NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
630761 | 6ccx | 30403 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 HE21 GLN 220 HE21 GLN 220 -39.908 -24.043 4.705 2 HE22 GLN 220 HE22 GLN 220 -41.357 -24.712 5.362 3 HE21 GLN 226 HE21 GLN 226 -36.949 -35.232 12.717 4 HE22 GLN 226 HE22 GLN 226 -38.499 -34.460 12.675 5 HE21 GLN 241 HE21 GLN 241 -20.476 -52.395 10.776 6 HE22 GLN 241 HE22 GLN 241 -21.915 -51.837 9.991 7 HE21 GLN 255 HE21 GLN 255 3.949 -54.415 17.947 8 HE22 GLN 255 HE22 GLN 255 2.763 -55.536 18.517 9 HE21 GLN 262 HE21 GLN 262 12.148 -49.800 15.338 10 HE22 GLN 262 HE22 GLN 262 10.933 -49.137 16.374 11 HE21 GLN 266 HE21 GLN 266 19.151 -52.235 14.844 12 HE22 GLN 266 HE22 GLN 266 18.123 -53.067 15.962 13 HE21 GLN 274 HE21 GLN 274 31.943 -51.338 7.600 14 HE22 GLN 274 HE22 GLN 274 31.134 -52.867 7.610 15 HE21 GLN 284 HE21 GLN 284 41.269 -37.282 10.735 16 HE22 GLN 284 HE22 GLN 284 40.486 -38.053 12.071 17 HE21 GLN 289 HE21 GLN 289 48.751 -32.730 -0.866 18 HE22 GLN 289 HE22 GLN 289 48.492 -34.050 -1.967 19 HE21 GLN 295 HE21 GLN 295 52.020 -25.135 6.281 20 HE22 GLN 295 HE22 GLN 295 51.824 -26.076 7.725 21 HE21 GLN 329 HE21 GLN 329 47.828 24.051 -8.604 22 HE22 GLN 329 HE22 GLN 329 49.309 23.209 -8.881 23 H MET 1 HT1 MET 1 3.165 -11.869 16.312 24 H THR 2 HN THR 2 1.940 -8.950 19.482 25 HG1 THR 2 HG1 THR 2 -0.592 -7.008 17.858 26 H GLU 3 HN GLU 3 3.591 -5.281 17.461 27 H TYR 4 HN TYR 4 6.009 -4.123 21.064 28 HH TYR 4 HH TYR 4 -1.035 -4.730 23.001 29 H LYS 5 HN LYS 5 5.160 0.179 21.029 30 HZ1 LYS 5 HZ1 LYS 5 8.717 0.917 15.699 31 HZ2 LYS 5 HZ2 LYS 5 7.691 0.078 14.652 32 HZ3 LYS 5 HZ3 LYS 5 8.082 -0.587 16.163 33 H LEU 6 HN LEU 6 8.389 0.675 23.507 34 H VAL 7 HN VAL 7 7.889 4.534 25.857 35 H VAL 8 HN VAL 8 11.777 6.469 26.833 36 H VAL 9 HN VAL 9 10.299 8.967 30.014 37 H GLY 10 HN GLY 10 13.054 12.486 30.581 38 H ALA 11 HN ALA 11 14.226 13.556 34.589 39 H VAL 12 HN VAL 12 18.304 15.474 33.647 40 H GLY 13 HN GLY 13 19.260 11.655 34.723 41 H VAL 14 HN VAL 14 17.818 11.416 35.969 42 H GLY 15 HN GLY 15 18.040 8.540 35.621 43 H LYS 16 HN LYS 16 17.384 7.286 34.136 44 HZ1 LYS 16 HZ1 LYS 16 15.922 8.037 28.934 45 HZ2 LYS 16 HZ2 LYS 16 15.863 9.699 28.615 46 HZ3 LYS 16 HZ3 LYS 16 14.424 8.811 28.735 47 H SER 17 HN SER 17 18.928 5.659 32.760 48 HG SER 17 HG SER 17 21.488 6.031 31.086 49 H ALA 18 HN ALA 18 19.621 3.644 34.478 50 H LEU 19 HN LEU 19 17.198 2.584 35.048 51 H THR 20 HN THR 20 16.505 1.486 32.562 52 HG1 THR 20 HG1 THR 20 16.226 2.596 30.896 53 H ILE 21 HN ILE 21 18.430 -0.368 31.925 54 H GLN 22 HN GLN 22 17.961 -1.967 33.933 55 HE21 GLN 22 HE21 GLN 22 18.753 -3.193 39.045 56 HE22 GLN 22 HE22 GLN 22 19.567 -4.714 39.122 57 H LEU 23 HN LEU 23 16.043 -3.518 33.027 58 H ILE 24 HN ILE 24 16.373 -4.605 31.199 59 H GLN 25 HN GLN 25 18.744 -5.907 30.927 60 HE21 GLN 25 HE21 GLN 25 23.404 -7.115 30.085 61 HE22 GLN 25 HE22 GLN 25 24.194 -7.457 28.586 62 H ASN 26 HN ASN 26 18.142 -6.858 32.872 63 HD21 ASN 26 HD21 ASN 26 17.004 -9.038 37.335 64 HD22 ASN 26 HD22 ASN 26 15.360 -9.245 36.836 65 H HIS 27 HN HIS 27 20.269 -5.845 34.199 66 HD1 HIS 27 HD1 HIS 27 24.976 -7.622 36.069 67 HE2 HIS 27 HE2 HIS 27 26.894 -4.119 36.138 68 H PHE 28 HN PHE 28 22.276 -4.624 37.804 69 H VAL 29 HN VAL 29 22.564 -0.517 36.145 70 H ASP 30 HN ASP 30 26.661 0.140 37.752 71 H GLU 31 HN GLU 31 27.645 1.832 36.751 72 H TYR 32 HN TYR 32 28.728 6.229 35.921 73 HH TYR 32 HH TYR 32 25.768 12.883 31.853 74 H ASP 33 HN ASP 33 25.535 6.597 32.918 75 H THR 35 HN THR 35 23.572 10.828 27.352 76 HG1 THR 35 HG1 THR 35 22.382 7.449 27.993 77 H ILE 36 HN ILE 36 22.309 8.897 23.918 78 H GLU 37 HN GLU 37 21.512 8.092 22.615 79 H ASP 38 HN ASP 38 18.347 6.061 22.729 80 H SER 39 HN SER 39 18.913 1.664 22.661 81 HG SER 39 HG SER 39 18.053 2.062 20.545 82 H TYR 40 HN TYR 40 15.703 -0.370 23.963 83 HH TYR 40 HH TYR 40 22.660 -0.666 26.237 84 H ARG 41 HN ARG 41 16.387 -4.541 22.624 85 HE ARG 41 HE ARG 41 14.251 -7.128 17.959 86 HH11 ARG 41 HH11 ARG 41 15.877 -3.455 17.449 87 HH12 ARG 41 HH12 ARG 41 14.302 -3.621 18.327 88 HH21 ARG 41 HH21 ARG 41 16.976 -5.305 16.664 89 HH22 ARG 41 HH22 ARG 41 16.278 -6.949 16.915 90 H LYS 42 HN LYS 42 12.470 -6.211 23.600 91 HZ1 LYS 42 HZ1 LYS 42 13.190 -9.635 29.422 92 HZ2 LYS 42 HZ2 LYS 42 13.763 -11.053 30.138 93 HZ3 LYS 42 HZ3 LYS 42 12.845 -11.141 28.721 94 H GLN 43 HN GLN 43 12.250 -10.478 24.198 95 HE21 GLN 43 HE21 GLN 43 6.902 -13.845 22.860 96 HE22 GLN 43 HE22 GLN 43 7.471 -14.814 21.536 97 H VAL 44 HN VAL 44 8.121 -10.013 25.658 98 H VAL 45 HN VAL 45 6.873 -12.243 29.245 99 H ILE 46 HN ILE 46 3.565 -10.577 28.150 100 H ASP 47 HN ASP 47 1.770 -11.185 31.920 101 H GLY 48 HN GLY 48 0.944 -13.556 30.685 102 H GLU 49 HN GLU 49 -0.683 -12.353 28.163 103 H THR 50 HN THR 50 1.603 -13.492 24.568 104 HG1 THR 50 HG1 THR 50 5.936 -12.837 25.008 105 H CYS 51 HN CYS 51 4.891 -10.417 24.676 106 HG CYS 51 HG CYS 51 2.980 -9.084 25.376 107 H LEU 52 HN LEU 52 5.790 -8.091 21.064 108 H LEU 53 HN LEU 53 9.598 -6.664 23.125 109 H ASP 54 HN ASP 54 9.386 -2.393 22.534 110 H ILE 55 HN ILE 55 12.940 -1.087 24.038 111 H LEU 56 HN LEU 56 12.109 3.220 23.825 112 H ASP 57 HN ASP 57 16.317 4.660 24.407 113 H THR 58 HN THR 58 14.896 8.237 26.236 114 HG1 THR 58 HG1 THR 58 13.412 11.390 26.021 115 H ALA 59 HN ALA 59 17.039 11.966 24.758 116 H GLY 60 HN GLY 60 18.372 14.057 28.594 117 H GLN 61 HN GLN 61 18.960 16.324 28.825 118 HE21 GLN 61 HE21 GLN 61 20.208 21.829 31.300 119 HE22 GLN 61 HE22 GLN 61 21.740 21.467 32.026 120 H GLU 62 HN GLU 62 17.172 18.984 26.378 121 H GLU 63 HN GLU 63 17.948 19.844 22.152 122 H TYR 64 HN TYR 64 15.525 22.797 20.243 123 HH TYR 64 HH TYR 64 9.449 21.423 14.266 124 H SER 65 HN SER 65 14.590 19.148 18.020 125 HG SER 65 HG SER 65 17.941 19.489 18.364 126 H ALA 66 HN ALA 66 16.095 18.270 13.991 127 H MET 67 HN MET 67 16.430 15.366 14.320 128 H ARG 68 HN ARG 68 15.789 15.592 16.921 129 HE ARG 68 HE ARG 68 13.133 16.673 22.612 130 HH11 ARG 68 HH11 ARG 68 16.098 15.035 23.534 131 HH12 ARG 68 HH12 ARG 68 15.586 14.831 25.258 132 HH21 ARG 68 HH21 ARG 68 13.543 15.623 25.960 133 HH22 ARG 68 HH22 ARG 68 12.436 16.443 24.793 134 H ASP 69 HN ASP 69 13.059 15.934 16.933 135 H GLN 70 HN GLN 70 12.353 13.652 16.540 136 HE21 GLN 70 HE21 GLN 70 11.093 10.826 12.375 137 HE22 GLN 70 HE22 GLN 70 11.161 11.219 10.693 138 H TYR 71 HN TYR 71 12.915 11.918 17.396 139 HH TYR 71 HH TYR 71 16.917 13.318 22.780 140 H MET 72 HN MET 72 10.642 10.881 18.576 141 H ARG 73 HN ARG 73 9.149 9.980 18.059 142 HE ARG 73 HE ARG 73 7.532 14.274 16.160 143 HH11 ARG 73 HH11 ARG 73 4.424 16.351 14.576 144 HH12 ARG 73 HH12 ARG 73 4.569 14.582 14.265 145 HH21 ARG 73 HH21 ARG 73 7.385 16.533 16.568 146 HH22 ARG 73 HH22 ARG 73 5.986 17.435 15.858 147 H THR 74 HN THR 74 8.207 8.249 17.510 148 HG1 THR 74 HG1 THR 74 6.516 4.447 16.559 149 H GLY 75 HN GLY 75 6.806 7.565 19.505 150 H GLU 76 HN GLU 76 5.133 3.975 21.821 151 H GLY 77 HN GLY 77 4.649 4.257 23.983 152 H PHE 78 HN PHE 78 3.964 6.953 27.329 153 H LEU 79 HN LEU 79 7.830 6.565 29.148 154 H CYS 80 HN CYS 80 6.565 8.464 33.033 155 HG CYS 80 HG CYS 80 5.903 10.299 31.268 156 H VAL 81 HN VAL 81 10.512 9.759 33.626 157 H PHE 82 HN PHE 82 10.792 9.732 38.116 158 H ALA 83 HN ALA 83 13.296 12.746 40.108 159 H ILE 84 HN ILE 84 12.873 10.294 43.824 160 H ASN 85 HN ASN 85 14.422 12.110 44.854 161 HD21 ASN 85 HD21 ASN 85 16.078 10.178 45.997 162 HD22 ASN 85 HD22 ASN 85 16.968 10.134 44.516 163 H ASN 86 HN ASN 86 13.994 14.365 44.313 164 HD21 ASN 86 HD21 ASN 86 18.122 16.935 42.963 165 HD22 ASN 86 HD22 ASN 86 18.037 18.227 41.812 166 H THR 87 HN THR 87 13.705 18.119 44.643 167 HG1 THR 87 HG1 THR 87 11.033 18.745 46.184 168 H LYS 88 HN LYS 88 13.946 19.495 42.315 169 HZ1 LYS 88 HZ1 LYS 88 16.456 23.221 36.554 170 HZ2 LYS 88 HZ2 LYS 88 15.495 21.876 36.200 171 HZ3 LYS 88 HZ3 LYS 88 16.951 22.111 35.379 172 H SER 89 HN SER 89 13.942 17.583 40.284 173 HG SER 89 HG SER 89 15.493 16.524 39.523 174 H PHE 90 HN PHE 90 11.461 17.025 40.364 175 H GLU 91 HN GLU 91 10.057 18.880 39.595 176 H ASP 92 HN ASP 92 10.527 18.932 37.196 177 H ILE 93 HN ILE 93 8.769 17.368 36.112 178 H HIS 94 HN HIS 94 6.562 18.525 35.172 179 HD1 HIS 94 HD1 HIS 94 1.933 19.983 34.646 180 HE2 HIS 94 HE2 HIS 94 2.172 23.492 32.731 181 H HIS 95 HN HIS 95 7.439 19.717 33.045 182 HD1 HIS 95 HD1 HIS 95 11.506 20.238 31.212 183 HE2 HIS 95 HE2 HIS 95 11.211 21.750 27.510 184 H TYR 96 HN TYR 96 8.055 17.889 31.462 185 HH TYR 96 HH TYR 96 13.896 17.788 32.869 186 H ARG 97 HN ARG 97 5.913 16.599 30.810 187 HE ARG 97 HE ARG 97 0.231 13.457 31.173 188 HH11 ARG 97 HH11 ARG 97 -0.636 16.776 31.955 189 HH12 ARG 97 HH12 ARG 97 -2.406 16.431 31.899 190 HH21 ARG 97 HH21 ARG 97 -3.156 14.327 31.432 191 HH22 ARG 97 HH22 ARG 97 -1.984 12.997 31.106 192 H GLU 98 HN GLU 98 4.339 18.424 29.275 193 H GLN 99 HN GLN 99 5.874 18.326 27.054 194 HE21 GLN 99 HE21 GLN 99 9.800 19.918 23.835 195 HE22 GLN 99 HE22 GLN 99 11.393 19.544 24.386 196 H ILE 100 HN ILE 100 5.600 15.935 25.969 197 H LYS 101 HN LYS 101 3.096 16.109 25.307 198 HZ1 LYS 101 HZ1 LYS 101 -1.594 20.207 27.202 199 HZ2 LYS 101 HZ2 LYS 101 -0.464 19.481 28.240 200 HZ3 LYS 101 HZ3 LYS 101 -2.112 19.121 28.390 201 H ARG 102 HN ARG 102 3.297 17.415 23.016 202 HE ARG 102 HE ARG 102 6.395 20.624 21.530 203 HH11 ARG 102 HH11 ARG 102 7.468 18.860 18.035 204 HH12 ARG 102 HH12 ARG 102 5.955 19.851 18.120 205 HH21 ARG 102 HH21 ARG 102 8.773 18.602 19.893 206 HH22 ARG 102 HH22 ARG 102 8.292 19.383 21.459 