915 -11.400 0.400 88 HG LEU 13 HG LEU 13 -1.898 -12.526 -2.381 89 HD11 LEU 13 HD11 LEU 13 -3.815 -10.641 -1.185 90 HD12 LEU 13 HD12 LEU 13 -3.959 -11.656 -2.620 91 HD13 LEU 13 HD13 LEU 13 -3.083 -10.128 -2.706 92 HD21 LEU 13 HD21 LEU 13 -1.141 -9.866 -2.371 93 HD22 LEU 13 HD22 LEU 13 -0.065 -11.262 -2.438 94 HD23 LEU 13 HD23 LEU 13 -0.442 -10.512 -0.886 95 H LEU 14 H LEU 14 -0.016 -13.240 2.352 96 HA LEU 14 HA LEU 14 1.824 -11.241 2.151 97 HB2 LEU 14 HB2 LEU 14 1.350 -12.476 4.208 98 HB3 LEU 14 HB3 LEU 14 2.204 -13.877 3.566 99 HG LEU 14 HG LEU 14 4.265 -12.373 3.485 100 HD11 LEU 14 HD11 LEU 14 2.291 -10.562 4.660 101 HD12 LEU 14 HD12 LEU 14 3.820 -10.212 3.856 102 HD13 LEU 14 HD13 LEU 14 3.804 -10.667 5.559 103 HD21 LEU 14 HD21 LEU 14 2.955 -13.321 6.013 104 HD22 LEU 14 HD22 LEU 14 4.569 -12.609 6.015 105 HD23 LEU 14 HD23 LEU 14 4.253 -14.076 5.087 106 H PHE 15 H PHE 15 2.015 -14.436 0.772 107 HA PHE 15 HA PHE 15 4.218 -13.633 -0.896 108 HB2 PHE 15 HB2 PHE 15 4.580 -15.746 1.226 109 HB3 PHE 15 HB3 PHE 15 5.595 -15.669 -0.211 110 HD1 PHE 15 HD2 PHE 15 6.514 -13.170 -0.665 111 HD2 PHE 15 HD1 PHE 15 5.428 -14.791 3.119 112 HE1 PHE 15 HE2 PHE 15 7.968 -11.530 0.452 113 HE2 PHE 15 HE1 PHE 15 6.880 -13.152 4.241 114 HZ PHE 15 HZ PHE 15 8.154 -11.520 2.907 115 H ARG 16 H ARG 16 4.996 -15.829 -2.094 116 HA ARG 16 HA ARG 16 4.389 -17.272 -3.750 117 HB2 ARG 16 HB2 ARG 16 4.011 -18.634 -1.670 118 HB3 ARG 16 HB3 ARG 16 2.311 -18.193 -1.762 119 HG2 ARG 16 HG2 ARG 16 2.889 -19.165 -4.289 120 HG3 ARG 16 HG3 ARG 16 3.776 -20.230 -3.196 121 HD2 ARG 16 HD2 ARG 16 1.244 -19.811 -2.038 122 HD3 ARG 16 HD3 ARG 16 0.967 -20.132 -3.749 123 HE ARG 16 HE ARG 16 2.655 -22.096 -3.114 124 HH11 ARG 16 HH11 ARG 16 -0.200 -20.923 -1.504 125 HH12 ARG 16 HH12 ARG 16 -0.608 -22.464 -0.823 126 HH21 ARG 16 HH21 ARG 16 2.129 -24.130 -2.224 127 HH22 ARG 16 HH22 ARG 16 0.718 -24.287 -1.233 128 H CYS 17 H CYS 17 2.945 -14.660 -3.516 129 HA CYS 17 HA CYS 17 0.523 -14.132 -3.948 130 HB2 CYS 17 HB2 CYS 17 0.904 -13.218 -6.281 131 HB3 CYS 17 HB3 CYS 17 2.060 -12.695 -5.059 132 H ARG 18 H ARG 18 -1.167 -15.445 -4.178 133 HA ARG 18 HA ARG 18 -1.208 -17.843 -5.615 134 HB2 ARG 18 HB2 ARG 18 -3.817 -16.544 -5.425 135 HB3 ARG 18 HB3 ARG 18 -3.267 -18.068 -4.743 136 HG2 ARG 18 HG2 ARG 18 -2.738 -15.345 -3.572 137 HG3 ARG 18 HG3 ARG 18 -3.974 -16.479 -3.022 138 HD2 ARG 18 HD2 ARG 18 -1.101 -16.433 -2.507 139 HD3 ARG 18 HD3 ARG 18 -2.403 -17.197 -1.596 140 HE ARG 18 HE ARG 18 -0.749 -18.413 -3.631 141 HH11 ARG 18 HH11 ARG 18 -3.692 -18.599 -1.780 142 HH12 ARG 18 HH12 ARG 18 -3.877 -20.308 -2.002 143 HH21 ARG 18 HH21 ARG 18 -0.982 -20.662 -3.930 144 HH22 ARG 18 HH22 ARG 18 -2.334 -21.480 -3.224 145 H ARG 19 H ARG 19 -1.525 -14.593 -6.674 146 HA ARG 19 HA ARG 19 -1.288 -15.111 -9.365 147 HB2 ARG 19 HB2 ARG 19 -3.469 -16.240 -9.189 148 HB3 ARG 19 HB3 ARG 19 -4.187 -14.754 -8.582 149 HG2 ARG 19 HG2 ARG 19 -4.182 -13.747 -10.630 150 HG3 ARG 19 HG3 ARG 19 -2.795 -14.675 -11.205 151 HD2 ARG 19 HD2 ARG 19 -4.500 -16.683 -10.946 152 HD3 ARG 19 HD3 ARG 19 -5.680 -15.390 -11.153 153 HE ARG 19 HE ARG 19 -3.737 -15.159 -13.157 154 HH11 ARG 19 HH11 ARG 19 -6.316 -17.283 -12.178 155 HH12 ARG 19 HH12 ARG 19 -6.651 -17.830 -13.788 156 HH21 ARG 19 HH21 ARG 19 -4.169 -15.871 -15.280 157 HH22 ARG 19 HH22 ARG 19 -5.429 -17.027 -15.551 158 H ASP 20 H ASP 20 -1.654 -13.211 -10.724 159 HA ASP 20 HA ASP 20 -0.728 -10.864 -9.638 160 HB2 ASP 20 HB2 ASP 20 -2.583 -10.980 -12.020 161 HB3 ASP 20 HB3 ASP 20 -1.333 -9.783 -11.691 162 H SER 21 H SER 21 -4.035 -11.999 -9.876 163 HA SER 21 HA SER 21 -5.454 -9.678 -9.408 164 HB2 SER 21 HB2 SER 21 -5.944 -12.545 -8.654 165 HB3 SER 21 HB3 SER 21 -7.067 -11.286 -8.140 166 HG SER 21 HG SER 21 -7.489 -12.367 -10.230 167 H ASP 22 H ASP 22 -3.389 -11.425 -7.271 168 HA ASP 22 HA ASP 22 -4.306 -10.830 -4.762 169 HB2 ASP 22 HB2 ASP 22 -1.498 -10.922 -5.849 170 HB3 ASP 22 HB3 ASP 22 -1.822 -10.646 -4.140 171 H CYS 23 H CYS 23 -2.803 -8.671 -7.071 172 HA CYS 23 HA CYS 23 -3.453 -6.419 -5.303 173 HB2 CYS 23 HB2 CYS 23 -1.169 -5.647 -6.760 174 HB3 CYS 23 HB3 CYS 23 -1.292 -5.920 -5.025 175 HA PRO 24 HA PRO 24 -5.487 -5.291 -9.123 176 HB2 PRO 24 HB2 PRO 24 -6.722 -3.096 -8.109 177 HB3 PRO 24 HB3 PRO 24 -7.302 -4.742 -7.826 178 HG2 PRO 24 HG2 PRO 24 -5.663 -2.979 -6.047 179 HG3 PRO 24 HG3 PRO 24 -7.034 -4.024 -5.631 180 HD2 PRO 24 HD2 PRO 24 -4.464 -4.752 -5.191 181 HD3 PRO 24 HD3 PRO 24 -5.735 -5.927 -5.587 182 H GLY 25 H GLY 25 -3.864 -2.891 -7.045 183 HA2 GLY 25 HA2 GLY 25 -3.501 -0.943 -9.053 184 HA3 GLY 25 HA3 GLY 25 -2.582 -1.058 -7.560 185 H ALA 26 H ALA 26 -0.681 -0.434 -8.658 186 HA ALA 26 HA ALA 26 0.371 -1.620 -10.943 187 HB1 ALA 26 HB1 ALA 26 2.526 -0.974 -9.215 188 HB2 ALA 26 HB2 ALA 26 1.902 -0.057 -10.587 189 HB3 ALA 26 HB3 ALA 26 1.252 0.222 -8.972 190 H CYS 27 H CYS 27 1.326 -2.328 -7.574 191 HA CYS 27 HA CYS 27 3.018 -4.381 -7.843 192 HB2 CYS 27 HB2 CYS 27 1.714 -5.447 -5.822 193 HB3 CYS 27 HB3 CYS 27 2.551 -3.910 -5.632 194 H ILE 28 H ILE 28 3.010 -6.563 -8.272 195 HA ILE 28 HA ILE 28 0.518 -7.914 -8.893 196 HB ILE 28 HB ILE 28 1.491 -8.693 -11.123 197 HG12 ILE 28 HG12 ILE 28 3.156 -6.205 -10.686 198 HG13 ILE 28 HG13 ILE 28 3.760 -7.852 -10.826 199 HG21 ILE 28 HG21 ILE 28 0.895 -5.825 -11.429 200 HG22 ILE 28 HG22 ILE 28 0.122 -7.231 -12.158 201 HG23 ILE 28 HG23 ILE 28 -0.283 -6.760 -10.508 202 HD11 ILE 28 HD11 ILE 28 4.129 -6.678 -12.885 203 HD12 ILE 28 HD12 ILE 28 2.906 -7.924 -13.139 204 HD13 ILE 28 HD13 ILE 28 2.425 -6.235 -12.981 205 H CYS 29 H CYS 29 0.913 -10.234 -9.478 206 HA CYS 29 HA CYS 29 2.778 -11.361 -7.618 207 HB2 CYS 29 HB2 CYS 29 0.747 -12.538 -7.799 208 HB3 CYS 29 HB3 CYS 29 0.792 -12.519 -9.559 209 H ARG 30 H ARG 30 4.875 -11.496 -8.055 210 HA ARG 30 HA ARG 30 5.686 -12.296 -10.773 211 HB2 ARG 30 HB2 ARG 30 7.823 -10.973 -9.402 212 HB3 ARG 30 HB3 ARG 30 7.030 -10.521 -10.905 213 HG2 ARG 30 HG2 ARG 30 6.356 -8.693 -9.840 214 HG3 ARG 30 HG3 ARG 30 5.226 -9.738 -8.976 215 HD2 ARG 30 HD2 ARG 30 6.255 -9.233 -7.075 216 HD3 ARG 30 HD3 ARG 30 7.721 -9.995 -7.691 217 HE ARG 30 HE ARG 30 7.144 -7.157 -7.570 218 HH11 ARG 30 HH11 ARG 30 9.169 -9.683 -8.851 219 HH12 ARG 30 HH12 ARG 30 10.493 -8.622 -9.203 220 HH21 ARG 30 HH21 ARG 30 8.880 -5.751 -8.027 221 HH22 ARG 30 HH22 ARG 30 10.328 -6.386 -8.732 222 H GLY 31 H GLY 31 8.070 -13.144 -10.691 223 HA2 GLY 31 HA2 GLY 31 8.067 -15.562 -9.296 224 HA3 GLY 31 HA3 GLY 31 9.484 -14.826 -10.030 225 H ASN 32 H ASN 32 8.812 -12.433 -8.157 226 HA ASN 32 HA ASN 32 10.771 -12.922 -6.244 227 HB2 ASN 32 HB2 ASN 32 10.397 -10.785 -5.616 228 HB3 ASN 32 HB3 ASN 32 9.311 -10.739 -7.001 229 HD21 ASN 32 HD21 ASN 32 9.504 -11.167 -3.533 230 HD22 ASN 32 HD22 ASN 32 7.857 -10.766 -3.200 231 H GLY 33 H GLY 33 7.653 -14.182 -6.415 232 HA2 GLY 33 HA2 GLY 33 6.740 -15.796 -4.996 233 HA3 GLY 33 HA3 GLY 33 7.945 -15.379 -3.786 234 H TYR 34 H TYR 34 5.863 -13.042 -5.373 235 HA TYR 34 HA TYR 34 3.769 -12.943 -3.544 236 HB2 TYR 34 HB2 TYR 34 5.279 -12.386 -1.796 237 HB3 TYR 34 HB3 TYR 34 6.140 -11.231 -2.807 238 HD1 TYR 34 HD2 TYR 34 2.896 -11.844 -1.109 239 HD2 TYR 34 HD1 TYR 34 5.502 -8.969 -2.855 240 HE1 TYR 34 HE2 TYR 34 1.473 -10.035 -0.242 241 HE2 TYR 34 HE1 TYR 34 4.087 -7.152 -1.992 242 HH TYR 34 HH TYR 34 1.819 -6.782 -1.244 243 H CYS 35 H CYS 35 2.521 -10.898 -3.683 244 HA CYS 35 HA CYS 35 2.438 -9.987 -6.383 245 HB2 CYS 35 HB2 CYS 35 0.398 -10.251 -5.047 246 HB3 CYS 35 HB3 CYS 35 0.948 -8.993 -3.945 247 H GLY 36 H GLY 36 4.738 -9.196 -6.306 248 HA2 GLY 36 HA2 GLY 36 5.154 -6.671 -4.930 249 HA3 GLY 36 HA3 GLY 36 6.329 -7.531 -5.915 Start of MODEL 19 1 H1 GLY 1 H