207 H VAL 103 HN VAL 103 4.521 16.275 21.246 208 H LYS 104 HN LYS 104 2.880 14.254 20.726 209 HZ1 LYS 104 HZ1 LYS 104 3.322 8.756 17.398 210 HZ2 LYS 104 HZ2 LYS 104 2.167 9.888 16.891 211 HZ3 LYS 104 HZ3 LYS 104 1.706 8.290 17.195 212 H ASP 105 HN ASP 105 1.093 15.266 19.966 213 H SER 106 HN SER 106 -1.588 15.055 21.595 214 HG SER 106 HG SER 106 -2.910 12.851 19.578 215 H GLU 107 HN GLU 107 -5.618 14.079 22.801 216 H ASP 108 HN ASP 108 -5.082 12.365 24.014 217 H VAL 109 HN VAL 109 -2.941 10.942 26.942 218 H MET 111 HN MET 111 -0.150 7.447 30.240 219 H VAL 112 HN VAL 112 3.741 7.285 32.247 220 H LEU 113 HN LEU 113 2.715 7.506 36.413 221 H VAL 114 HN VAL 114 7.044 8.505 36.736 222 H GLY 115 HN GLY 115 7.725 6.666 40.380 223 H ASN 116 HN ASN 116 11.585 8.183 40.531 224 HD21 ASN 116 HD21 ASN 116 15.950 6.598 39.157 225 HD22 ASN 116 HD22 ASN 116 16.544 5.044 39.638 226 H LYS 117 HN LYS 117 14.569 5.400 42.539 227 HZ1 LYS 117 HZ1 LYS 117 20.121 10.044 39.981 228 HZ2 LYS 117 HZ2 LYS 117 20.748 9.750 41.524 229 HZ3 LYS 117 HZ3 LYS 117 19.433 10.793 41.333 230 H CYS 118 HN CYS 118 13.574 5.121 45.026 231 HG CYS 118 HG CYS 118 11.687 3.576 44.739 232 H ASP 119 HN ASP 119 15.248 4.768 46.742 233 H LEU 120 HN LEU 120 15.835 6.532 48.363 234 H SER 122 HN SER 122 17.699 10.587 51.297 235 HG SER 122 HG SER 122 19.541 13.104 50.577 236 H ARG 123 HN ARG 123 14.182 13.102 52.025 237 HE ARG 123 HE ARG 123 8.425 10.036 49.581 238 HH11 ARG 123 HH11 ARG 123 9.702 6.290 50.425 239 HH12 ARG 123 HH12 ARG 123 10.454 7.707 51.246 240 HH21 ARG 123 HH21 ARG 123 8.003 6.605 48.866 241 HH22 ARG 123 HH22 ARG 123 7.434 8.283 48.501 242 H THR 124 HN THR 124 12.876 14.371 48.610 243 HG1 THR 124 HG1 THR 124 13.864 16.720 46.768 244 H VAL 125 HN VAL 125 10.914 14.335 47.619 245 H ASP 126 HN ASP 126 6.638 15.125 48.245 246 H THR 127 HN THR 127 5.111 11.174 50.074 247 HG1 THR 127 HG1 THR 127 4.688 8.539 51.140 248 H LYS 128 HN LYS 128 2.475 11.634 49.737 249 HZ1 LYS 128 HZ1 LYS 128 -1.270 16.646 49.079 250 HZ2 LYS 128 HZ2 LYS 128 -2.922 16.943 48.846 251 HZ3 LYS 128 HZ3 LYS 128 -2.206 15.562 48.171 252 H GLN 129 HN GLN 129 2.624 13.809 48.164 253 HE21 GLN 129 HE21 GLN 129 4.404 17.650 49.873 254 HE22 GLN 129 HE22 GLN 129 6.077 17.923 49.511 255 H ALA 130 HN ALA 130 3.488 12.829 45.669 256 H GLN 131 HN GLN 131 1.531 11.108 45.030 257 HE21 GLN 131 HE21 GLN 131 0.771 6.272 46.316 258 HE22 GLN 131 HE22 GLN 131 -0.098 6.242 47.814 259 H ASP 132 HN ASP 132 -0.501 12.855 44.729 260 H LEU 133 HN LEU 133 0.054 14.306 42.528 261 H ALA 134 HN ALA 134 -0.008 12.452 40.710 262 H ARG 135 HN ARG 135 -2.595 11.634 40.688 263 HE ARG 135 HE ARG 135 -9.105 10.805 40.247 264 HH11 ARG 135 HH11 ARG 135 -9.197 7.366 42.387 265 HH12 ARG 135 HH12 ARG 135 -7.610 8.075 41.899 266 HH21 ARG 135 HH21 ARG 135 -11.159 8.402 41.791 267 HH22 ARG 135 HH22 ARG 135 -11.124 9.940 40.845 268 H SER 136 HN SER 136 -3.769 13.905 39.819 269 HG SER 136 HG SER 136 -4.020 18.188 38.686 270 H TYR 137 HN TYR 137 -2.868 14.043 37.246 271 HH TYR 137 HH TYR 137 1.002 19.175 36.441 272 H GLY 138 HN GLY 138 -4.112 12.111 36.355 273 H ILE 139 HN ILE 139 -2.890 10.195 36.086 274 H PHE 141 HN PHE 141 -0.055 5.573 39.861 275 H ILE 142 HN ILE 142 4.243 5.255 39.548 276 H GLU 143 HN GLU 143 5.436 3.022 43.040 277 H THR 144 HN THR 144 9.676 4.446 42.331 278 HG1 THR 144 HG1 THR 144 10.707 4.798 40.886 279 H SER 145 HN SER 145 12.606 1.107 41.822 280 HG SER 145 HG SER 145 15.787 2.264 45.107 281 H ALA 146 HN ALA 146 16.174 2.555 41.560 282 H LYS 147 HN LYS 147 17.627 1.182 43.137 283 HZ1 LYS 147 HZ1 LYS 147 21.197 3.180 48.382 284 HZ2 LYS 147 HZ2 LYS 147 22.803 3.147 47.857 285 HZ3 LYS 147 HZ3 LYS 147 22.218 1.916 48.851 286 H THR 148 HN THR 148 16.760 -0.418 45.064 287 HG1 THR 148 HG1 THR 148 15.387 -0.340 47.927 288 H ARG 149 HN ARG 149 16.094 -1.990 43.086 289 HE ARG 149 HE ARG 149 16.206 -6.494 38.052 290 HH11 ARG 149 HH11 ARG 149 13.256 -6.652 39.951 291 HH12 ARG 149 HH12 ARG 149 12.174 -6.737 38.504 292 HH21 ARG 149 HH21 ARG 149 13.068 -6.703 36.393 293 HH22 ARG 149 HH22 ARG 149 14.866 -6.577 36.163 294 H GLN 150 HN GLN 150 13.423 -1.660 43.362 295 HE21 GLN 150 HE21 GLN 150 8.854 0.624 44.851 296 HE22 GLN 150 HE22 GLN 150 8.834 1.340 46.427 297 H GLY 151 HN GLY 151 9.362 -2.934 42.098 298 H VAL 152 HN VAL 152 10.992 -2.304 40.088 299 H ASP 153 HN ASP 153 10.291 -4.131 37.911 300 H ASP 154 HN ASP 154 8.020 -3.445 38.141 301 H ALA 155 HN ALA 155 7.464 -0.834 37.319 302 H PHE 156 HN PHE 156 7.798 -0.970 34.496 303 H TYR 157 HN TYR 157 5.973 -2.862 33.868 304 HH TYR 157 HH TYR 157 7.972 -9.204 32.657 305 H THR 158 HN THR 158 3.789 -1.481 34.429 306 HG1 THR 158 HG1 THR 158 3.140 -0.919 36.533 307 H LEU 159 HN LEU 159 3.565 0.363 32.622 308 H VAL 160 HN VAL 160 3.065 -1.066 30.360 309 H ARG 161 HN ARG 161 0.494 -1.758 30.909 310 HE ARG 161 HE ARG 161 -1.569 -6.121 33.537 311 HH11 ARG 161 HH11 ARG 161 1.398 -5.268 36.176 312 HH12 ARG 161 HH12 ARG 161 0.464 -3.930 35.405 313 HH21 ARG 161 HH21 ARG 161 -0.385 -7.841 34.417 314 HH22 ARG 161 HH22 ARG 161 0.910 -7.473 35.627 315 H GLU 162 HN GLU 162 -0.747 0.426 30.547 316 H ILE 163 HN ILE 163 -0.650 0.992 28.119 317 H ARG 164 HN ARG 164 -1.954 -0.928 27.067 318 HE ARG 164 HE ARG 164 -0.913 -6.035 25.507 319 HH11 ARG 164 HH11 ARG 164 -1.794 -6.964 28.795 320 HH12 ARG 164 HH12 ARG 164 -0.737 -8.425 28.778 321 HH21 ARG 164 HH21 ARG 164 0.459 -7.889 25.484 322 HH22 ARG 164 HH22 ARG 164 0.505 -8.937 26.951 323 H LYS 165 HN LYS 165 -4.505 -0.290 27.707 324 HZ1 LYS 165 HZ1 LYS 165 -4.205 0.517 32.538 325 HZ2 LYS 165 HZ2 LYS 165 -4.577 -0.483 31.214 326 HZ3 LYS 165 HZ3 LYS 165 -5.279 -0.789 32.719 327 H HIS 166 HN HIS 166 -4.809 1.730 26.421 328 HD1 HIS 166 HD1 HIS 166 -3.723 4.345 22.353 329 HE2 HIS 166 HE2 HIS 166 -4.352 8.102 23.546 330 H LYS 167 HN LYS 167 -4.774 1.129 23.838 331 HZ1 LYS 167 HZ1 LYS 167 0.924 -0.507 19.872 332 HZ2 LYS 167 HZ2 LYS 167 -0.437 -1.256 19.190 333 HZ3 LYS 167 HZ3 LYS 167 0.177 -1.817 20.659 334 H GLU 168 HN GLU 168 -6.988 -0.330 23.659 335 H LYS 169 HN LYS 169 -8.788 1.505 24.055 336 HZ1 LYS 169 HZ1 LYS 169 -10.643 8.336 26.815 337 HZ2 LYS 169 HZ2 LYS 169 -9.056 8.036 26.316 338 HZ3 LYS 169 HZ3 LYS 169 -10.047 6.754 26.809 339 H MET 170 HN MET 170 -8.742 2.790 21.789 340 H SER 171 HN SER 171 -9.842 1.154 20.176 341 HG SER 171 HG SER 171 -8.883 -0.543 18.594 342 H LYS 172 HN LYS 172 -12.397 1.233 20.662 343 HZ1 LYS 172 HZ1 LYS 172 -14.823 -2.799 24.967 344 HZ2 LYS 172 HZ2 LYS 172 -15.154 -1.435 25.918 345 HZ3 LYS 172 HZ3 LYS 172 -13.568 -2.019 25.793 346 H ASP 173 HN ASP 173 -12.937 3.268 19.565 347 H GLY 174 HN GLY 174 -14.025 4.216 21.869 348 H LYS 175 HN LYS 175 -16.239 7.278 21.917 349 HZ1 LYS 175 HZ1 LYS 175 -20.692 6.604 27.695 350 HZ2 LYS 175 HZ2 LYS 175 -19.406 5.819 28.474 351 HZ3 LYS 175 HZ3 LYS 175 -19.901 5.309 26.944 352 H LYS 176 HN LYS 176 -20.604 7.659 21.978 353 HZ1 LYS 176 HZ1 LYS 176 -17.862 5.002 18.828 354 HZ2 LYS 176 HZ2 LYS 176 -17.531 3.411 19.298 355 HZ3 LYS 176 HZ3 LYS 176 -18.546 4.376 20.239 356 H LYS 177 HN LYS 177 -20.428 9.126 17.993 357 HZ1 LYS 177 HZ1 LYS 177 -16.775 14.077 18.642 358 HZ2 LYS 177 HZ2 LYS 177 -17.302 15.131 17.432 359 HZ3 LYS 177 HZ3 LYS 177 -17.249 13.466 17.140 360 H LYS 178 HN LYS 178 -23.902 11.302 19.328 361 HZ1 LYS 178 HZ1 LYS 178 -23.829 9.232 21.614 362 HZ2 LYS 178 HZ2 LYS 178 -23.823 7.803 22.516 363 HZ3 LYS 178 HZ3 LYS 178 -24.684 9.143 23.071 364 H LYS 179 HN LYS 179 -24.669 13.040 18.841 365 HZ1 LYS 179 HZ1 LYS 179 -23.718 17.631 13.055 366 HZ2 LYS 179 HZ2 LYS 179 -24.123 16.145 12.362 367 HZ3 LYS 179 HZ3 LYS 179 -22.497 16.592 12.507 368 H LYS 180 HN LYS 180 -26.663 14.589 20.821 369 HZ1 LYS 180 HZ1 LYS 180 -33.408 14.689 22.094 370 HZ2 LYS 180 HZ2 LYS 180 -32.420 15.691 23.032 371 HZ3 LYS 180 HZ3 LYS 180 -33.862 15.082 23.675 372 H SER 181 HN SER 181 -30.973 15.600 20.288 373 HG SER 181 HG SER 181 -31.094 17.243 23.885 374 H LYS 182 HN LYS 182 -32.015 19.895 20.027 375 HZ1 LYS 182 HZ1 LYS 182 -30.661 21.993 11.723 376 HZ2 LYS 182 HZ2 LYS 182 -32.191 22.383 12.322 377 HZ3 LYS 182 HZ3 LYS 182 -31.604 20.804 12.473 378 H THR 183 HN THR 183 -33.122 21.347 18.829 379 HG1 THR 183 HG1 THR 183 -33.470 23.585 16.920 380 H LYS 184 HN LYS 184 -33.446 25.130 21.254 381 HZ1 LYS 184 HZ1 LYS 184 -37.428 27.535 25.314 382 HZ2 LYS 184 HZ2 LYS 184 -39.049 27.897 25.021 383 HZ3 LYS 184 HZ3 LYS 184 -38.060 27.382 23.751 384 H CYS 185 HN CYS 185 -31.818 23.752 22.874 385 HG CYS 185 HG CYS 185 -28.229 20.201 23.499 386 HE21 GLN 418 HE21 GLN 418 9.052 38.271 -14.358 387 HE22 GLN 418 HE22 GLN 418 10.221 37.161 -13.744 388 HE21 GLN 424 HE21 GLN 424 19.128 43.119 -20.421 389 HE22 GLN 424 HE22 GLN 424 17.978 44.327 -20.874 390 HE21 GLN 439 HE21 GLN 439 37.722 32.252 -15.345 391 HE22 GLN 439 HE22 GLN 439 36.678 33.180 -16.362 392 HE21 GLN 453 HE21 GLN 453 50.685 11.124 -19.706 393 HE22 GLN 453 HE22 GLN 453 50.857 12.418 -20.838 394 HE21 GLN 460 HE21 GLN 460 51.146 0.572 -18.054 395 HE22 GLN 460 HE22 GLN 460 51.021 0.904 -19.745 396 HE21 GLN 464 HE21 GLN 464 53.109 -3.755 -15.606 397 HE22 GLN 464 HE22 GLN 464 53.701 -3.768 -17.228 398 HE21 GLN 472 HE21 GLN 472 54.045 -15.728 -7.639 399 HE22 GLN 472 HE22 GLN 472 55.294 -14.544 -7.515 400 HE21 GLN 482 HE21 GLN 482 45.157 -28.822 -11.970 401 HE22 GLN 482 HE22 GLN 482 45.358 -28.459 -13.649 402 HE21 GLN 487 HE21 GLN 487 43.275 -36.955 -1.545 403 HE22 GLN 487 HE22 GLN 487 44.706 -36.401 -0.744 404 HE21 GLN 493 HE21 GLN 493 35.419 -44.761 -9.730 405 HE22 GLN 493 HE22 GLN 493 36.990 -44.266 -10.262 406 HE21 GLN 527 HE21 GLN 527 -10.867 -54.793 3.530 407 HE22 GLN 527 HE22 GLN 527 -9.415 -55.721 3.401 408 HAC EWS 237 HAC DRG 203 12.917 8.278 17.692 409 HAD EWS 237 HAD DRG 203 11.737 6.570 15.557 410 HAE EWS 237 HAE DRG 203 11.438 8.326 15.952 411 HAF EWS 237 HAF DRG 203 14.767 6.772 17.982 412 HAG EWS 237 HAG DRG 203 14.308 5.887 16.444 413 HAI EWS 237 HAI DRG 203 15.491 8.591 16.932 414 HAH EWS 237 HAH DRG 203 15.879 7.382 15.631 415 HAJ EWS 237 HAJ DRG 203 13.520 6.993 14.270 416 HAL EWS 237 HAL DRG 203 11.582 7.992 13.271 417 HAK EWS 237 HAK DRG 203 11.977 9.598 14.026 418 HAM EWS 237 HAM DRG 203 12.969 7.005 11.602 419 HAN EWS 237 HAN DRG 203 13.534 11.033 13.174 420 HAO EWS 237 HAO DRG 203 14.958 11.593 11.194 421 HAP EWS 237 HAP DRG 203 14.403 7.569 9.636 422 HAQ EWS 237 HAQ DRG 203 12.434 3.617 17.875 423 HAS EWS 237 HAS DRG 203 9.711 0.505 19.255 424 HAT EWS 237 HAT DRG 203 8.974 2.044 21.097 425 HAX EWS 237 HAX DRG 203 10.863 6.566 21.563 426 HAA EWS 237 HAA DRG 203 11.316 5.908 17.576 427 HAZ EWS 237 HAZ DRG 203 13.949 9.497 15.713 428 HAW EWS 237 HAW DRG 203 9.403 4.537 22.084 429 HAY EWS 237 HAY DRG 203 14.870 8.973 14.480 Start of MODEL 2 1 HE21 GLN 220 HE21 GLN 220 -50.214 -19.998 7.395 2 HE22 GLN 220 HE22 GLN 220 -51.708 -20.408 8.156 3 HE21 GLN 226 HE21 GLN 226 -48.270 -30.171 18.271 4 HE22 GLN 226 HE22 GLN 226 -49.786 -29.438 18.660 5 HE21 GLN 241 HE21 GLN 241 -34.685 -49.869 17.941 6 HE22 GLN 241 HE22 GLN 241 -36.364 -49.928 17.530 7 HE21 GLN 255 HE21 GLN 255 -12.957 -56.760 26.097 8 HE22 GLN 255 HE22 GLN 255 -14.120 -57.119 27.323 9 HE21 GLN 262 HE21 GLN 262 -4.109 -53.912 24.819 10 HE22 GLN 262 HE22 GLN 262 -5.407 -53.185 25.697 11 HE21 GLN 266 HE21 GLN 266 2.676 -57.683 24.072 12 HE22 GLN 266 HE22 GLN 266 1.663 -58.289 25.332 13 HE21 GLN 274 HE21 GLN 274 14.801 -58.460 15.948 14 HE22 GLN 274 HE22 GLN 274 13.739 -59.821 15.815 15 HE21 GLN 284 HE21 GLN 284 27.439 -45.685 19.442 16 HE22 GLN 284 HE22 GLN 284 26.605 -45.739 20.955 17 HE21 GLN 289 HE21 GLN 289 36.406 -45.719 8.570 18 HE22 GLN 289 HE22 GLN 289 36.178 -46.656 7.128 19 HE21 GLN 295 HE21 GLN 295 34.822 -37.795 13.930 20 HE22 GLN 295 HE22 GLN 295 34.586 -37.184 15.528 21 HE21 GLN 329 HE21 GLN 329 45.820 6.746 -8.903 22 HE22 GLN 329 HE22 GLN 329 47.422 7.078 -9.473 23 H MET 1 HT1 MET 1 3.605 -13.220 17.396 24 H THR 2 HN THR 2 3.081 -9.867 20.462 25 HG1 THR 2 HG1 THR 2 0.587 -9.718 21.299 26 H GLU 3 HN GLU 3 3.168 -6.053 18.377 27 H TYR 4 HN TYR 4 5.938 -4.043 21.369 28 HH TYR 4 HH TYR 4 -1.402 -4.663 23.331 29 H LYS 5 HN LYS 5 4.600 0.059 21.804 30 HZ1 LYS 5 HZ1 LYS 5 8.055 0.631 16.744 31 HZ2 LYS 5 HZ2 LYS 5 6.991 -0.158 15.693 32 HZ3 LYS 5 HZ3 LYS 5 6.958 -0.517 17.344 33 H LEU 6 HN LEU 6 8.412 1.024 23.582 34 H VAL 7 HN VAL 7 7.989 4.666 26.079 35 H VAL 8 HN VAL 8 12.146 5.748 26.988 36 H VAL 9 HN VAL 9 11.075 8.567 30.117 37 H GLY 10 HN GLY 10 13.939 11.937 30.672 38 H ALA 11 HN ALA 11 15.409 12.294 34.690 39 H VAL 12 HN VAL 12 19.292 14.469 34.188 40 H GLY 13 HN GLY 13 20.116 13.186 35.889 41 H VAL 14 HN VAL 14 19.069 10.997 36.113 42 H GLY 15 HN GLY 15 18.350 6.671 37.564 43 H LYS 16 HN LYS 16 18.789 6.942 34.085 44 HZ1 LYS 16 HZ1 LYS 16 16.508 9.228 27.710 45 HZ2 LYS 16 HZ2 LYS 16 15.188 8.373 28.353 46 HZ3 LYS 16 HZ3 LYS 16 16.713 7.628 28.237 47 H SER 17 HN SER 17 19.973 5.375 31.993 48 HG SER 17 HG SER 17 21.544 5.758 29.595 49 H ALA 18 HN ALA 18 20.499 3.487 33.498 50 H LEU 19 HN LEU 19 18.224 2.114 34.163 51 H THR 20 HN THR 20 17.270 1.036 31.866 52 HG1 THR 20 HG1 THR 20 15.952 1.974 29.041 53 H ILE 21 HN ILE 21 19.423 -0.506 30.982 54 H GLN 22 HN GLN 22 19.310 -2.313 32.892 55 HE21 GLN 22 HE21 GLN 22 19.145 -6.879 35.374 56 HE22 GLN 22 HE22 GLN 22 20.637 -7.284 36.154 57 H LEU 23 HN LEU 23 17.198 -3.593 32.493 58 H ILE 24 HN ILE 24 17.439 -4.702 30.319 59 H GLN 25 HN GLN 25 19.747 -5.620 29.109 60 HE21 GLN 25 HE21 GLN 25 22.706 -3.559 27.473 61 HE22 GLN 25 HE22 GLN 25 24.349 -3.534 26.937 62 H ASN 26 HN ASN 26 19.643 -6.938 31.284 63 HD21 ASN 26 HD21 ASN 26 18.907 -11.658 32.241 64 HD22 ASN 26 HD22 ASN 26 17.432 -11.428 33.114 65 H HIS 27 HN HIS 27 21.770 -6.011 32.461 66 HD1 HIS 27 HD1 HIS 27 26.747 -6.693 34.226 67 HE2 HIS 27 HE2 HIS 27 28.168 -3.200 32.888 68 H PHE 28 HN PHE 28 24.312 -5.172 35.864 69 H VAL 29 HN VAL 29 23.813 -0.733 35.205 70 H ASP 30 HN ASP 30 27.892 0.172 36.189 71 H GLU 31 HN GLU 31 28.449 1.967 35.186 72 H TYR 32 HN TYR 32 29.476 6.353 34.269 73 HH TYR 32 HH TYR 32 25.070 13.008 31.374 74 H ASP 33 HN ASP 33 25.747 6.665 31.972 75 H THR 35 HN THR 35 23.155 8.971 27.847 76 HG1 THR 35 HG1 THR 35 23.373 6.650 27.278 77 H ILE 36 HN ILE 36 22.743 9.150 23.319 78 H GLU 37 HN GLU 37 21.830 8.438 22.000 79 H ASP 38 HN ASP 38 18.561 5.978 21.497 80 H SER 39 HN SER 39 19.176 1.736 21.635 81 HG SER 39 HG SER 39 17.894 2.603 19.723 82 H TYR 40 HN TYR 40 15.925 -0.309 23.172 83 HH TYR 40 HH TYR 40 23.391 -2.158 24.465 84 H ARG 41 HN ARG 41 16.754 -4.469 21.957 85 HE ARG 41 HE ARG 41 15.238 -6.215 17.782 86 HH11 ARG 41 HH11 ARG 41 13.006 -5.433 14.492 87 HH12 ARG 41 HH12 ARG 41 12.281 -5.321 16.140 88 HH21 ARG 41 HH21 ARG 41 15.247 -5.992 14.254 89 HH22 ARG 41 HH22 ARG 41 16.235 -6.346 15.721 90 H LYS 42 HN LYS 42 12.835 -6.094 23.079 91 HZ1 LYS 42 HZ1 LYS 42 15.629 -8.863 30.223 92 HZ2 LYS 42 HZ2 LYS 42 16.808 -9.494 29.175 93 HZ3 LYS 42 HZ3 LYS 42 15.897 -10.537 30.145 94 H GLN 43 HN GLN 43 12.669 -10.283 23.871 95 HE21 GLN 43 HE21 GLN 43 10.810 -12.552 20.864 96 HE22 GLN 43 HE22 GLN 43 10.053 -13.946 20.182 97 H VAL 44 HN VAL 44 8.378 -9.887 25.203 98 H VAL 45 HN VAL 45 7.362 -12.061 28.942 99 H ILE 46 HN ILE 46 3.555 -10.766 28.045 100 H ASP 47 HN ASP 47 1.565 -10.771 31.902 101 H GLY 48 HN GLY 48 0.974 -13.152 30.688 102 H GLU 49 HN GLU 49 0.507 -12.394 28.149 103 H THR 50 HN THR 50 1.873 -13.720 24.119 104 HG1 THR 50 HG1 THR 50 3.364 -15.708 23.342 105 H CYS 51 HN CYS 51 5.096 -10.799 24.898 106 HG CYS 51 HG CYS 51 2.651 -9.976 25.712 107 H LEU 52 HN LEU 52 5.620 -7.748 21.718 108 H LEU 53 HN LEU 53 9.744 -6.720 23.156 109 H ASP 54 HN ASP 54 9.570 -2.367 22.865 110 H ILE 55 HN ILE 55 13.244 -0.958 23.657 111 H LEU 56 HN LEU 56 12.267 3.289 23.558 112 H ASP 57 HN ASP 57 16.518 4.712 23.546 113 H THR 58 HN THR 58 15.247 8.012 25.564 114 HG1 THR 58 HG1 THR 58 13.156 9.945 25.656 115 H ALA 59 HN ALA 59 17.554 11.592 23.837 116 H GLY 60 HN GLY 60 19.536 13.087 27.746 117 H GLN 61 HN GLN 61 19.981 15.719 28.544 118 HE21 GLN 61 HE21 GLN 61 21.785 17.548 32.531 119 HE22 GLN 61 HE22 GLN 61 23.136 18.625 32.502 120 H GLU 62 HN GLU 62 17.279 18.337 26.843 121 H GLU 63 HN GLU 63 17.597 20.621 23.204 122 H TYR 64 HN TYR 64 14.934 22.748 21.392 123 HH TYR 64 HH TYR 64 9.402 21.895 14.858 124 H SER 65 HN SER 65 13.625 19.331 18.819 125 HG SER 65 HG SER 65 16.660 17.298 19.431 126 H ALA 66 HN ALA 66 15.194 19.182 14.833 127 H MET 67 HN MET 67 15.678 16.571 14.929 128 H ARG 68 HN ARG 68 14.896 15.546 17.306 129 HE ARG 68 HE ARG 68 12.641 15.292 23.671 130 HH11 ARG 68 HH11 ARG 68 16.123 15.086 23.093 131 HH12 ARG 68 HH12 ARG 68 16.451 14.397 24.737 132 HH21 ARG 68 HH21 ARG 68 14.744 14.018 26.205 133 HH22 ARG 68 HH22 ARG 68 13.042 14.399 25.744 134 H ASP 69 HN ASP 69 12.269 16.043 17.210 135 H GLN 70 HN GLN 70 11.671 14.261 15.485 136 HE21 GLN 70 HE21 GLN 70 12.992 9.397 11.950 137 HE22 GLN 70 HE22 GLN 70 14.325 10.059 11.073 138 H TYR 71 HN TYR 71 12.315 11.608 15.929 139 HH TYR 71 HH TYR 71 16.060 13.134 20.452 140 H MET 72 HN MET 72 10.681 11.296 18.257 141 H ARG 73 HN ARG 73 8.383 10.535 17.038 142 HE ARG 73 HE ARG 73 4.133 13.542 16.031 143 HH11 ARG 73 HH11 ARG 73 7.224 15.401 14.220 144 HH12 ARG 73 HH12 ARG 73 6.602 13.848 13.544 145 HH21 ARG 73 HH21 ARG 73 6.315 16.313 16.083 146 HH22 ARG 73 HH22 ARG 73 4.935 15.491 16.926 147 H THR 74 HN THR 74 7.693 8.141 16.928 148 HG1 THR 74 HG1 THR 74 9.337 6.505 16.520 149 H GLY 75 HN GLY 75 7.243 7.169 19.091 150 H GLU 76 HN GLU 76 5.047 4.264 21.956 151 H GLY 77 HN GLY 77 4.382 3.871 24.034 152 H PHE 78 HN PHE 78 3.849 6.771 27.352 153 H LEU 79 HN LEU 79 7.795 6.763 29.165 154 H CYS 80 HN CYS 80 6.348 8.333 33.128 155 HG CYS 80 HG CYS 80 5.097 12.025 31.827 156 H VAL 81 HN VAL 81 10.055 9.502 33.559 157 H PHE 82 HN PHE 82 10.591 9.563 38.041 158 H ALA 83 HN ALA 83 13.351 12.398 39.901 159 H ILE 84 HN ILE 84 12.585 10.085 43.665 160 H ASN 85 HN ASN 85 14.215 11.780 44.720 161 HD21 ASN 85 HD21 ASN 85 18.191 13.106 45.383 162 HD22 ASN 85 HD22 ASN 85 18.319 12.096 43.987 163 H ASN 86 HN ASN 86 13.986 13.998 44.142 164 HD21 ASN 86 HD21 ASN 86 18.190 16.269 43.010 165 HD22 ASN 86 HD22 ASN 86 18.315 17.572 41.879 166 H THR 87 HN THR 87 14.083 17.978 44.342 167 HG1 THR 87 HG1 THR 87 11.292 18.706 46.045 168 H LYS 88 HN LYS 88 14.353 18.869 41.954 169 HZ1 LYS 88 HZ1 LYS 88 15.731 21.670 34.722 170 HZ2 LYS 88 HZ2 LYS 88 15.043 21.791 36.260 171 HZ3 LYS 88 HZ3 LYS 88 14.402 20.700 35.135 172 H SER 89 HN SER 89 13.993 17.088 39.860 173 HG SER 89 HG SER 89 15.358 14.560 38.755 174 H PHE 90 HN PHE 90 11.498 16.754 40.387 175 H GLU 91 HN GLU 91 10.036 18.908 39.802 176 H ASP 92 HN ASP 92 10.366 18.609 37.377 177 H ILE 93 HN ILE 93 8.486 17.283 36.452 178 H HIS 94 HN HIS 94 6.430 18.542 35.464 179 HD1 HIS 94 HD1 HIS 94 2.706 21.264 36.317 180 HE2 HIS 94 HE2 HIS 94 1.471 22.805 32.835 181 H HIS 95 HN HIS 95 7.371 19.828 33.341 182 HD1 HIS 95 HD1 HIS 95 11.523 19.573 31.352 183 HE2 HIS 95 HE2 HIS 95 11.302 21.037 27.621 184 H TYR 96 HN TYR 96 8.084 17.712 31.863 185 HH TYR 96 HH TYR 96 14.696 15.272 31.854 186 H ARG 97 HN ARG 97 5.757 16.508 31.269 187 HE ARG 97 HE ARG 97 0.602 12.991 30.928 188 HH11 ARG 97 HH11 ARG 97 -1.260 15.880 31.702 189 HH12 ARG 97 HH12 ARG 97 -2.824 15.136 31.193 190 HH21 ARG 97 HH21 ARG 97 -1.373 12.024 30.252 191 HH22 ARG 97 HH22 ARG 97 -2.884 12.996 30.386 192 H GLU 98 HN GLU 98 4.280 18.250 29.678 193 H GLN 99 HN GLN 99 5.846 18.022 27.514 194 HE21 GLN 99 HE21 GLN 99 9.458 16.399 26.893 195 HE22 GLN 99 HE22 GLN 99 11.155 16.274 26.601 196 H ILE 100 HN ILE 100 5.457 15.652 26.429 197 H LYS 101 HN LYS 101 2.848 15.766 25.700 198 HZ1 LYS 101 HZ1 LYS 101 -0.247 19.312 28.572 199 HZ2 LYS 101 HZ2 LYS 101 -1.924 19.119 28.695 200 HZ3 LYS 101 HZ3 LYS 101 -1.281 20.187 27.553 201 H ARG 102 HN ARG 102 3.076 17.643 23.749 202 HE ARG 102 HE ARG 102 6.109 22.483 19.888 203 HH11 ARG 102 HH11 ARG 102 7.468 18.975 18.347 204 HH12 ARG 102 HH12 ARG 102 6.638 19.025 19.952 205 HH21 ARG 102 HH21 ARG 102 7.193 22.499 17.846 206 HH22 ARG 102 HH22 ARG 102 7.765 20.930 17.166 207 H VAL 103 HN VAL 103 4.637 16.520 21.705 208 H LYS 104 HN LYS 104 3.006 14.609 21.035 209 HZ1 LYS 104 HZ1 LYS 104 2.768 8.959 18.202 210 HZ2 LYS 104 HZ2 LYS 104 1.640 7.883 18.858 211 HZ3 LYS 104 HZ3 LYS 104 3.242 7.848 19.394 212 H ASP 105 HN ASP 105 1.170 15.616 19.967 213 H SER 106 HN SER 106 -0.929 15.037 21.348 214 HG SER 106 HG SER 106 -4.190 11.763 22.573 215 H GLU 107 HN GLU 107 -4.622 14.846 23.461 216 H ASP 108 HN ASP 108 -3.936 12.702 24.485 217 H VAL 109 HN VAL 109 -2.130 11.674 25.627 218 H MET 111 HN MET 111 -0.309 7.638 30.131 219 H VAL 112 HN VAL 112 3.646 7.347 32.037 220 H LEU 113 HN LEU 113 2.607 7.664 36.164 221 H VAL 114 HN VAL 114 6.971 8.468 36.752 222 H GLY 115 HN GLY 115 7.484 6.763 40.460 223 H ASN 116 HN ASN 116 11.470 8.080 40.606 224 HD21 ASN 116 HD21 ASN 116 12.565 4.157 39.237 225 HD22 ASN 116 HD22 ASN 116 13.877 3.081 39.557 226 H LYS 117 HN LYS 117 14.239 5.186 42.774 227 HZ1 LYS 117 HZ1 LYS 117 20.682 9.217 41.153 228 HZ2 LYS 117 HZ2 LYS 117 20.262 9.818 42.670 229 HZ3 LYS 117 HZ3 LYS 117 19.308 10.189 41.325 230 H CYS 118 HN CYS 118 12.995 4.958 45.071 231 HG CYS 118 HG CYS 118 10.198 2.431 46.216 232 H ASP 119 HN ASP 119 14.351 4.188 47.097 233 H LEU 120 HN LEU 120 15.247 6.178 48.390 234 H SER 122 HN SER 122 17.482 10.074 51.123 235 HG SER 122 HG SER 122 19.962 12.830 51.032 236 H ARG 123 HN ARG 123 14.514 11.258 51.623 237 HE ARG 123 HE ARG 123 9.767 8.670 51.091 238 HH11 ARG 123 HH11 ARG 123 7.291 9.471 47.988 239 HH12 ARG 123 HH12 ARG 123 8.126 10.827 48.836 240 HH21 ARG 123 HH21 ARG 123 7.620 7.292 48.656 241 HH22 ARG 123 HH22 ARG 123 8.725 6.934 50.050 242 H THR 124 HN THR 124 12.699 13.802 48.377 243 HG1 THR 124 HG1 THR 124 12.959 16.510 46.441 244 H VAL 125 HN VAL 125 10.890 14.138 47.622 245 H ASP 126 HN ASP 126 6.635 14.964 48.577 246 H THR 127 HN THR 127 5.102 10.716 49.460 247 HG1 THR 127 HG1 THR 127 5.340 7.841 48.554 248 H LYS 128 HN LYS 128 2.592 11.769 49.238 249 HZ1 LYS 128 HZ1 LYS 128 -2.459 15.725 52.681 250 HZ2 LYS 128 HZ2 LYS 128 -3.507 14.397 52.624 251 HZ3 LYS 128 HZ3 LYS 128 -4.022 15.904 52.052 252 H GLN 129 HN GLN 129 2.798 14.004 47.825 253 HE21 GLN 129 HE21 GLN 129 4.223 19.006 47.733 254 HE22 GLN 129 HE22 GLN 129 5.879 19.064 48.232 255 H ALA 130 HN ALA 130 3.429 13.150 45.412 256 H GLN 131 HN GLN 131 1.535 11.595 44.693 257 HE21 GLN 131 HE21 GLN 131 -2.499 8.901 45.467 258 HE22 GLN 131 HE22 GLN 131 -2.511 7.699 46.711 259 H ASP 132 HN ASP 132 -0.563 13.344 44.512 260 H LEU 133 HN LEU 133 0.094 14.764 42.343 261 H ALA 134 HN ALA 134 0.106 12.984 40.399 262 H ARG 135 HN ARG 135 -2.436 12.469 40.393 263 HE ARG 135 HE ARG 135 -8.786 11.487 40.525 264 HH11 ARG 135 HH11 ARG 135 -7.211 8.361 40.903 265 HH12 ARG 135 HH12 ARG 135 -8.736 7.428 40.659 266 HH21 ARG 135 HH21 ARG 135 -10.702 8.525 40.253 267 HH22 ARG 135 HH22 ARG 135 -10.745 10.330 40.184 268 H SER 136 HN SER 136 -3.685 14.640 39.292 269 HG SER 136 HG SER 136 -2.518 16.150 38.333 270 H TYR 137 HN TYR 137 -3.180 13.926 36.853 271 HH TYR 137 HH TYR 137 0.809 19.357 35.711 272 H GLY 138 HN GLY 138 -4.631 12.483 36.028 273 H ILE 139 HN ILE 139 -2.990 10.590 35.647 274 H PHE 141 HN PHE 141 -0.103 5.849 39.808 275 H ILE 142 HN ILE 142 4.155 5.438 39.769 276 H GLU 143 HN GLU 143 5.197 3.494 43.532 277 H THR 144 HN THR 144 9.536 4.542 42.646 278 HG1 THR 144 HG1 THR 144 10.146 4.643 40.831 279 H SER 145 HN SER 145 12.316 1.143 42.033 280 HG SER 145 HG SER 145 15.786 1.992 45.392 281 H ALA 146 HN ALA 146 16.184 2.776 41.847 282 H LYS 147 HN LYS 147 17.168 1.016 43.175 283 HZ1 LYS 147 HZ1 LYS 147 23.508 0.129 46.255 284 HZ2 LYS 147 HZ2 LYS 147 23.497 1.622 45.468 285 HZ3 LYS 147 HZ3 LYS 147 22.667 0.310 44.799 286 H THR 148 HN THR 148 16.570 -0.569 44.926 287 HG1 THR 148 HG1 THR 148 14.846 -0.575 47.471 288 H ARG 149 HN ARG 149 15.591 -1.682 43.032 289 HE ARG 149 HE ARG 149 12.591 -6.209 38.442 290 HH11 ARG 149 HH11 ARG 149 15.913 -7.823 36.774 291 HH12 ARG 149 HH12 ARG 149 16.005 -7.083 38.416 292 HH21 ARG 149 HH21 ARG 149 12.427 -7.119 36.355 293 HH22 ARG 149 HH22 ARG 149 13.917 -7.834 35.609 294 H GLN 150 HN GLN 150 12.727 -1.089 43.045 295 HE21 GLN 150 HE21 GLN 150 9.980 -1.132 47.964 296 HE22 GLN 150 HE22 GLN 150 9.623 0.464 48.527 297 H GLY 151 HN GLY 151 8.852 -3.042 42.619 298 H VAL 152 HN VAL 152 10.195 -2.144 40.303 299 H ASP 153 HN ASP 153 9.653 -3.858 38.391 300 H ASP 154 HN ASP 154 7.165 -3.552 38.425 301 H ALA 155 HN ALA 155 6.641 -1.187 37.488 302 H PHE 156 HN PHE 156 7.281 -1.303 34.820 303 H TYR 157 HN TYR 157 5.405 -3.013 34.148 304 HH TYR 157 HH TYR 157 6.907 -9.674 33.758 305 H THR 158 HN THR 158 3.075 -1.778 34.553 306 HG1 THR 158 HG1 THR 158 2.358 -1.152 36.316 307 H LEU 159 HN LEU 159 3.275 0.162 32.616 308 H VAL 160 HN VAL 160 2.907 -1.190 30.223 309 H ARG 161 HN ARG 161 0.415 -1.893 30.590 310 HE ARG 161 HE ARG 161 -1.475 -6.228 33.007 311 HH11 ARG 161 HH11 ARG 161 -0.463 -3.975 35.528 312 HH12 ARG 161 HH12 ARG 161 0.270 -5.266 36.553 313 HH21 ARG 161 HH21 ARG 161 -0.559 -7.901 34.291 314 HH22 ARG 161 HH22 ARG 161 0.211 -7.445 35.864 315 H GLU 162 HN GLU 162 -0.914 0.387 30.529 316 H ILE 163 HN ILE 163 -0.813 1.060 27.879 317 H ARG 164 HN ARG 164 -2.318 -0.866 26.852 318 HE ARG 164 HE ARG 164 -1.398 -5.803 25.375 319 HH11 ARG 164 HH11 ARG 164 -3.003 -7.170 28.206 320 HH12 ARG 164 HH12 ARG 164 -2.296 -8.809 27.947 321 HH21 ARG 164 HH21 ARG 164 -0.871 -9.182 26.173 322 HH22 ARG 164 HH22 ARG 164 -0.474 -7.844 25.037 323 H LYS 165 HN LYS 165 -4.861 -0.309 27.808 324 HZ1 LYS 165 HZ1 LYS 165 -6.395 2.510 32.659 325 HZ2 LYS 165 HZ2 LYS 165 -4.754 2.259 33.011 326 HZ3 LYS 165 HZ3 LYS 165 -5.930 1.217 33.642 327 H HIS 166 HN HIS 166 -5.184 1.922 26.630 328 HD1 HIS 166 HD1 HIS 166 -3.481 4.873 22.878 329 HE2 HIS 166 HE2 HIS 166 -5.466 8.249 23.710 330 H LYS 167 HN LYS 167 -5.418 1.367 23.926 331 HZ1 LYS 167 HZ1 LYS 167 -0.776 -1.168 20.503 332 HZ2 LYS 167 HZ2 LYS 167 -0.034 0.133 19.705 333 HZ3 LYS 167 HZ3 LYS 167 -1.292 -0.717 18.955 334 H GLU 168 HN GLU 168 -7.670 0.199 24.091 335 H LYS 169 HN LYS 169 -9.472 1.991 24.600 336 HZ1 LYS 169 HZ1 LYS 169 -10.995 9.273 24.295 337 HZ2 LYS 169 HZ2 LYS 169 -10.163 8.922 22.858 338 HZ3 LYS 169 HZ3 LYS 169 -9.416 8.677 24.350 339 H MET 170 HN MET 170 -9.477 3.333 22.357 340 H SER 171 HN SER 171 -10.670 1.635 20.768 341 HG SER 171 HG SER 171 -9.675 0.024 20.031 342 H LYS 172 HN LYS 172 -13.075 2.036 21.313 343 HZ1 LYS 172 HZ1 LYS 172 -15.040 -1.430 26.562 344 HZ2 LYS 172 HZ2 LYS 172 -13.462 -2.002 26.317 345 HZ3 LYS 172 HZ3 LYS 172 -14.777 -3.060 26.195 346 H ASP 173 HN ASP 173 -13.900 3.793 20.024 347 H GLY 174 HN GLY 174 -16.518 7.532 19.925 348 H LYS 175 HN LYS 175 -18.893 9.024 16.996 349 HZ1 LYS 175 HZ1 LYS 175 -14.927 13.373 12.209 350 HZ2 LYS 175 HZ2 LYS 175 -14.251 11.896 12.686 351 HZ3 LYS 175 HZ3 LYS 175 -14.711 13.028 13.849 352 H LYS 176 HN LYS 176 -18.671 13.006 18.387 353 HZ1 LYS 176 HZ1 LYS 176 -19.986 18.055 15.409 354 HZ2 LYS 176 HZ2 LYS 176 -19.802 16.592 14.589 355 HZ3 LYS 176 HZ3 LYS 176 -18.494 17.656 14.709 356 H LYS 177 HN LYS 177 -23.332 13.171 18.508 357 HZ1 LYS 177 HZ1 LYS 177 -26.115 16.405 20.541 358 HZ2 LYS 177 HZ2 LYS 177 -26.572 14.786 20.387 359 HZ3 LYS 177 HZ3 LYS 177 -24.957 15.232 20.164 360 H LYS 178 HN LYS 178 -24.994 9.265 20.037 361 HZ1 LYS 178 HZ1 LYS 178 -23.423 3.221 21.227 362 HZ2 LYS 178 HZ2 LYS 178 -22.274 2.648 20.135 363 HZ3 LYS 178 HZ3 LYS 178 -23.917 2.520 19.771 364 H LYS 179 HN LYS 179 -27.005 8.222 16.052 365 HZ1 LYS 179 HZ1 LYS 179 -30.320 11.643 12.783 366 HZ2 LYS 179 HZ2 LYS 179 -30.936 11.190 11.279 367 HZ3 LYS 179 HZ3 LYS 179 -29.535 12.135 11.370 368 H LYS 180 HN LYS 180 -31.023 9.385 17.588 369 HZ1 LYS 180 HZ1 LYS 180 -30.075 5.872 22.784 370 HZ2 LYS 180 HZ2 LYS 180 -29.850 5.655 21.126 371 HZ3 LYS 180 HZ3 LYS 180 -30.800 4.563 22.000 372 H SER 181 HN SER 181 -32.911 9.315 16.237 373 HG SER 181 HG SER 181 -36.124 11.003 16.147 374 H LYS 182 HN LYS 182 -34.915 6.569 13.428 375 HZ1 LYS 182 HZ1 LYS 182 -33.485 4.282 7.225 376 HZ2 LYS 182 HZ2 LYS 182 -32.210 3.242 6.812 377 HZ3 LYS 182 HZ3 LYS 182 -31.997 4.394 8.028 378 H THR 183 HN THR 183 -36.125 7.404 11.527 379 HG1 THR 183 HG1 THR 183 -38.097 6.478 10.306 380 H LYS 184 HN LYS 184 -36.216 10.105 7.799 381 HZ1 LYS 184 HZ1 LYS 184 -31.206 13.615 3.914 382 HZ2 LYS 184 HZ2 LYS 184 -32.416 14.776 3.695 383 HZ3 