GLY 1 -3.167 3.009 -0.796 2 HA2 GLY 1 HA2 GLY 1 -1.379 1.643 -0.283 3 HA3 GLY 1 HA3 GLY 1 -2.463 0.263 -0.380 4 H CYS 2 H CYS 2 -3.353 0.443 -2.982 5 HA CYS 2 HA CYS 2 -0.922 0.393 -4.625 6 HB2 CYS 2 HB2 CYS 2 -2.843 -1.861 -4.152 7 HB3 CYS 2 HB3 CYS 2 -2.019 -1.727 -5.702 8 H ILE 3 H ILE 3 -2.899 2.391 -4.539 9 HA ILE 3 HA ILE 3 -4.351 3.580 -5.839 10 HB ILE 3 HB ILE 3 -3.149 2.188 -8.214 11 HG12 ILE 3 HG12 ILE 3 -1.866 4.340 -6.518 12 HG13 ILE 3 HG13 ILE 3 -1.293 2.686 -6.706 13 HG21 ILE 3 HG21 ILE 3 -4.950 4.237 -7.988 14 HG22 ILE 3 HG22 ILE 3 -3.423 5.093 -8.194 15 HG23 ILE 3 HG23 ILE 3 -3.941 3.913 -9.397 16 HD11 ILE 3 HD11 ILE 3 -1.030 3.183 -9.157 17 HD12 ILE 3 HD12 ILE 3 -1.324 4.876 -8.756 18 HD13 ILE 3 HD13 ILE 3 0.068 4.036 -8.072 19 H LEU 4 H LEU 4 -5.195 0.871 -4.987 20 HA LEU 4 HA LEU 4 -7.679 0.750 -6.224 21 HB2 LEU 4 HB2 LEU 4 -5.633 -0.411 -7.801 22 HB3 LEU 4 HB3 LEU 4 -6.627 -1.724 -7.172 23 HG LEU 4 HG LEU 4 -8.157 0.501 -8.313 24 HD11 LEU 4 HD11 LEU 4 -6.292 -1.125 -10.030 25 HD12 LEU 4 HD12 LEU 4 -6.359 0.631 -9.877 26 HD13 LEU 4 HD13 LEU 4 -7.685 -0.238 -10.649 27 HD21 LEU 4 HD21 LEU 4 -8.358 -2.278 -9.297 28 HD22 LEU 4 HD22 LEU 4 -9.624 -1.145 -8.822 29 HD23 LEU 4 HD23 LEU 4 -8.713 -2.018 -7.589 30 H ASN 5 H ASN 5 -9.033 -0.805 -5.300 31 HA ASN 5 HA ASN 5 -9.776 -2.088 -3.569 32 HB2 ASN 5 HB2 ASN 5 -7.508 -3.485 -4.784 33 HB3 ASN 5 HB3 ASN 5 -7.818 -3.980 -3.122 34 HD21 ASN 5 HD21 ASN 5 -9.974 -2.985 -5.753 35 HD22 ASN 5 HD22 ASN 5 -10.928 -4.426 -5.745 36 H GLY 6 H GLY 6 -8.854 -3.270 -1.414 37 HA2 GLY 6 HA2 GLY 6 -6.990 -1.408 -0.100 38 HA3 GLY 6 HA3 GLY 6 -8.564 -1.714 0.621 39 H ARG 7 H ARG 7 -6.500 -4.077 -0.996 40 HA ARG 7 HA ARG 7 -6.460 -5.626 1.493 41 HB2 ARG 7 HB2 ARG 7 -6.220 -6.331 -1.406 42 HB3 ARG 7 HB3 ARG 7 -5.537 -7.410 -0.197 43 HG2 ARG 7 HG2 ARG 7 -7.528 -8.283 0.200 44 HG3 ARG 7 HG3 ARG 7 -8.187 -6.691 0.583 45 HD2 ARG 7 HD2 ARG 7 -8.553 -6.293 -1.820 46 HD3 ARG 7 HD3 ARG 7 -7.947 -7.912 -2.165 47 HE ARG 7 HE ARG 7 -10.549 -7.212 -1.179 48 HH11 ARG 7 HH11 ARG 7 -8.131 -9.713 -1.318 49 HH12 ARG 7 HH12 ARG 7 -9.264 -11.002 -1.084 50 HH21 ARG 7 HH21 ARG 7 -12.051 -8.901 -0.870 51 HH22 ARG 7 HH22 ARG 7 -11.494 -10.539 -0.829 52 H THR 8 H THR 8 -4.154 -5.978 -1.121 53 HA THR 8 HA THR 8 -1.880 -5.886 -1.189 54 HB THR 8 HB THR 8 -1.614 -3.942 1.021 55 HG1 THR 8 HG1 THR 8 -2.730 -2.925 -1.340 56 HG21 THR 8 HG21 THR 8 -0.518 -2.737 -1.054 57 HG22 THR 8 HG22 THR 8 -0.569 -4.361 -1.740 58 HG23 THR 8 HG23 THR 8 0.305 -4.064 -0.237 59 H ASP 9 H ASP 9 -0.860 -7.630 -0.463 60 HA ASP 9 HA ASP 9 0.015 -9.210 0.926 61 HB2 ASP 9 HB2 ASP 9 1.093 -6.833 1.631 62 HB3 ASP 9 HB3 ASP 9 0.362 -7.303 3.164 63 H LEU 10 H LEU 10 -1.932 -10.363 1.209 64 HA LEU 10 HA LEU 10 -3.286 -9.890 3.782 65 HB2 LEU 10 HB2 LEU 10 -5.277 -10.593 2.889 66 HB3 LEU 10 HB3 LEU 10 -4.541 -9.785 1.506 67 HG LEU 10 HG LEU 10 -3.728 -12.419 1.240 68 HD11 LEU 10 HD11 LEU 10 -5.132 -13.674 2.428 69 HD12 LEU 10 HD12 LEU 10 -6.369 -13.200 1.265 70 HD13 LEU 10 HD13 LEU 10 -6.193 -12.307 2.775 71 HD21 LEU 10 HD21 LEU 10 -4.442 -10.850 -0.523 72 HD22 LEU 10 HD22 LEU 10 -6.117 -11.075 -0.020 73 HD23 LEU 10 HD23 LEU 10 -5.203 -12.434 -0.676 74 H GLY 11 H GLY 11 -4.548 -12.230 4.204 75 HA2 GLY 11 HA2 GLY 11 -2.807 -13.850 5.500 76 HA3 GLY 11 HA3 GLY 11 -4.294 -14.454 4.785 77 H THR 12 H THR 12 -4.228 -15.392 2.694 78 HA THR 12 HA THR 12 -1.988 -17.022 2.224 79 HB THR 12 HB THR 12 -3.695 -16.553 -0.121 80 HG1 THR 12 HG1 THR 12 -5.555 -16.691 0.866 81 HG21 THR 12 HG21 THR 12 -3.489 -19.102 1.429 82 HG22 THR 12 HG22 THR 12 -2.096 -18.521 0.516 83 HG23 THR 12 HG23 THR 12 -3.617 -18.856 -0.312 84 H LEU 13 H LEU 13 -3.144 -14.121 0.523 85 HA LEU 13 HA LEU 13 -1.213 -14.031 -1.478 86 HB2 LEU 13 HB2 LEU 13 -3.231 -12.625 -1.403 87 HB3 LEU 13 HB3 LEU 13 -2.524 -11.704 -0.077 88 HG LEU 13 HG LEU 13 -2.462 -10.792 -2.531 89 HD11 LEU 13 HD11 LEU 13 -1.441 -9.351 -1.135 90 HD12 LEU 13 HD12 LEU 13 0.025 -10.010 -1.858 91 HD13 LEU 13 HD13 LEU 13 -0.543 -10.621 -0.304 92 HD21 LEU 13 HD21 LEU 13 -0.848 -11.554 -3.941 93 HD22 LEU 13 HD22 LEU 13 -1.208 -13.063 -3.101 94 HD23 LEU 13 HD23 LEU 13 0.197 -12.105 -2.630 95 H LEU 14 H LEU 14 -0.848 -13.609 1.866 96 HA LEU 14 HA LEU 14 1.027 -11.740 2.332 97 HB2 LEU 14 HB2 LEU 14 0.267 -13.205 4.074 98 HB3 LEU 14 HB3 LEU 14 1.034 -14.591 3.302 99 HG LEU 14 HG LEU 14 3.182 -12.990 3.713 100 HD11 LEU 14 HD11 LEU 14 1.139 -11.814 5.250 101 HD12 LEU 14 HD12 LEU 14 2.862 -11.441 5.263 102 HD13 LEU 14 HD13 LEU 14 2.212 -12.645 6.377 103 HD21 LEU 14 HD21 LEU 14 2.773 -15.413 4.306 104 HD22 LEU 14 HD22 LEU 14 2.103 -14.834 5.832 105 HD23 LEU 14 HD23 LEU 14 3.788 -14.502 5.425 106 H PHE 15 H PHE 15 1.593 -14.825 0.715 107 HA PHE 15 HA PHE 15 3.915 -13.761 -0.604 108 HB2 PHE 15 HB2 PHE 15 4.186 -15.900 1.501 109 HB3 PHE 15 HB3 PHE 15 5.358 -15.723 0.199 110 HD1 PHE 15 HD2 PHE 15 6.019 -13.076 -0.116 111 HD2 PHE 15 HD1 PHE 15 4.844 -15.002 3.492 112 HE1 PHE 15 HE2 PHE 15 7.202 -11.354 1.184 113 HE2 PHE 15 HE1 PHE 15 6.024 -13.283 4.798 114 HZ PHE 15 HZ PHE 15 7.206 -11.457 3.644 115 H ARG 16 H ARG 16 5.035 -15.769 -1.805 116 HA ARG 16 HA ARG 16 4.747 -17.112 -3.633 117 HB2 ARG 16 HB2 ARG 16 4.486 -18.643 -1.619 118 HB3 ARG 16 HB3 ARG 16 2.751 -18.551 -1.889 119 HG2 ARG 16 HG2 ARG 16 3.214 -19.376 -4.239 120 HG3 ARG 16 HG3 ARG 16 4.847 -19.738 -3.677 121 HD2 ARG 16 HD2 ARG 16 3.307 -21.682 -3.580 122 HD3 ARG 16 HD3 ARG 16 4.003 -21.252 -2.018 123 HE ARG 16 HE ARG 16 1.472 -20.007 -2.439 124 HH11 ARG 16 HH11 ARG 16 3.008 -22.993 -1.519 125 HH12 ARG 16 HH12 ARG 16 1.662 -23.548 -0.580 126 HH21 ARG 16 HH21 ARG 16 -0.307 -20.727 -1.207 127 HH22 ARG 16 HH22 ARG 16 -0.224 -22.259 -0.404 128 H CYS 17 H CYS 17 2.914 -14.803 -3.391 129 HA CYS 17 HA CYS 17 0.409 -14.740 -3.895 130 HB2 CYS 17 HB2 CYS 17 0.713 -13.435 -6.016 131 HB3 CYS 17 HB3 CYS 17 1.740 -12.906 -4.688 132 H ARG 18 H ARG 18 -1.060 -16.139 -4.576 133 HA ARG 18 HA ARG 18 -0.422 -18.305 -6.326 134 HB2 ARG 18 HB2 ARG 18 -3.259 -17.891 -6.052 135 HB3 ARG 18 HB3 ARG 18 -2.262 -19.203 -5.437 136 HG2 ARG 18 HG2 ARG 18 -2.616 -16.542 -4.074 137 HG3 ARG 18 HG3 ARG 18 -3.521 -18.005 -3.682 138 HD2 ARG 18 HD2 ARG 18 -0.839 -17.214 -2.910 139 HD3 ARG 18 HD3 ARG 18 -1.892 -18.451 -2.224 140 HE ARG 18 HE ARG 18 0.165 -18.822 -4.235 141 HH11 ARG 18 HH11 ARG 18 -2.589 -20.153 -2.572 142 HH12 ARG 18 HH12 ARG 18 -2.188 -21.796 -2.952 143 HH21 ARG 18 HH21 ARG 18 0.702 -20.980 -4.741 144 HH22 ARG 18 HH22 ARG 18 -0.316 -22.265 -4.185 145 H ARG 19 H ARG 19 -1.223 -15.094 -6.870 146 HA ARG 19 HA ARG 19 -1.058 -15.089 -9.579 147 HB2 ARG 19 HB2 ARG 19 -2.923 -16.589 -9.775 148 HB3 ARG 19 HB3 ARG 19 -3.905 -15.592 -8.710 149 HG2 ARG 19 HG2 ARG 19 -4.525 -14.226 -10.365 150 HG3 ARG 19 HG3 ARG 19 -2.905 -14.179 -11.064 151 HD2 ARG 19 HD2 ARG 19 -4.078 -15.261 -12.721 152 HD3 ARG 19 HD3 ARG 19 -3.461 -16.625 -11.788 153 HE ARG 19 HE ARG 19 -5.932 -16.013 -10.719 154 HH11 ARG 19 HH11 ARG 19 -4.664 -17.017 -13.802 155 HH12 ARG 19 HH12 ARG 19 -6.105 -17.859 -14.267 156 HH21 ARG 19 HH21 ARG 19 -7.834 -17.118 -11.319 157 HH22 ARG 19 HH22 ARG 19 -7.908 -17.915 -12.854 158 H ASP 20 H ASP 20 -1.443 -13.055 -10.497 159 HA ASP 20 HA ASP 20 -1.165 -10.841 -8.914 160 HB2 ASP 20 HB2 ASP 20 -0.724 -10.575 -11.216 161 HB3 ASP 20 HB3 ASP 20 -2.326 -11.149 -11.675 162 H SER 21 H SER 21 -4.083 -12.555 -9.684 163 HA SER 21 HA SER 21 -6.016 -10.626 -9.174 164 HB2 SER 21 HB2 SER 21 -6.526 -12.865 -10.072 165 HB3 SER 21 HB3 SER 21 -6.139 -13.578 -8.506 166 HG SER 21 HG SER 21 -8.418 -13.177 -8.890 167 H ASP 22 H ASP 22 -4.055 -12.499 -6.962 168 HA ASP 22 HA ASP 22 -5.510 -11.989 -4.601 169 HB2 ASP 22 HB2 ASP 22 -2.531 -12.445 -4.856 170 HB3 ASP 22 HB3 ASP 22 -3.515 -12.692 -3.416 171 H CYS 23 H CYS 23 -3.583 -9.968 -6.549 172 HA CYS 23 HA CYS 23 -2.942 -8.107 -4.410 173 HB2 CYS 23 HB2 CYS 23 -2.520 -7.610 -7.348 174 HB3 CYS 23 HB3 CYS 23 -1.630 -6.943 -5.984 175 HA PRO 24 HA PRO 24 -6.553 -5.635 -4.874 176 HB2 PRO 24 HB2 PRO 24 -5.597 -3.289 -3.899 177 HB3 PRO 24 HB3 PRO 24 -5.971 -4.676 -2.869 178 HG2 PRO 24 HG2 PRO 24 -3.324 -3.760 -3.927 179 HG3 PRO 24 HG3 PRO 24 -3.740 -4.340 -2.303 180 HD2 PRO 24 HD2 PRO 24 -2.530 -5.912 -4.146 181 HD3 PRO 24 HD3 PRO 24 -3.660 -6.555 -2.937 182 H GLY 25 H GLY 25 -3.582 -3.841 -5.741 183 HA2 GLY 25 HA2 GLY 25 -4.792 -3.196 -8.332 184 HA3 GLY 25 HA3 GLY 25 -4.304 -1.863 -7.297 185 H ALA 26 H ALA 26 -2.399 -1.032 -7.795 186 HA ALA 26 HA ALA 26 -0.650 -1.639 -9.681 187 HB1 ALA 26 HB1 ALA 26 -0.290 -0.453 -7.005 188 HB2 ALA 26 HB2 ALA 26 1.181 -0.966 -7.831 189 HB3 ALA 26 HB3 ALA 26 0.098 0.195 -8.599 190 H CYS 27 H CYS 27 0.444 -2.634 -6.463 191 HA CYS 27 HA CYS 27 2.316 -4.425 -6.997 192 HB2 CYS 27 HB2 CYS 27 1.187 -5.887 -5.089 193 HB3 CYS 27 HB3 CYS 27 1.919 -4.324 -4.740 194 H ILE 28 H ILE 28 2.605 -6.350 -7.959 195 HA ILE 28 HA ILE 28 0.235 -7.924 -8.694 196 HB ILE 28 HB ILE 28 1.341 -8.425 -10.894 197 HG12 ILE 28 HG12 ILE 28 3.004 -5.991 -10.213 198 HG13 ILE 28 HG13 ILE 28 3.608 -7.644 -10.215 199 HG21 ILE 28 HG21 ILE 28 0.902 -5.544 -11.072 200 HG22 ILE 28 HG22 ILE 28 0.029 -6.875 -11.831 201 HG23 ILE 28 HG23 ILE 28 -0.353 -6.400 -10.176 202 HD11 ILE 28 HD11 ILE 28 3.132 -7.816 -12.599 203 HD12 ILE 28 HD12 ILE 28 2.522 -6.161 -12.596 204 HD13 ILE 28 HD13 ILE 28 4.222 -6.474 -12.249 205 H CYS 29 H CYS 29 0.687 -10.168 -9.180 206 HA CYS 29 HA CYS 29 2.643 -11.265 -7.392 207 HB2 CYS 29 HB2 CYS 29 0.637 -12.488 -7.490 208 HB3 CYS 29 HB3 CYS 29 0.593 -12.447 -9.249 209 H ARG 30 H ARG 30 4.724 -11.235 -7.949 210 HA ARG 30 HA ARG 30 5.439 -12.016 -10.699 211 HB2 ARG 30 HB2 ARG 30 7.614 -10.721 -9.359 212 HB3 ARG 30 HB3 ARG 30 6.769 -10.230 -10.821 213 HG2 ARG 30 HG2 ARG 30 6.171 -8.430 -9.656 214 HG3 ARG 30 HG3 ARG 30 5.010 -9.496 -8.862 215 HD2 ARG 30 HD2 ARG 30 6.027 -9.136 -6.923 216 HD3 ARG 30 HD3 ARG 30 7.499 -9.856 -7.574 217 HE ARG 30 HE ARG 30 6.921 -7.035 -7.268 218 HH11 ARG 30 HH11 ARG 30 8.947 -9.465 -8.720 219 HH12 ARG 30 HH12 ARG 30 10.270 -8.381 -8.999 220 HH21 ARG 30 HH21 ARG 30 8.656 -5.599 -7.629 221 HH22 ARG 30 HH22 ARG 30 10.104 -6.183 -8.377 222 H GLY 31 H GLY 31 7.855 -12.820 -10.710 223 HA2 GLY 31 HA2 GLY 31 7.917 -15.298 -9.425 224 HA3 GLY 31 HA3 GLY 31 9.308 -14.506 -10.152 225 H ASN 32 H ASN 32 8.657 -12.207 -8.170 226 HA ASN 32 HA ASN 32 10.655 -12.732 -6.323 227 HB2 ASN 32 HB2 ASN 32 10.220 -10.649 -5.556 228 HB3 ASN 32 HB3 ASN 32 9.121 -10.561 -6.930 229 HD21 ASN 32 HD21 ASN 32 9.346 -11.229 -3.495 230 HD22 ASN 32 HD22 ASN 32 7.695 -10.878 -3.128 231 H GLY 33 H GLY 33 7.527 -14.022 -6.460 232 HA2 GLY 33 HA2 GLY 33 6.736 -15.771 -5.112 233 HA3 GLY 33 HA3 GLY 33 7.943 -15.355 -3.903 234 H TYR 34 H TYR 34 5.740 -13.042 -5.355 235 HA TYR 34 HA TYR 34 3.654 -13.101 -3.534 236 HB2 TYR 34 HB2 TYR 34 5.061 -12.631 -1.709 237 HB3 TYR 34 HB3 TYR 34 6.013 -11.469 -2.627 238 HD1 TYR 34 HD2 TYR 34 2.807 -12.017 -0.891 239 HD2 TYR 34 HD1 TYR 34 5.342 -9.180 -2.797 240 HE1 TYR 34 HE2 TYR 34 1.425 -10.189 0.003 241 HE2 TYR 34 HE1 TYR 34 3.968 -7.345 -1.907 242 HH TYR 34 HH TYR 34 1.340 -7.232 -1.111 243 H CYS 35 H CYS 35 2.378 -11.057 -3.515 244 HA CYS 35 HA CYS 35 2.261 -9.969 -6.143 245 HB2 CYS 35 HB2 CYS 35 0.601 -10.012 -3.796 246 HB3 CYS 35 HB3 CYS 35 0.706 -8.366 -4.411 247 H GLY 36 H GLY 36 4.534 -9.160 -6.107 248 HA2 GLY 36 HA2 GLY 36 4.989 -6.735 -4.565 249 HA3 GLY 36 HA3 GLY 36 6.141 -7.527 -5.630 Start of MODEL 20 1 H1 GLY 1 H GLY 1 -1.707 -1.118 0.793 2 HA2 GLY 1 HA2 GLY 1 -2.978 -0.194 -1.127 3 HA3 GLY 1 HA3 GLY 1 -2.071 1.063 -0.298 4 H CYS 2 H CYS 2 -2.438 -0.757 -3.194 5 HA CYS 2 HA CYS 2 -0.130 0.629 -4.387 6 HB2 CYS 2 HB2 CYS 2 -1.524 -1.698 -5.675 7 HB3 CYS 2 HB3 CYS 2 0.127 -1.132 -5.904 8 H ILE 3 H ILE 3 -2.276 2.210 -4.079 9 HA ILE 3 HA ILE 3 -3.626 3.651 -5.210 10 HB ILE 3 HB ILE 3 -2.596 2.392 -7.750 11 HG12 ILE 3 HG12 ILE 3 -1.223 4.792 -7.238 12 HG13 ILE 3 HG13 ILE 3 -1.182 3.892 -5.726 13 HG21 ILE 3 HG21 ILE 3 -3.265 4.349 -8.838 14 HG22 ILE 3 HG22 ILE 3 -4.595 3.990 -7.738 15 HG23 ILE 3 HG23 ILE 3 -3.425 5.243 -7.326 16 HD11 ILE 3 HD11 ILE 3 -0.126 3.068 -8.408 17 HD12 ILE 3 HD12 ILE 3 0.755 3.280 -6.895 18 HD13 ILE 3 HD13 ILE 3 -0.358 1.925 -7.086 19 H LEU 4 H LEU 4 -5.631 2.946 -4.656 20 HA LEU 4 HA LEU 4 -7.734 2.136 -4.980 21 HB2 LEU 4 HB2 LEU 4 -7.102 2.803 -7.404 22 HB3 LEU 4 HB3 LEU 4 -6.929 1.067 -7.658 23 HG LEU 4 HG LEU 4 -9.351 0.942 -6.735 24 HD11 LEU 4 HD11 LEU 4 -9.119 3.847 -7.488 25 HD12 LEU 4 HD12 LEU 4 -9.622 3.167 -5.941 26 HD13 LEU 4 HD13 LEU 4 -10.654 2.986 -7.360 27 HD21 LEU 4 HD21 LEU 4 -10.238 1.259 -8.985 28 HD22 LEU 4 HD22 LEU 4 -8.695 0.406 -9.028 29 HD23 LEU 4 HD23 LEU 4 -8.769 2.117 -9.452 30 H ASN 5 H ASN 5 -8.487 0.378 -4.008 31 HA ASN 5 HA ASN 5 -8.750 -1.775 -3.321 32 HB2 ASN 5 HB2 ASN 5 -7.066 -2.819 -5.561 33 HB3 ASN 5 HB3 ASN 5 -8.553 -3.473 -4.880 34 HD21 ASN 5 HD21 ASN 5 -10.544 -2.323 -5.350 35 HD22 ASN 5 HD22 ASN 5 -10.701 -1.500 -6.861 36 H GLY 6 H GLY 6 -7.148 -0.798 -1.694 37 HA2 GLY 6 HA2 GLY 6 -4.470 -1.923 -1.826 38 HA3 GLY 6 HA3 GLY 6 -5.095 -0.857 -0.576 39 H ARG 7 H ARG 7 -6.215 -4.006 -1.803 40 HA ARG 7 HA ARG 7 -6.416 -4.939 0.959 41 HB2 ARG 7 HB2 ARG 7 -7.960 -5.334 -1.386 42 HB3 ARG 7 HB3 ARG 7 -7.284 -6.896 -0.944 43 HG2 ARG 7 HG2 ARG 7 -8.439 -6.997 1.028 44 HG3 ARG 7 HG3 ARG 7 -8.556 -5.242 1.175 45 HD2 ARG 7 HD2 ARG 7 -10.721 -6.334 0.664 46 HD3 ARG 7 HD3 ARG 7 -10.226 -5.156 -0.550 47 HE ARG 7 HE ARG 7 -9.394 -7.798 -1.226 48 HH11 ARG 7 HH11 ARG 7 -12.120 -5.632 -1.232 49 HH12 ARG 7 HH12 ARG 7 -12.910 -6.422 -2.556 50 HH21 ARG 7 HH21 ARG 7 -10.425 -8.846 -2.970 51 HH22 ARG 7 HH22 ARG 7 -11.945 -8.251 -3.543 52 H THR 8 H THR 8 -3.862 -4.671 -0.602 53 HA THR 8 HA THR 8 -2.927 -7.285 -1.217 54 HB THR 8 HB THR 8 -1.906 -5.195 -2.122 55 HG1 THR 8 HG1 THR 8 -0.766 -7.253 -2.023 56 HG21 THR 8 HG21 THR 8 -1.955 -4.026 0.140 57 HG22 THR 8 HG22 THR 8 -0.487 -3.828 -0.817 58 HG23 THR 8 HG23 THR 8 -0.513 -4.959 0.535 59 H ASP 9 H ASP 9 -0.849 -8.090 -0.072 60 HA ASP 9 HA ASP 9 0.007 -9.146 1.754 61 HB2 ASP 9 HB2 ASP 9 0.396 -6.597 2.219 62 HB3 ASP 9 HB3 ASP 9 -0.826 -6.831 3.467 63 H LEU 10 H LEU 10 -1.764 -10.685 1.615 64 HA LEU 10 HA LEU 10 -3.597 -10.470 3.913 65 HB2 LEU 10 HB2 LEU 10 -4.189 -10.830 1.166 66 HB3 LEU 10 HB3 LEU 10 -4.567 -12.340 1.994 67 HG LEU 10 HG LEU 10 -5.607 -9.951 3.334 68 HD11 LEU 10 HD11 LEU 10 -7.135 -10.703 0.908 69 HD12 LEU 10 HD12 LEU 10 -5.740 -9.644 0.700 70 HD13 LEU 10 HD13 LEU 10 -7.057 -9.167 1.772 71 HD21 LEU 10 HD21 LEU 10 -7.700 -11.573 2.907 72 HD22 LEU 10 HD22 LEU 10 -6.549 -11.803 4.224 73 HD23 LEU 10 HD23 LEU 10 -6.385 -12.736 2.735 74 H GLY 11 H GLY 11 -4.576 -12.947 4.117 75 HA2 GLY 11 HA2 GLY 11 -2.734 -14.396 5.526 76 HA3 GLY 11 HA3 GLY 11 -4.129 -15.120 4.739 77 H THR 12 H THR 12 -3.889 -16.093 2.705 78 HA THR 12 HA THR 12 -1.439 -17.416 2.289 79 HB THR 12 HB THR 12 -2.735 -17.639 -0.133 80 HG1 THR 12 HG1 THR 12 -4.955 -17.825 0.435 81 HG21 THR 12 HG21 THR 12 -1.889 -19.479 1.247 82 HG22 THR 12 HG22 THR 12 -3.548 -19.782 0.732 83 HG23 THR 12 HG23 THR 12 -3.220 -19.245 2.379 84 H LEU 13 H LEU 13 -2.877 -14.571 0.788 85 HA LEU 13 HA LEU 13 -1.066 -14.293 -1.342 86 HB2 LEU 13 HB2 LEU 13 -3.175 -13.087 -1.241 87 HB3 LEU 13 HB3 LEU 13 -2.610 -12.187 0.165 88 