LYS 184 HZ3 LYS 184 -32.688 13.174 3.232 384 H CYS 185 HN CYS 185 -35.950 13.578 10.452 385 HG CYS 185 HG CYS 185 -38.354 12.427 12.125 386 HE21 GLN 418 HE21 GLN 418 11.157 30.186 -17.962 387 HE22 GLN 418 HE22 GLN 418 10.877 28.895 -16.843 388 HE21 GLN 424 HE21 GLN 424 21.700 28.945 -26.382 389 HE22 GLN 424 HE22 GLN 424 20.844 30.035 -27.420 390 HE21 GLN 439 HE21 GLN 439 37.865 14.946 -15.683 391 HE22 GLN 439 HE22 GLN 439 38.614 16.428 -15.202 392 HE21 GLN 453 HE21 GLN 453 47.249 -6.555 -17.644 393 HE22 GLN 453 HE22 GLN 453 47.479 -5.282 -18.788 394 HE21 GLN 460 HE21 GLN 460 41.949 -16.192 -14.595 395 HE22 GLN 460 HE22 GLN 460 40.570 -16.879 -15.385 396 HE21 GLN 464 HE21 GLN 464 47.076 -23.414 -10.969 397 HE22 GLN 464 HE22 GLN 464 48.226 -22.521 -11.893 398 HE21 GLN 472 HE21 GLN 472 46.114 -33.674 -3.853 399 HE22 GLN 472 HE22 GLN 472 47.219 -32.366 -4.100 400 HE21 GLN 482 HE21 GLN 482 33.867 -45.183 -3.173 401 HE22 GLN 482 HE22 GLN 482 34.446 -45.868 -4.651 402 HE21 GLN 487 HE21 GLN 487 28.814 -50.827 5.766 403 HE22 GLN 487 HE22 GLN 487 29.881 -51.849 6.656 404 HE21 GLN 493 HE21 GLN 493 21.814 -55.500 0.223 405 HE22 GLN 493 HE22 GLN 493 23.128 -55.094 -0.822 406 HE21 GLN 527 HE21 GLN 527 -26.696 -54.126 12.756 407 HE22 GLN 527 HE22 GLN 527 -26.605 -55.607 13.642 408 HAC EWS 237 HAC DRG 203 12.205 7.109 15.702 409 HAD EWS 237 HAD DRG 203 10.607 4.838 14.628 410 HAE EWS 237 HAE DRG 203 10.464 6.628 14.304 411 HAF EWS 237 HAF DRG 203 14.000 5.644 16.340 412 HAG EWS 237 HAG DRG 203 13.251 4.279 15.374 413 HAI EWS 237 HAI DRG 203 14.632 6.803 14.553 414 HAH EWS 237 HAH DRG 203 14.739 5.141 13.824 415 HAJ EWS 237 HAJ DRG 203 12.172 4.512 13.061 416 HAL EWS 237 HAL DRG 203 10.148 5.242 12.002 417 HAK EWS 237 HAK DRG 203 10.741 6.960 11.974 418 HAM EWS 237 HAM DRG 203 11.191 3.525 10.718 419 HAN EWS 237 HAN DRG 203 12.207 7.754 10.414 420 HAO EWS 237 HAO DRG 203 13.312 7.318 8.212 421 HAP EWS 237 HAP DRG 203 12.309 3.096 8.526 422 HAQ EWS 237 HAQ DRG 203 11.528 2.991 17.839 423 HAS EWS 237 HAS DRG 203 8.917 1.010 20.715 424 HAT EWS 237 HAT DRG 203 8.571 3.226 21.843 425 HAX EWS 237 HAX DRG 203 10.734 7.317 20.166 426 HAA EWS 237 HAA DRG 203 10.491 5.084 16.777 427 HAZ EWS 237 HAZ DRG 203 12.957 7.317 13.282 428 HAW EWS 237 HAW DRG 203 9.280 5.841 21.658 429 HAY EWS 237 HAY DRG 203 13.635 6.247 12.263 Start of MODEL 3 1 HE21 GLN 220 HE21 GLN 220 -19.227 -51.436 16.420 2 HE22 GLN 220 HE22 GLN 220 -20.027 -52.943 16.709 3 HE21 GLN 226 HE21 GLN 226 -9.560 -56.878 21.962 4 HE22 GLN 226 HE22 GLN 226 -11.179 -57.012 22.550 5 HE21 GLN 241 HE21 GLN 241 12.425 -58.839 14.603 6 HE22 GLN 241 HE22 GLN 241 11.804 -60.439 14.796 7 HE21 GLN 255 HE21 GLN 255 34.287 -49.056 15.907 8 HE22 GLN 255 HE22 GLN 255 33.456 -50.305 16.769 9 HE21 GLN 262 HE21 GLN 262 38.533 -38.715 13.694 10 HE22 GLN 262 HE22 GLN 262 37.547 -39.251 15.008 11 HE21 GLN 266 HE21 GLN 266 45.382 -37.622 10.054 12 HE22 GLN 266 HE22 GLN 266 45.309 -38.192 11.687 13 HE21 GLN 274 HE21 GLN 274 51.120 -29.487 0.129 14 HE22 GLN 274 HE22 GLN 274 51.376 -31.195 0.230 15 HE21 GLN 284 HE21 GLN 284 51.895 -12.583 2.090 16 HE22 GLN 284 HE22 GLN 284 51.794 -12.882 3.790 17 HE21 GLN 289 HE21 GLN 289 52.415 -7.648 -9.699 18 HE22 GLN 289 HE22 GLN 289 53.103 -9.187 -10.099 19 HE21 GLN 295 HE21 GLN 295 49.194 3.565 -2.324 20 HE22 GLN 295 HE22 GLN 295 49.418 2.832 -0.775 21 HE21 GLN 329 HE21 GLN 329 16.276 36.997 -17.259 22 HE22 GLN 329 HE22 GLN 329 17.941 37.435 -17.397 23 H MET 1 HT1 MET 1 5.243 -11.357 16.465 24 H THR 2 HN THR 2 2.602 -10.032 19.713 25 HG1 THR 2 HG1 THR 2 0.446 -9.097 21.110 26 H GLU 3 HN GLU 3 3.460 -5.819 18.140 27 H TYR 4 HN TYR 4 6.349 -4.146 21.124 28 HH TYR 4 HH TYR 4 -0.342 -5.875 23.043 29 H LYS 5 HN LYS 5 4.896 -0.043 21.214 30 HZ1 LYS 5 HZ1 LYS 5 5.932 3.042 15.083 31 HZ2 LYS 5 HZ2 LYS 5 4.627 1.987 15.259 32 HZ3 LYS 5 HZ3 LYS 5 5.888 1.597 14.203 33 H LEU 6 HN LEU 6 8.602 1.239 22.997 34 H VAL 7 HN VAL 7 8.128 4.879 25.501 35 H VAL 8 HN VAL 8 12.084 5.778 26.808 36 H VAL 9 HN VAL 9 10.559 8.794 29.773 37 H GLY 10 HN GLY 10 13.387 12.257 30.108 38 H ALA 11 HN ALA 11 14.431 13.403 34.195 39 H VAL 12 HN VAL 12 18.473 15.282 33.180 40 H GLY 13 HN GLY 13 19.948 11.382 34.662 41 H VAL 14 HN VAL 14 18.055 11.384 36.049 42 H GLY 15 HN GLY 15 18.794 8.828 35.947 43 H LYS 16 HN LYS 16 18.062 7.582 33.961 44 HZ1 LYS 16 HZ1 LYS 16 14.627 8.904 28.569 45 HZ2 LYS 16 HZ2 LYS 16 16.069 8.011 28.669 46 HZ3 LYS 16 HZ3 LYS 16 16.064 9.541 27.938 47 H SER 17 HN SER 17 19.141 5.726 32.137 48 HG SER 17 HG SER 17 21.302 5.865 30.686 49 H ALA 18 HN ALA 18 19.363 3.932 34.064 50 H LEU 19 HN LEU 19 17.092 2.625 34.588 51 H THR 20 HN THR 20 16.480 1.342 32.377 52 HG1 THR 20 HG1 THR 20 15.444 2.021 30.592 53 H ILE 21 HN ILE 21 18.594 -0.389 31.807 54 H GLN 22 HN GLN 22 18.067 -1.909 33.878 55 HE21 GLN 22 HE21 GLN 22 18.630 -2.637 39.193 56 HE22 GLN 22 HE22 GLN 22 19.746 -3.946 39.373 57 H LEU 23 HN LEU 23 16.192 -3.443 33.174 58 H ILE 24 HN ILE 24 16.585 -4.583 31.191 59 H GLN 25 HN GLN 25 19.235 -5.880 30.924 60 HE21 GLN 25 HE21 GLN 25 22.289 -5.223 28.210 61 HE22 GLN 25 HE22 GLN 25 23.998 -5.333 27.986 62 H ASN 26 HN ASN 26 18.753 -6.666 33.019 63 HD21 ASN 26 HD21 ASN 26 17.323 -9.715 33.529 64 HD22 ASN 26 HD22 ASN 26 15.796 -9.672 34.334 65 H HIS 27 HN HIS 27 20.644 -5.426 34.383 66 HD1 HIS 27 HD1 HIS 27 25.696 -6.039 36.061 67 HE2 HIS 27 HE2 HIS 27 26.848 -2.367 34.963 68 H PHE 28 HN PHE 28 22.865 -4.539 37.964 69 H VAL 29 HN VAL 29 22.176 -0.302 36.784 70 H ASP 30 HN ASP 30 26.048 0.440 37.890 71 H GLU 31 HN GLU 31 27.261 1.973 36.820 72 H TYR 32 HN TYR 32 28.987 6.110 35.687 73 HH TYR 32 HH TYR 32 24.857 12.776 32.263 74 H ASP 33 HN ASP 33 25.883 6.299 32.821 75 H THR 35 HN THR 35 22.766 9.274 28.375 76 HG1 THR 35 HG1 THR 35 22.515 6.444 28.125 77 H ILE 36 HN ILE 36 23.048 7.903 24.096 78 H GLU 37 HN GLU 37 22.475 7.206 22.372 79 H ASP 38 HN ASP 38 19.107 5.414 22.262 80 H SER 39 HN SER 39 19.515 1.084 21.997 81 HG SER 39 HG SER 39 17.212 2.612 20.230 82 H TYR 40 HN TYR 40 15.734 -0.643 23.041 83 HH TYR 40 HH TYR 40 21.521 1.198 26.247 84 H ARG 41 HN ARG 41 16.456 -4.750 22.454 85 HE ARG 41 HE ARG 41 13.028 -4.107 19.273 86 HH11 ARG 41 HH11 ARG 41 9.633 -5.091 17.257 87 HH12 ARG 41 HH12 ARG 41 10.148 -6.065 18.693 88 HH21 ARG 41 HH21 ARG 41 12.435 -2.908 17.415 89 HH22 ARG 41 HH22 ARG 41 10.909 -3.348 16.555 90 H LYS 42 HN LYS 42 12.462 -6.196 23.662 91 HZ1 LYS 42 HZ1 LYS 42 14.932 -10.992 29.882 92 HZ2 LYS 42 HZ2 LYS 42 15.859 -9.725 29.261 93 HZ3 LYS 42 HZ3 LYS 42 14.794 -10.564 28.253 94 H GLN 43 HN GLN 43 12.410 -10.313 25.291 95 HE21 GLN 43 HE21 GLN 43 9.685 -13.363 21.266 96 HE22 GLN 43 HE22 GLN 43 9.995 -15.058 21.414 97 H VAL 44 HN VAL 44 8.190 -10.069 25.937 98 H VAL 45 HN VAL 45 6.862 -12.329 29.532 99 H ILE 46 HN ILE 46 2.971 -11.050 28.330 100 H ASP 47 HN ASP 47 0.702 -11.049 31.948 101 H GLY 48 HN GLY 48 0.505 -13.246 30.649 102 H GLU 49 HN GLU 49 0.017 -12.709 28.208 103 H THR 50 HN THR 50 2.301 -14.286 24.746 104 HG1 THR 50 HG1 THR 50 6.811 -14.493 25.210 105 H CYS 51 HN CYS 51 5.482 -11.093 24.998 106 HG CYS 51 HG CYS 51 4.501 -9.755 26.009 107 H LEU 52 HN LEU 52 6.007 -8.460 21.483 108 H LEU 53 HN LEU 53 9.587 -6.611 23.230 109 H ASP 54 HN ASP 54 9.499 -2.312 22.203 110 H ILE 55 HN ILE 55 13.278 -0.964 23.823 111 H LEU 56 HN LEU 56 12.583 3.101 23.201 112 H ASP 57 HN ASP 57 16.797 4.408 24.118 113 H THR 58 HN THR 58 15.149 7.938 25.934 114 HG1 THR 58 HG1 THR 58 13.347 9.709 26.189 115 H ALA 59 HN ALA 59 17.246 11.681 24.275 116 H GLY 60 HN GLY 60 19.124 13.077 28.235 117 H GLN 61 HN GLN 61 19.716 15.402 28.608 118 HE21 GLN 61 HE21 GLN 61 21.163 21.121 31.059 119 HE22 GLN 61 HE22 GLN 61 22.779 20.814 31.588 120 H GLU 62 HN GLU 62 17.423 18.097 26.885 121 H GLU 63 HN GLU 63 18.000 19.984 23.002 122 H TYR 64 HN TYR 64 15.195 22.820 21.632 123 HH TYR 64 HH TYR 64 9.985 22.898 14.772 124 H SER 65 HN SER 65 14.310 19.312 19.339 125 HG SER 65 HG SER 65 17.720 16.597 17.818 126 H ALA 66 HN ALA 66 15.686 19.256 15.208 127 H MET 67 HN MET 67 16.042 16.630 15.225 128 H ARG 68 HN ARG 68 15.412 15.709 17.389 129 HE ARG 68 HE ARG 68 12.805 16.736 23.469 130 HH11 ARG 68 HH11 ARG 68 15.651 14.458 25.265 131 HH12 ARG 68 HH12 ARG 68 15.881 15.001 23.552 132 HH21 ARG 68 HH21 ARG 68 12.483 16.079 25.624 133 HH22 ARG 68 HH22 ARG 68 13.750 15.064 26.424 134 H ASP 69 HN ASP 69 12.814 16.128 17.520 135 H GLN 70 HN GLN 70 12.204 14.170 16.100 136 HE21 GLN 70 HE21 GLN 70 14.180 11.264 12.304 137 HE22 GLN 70 HE22 GLN 70 14.323 11.867 10.690 138 H TYR 71 HN TYR 71 12.876 11.868 16.484 139 HH TYR 71 HH TYR 71 16.434 13.235 21.636 140 H MET 72 HN MET 72 11.369 11.362 18.794 141 H ARG 73 HN ARG 73 9.200 10.454 17.547 142 HE ARG 73 HE ARG 73 7.292 13.953 16.126 143 HH11 ARG 73 HH11 ARG 73 4.784 16.778 14.656 144 HH12 ARG 73 HH12 ARG 73 4.463 15.031 14.345 145 HH21 ARG 73 HH21 ARG 73 7.729 16.163 16.558 146 HH22 ARG 73 HH22 ARG 73 6.610 17.410 15.893 147 H THR 74 HN THR 74 8.461 8.277 17.889 148 HG1 THR 74 HG1 THR 74 10.163 7.630 16.339 149 H GLY 75 HN GLY 75 6.311 7.220 19.103 150 H GLU 76 HN GLU 76 4.821 4.059 21.802 151 H GLY 77 HN GLY 77 4.440 3.872 23.885 152 H PHE 78 HN PHE 78 3.963 6.565 27.441 153 H LEU 79 HN LEU 79 8.060 6.859 28.927 154 H CYS 80 HN CYS 80 6.547 8.255 32.808 155 HG CYS 80 HG CYS 80 5.938 10.058 30.949 156 H VAL 81 HN VAL 81 10.195 9.627 33.705 157 H PHE 82 HN PHE 82 10.339 9.938 38.184 158 H ALA 83 HN ALA 83 12.746 13.114 40.070 159 H ILE 84 HN ILE 84 13.059 10.620 43.607 160 H ASN 85 HN ASN 85 14.733 12.181 44.667 161 HD21 ASN 85 HD21 ASN 85 19.241 12.510 45.656 162 HD22 ASN 85 HD22 ASN 85 19.170 12.050 43.992 163 H ASN 86 HN ASN 86 14.281 14.568 44.205 164 HD21 ASN 86 HD21 ASN 86 16.595 16.345 39.991 165 HD22 ASN 86 HD22 ASN 86 16.836 18.051 39.843 166 H THR 87 HN THR 87 14.044 18.392 44.541 167 HG1 THR 87 HG1 THR 87 11.680 19.157 46.228 168 H LYS 88 HN LYS 88 14.303 19.361 42.067 169 HZ1 LYS 88 HZ1 LYS 88 14.947 23.790 35.628 170 HZ2 LYS 88 HZ2 LYS 88 13.796 22.889 36.472 171 HZ3 LYS 88 HZ3 LYS 88 15.228 22.154 35.950 172 H SER 89 HN SER 89 14.033 17.500 40.076 173 HG SER 89 HG SER 89 15.333 16.314 37.924 174 H PHE 90 HN PHE 90 11.585 17.091 40.458 175 H GLU 91 HN GLU 91 10.168 19.045 39.655 176 H ASP 92 HN ASP 92 10.514 18.855 37.261 177 H ILE 93 HN ILE 93 8.609 17.430 36.281 178 H HIS 94 HN HIS 94 6.346 18.694 35.214 179 HD1 HIS 94 HD1 HIS 94 1.817 19.875 34.615 180 HE2 HIS 94 HE2 HIS 94 1.586 23.032 32.148 181 H HIS 95 HN HIS 95 7.437 19.824 33.120 182 HD1 HIS 95 HD1 HIS 95 11.305 18.988 31.243 183 HE2 HIS 95 HE2 HIS 95 11.693 20.666 27.616 184 H TYR 96 HN TYR 96 8.145 17.838 31.442 185 HH TYR 96 HH TYR 96 14.494 14.621 29.266 186 H ARG 97 HN ARG 97 5.788 16.966 30.993 187 HE ARG 97 HE ARG 97 -0.660 15.797 30.669 188 HH11 ARG 97 HH11 ARG 97 0.924 12.833 31.679 189 HH12 ARG 97 HH12 ARG 97 -0.632 11.968 31.963 190 HH21 ARG 97 HH21 ARG 97 -2.648 14.772 31.051 191 HH22 ARG 97 HH22 ARG 97 -2.649 13.058 31.616 192 H GLU 98 HN GLU 98 4.500 18.810 29.380 193 H GLN 99 HN GLN 99 5.956 18.456 27.322 194 HE21 GLN 99 HE21 GLN 99 10.192 19.887 24.720 195 HE22 GLN 99 HE22 GLN 99 11.710 19.320 25.321 196 H ILE 100 HN ILE 100 5.688 16.011 26.329 197 H LYS 101 HN LYS 101 3.124 16.158 25.697 198 HZ1 LYS 101 HZ1 LYS 101 -2.972 17.785 27.368 199 HZ2 LYS 101 HZ2 LYS 101 -2.249 18.077 25.866 200 HZ3 LYS 101 HZ3 LYS 101 -2.557 19.358 26.917 201 H ARG 102 HN ARG 102 3.288 17.719 23.575 202 HE ARG 102 HE ARG 102 6.739 20.671 22.062 203 HH11 ARG 102 HH11 ARG 102 6.104 20.221 18.617 204 HH12 ARG 102 HH12 ARG 102 7.580 19.197 18.367 205 HH21 ARG 102 HH21 ARG 102 8.642 19.439 21.752 206 HH22 ARG 102 HH22 ARG 102 8.996 18.775 20.102 207 H VAL 103 HN VAL 103 4.632 16.633 21.541 208 H LYS 104 HN LYS 104 2.804 14.788 21.021 209 HZ1 LYS 104 HZ1 LYS 104 3.095 7.797 19.848 210 HZ2 LYS 104 HZ2 LYS 104 3.111 9.454 19.541 211 HZ3 LYS 104 HZ3 LYS 104 1.947 8.470 18.805 212 H ASP 105 HN ASP 105 1.008 15.883 20.211 213 H SER 106 HN SER 106 -1.192 14.698 21.095 214 HG SER 106 HG SER 106 -2.138 13.167 19.492 215 H GLU 107 HN GLU 107 -5.350 14.551 22.679 216 H ASP 108 HN ASP 108 -5.618 12.682 24.343 217 H VAL 109 HN VAL 109 -2.633 11.371 26.872 218 H MET 111 HN MET 111 -0.228 7.786 29.824 219 H VAL 112 HN VAL 112 3.662 7.456 31.923 220 H LEU 113 HN LEU 113 2.525 7.776 36.061 221 H VAL 114 HN VAL 114 6.835 8.557 36.745 222 H GLY 115 HN GLY 115 7.729 6.621 40.531 223 H ASN 116 HN ASN 116 11.660 8.082 40.456 224 HD21 ASN 116 HD21 ASN 116 15.896 6.310 39.032 225 HD22 ASN 116 HD22 ASN 116 16.505 4.790 39.585 226 H LYS 117 HN LYS 117 14.541 5.235 42.507 227 HZ1 LYS 117 HZ1 LYS 117 20.181 10.198 40.363 228 HZ2 LYS 117 HZ2 LYS 117 20.336 10.176 42.046 229 HZ3 LYS 117 HZ3 LYS 117 19.056 11.025 41.324 230 H CYS 118 HN CYS 118 13.282 5.105 44.748 231 HG CYS 118 HG CYS 118 11.174 2.523 47.300 232 H ASP 119 HN ASP 119 14.843 4.344 46.717 233 H LEU 120 HN LEU 120 15.685 6.256 48.036 234 H SER 122 HN SER 122 16.908 10.147 50.586 235 HG SER 122 HG SER 122 18.950 11.188 50.064 236 H ARG 123 HN ARG 123 14.107 11.582 51.715 237 HE ARG 123 HE ARG 123 10.340 8.327 50.698 238 HH11 ARG 123 HH11 ARG 123 8.008 9.821 48.521 239 HH12 ARG 123 HH12 ARG 123 7.807 8.326 47.531 240 HH21 ARG 123 HH21 ARG 123 8.950 6.420 48.063 241 HH22 ARG 123 HH22 ARG 123 10.072 6.400 49.487 242 H THR 124 HN THR 124 13.143 14.082 48.598 243 HG1 THR 124 HG1 THR 124 14.571 15.641 49.024 244 H VAL 125 HN VAL 125 10.872 14.617 47.557 245 H ASP 126 HN ASP 126 6.676 15.273 48.989 246 H THR 127 HN THR 127 5.163 11.029 49.990 247 HG1 THR 127 HG1 THR 127 5.419 7.889 48.743 248 H LYS 128 HN LYS 128 2.614 11.845 49.608 249 HZ1 LYS 128 HZ1 LYS 128 -4.518 15.304 49.522 250 HZ2 LYS 128 HZ2 LYS 128 -3.833 13.810 49.908 251 HZ3 LYS 128 HZ3 LYS 128 -3.302 14.658 48.538 252 H GLN 129 HN GLN 129 2.914 13.950 47.973 253 HE21 GLN 129 HE21 GLN 129 4.358 18.952 46.791 254 HE22 GLN 129 HE22 GLN 129 5.990 19.210 47.311 255 H ALA 130 HN ALA 130 3.473 12.865 45.567 256 H GLN 131 HN GLN 131 1.512 11.399 45.095 257 HE21 GLN 131 HE21 GLN 131 -2.441 8.574 46.069 258 HE22 GLN 131 HE22 GLN 131 -2.453 7.519 47.439 259 H ASP 132 HN ASP 132 -0.560 13.127 44.838 260 H LEU 133 HN LEU 133 0.141 14.209 42.669 261 H ALA 134 HN ALA 134 0.233 12.515 40.656 262 H ARG 135 HN ARG 135 -2.400 12.010 40.635 263 HE ARG 135 HE ARG 135 -8.148 9.554 41.544 264 HH11 ARG 135 HH11 ARG 135 -5.188 7.760 40.910 265 HH12 ARG 135 HH12 ARG 135 -5.846 6.203 41.539 266 HH21 ARG 135 HH21 ARG 135 -9.025 7.616 42.374 267 HH22 ARG 135 HH22 ARG 135 -8.012 6.124 42.362 268 H SER 136 HN SER 136 -3.467 14.263 39.583 269 HG SER 136 HG SER 136 -5.170 17.550 37.558 270 H TYR 137 HN TYR 137 -2.715 14.015 37.113 271 HH TYR 137 HH TYR 137 2.781 17.933 35.873 272 H GLY 138 HN GLY 138 -4.361 12.403 36.356 273 H ILE 139 HN ILE 139 -2.871 10.553 35.744 274 H PHE 141 HN PHE 141 -0.206 5.743 39.765 275 H ILE 142 HN ILE 142 4.096 5.723 39.339 276 H GLU 143 HN GLU 143 5.317 3.029 42.579 277 H THR 144 HN THR 144 9.570 4.380 42.299 278 HG1 THR 144 HG1 THR 144 10.792 4.485 40.716 279 H SER 145 HN SER 145 12.410 1.000 41.961 280 HG SER 145 HG SER 145 15.860 2.095 45.167 281 H ALA 146 HN ALA 146 15.810 2.470 41.165 282 H LYS 147 HN LYS 147 17.483 1.273 42.643 283 HZ1 LYS 147 HZ1 LYS 147 21.166 1.660 48.905 284 HZ2 LYS 147 HZ2 LYS 147 22.381 2.552 48.137 285 HZ3 LYS 147 HZ3 LYS 147 22.786 1.183 49.040 286 H THR 148 HN THR 148 16.684 -0.466 44.405 287 HG1 THR 148 HG1 THR 148 15.107 -0.275 45.825 288 H ARG 149 HN ARG 149 16.077 -2.013 42.752 289 HE ARG 149 HE ARG 149 16.150 -6.611 37.817 290 HH11 ARG 149 HH11 ARG 149 12.871 -6.850 39.053 291 HH12 ARG 149 HH12 ARG 149 12.144 -7.104 37.418 292 HH21 ARG 149 HH21 ARG 149 15.284 -6.903 35.722 293 HH22 ARG 149 HH22 ARG 149 13.500 -7.149 35.555 294 H GLN 150 HN GLN 150 13.237 -1.623 43.000 295 HE21 GLN 150 HE21 GLN 150 9.481 0.788 45.702 296 HE22 GLN 150 HE22 GLN 150 9.525 0.943 47.423 297 H GLY 151 HN GLY 151 9.212 -3.224 42.359 298 H VAL 152 HN VAL 152 10.607 -2.509 40.201 299 H ASP 153 HN ASP 153 9.818 -4.284 38.279 300 H ASP 154 HN ASP 154 7.231 -3.733 38.242 301 H ALA 155 HN ALA 155 7.323 -1.271 37.224 302 H PHE 156 HN PHE 156 7.159 -1.815 34.590 303 H TYR 157 HN TYR 157 5.678 -3.249 33.776 304 HH TYR 157 HH TYR 157 7.546 -9.601 33.898 305 H THR 158 HN THR 158 3.336 -1.922 34.431 306 HG1 THR 158 HG1 THR 158 2.252 -1.008 36.869 307 H LEU 159 HN LEU 159 3.253 0.245 32.645 308 H VAL 160 HN VAL 160 2.882 -1.171 30.348 309 H ARG 161 HN ARG 161 0.422 -2.132 30.654 310 HE ARG 161 HE ARG 161 -0.886 -4.118 34.573 311 HH11 ARG 161 HH11 ARG 161 -1.458 -7.206 32.932 312 HH12 ARG 161 HH12 ARG 161 -0.248 -8.075 33.954 313 HH21 ARG 161 HH21 ARG 161 0.636 -5.214 35.869 314 HH22 ARG 161 HH22 ARG 161 0.913 -6.973 35.576 315 H GLU 162 HN GLU 162 -0.935 0.124 30.562 316 H ILE 163 HN ILE 163 -0.819 0.992 28.038 317 H ARG 164 HN ARG 164 -2.123 -1.013 26.910 318 HE ARG 164 HE ARG 164 -0.697 -5.866 25.309 319 HH11 ARG 164 HH11 ARG 164 -0.658 -8.536 28.367 320 HH12 ARG 164 HH12 ARG 164 -1.734 -7.091 28.454 321 HH21 ARG 164 HH21 ARG 164 0.651 -7.667 25.166 322 HH22 ARG 164 HH22 ARG 164 0.686 -8.856 26.523 323 H LYS 165 HN LYS 165 -4.693 -0.528 27.636 324 HZ1 LYS 165 HZ1 LYS 165 -6.290 2.524 31.679 325 HZ2 LYS 165 HZ2 LYS 165 -4.996 2.029 32.656 326 HZ3 LYS 165 HZ3 LYS 165 -6.573 1.533 33.024 327 H HIS 166 HN HIS 166 -5.165 1.606 26.425 328 HD1 HIS 166 HD1 HIS 166 -3.583 4.893 22.796 329 HE2 HIS 166 HE2 HIS 166 -5.892 7.988 23.872 330 H LYS 167 HN LYS 167 -5.130 0.991 23.721 331 HZ1 LYS 167 HZ1 LYS 167 -0.062 0.497 19.736 332 HZ2 LYS 167 HZ2 LYS 167 -1.659 0.291 19.210 333 HZ3 LYS 167 HZ3 LYS 167 -0.599 -1.022 19.210 334 H GLU 168 HN GLU 168 -7.346 -0.583 23.611 335 H LYS 169 HN LYS 169 -9.372 1.082 24.254 336 HZ1 LYS 169 HZ1 LYS 169 -13.776 5.641 27.218 337 HZ2 LYS 169 HZ2 LYS 169 -14.028 5.854 25.557 338 HZ3 LYS 169 HZ3 LYS 169 -14.062 7.188 26.598 339 H MET 170 HN MET 170 -9.265 2.702 22.157 340 H SER 171 HN SER 171 -10.721 1.306 20.361 341 HG SER 171 HG SER 171 -9.575 0.299 18.922 342 H LYS 172 HN LYS 172 -13.042 1.766 20.684 343 HZ1 LYS 172 HZ1 LYS 172 -18.374 -2.979 21.690 344 HZ2 LYS 172 HZ2 LYS 172 -16.744 -3.407 21.640 345 HZ3 LYS 172 HZ3 LYS 172 -17.318 -2.159 20.658 346 H ASP 173 HN ASP 173 -13.731 3.617 21.056 347 H GLY 174 HN GLY 174 -15.927 6.587 19.049 348 H LYS 175 HN LYS 175 -13.322 9.307 16.535 349 HZ1 LYS 175 HZ1 LYS 175 -8.205 13.792 17.090 350 HZ2 LYS 175 HZ2 LYS 175 -9.485 13.978 18.182 351 HZ3 LYS 175 HZ3 LYS 175 -8.578 15.320 17.706 352 H LYS 176 HN LYS 176 -14.104 12.379 19.661 353 HZ1 LYS 176 HZ1 LYS 176 -20.630 15.210 24.143 354 HZ2 LYS 176 HZ2 LYS 176 -19.010 15.071 24.614 355 HZ3 LYS 176 HZ3 LYS 176 -19.918 13.686 24.289 356 H LYS 177 HN LYS 177 -16.911 14.580 17.147 357 HZ1 LYS 177 HZ1 LYS 177 -17.653 18.162 13.039 358 HZ2 LYS 177 HZ2 LYS 177 -17.037 17.971 11.480 359 HZ3 LYS 177 HZ3 LYS 177 -16.790 19.422 12.310 360 H LYS 178 HN