HG LEU 13 HG LEU 13 -2.603 -11.092 -2.206 89 HD11 LEU 13 HD11 LEU 13 -0.692 -10.900 0.040 90 HD12 LEU 13 HD12 LEU 13 -1.774 -9.685 -0.642 91 HD13 LEU 13 HD13 LEU 13 -0.255 -10.067 -1.452 92 HD21 LEU 13 HD21 LEU 13 0.184 -12.077 -2.364 93 HD22 LEU 13 HD22 LEU 13 -0.922 -11.587 -3.647 94 HD23 LEU 13 HD23 LEU 13 -1.088 -13.175 -2.898 95 H LEU 14 H LEU 14 -0.627 -13.903 1.998 96 HA LEU 14 HA LEU 14 1.102 -11.855 2.389 97 HB2 LEU 14 HB2 LEU 14 0.453 -13.336 4.173 98 HB3 LEU 14 HB3 LEU 14 1.338 -14.670 3.437 99 HG LEU 14 HG LEU 14 3.344 -12.898 3.791 100 HD11 LEU 14 HD11 LEU 14 2.004 -12.559 6.391 101 HD12 LEU 14 HD12 LEU 14 1.376 -11.579 5.067 102 HD13 LEU 14 HD13 LEU 14 3.079 -11.471 5.513 103 HD21 LEU 14 HD21 LEU 14 4.112 -14.337 5.432 104 HD22 LEU 14 HD22 LEU 14 2.966 -15.347 4.549 105 HD23 LEU 14 HD23 LEU 14 2.498 -14.619 6.087 106 H PHE 15 H PHE 15 1.794 -14.882 0.745 107 HA PHE 15 HA PHE 15 4.052 -13.717 -0.582 108 HB2 PHE 15 HB2 PHE 15 4.462 -15.831 1.526 109 HB3 PHE 15 HB3 PHE 15 5.606 -15.601 0.208 110 HD1 PHE 15 HD2 PHE 15 6.215 -12.979 -0.130 111 HD2 PHE 15 HD1 PHE 15 5.012 -14.836 3.506 112 HE1 PHE 15 HE2 PHE 15 7.326 -11.193 1.147 113 HE2 PHE 15 HE1 PHE 15 6.120 -13.053 4.788 114 HZ PHE 15 HZ PHE 15 7.281 -11.229 3.609 115 H ARG 16 H ARG 16 5.264 -15.678 -1.782 116 HA ARG 16 HA ARG 16 5.033 -17.056 -3.591 117 HB2 ARG 16 HB2 ARG 16 4.886 -18.627 -1.657 118 HB3 ARG 16 HB3 ARG 16 3.134 -18.507 -1.742 119 HG2 ARG 16 HG2 ARG 16 4.027 -19.163 -4.330 120 HG3 ARG 16 HG3 ARG 16 4.896 -20.206 -3.203 121 HD2 ARG 16 HD2 ARG 16 3.004 -21.270 -2.515 122 HD3 ARG 16 HD3 ARG 16 1.988 -19.850 -2.760 123 HE ARG 16 HE ARG 16 1.555 -20.571 -4.889 124 HH11 ARG 16 HH11 ARG 16 4.304 -22.300 -3.634 125 HH12 ARG 16 HH12 ARG 16 4.382 -23.405 -4.966 126 HH21 ARG 16 HH21 ARG 16 1.647 -22.020 -6.648 127 HH22 ARG 16 HH22 ARG 16 2.871 -23.244 -6.680 128 H CYS 17 H CYS 17 3.093 -14.815 -3.332 129 HA CYS 17 HA CYS 17 0.620 -14.784 -3.859 130 HB2 CYS 17 HB2 CYS 17 0.901 -13.618 -6.081 131 HB3 CYS 17 HB3 CYS 17 1.885 -12.978 -4.770 132 H ARG 18 H ARG 18 -0.699 -16.448 -4.248 133 HA ARG 18 HA ARG 18 -0.134 -18.639 -5.905 134 HB2 ARG 18 HB2 ARG 18 -2.834 -18.672 -5.848 135 HB3 ARG 18 HB3 ARG 18 -1.825 -19.236 -4.523 136 HG2 ARG 18 HG2 ARG 18 -2.494 -16.363 -4.520 137 HG3 ARG 18 HG3 ARG 18 -3.822 -17.485 -4.217 138 HD2 ARG 18 HD2 ARG 18 -1.284 -17.111 -2.661 139 HD3 ARG 18 HD3 ARG 18 -2.950 -16.994 -2.096 140 HE ARG 18 HE ARG 18 -2.866 -19.545 -2.783 141 HH11 ARG 18 HH11 ARG 18 -0.519 -17.634 -1.062 142 HH12 ARG 18 HH12 ARG 18 0.087 -18.972 -0.142 143 HH21 ARG 18 HH21 ARG 18 -2.076 -21.313 -1.578 144 HH22 ARG 18 HH22 ARG 18 -0.798 -21.064 -0.437 145 H ARG 19 H ARG 19 -1.089 -15.469 -6.678 146 HA ARG 19 HA ARG 19 -0.783 -15.629 -9.379 147 HB2 ARG 19 HB2 ARG 19 -2.560 -17.250 -9.526 148 HB3 ARG 19 HB3 ARG 19 -3.640 -16.218 -8.598 149 HG2 ARG 19 HG2 ARG 19 -4.238 -15.030 -10.391 150 HG3 ARG 19 HG3 ARG 19 -2.587 -14.952 -11.009 151 HD2 ARG 19 HD2 ARG 19 -4.072 -16.176 -12.527 152 HD3 ARG 19 HD3 ARG 19 -2.788 -17.205 -11.893 153 HE ARG 19 HE ARG 19 -5.223 -17.340 -10.376 154 HH11 ARG 19 HH11 ARG 19 -3.500 -18.585 -13.132 155 HH12 ARG 19 HH12 ARG 19 -4.367 -20.085 -13.161 156 HH21 ARG 19 HH21 ARG 19 -6.372 -19.310 -10.403 157 HH22 ARG 19 HH22 ARG 19 -6.001 -20.496 -11.609 158 H ASP 20 H ASP 20 -1.245 -13.684 -10.447 159 HA ASP 20 HA ASP 20 -1.159 -11.361 -9.000 160 HB2 ASP 20 HB2 ASP 20 -2.515 -11.553 -11.691 161 HB3 ASP 20 HB3 ASP 20 -1.637 -10.181 -11.021 162 H SER 21 H SER 21 -3.904 -13.337 -9.657 163 HA SER 21 HA SER 21 -5.996 -11.515 -9.441 164 HB2 SER 21 HB2 SER 21 -5.710 -14.437 -8.868 165 HB3 SER 21 HB3 SER 21 -7.184 -13.613 -8.361 166 HG SER 21 HG SER 21 -7.277 -12.842 -10.607 167 H ASP 22 H ASP 22 -3.882 -12.810 -7.014 168 HA ASP 22 HA ASP 22 -5.536 -12.029 -4.788 169 HB2 ASP 22 HB2 ASP 22 -3.483 -12.600 -3.444 170 HB3 ASP 22 HB3 ASP 22 -4.100 -13.912 -4.445 171 H CYS 23 H CYS 23 -3.977 -10.233 -6.966 172 HA CYS 23 HA CYS 23 -3.062 -8.231 -5.010 173 HB2 CYS 23 HB2 CYS 23 -1.960 -9.175 -7.516 174 HB3 CYS 23 HB3 CYS 23 -2.215 -7.434 -7.560 175 HA PRO 24 HA PRO 24 -6.888 -6.261 -6.399 176 HB2 PRO 24 HB2 PRO 24 -6.983 -4.506 -4.330 177 HB3 PRO 24 HB3 PRO 24 -7.533 -6.180 -4.196 178 HG2 PRO 24 HG2 PRO 24 -4.933 -4.965 -3.344 179 HG3 PRO 24 HG3 PRO 24 -5.957 -6.132 -2.486 180 HD2 PRO 24 HD2 PRO 24 -3.737 -6.869 -3.851 181 HD3 PRO 24 HD3 PRO 24 -5.162 -7.918 -3.708 182 H GLY 25 H GLY 25 -4.243 -4.340 -4.947 183 HA2 GLY 25 HA2 GLY 25 -4.803 -2.064 -6.593 184 HA3 GLY 25 HA3 GLY 25 -3.420 -2.264 -5.528 185 H ALA 26 H ALA 26 -2.469 -1.092 -7.465 186 HA ALA 26 HA ALA 26 -2.109 -2.186 -9.964 187 HB1 ALA 26 HB1 ALA 26 0.141 -0.975 -9.909 188 HB2 ALA 26 HB2 ALA 26 -1.312 -0.010 -9.645 189 HB3 ALA 26 HB3 ALA 26 -0.307 -0.482 -8.275 190 H CYS 27 H CYS 27 -0.266 -2.845 -7.011 191 HA CYS 27 HA CYS 27 1.818 -4.333 -7.874 192 HB2 CYS 27 HB2 CYS 27 1.255 -5.844 -5.788 193 HB3 CYS 27 HB3 CYS 27 1.750 -4.168 -5.575 194 H ILE 28 H ILE 28 2.196 -6.622 -8.140 195 HA ILE 28 HA ILE 28 -0.094 -8.299 -8.756 196 HB ILE 28 HB ILE 28 0.937 -8.930 -10.989 197 HG12 ILE 28 HG12 ILE 28 2.348 -6.287 -10.556 198 HG13 ILE 28 HG13 ILE 28 3.117 -7.866 -10.669 199 HG21 ILE 28 HG21 ILE 28 -0.331 -7.330 -12.154 200 HG22 ILE 28 HG22 ILE 28 -1.112 -7.481 -10.581 201 HG23 ILE 28 HG23 ILE 28 -0.068 -6.100 -10.918 202 HD11 ILE 28 HD11 ILE 28 1.808 -6.257 -12.823 203 HD12 ILE 28 HD12 ILE 28 3.443 -6.917 -12.762 204 HD13 ILE 28 HD13 ILE 28 2.065 -7.993 -12.998 205 H CYS 29 H CYS 29 0.564 -10.546 -9.264 206 HA CYS 29 HA CYS 29 2.600 -11.403 -7.444 207 HB2 CYS 29 HB2 CYS 29 0.739 -12.833 -7.557 208 HB3 CYS 29 HB3 CYS 29 0.724 -12.822 -9.317 209 H ARG 30 H ARG 30 4.691 -11.584 -7.864 210 HA ARG 30 HA ARG 30 5.535 -12.192 -10.618 211 HB2 ARG 30 HB2 ARG 30 7.556 -10.675 -9.271 212 HB3 ARG 30 HB3 ARG 30 6.702 -10.297 -10.760 213 HG2 ARG 30 HG2 ARG 30 5.857 -8.550 -9.684 214 HG3 ARG 30 HG3 ARG 30 4.864 -9.701 -8.788 215 HD2 ARG 30 HD2 ARG 30 5.883 -9.069 -6.919 216 HD3 ARG 30 HD3 ARG 30 7.396 -9.704 -7.563 217 HE ARG 30 HE ARG 30 6.567 -6.927 -7.463 218 HH11 ARG 30 HH11 ARG 30 8.793 -9.281 -8.737 219 HH12 ARG 30 HH12 ARG 30 10.012 -8.112 -9.122 220 HH21 ARG 30 HH21 ARG 30 8.164 -5.378 -7.965 221 HH22 ARG 30 HH22 ARG 30 9.654 -5.892 -8.682 222 H GLY 31 H GLY 31 7.990 -12.808 -10.574 223 HA2 GLY 31 HA2 GLY 31 8.239 -15.221 -9.193 224 HA3 GLY 31 HA3 GLY 31 9.568 -14.349 -9.941 225 H ASN 32 H ASN 32 8.705 -12.038 -8.050 226 HA ASN 32 HA ASN 32 10.724 -12.335 -6.168 227 HB2 ASN 32 HB2 ASN 32 10.128 -10.260 -5.491 228 HB3 ASN 32 HB3 ASN 32 9.046 -10.309 -6.880 229 HD21 ASN 32 HD21 ASN 32 9.267 -10.821 -3.418 230 HD22 ASN 32 HD22 ASN 32 7.589 -10.577 -3.085 231 H GLY 33 H GLY 33 7.725 -13.885 -6.290 232 HA2 GLY 33 HA2 GLY 33 7.028 -15.613 -4.876 233 HA3 GLY 33 HA3 GLY 33 8.200 -15.078 -3.681 234 H TYR 34 H TYR 34 5.850 -12.972 -5.217 235 HA TYR 34 HA TYR 34 3.769 -13.104 -3.396 236 HB2 TYR 34 HB2 TYR 34 5.176 -12.483 -1.600 237 HB3 TYR 34 HB3 TYR 34 5.992 -11.252 -2.557 238 HD1 TYR 34 HD2 TYR 34 2.864 -12.085 -0.786 239 HD2 TYR 34 HD1 TYR 34 5.110 -9.044 -2.737 240 HE1 TYR 34 HE2 TYR 34 1.317 -10.386 0.093 241 HE2 TYR 34 HE1 TYR 34 3.570 -7.337 -1.863 242 HH TYR 34 HH TYR 34 1.709 -6.950 -0.715 243 H CYS 35 H CYS 35 2.365 -11.141 -3.444 244 HA CYS 35 HA CYS 35 2.179 -10.161 -6.111 245 HB2 CYS 35 HB2 CYS 35 0.145 -10.532 -4.908 246 HB3 CYS 35 HB3 CYS 35 0.667 -9.497 -3.583 247 H GLY 36 H GLY 36 4.297 -9.141 -6.267 248 HA2 GLY 36 HA2 GLY 36 4.634 -6.659 -4.761 249 HA3 GLY 36 HA3 GLY 36 5.830 -7.410 -5.806
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