LYS 178 -16.600 18.843 16.116 361 HZ1 LYS 178 HZ1 LYS 178 -16.150 23.858 17.125 362 HZ2 LYS 178 HZ2 LYS 178 -14.663 23.529 16.394 363 HZ3 LYS 178 HZ3 LYS 178 -14.712 24.054 18.001 364 H LYS 179 HN LYS 179 -21.080 18.457 16.385 365 HZ1 LYS 179 HZ1 LYS 179 -20.361 11.768 17.035 366 HZ2 LYS 179 HZ2 LYS 179 -19.663 11.413 15.535 367 HZ3 LYS 179 HZ3 LYS 179 -21.342 11.405 15.709 368 H LYS 180 HN LYS 180 -23.665 17.086 13.116 369 HZ1 LYS 180 HZ1 LYS 180 -29.456 19.007 16.565 370 HZ2 LYS 180 HZ2 LYS 180 -28.968 18.631 18.141 371 HZ3 LYS 180 HZ3 LYS 180 -30.603 18.552 17.724 372 H SER 181 HN SER 181 -24.865 19.752 15.516 373 HG SER 181 HG SER 181 -26.902 21.190 17.091 374 H LYS 182 HN LYS 182 -26.157 22.470 12.400 375 HZ1 LYS 182 HZ1 LYS 182 -23.641 20.255 6.582 376 HZ2 LYS 182 HZ2 LYS 182 -23.847 18.707 7.227 377 HZ3 LYS 182 HZ3 LYS 182 -23.314 19.973 8.217 378 H THR 183 HN THR 183 -26.260 24.858 12.144 379 HG1 THR 183 HG1 THR 183 -26.014 25.683 14.618 380 H LYS 184 HN LYS 184 -25.801 26.644 9.962 381 HZ1 LYS 184 HZ1 LYS 184 -24.012 32.392 5.148 382 HZ2 LYS 184 HZ2 LYS 184 -25.536 32.182 5.853 383 HZ3 LYS 184 HZ3 LYS 184 -25.354 32.032 4.182 384 H CYS 185 HN CYS 185 -23.393 26.328 7.589 385 HG CYS 185 HG CYS 185 -22.089 24.976 10.109 386 HE21 GLN 418 HE21 GLN 418 -24.242 23.649 -14.100 387 HE22 GLN 418 HE22 GLN 418 -24.635 22.784 -12.657 388 HE21 GLN 424 HE21 GLN 424 -20.492 33.737 -23.066 389 HE22 GLN 424 HE22 GLN 424 -22.180 34.013 -23.302 390 HE21 GLN 439 HE21 GLN 439 2.636 39.132 -22.853 391 HE22 GLN 439 HE22 GLN 439 1.292 39.383 -21.796 392 HE21 GLN 453 HE21 GLN 453 22.952 27.379 -31.075 393 HE22 GLN 453 HE22 GLN 453 22.405 29.009 -31.266 394 HE21 GLN 460 HE21 GLN 460 30.630 20.539 -26.903 395 HE22 GLN 460 HE22 GLN 460 30.936 20.833 -28.576 396 HE21 GLN 464 HE21 GLN 464 36.870 17.303 -26.028 397 HE22 GLN 464 HE22 GLN 464 36.574 18.718 -26.977 398 HE21 GLN 472 HE21 GLN 472 44.870 10.658 -20.205 399 HE22 GLN 472 HE22 GLN 472 44.505 12.210 -20.867 400 HE21 GLN 482 HE21 GLN 482 45.791 -6.260 -21.000 401 HE22 GLN 482 HE22 GLN 482 45.881 -6.409 -22.719 402 HE21 GLN 487 HE21 GLN 487 50.212 -12.554 -9.605 403 HE22 GLN 487 HE22 GLN 487 51.539 -11.722 -8.875 404 HE21 GLN 493 HE21 GLN 493 45.640 -21.439 -17.125 405 HE22 GLN 493 HE22 GLN 493 47.039 -20.559 -17.636 406 HE21 GLN 527 HE21 GLN 527 22.237 -57.661 4.665 407 HE22 GLN 527 HE22 GLN 527 23.134 -58.431 5.928 408 HAC EWS 237 HAC DRG 203 13.407 7.412 16.476 409 HAD EWS 237 HAD DRG 203 11.652 5.635 14.853 410 HAE EWS 237 HAE DRG 203 11.733 7.457 14.922 411 HAF EWS 237 HAF DRG 203 14.975 5.633 16.866 412 HAG EWS 237 HAG DRG 203 14.154 4.607 15.589 413 HAI EWS 237 HAI DRG 203 15.864 7.055 15.409 414 HAH EWS 237 HAH DRG 203 15.841 5.585 14.340 415 HAJ EWS 237 HAJ DRG 203 13.284 5.456 13.332 416 HAL EWS 237 HAL DRG 203 11.439 6.639 12.360 417 HAK EWS 237 HAK DRG 203 12.220 8.237 12.737 418 HAM EWS 237 HAM DRG 203 12.379 5.115 10.785 419 HAN EWS 237 HAN DRG 203 13.877 9.153 11.463 420 HAO EWS 237 HAO DRG 203 15.089 9.058 9.276 421 HAP EWS 237 HAP DRG 203 13.603 5.024 8.610 422 HAQ EWS 237 HAQ DRG 203 12.118 3.051 17.625 423 HAS EWS 237 HAS DRG 203 9.096 0.849 19.865 424 HAT EWS 237 HAT DRG 203 8.914 2.803 21.432 425 HAX EWS 237 HAX DRG 203 11.636 6.854 20.798 426 HAA EWS 237 HAA DRG 203 11.403 5.435 16.995 427 HAZ EWS 237 HAZ DRG 203 14.357 8.031 14.199 428 HAW EWS 237 HAW DRG 203 9.919 5.288 21.858 429 HAY EWS 237 HAY DRG 203 14.987 7.124 13.006 Start of MODEL 4 1 HE21 GLN 220 HE21 GLN 220 -50.365 -16.194 5.668 2 HE22 GLN 220 HE22 GLN 220 -51.644 -17.004 6.500 3 HE21 GLN 226 HE21 GLN 226 -48.767 -25.145 14.059 4 HE22 GLN 226 HE22 GLN 226 -49.774 -23.828 14.553 5 HE21 GLN 241 HE21 GLN 241 -37.823 -47.388 14.444 6 HE22 GLN 241 HE22 GLN 241 -39.196 -46.940 13.490 7 HE21 GLN 255 HE21 GLN 255 -15.974 -56.028 20.015 8 HE22 GLN 255 HE22 GLN 255 -17.460 -56.398 20.819 9 HE21 GLN 262 HE21 GLN 262 -6.901 -54.147 18.617 10 HE22 GLN 262 HE22 GLN 262 -7.377 -53.648 20.200 11 HE21 GLN 266 HE21 GLN 266 0.707 -56.654 19.805 12 HE22 GLN 266 HE22 GLN 266 -0.479 -57.842 20.229 13 HE21 GLN 274 HE21 GLN 274 11.686 -59.569 11.304 14 HE22 GLN 274 HE22 GLN 274 10.688 -60.780 12.032 15 HE21 GLN 284 HE21 GLN 284 25.782 -47.737 14.733 16 HE22 GLN 284 HE22 GLN 284 24.816 -47.987 16.144 17 HE21 GLN 289 HE21 GLN 289 33.167 -48.404 4.205 18 HE22 GLN 289 HE22 GLN 289 32.755 -50.063 3.942 19 HE21 GLN 295 HE21 GLN 295 37.256 -38.834 10.852 20 HE22 GLN 295 HE22 GLN 295 36.320 -39.624 12.071 21 HE21 GLN 329 HE21 GLN 329 48.042 7.531 -8.911 22 HE22 GLN 329 HE22 GLN 329 49.452 6.565 -9.170 23 H MET 1 HT1 MET 1 6.910 -10.096 14.742 24 H THR 2 HN THR 2 4.844 -10.342 18.632 25 HG1 THR 2 HG1 THR 2 2.536 -10.252 19.220 26 H GLU 3 HN GLU 3 5.100 -5.887 18.300 27 H TYR 4 HN TYR 4 7.378 -4.966 21.862 28 HH TYR 4 HH TYR 4 1.221 -7.344 24.473 29 H LYS 5 HN LYS 5 6.049 -1.334 21.024 30 HZ1 LYS 5 HZ1 LYS 5 4.388 1.228 15.761 31 HZ2 LYS 5 HZ2 LYS 5 5.556 0.676 14.669 32 HZ3 LYS 5 HZ3 LYS 5 5.865 2.037 15.616 33 H LEU 6 HN LEU 6 9.408 1.089 22.920 34 H VAL 7 HN VAL 7 8.508 4.442 25.546 35 H VAL 8 HN VAL 8 12.249 5.519 27.026 36 H VAL 9 HN VAL 9 10.458 8.476 29.825 37 H GLY 10 HN GLY 10 13.067 12.089 30.389 38 H ALA 11 HN ALA 11 14.155 13.214 34.465 39 H VAL 12 HN VAL 12 18.008 15.477 33.403 40 H GLY 13 HN GLY 13 19.282 11.752 34.453 41 H VAL 14 HN VAL 14 17.901 11.478 35.812 42 H GLY 15 HN GLY 15 18.551 8.838 35.637 43 H LYS 16 HN LYS 16 17.862 7.661 33.973 44 HZ1 LYS 16 HZ1 LYS 16 14.748 8.627 28.485 45 HZ2 LYS 16 HZ2 LYS 16 16.312 7.989 28.688 46 HZ3 LYS 16 HZ3 LYS 16 16.097 9.486 27.920 47 H SER 17 HN SER 17 19.389 5.843 32.476 48 HG SER 17 HG SER 17 21.920 6.115 30.927 49 H ALA 18 HN ALA 18 19.585 3.966 34.275 50 H LEU 19 HN LEU 19 17.328 2.815 34.600 51 H THR 20 HN THR 20 16.993 1.443 32.364 52 HG1 THR 20 HG1 THR 20 17.042 2.417 30.537 53 H ILE 21 HN ILE 21 18.957 -0.212 32.056 54 H GLN 22 HN GLN 22 18.527 -1.807 34.186 55 HE21 GLN 22 HE21 GLN 22 17.634 -6.149 36.929 56 HE22 GLN 22 HE22 GLN 22 18.978 -6.637 37.905 57 H LEU 23 HN LEU 23 16.632 -3.252 33.337 58 H ILE 24 HN ILE 24 16.831 -4.380 31.230 59 H GLN 25 HN GLN 25 19.317 -5.447 30.953 60 HE21 GLN 25 HE21 GLN 25 22.635 -4.218 30.370 61 HE22 GLN 25 HE22 GLN 25 24.047 -3.761 29.481 62 H ASN 26 HN ASN 26 18.709 -6.799 32.945 63 HD21 ASN 26 HD21 ASN 26 17.555 -11.337 34.534 64 HD22 ASN 26 HD22 ASN 26 16.386 -11.116 35.788 65 H HIS 27 HN HIS 27 20.619 -5.677 34.619 66 HD1 HIS 27 HD1 HIS 27 24.812 -6.696 37.768 67 HE2 HIS 27 HE2 HIS 27 27.269 -3.834 36.451 68 H PHE 28 HN PHE 28 22.338 -4.489 38.308 69 H VAL 29 HN VAL 29 22.658 -0.456 36.445 70 H ASP 30 HN ASP 30 26.583 0.086 38.247 71 H GLU 31 HN GLU 31 27.500 2.088 37.224 72 H TYR 32 HN TYR 32 28.656 6.496 36.669 73 HH TYR 32 HH TYR 32 24.973 12.741 32.283 74 H ASP 33 HN ASP 33 25.445 6.843 33.563 75 H THR 35 HN THR 35 22.882 9.718 28.371 76 HG1 THR 35 HG1 THR 35 22.951 6.849 28.492 77 H ILE 36 HN ILE 36 23.397 8.548 24.259 78 H GLU 37 HN GLU 37 22.445 7.693 22.808 79 H ASP 38 HN ASP 38 19.192 5.126 21.930 80 H SER 39 HN SER 39 20.283 0.990 22.879 81 HG SER 39 HG SER 39 17.021 -1.067 20.389 82 H TYR 40 HN TYR 40 17.026 -1.317 23.284 83 HH TYR 40 HH TYR 40 23.596 -0.264 26.580 84 H ARG 41 HN ARG 41 17.883 -4.396 21.868 85 HE ARG 41 HE ARG 41 15.226 -6.515 17.032 86 HH11 ARG 41 HH11 ARG 41 15.967 -3.276 18.233 87 HH12 ARG 41 HH12 ARG 41 17.211 -2.972 16.950 88 HH21 ARG 41 HH21 ARG 41 16.780 -6.157 15.394 89 HH22 ARG 41 HH22 ARG 41 17.657 -4.582 15.351 90 H LYS 42 HN LYS 42 14.401 -6.578 23.507 91 HZ1 LYS 42 HZ1 LYS 42 17.980 -9.960 29.121 92 HZ2 LYS 42 HZ2 LYS 42 17.588 -10.933 27.795 93 HZ3 LYS 42 HZ3 LYS 42 17.508 -11.571 29.361 94 H GLN 43 HN GLN 43 14.514 -10.920 24.293 95 HE21 GLN 43 HE21 GLN 43 9.303 -14.333 21.913 96 HE22 GLN 43 HE22 GLN 43 10.006 -15.064 20.508 97 H VAL 44 HN VAL 44 10.513 -10.753 25.670 98 H VAL 45 HN VAL 45 9.052 -12.942 29.083 99 H ILE 46 HN ILE 46 5.144 -11.834 27.675 100 H ASP 47 HN ASP 47 3.273 -11.170 31.412 101 H GLY 48 HN GLY 48 2.790 -13.476 30.120 102 H GLU 49 HN GLU 49 2.169 -13.053 27.829 103 H THR 50 HN THR 50 4.182 -14.757 24.329 104 HG1 THR 50 HG1 THR 50 8.412 -13.921 24.505 105 H CYS 51 HN CYS 51 7.397 -11.512 24.453 106 HG CYS 51 HG CYS 51 4.097 -10.874 23.234 107 H LEU 52 HN LEU 52 7.724 -8.400 21.374 108 H LEU 53 HN LEU 53 11.712 -7.018 22.933 109 H ASP 54 HN ASP 54 11.220 -2.696 22.904 110 H ILE 55 HN ILE 55 14.295 -0.934 24.287 111 H LEU 56 HN LEU 56 13.372 3.164 23.135 112 H ASP 57 HN ASP 57 17.302 4.250 24.573 113 H THR 58 HN THR 58 15.602 7.911 25.390 114 HG1 THR 58 HG1 THR 58 14.217 8.545 23.757 115 H ALA 59 HN ALA 59 17.542 11.867 24.346 116 H GLY 60 HN GLY 60 17.795 14.788 27.725 117 H GLN 61 HN GLN 61 17.538 16.892 28.714 118 HE21 GLN 61 HE21 GLN 61 17.338 19.422 32.927 119 HE22 GLN 61 HE22 GLN 61 18.610 20.531 33.303 120 H GLU 62 HN GLU 62 15.529 18.834 25.934 121 H GLU 63 HN GLU 63 16.659 20.412 21.976 122 H TYR 64 HN TYR 64 13.560 22.656 19.955 123 HH TYR 64 HH TYR 64 9.589 19.315 13.202 124 H SER 65 HN SER 65 13.093 18.864 17.538 125 HG SER 65 HG SER 65 17.171 16.883 16.138 126 H ALA 66 HN ALA 66 15.394 18.445 13.867 127 H MET 67 HN MET 67 15.097 16.009 14.870 128 H ARG 68 HN ARG 68 15.262 15.196 16.673 129 HE ARG 68 HE ARG 68 15.746 15.562 22.083 130 HH11 ARG 68 HH11 ARG 68 12.450 14.474 24.162 131 HH12 ARG 68 HH12 ARG 68 12.275 15.553 22.727 132 HH21 ARG 68 HH21 ARG 68 14.549 13.737 24.808 133 HH22 ARG 68 HH22 ARG 68 16.003 14.253 23.857 134 H ASP 69 HN ASP 69 12.607 15.650 17.080 135 H GLN 70 HN GLN 70 11.963 13.298 16.109 136 HE21 GLN 70 HE21 GLN 70 12.414 9.067 11.549 137 HE22 GLN 70 HE22 GLN 70 13.974 9.533 10.966 138 H TYR 71 HN TYR 71 12.625 10.955 15.829 139 HH TYR 71 HH TYR 71 17.485 12.547 18.450 140 H MET 72 HN MET 72 11.343 10.751 18.211 141 H ARG 73 HN ARG 73 8.927 9.697 17.565 142 HE ARG 73 HE ARG 73 6.496 12.394 15.090 143 HH11 ARG 73 HH11 ARG 73 3.310 13.825 15.554 144 HH12 ARG 73 HH12 ARG 73 3.866 15.472 15.076 145 HH21 ARG 73 HH21 ARG 73 6.081 15.818 14.474 146 HH22 ARG 73 HH22 ARG 73 7.234 14.428 14.484 147 H THR 74 HN THR 74 8.347 7.584 17.746 148 HG1 THR 74 HG1 THR 74 10.021 6.112 17.727 149 H GLY 75 HN GLY 75 7.380 6.480 19.757 150 H GLU 76 HN GLU 76 4.283 4.053 22.094 151 H GLY 77 HN GLY 77 4.089 4.348 24.010 152 H PHE 78 HN PHE 78 3.659 6.860 27.607 153 H LEU 79 HN LEU 79 7.704 6.652 29.322 154 H CYS 80 HN CYS 80 6.295 8.439 33.095 155 HG CYS 80 HG CYS 80 5.613 10.227 31.362 156 H VAL 81 HN VAL 81 10.133 9.472 33.482 157 H PHE 82 HN PHE 82 10.540 9.832 37.926 158 H ALA 83 HN ALA 83 13.317 12.823 39.620 159 H ILE 84 HN ILE 84 12.724 10.522 43.321 160 H ASN 85 HN ASN 85 14.350 12.399 44.365 161 HD21 ASN 85 HD21 ASN 85 15.802 10.243 45.976 162 HD22 ASN 85 HD22 ASN 85 16.591 9.962 44.464 163 H ASN 86 HN ASN 86 13.986 14.619 43.977 164 HD21 ASN 86 HD21 ASN 86 17.368 16.078 40.208 165 HD22 ASN 86 HD22 ASN 86 17.442 17.777 39.891 166 H THR 87 HN THR 87 14.066 18.505 44.444 167 HG1 THR 87 HG1 THR 87 12.572 20.026 46.355 168 H LYS 88 HN LYS 88 14.179 19.701 42.049 169 HZ1 LYS 88 HZ1 LYS 88 15.807 22.056 35.981 170 HZ2 LYS 88 HZ2 LYS 88 17.455 22.412 35.978 171 HZ3 LYS 88 HZ3 LYS 88 16.351 23.541 35.388 172 H SER 89 HN SER 89 13.749 17.786 40.426 173 HG SER 89 HG SER 89 13.272 14.641 37.558 174 H PHE 90 HN PHE 90 11.455 16.966 40.660 175 H GLU 91 HN GLU 91 10.057 18.950 39.884 176 H ASP 92 HN ASP 92 10.292 18.618 37.394 177 H ILE 93 HN ILE 93 8.375 17.557 36.321 178 H HIS 94 HN HIS 94 6.123 18.586 35.123 179 HD1 HIS 94 HD1 HIS 94 1.581 19.596 34.436 180 HE2 HIS 94 HE2 HIS 94 1.260 22.467 31.673 181 H HIS 95 HN HIS 95 7.372 19.747 33.214 182 HD1 HIS 95 HD1 HIS 95 11.840 19.830 31.602 183 HE2 HIS 95 HE2 HIS 95 11.831 21.954 28.203 184 H TYR 96 HN TYR 96 8.207 17.844 31.484 185 HH TYR 96 HH TYR 96 14.652 17.600 31.081 186 H ARG 97 HN ARG 97 6.064 16.973 30.824 187 HE ARG 97 HE ARG 97 1.646 14.615 32.164 188 HH11 ARG 97 HH11 ARG 97 -1.079 16.502 30.981 189 HH12 ARG 97 HH12 ARG 97 -2.174 15.070 30.873 190 HH21 ARG 97 HH21 ARG 97 0.305 12.779 32.047 191 HH22 ARG 97 HH22 ARG 97 -1.393 12.980 31.474 192 H GLU 98 HN GLU 98 4.675 18.792 29.220 193 H GLN 99 HN GLN 99 6.097 18.476 27.036 194 HE21 GLN 99 HE21 GLN 99 10.300 15.858 25.052 195 HE22 GLN 99 HE22 GLN 99 11.800 16.700 25.227 196 H ILE 100 HN ILE 100 5.602 16.073 26.176 197 H LYS 101 HN LYS 101 3.060 16.219 25.603 198 HZ1 LYS 101 HZ1 LYS 101 -2.235 16.939 24.941 199 HZ2 LYS 101 HZ2 LYS 101 -3.352 18.203 25.089 200 HZ3 LYS 101 HZ3 LYS 101 -3.239 17.021 26.299 201 H ARG 102 HN ARG 102 3.225 17.729 23.417 202 HE ARG 102 HE ARG 102 4.920 19.436 18.233 203 HH11 ARG 102 HH11 ARG 102 8.684 18.887 19.618 204 HH12 ARG 102 HH12 ARG 102 7.590 20.080 20.432 205 HH21 ARG 102 HH21 ARG 102 6.286 17.948 17.184 206 HH22 ARG 102 HH22 ARG 102 7.964 17.722 17.819 207 H VAL 103 HN VAL 103 4.564 16.418 21.525 208 H LYS 104 HN LYS 104 2.775 14.490 21.094 209 HZ1 LYS 104 HZ1 LYS 104 1.670 7.517 19.467 210 HZ2 LYS 104 HZ2 LYS 104 3.222 7.744 20.108 211 HZ3 LYS 104 HZ3 LYS 104 2.744 8.590 18.725 212 H ASP 105 HN ASP 105 1.071 15.592 20.037 213 H SER 106 HN SER 106 -1.410 15.300 21.448 214 HG SER 106 HG SER 106 -1.831 12.715 20.316 215 H GLU 107 HN GLU 107 -5.515 14.606 22.884 216 H ASP 108 HN ASP 108 -5.586 12.876 24.244 217 H VAL 109 HN VAL 109 -2.923 11.311 26.924 218 H MET 111 HN MET 111 -0.419 7.625 29.960 219 H VAL 112 HN VAL 112 3.516 7.181 31.813 220 H LEU 113 HN LEU 113 2.620 7.527 36.069 221 H VAL 114 HN VAL 114 6.970 8.554 36.674 222 H GLY 115 HN GLY 115 7.910 6.535 40.327 223 H ASN 116 HN ASN 116 11.662 8.083 40.188 224 HD21 ASN 116 HD21 ASN 116 16.017 6.523 38.801 225 HD22 ASN 116 HD22 ASN 116 16.613 4.970 39.267 226 H LYS 117 HN LYS 117 14.570 5.280 42.340 227 HZ1 LYS 117 HZ1 LYS 117 19.503 10.820 41.122 228 HZ2 LYS 117 HZ2 LYS 117 20.488 9.852 40.153 229 HZ3 LYS 117 HZ3 LYS 117 20.582 9.732 41.835 230 H CYS 118 HN CYS 118 13.506 4.995 44.704 231 HG CYS 118 HG CYS 118 11.271 2.302 46.321 232 H ASP 119 HN ASP 119 14.938 4.238 46.561 233 H LEU 120 HN LEU 120 16.190 6.076 47.675 234 H SER 122 HN SER 122 17.405 10.065 50.483 235 HG SER 122 HG SER 122 18.986 11.716 48.366 236 H ARG 123 HN ARG 123 14.868 10.994 50.936 237 HE ARG 123 HE ARG 123 10.598 8.347 50.250 238 HH11 ARG 123 HH11 ARG 123 8.147 10.248 48.588 239 HH12 ARG 123 HH12 ARG 123 7.390 8.805 47.816 240 HH21 ARG 123 HH21 ARG 123 9.673 6.488 49.282 241 HH22 ARG 123 HH22 ARG 123 8.239 6.697 48.196 242 H THR 124 HN THR 124 12.915 13.948 48.175 243 HG1 THR 124 HG1 THR 124 14.772 15.802 48.717 244 H VAL 125 HN VAL 125 10.993 14.073 47.654 245 H ASP 126 HN ASP 126 6.864 14.775 48.876 246 H THR 127 HN THR 127 5.451 10.463 49.663 247 HG1 THR 127 HG1 THR 127 5.181 7.388 49.686 248 H LYS 128 HN LYS 128 2.820 11.402 49.530 249 HZ1 LYS 128 HZ1 LYS 128 -2.648 14.658 48.467 250 HZ2 LYS 128 HZ2 LYS 128 -1.754 15.972 49.036 251 HZ3 LYS 128 HZ3 LYS 128 -3.439 15.996 49.128 252 H GLN 129 HN GLN 129 2.937 13.593 47.995 253 HE21 GLN 129 HE21 GLN 129 4.787 16.714 50.217 254 HE22 GLN 129 HE22 GLN 129 6.423 17.104 49.820 255 H ALA 130 HN ALA 130 3.592 12.827 45.476 256 H GLN 131 HN GLN 131 1.622 11.157 44.856 257 HE21 GLN 131 HE21 GLN 131 -0.732 9.355 47.221 258 HE22 GLN 131 HE22 GLN 131 -0.819 7.913 48.167 259 H ASP 132 HN ASP 132 -0.433 12.833 44.809 260 H LEU 133 HN LEU 133 -0.072 14.515 42.679 261 H ALA 134 HN ALA 134 -0.215 12.733 40.769 262 H ARG 135 HN ARG 135 -2.689 11.884 40.759 263 HE ARG 135 HE ARG 135 -7.793 9.150 39.581 264 HH11 ARG 135 HH11 ARG 135 -8.890 6.664 42.598 265 HH12 ARG 135 HH12 ARG 135 -7.420 7.695 42.770 266 HH21 ARG 135 HH21 ARG 135 -10.144 6.777 40.686 267 HH22 ARG 135 HH22 ARG 135 -9.664 7.877 39.342 268 H SER 136 HN SER 136 -3.920 13.954 39.631 269 HG SER 136 HG SER 136 -5.614 16.435 40.579 270 H TYR 137 HN TYR 137 -3.478 13.746 37.136 271 HH TYR 137 HH TYR 137 0.037 19.252 36.080 272 H GLY 138 HN GLY 138 -4.779 12.009 36.447 273 H ILE 139 HN ILE 139 -3.192 10.279 35.962 274 H PHE 141 HN PHE 141 0.023 5.581 39.598 275 H ILE 142 HN ILE 142 4.175 5.077 39.386 276 H GLU 143 HN GLU 143 5.379 3.265 43.164 277 H THR 144 HN THR 144 9.776 4.471 42.414 278 HG1 THR 144 HG1 THR 144 8.599 2.517 40.271 279 H SER 145 HN SER 145 12.369 1.001 41.838 280 HG SER 145 HG SER 145 15.938 2.147 44.862 281 H ALA 146 HN ALA 146 16.017 2.538 40.971 282 H LYS 147 HN LYS 147 17.430 1.079 42.394 283 HZ1 LYS 147 HZ1 LYS 147 23.488 2.377 46.353 284 HZ2 LYS 147 HZ2 LYS 147 23.987 1.307 47.563 285 HZ3 LYS 147 HZ3 LYS 147 22.564 2.196 47.759 286 H THR 148 HN THR 148 16.965 -0.765 44.270 287 HG1 THR 148 HG1 THR 148 15.287 -1.061 46.880 288 H ARG 149 HN ARG 149 15.992 -1.994 42.463 289 HE ARG 149 HE ARG 149 12.321 -6.594 38.342 290 HH11 ARG 149 HH11 ARG 149 15.604 -7.837 38.622 291 HH12 ARG 149 HH12 ARG 149 15.573 -8.639 37.004 292 HH21 ARG 149 HH21 ARG 149 13.653 -8.508 35.698 293 HH22 ARG 149 HH22 ARG 149 12.208 -7.599 36.301 294 H GLN 150 HN GLN 150 13.079 -1.309 42.429 295 HE21 GLN 150 HE21 GLN 150 9.389 -1.862 47.847 296 HE22 GLN 150 HE22 GLN 150 9.707 -0.347 48.622 297 H GLY 151 HN GLY 151 9.109 -2.882 42.308 298 H VAL 152 HN VAL 152 10.399 -2.295 40.022 299 H ASP 153 HN ASP 153 9.970 -4.094 37.889 300 H ASP 154 HN ASP 154 7.392 -3.655 38.188 301 H ALA 155 HN ALA 155 6.817 -0.982 37.413 302 H PHE 156 HN PHE 156 7.385 -1.169 34.723 303 H TYR 157 HN TYR 157 5.533 -2.962 33.943 304 HH TYR 157 HH TYR 157 7.157 -9.660 33.386 305 H THR 158 HN THR 158 3.295 -1.682 34.433 306 HG1 THR 158 HG1 THR 158 2.706 -1.003 36.356 307 H LEU 159 HN LEU 159 3.280 0.398 32.621 308 H VAL 160 HN VAL 160 2.944 -0.901 30.064 309 H ARG 161 HN ARG 161 0.543 -1.878 30.588 310 HE ARG 161 HE ARG 161 -0.881 -6.625 32.605 311 HH11 ARG 161 HH11 ARG 161 -0.374 -4.729 35.525 312 HH12 ARG 161 HH12 ARG 161 0.346 -6.109 36.433 313 HH21 ARG 161 HH21 ARG 161 0.045 -8.404 33.723 314 HH22 ARG 161 HH22 ARG 161 0.577 -8.152 35.438 315 H GLU 162 HN GLU 162 -0.942 0.275 30.462 316 H ILE 163 HN ILE 163 -0.986 1.007 28.122 317 H ARG 164 HN ARG 164 -2.379 -0.970 27.005 318 HE ARG 164 HE ARG 164 -0.689 -5.604 26.316 319 HH11 ARG 164 HH11 ARG 164 -2.136 -6.326 29.442 320 HH12 ARG 164 HH12 ARG 164 -0.818 -7.465 29.936 321 HH21 ARG 164 HH21 ARG 164 0.996 -7.047 26.872 322 HH22 ARG 164 HH22 ARG 164 0.936 -7.866 28.484 323 H LYS 165 HN LYS 165 -4.906 -0.281 27.726 324 HZ1 LYS 165 HZ1 LYS 165 -5.424 -1.003 32.691 325 HZ2 LYS 165 HZ2 LYS 165 -4.268 0.234 32.664 326 HZ3 LYS 165 HZ3 LYS 165 -4.602 -0.643 31.253 327 H HIS 166 HN HIS 166 -5.268 1.707 26.323 328 HD1 HIS 166 HD1 HIS 166 -3.571 4.771 22.653 329 HE2 HIS 166 HE2 HIS 166 -5.734 8.059 23.381 330 H LYS 167 HN LYS 167 -5.531 0.945 23.930 331 HZ1 LYS 167 HZ1 LYS 167 -1.169 -3.148 21.709 332 HZ2 LYS 167 HZ2 LYS 167 -0.207 -2.358 20.571 333 HZ3 LYS 167 HZ3 LYS 167 -1.649 -3.099 20.092 334 H GLU 168 HN GLU 168 -7.882 -0.270 23.809 335 H LYS 169 HN LYS 169 -9.481 1.692 24.366 336 HZ1 LYS 169 HZ1 LYS 169 -8.688 8.638 26.054 337 HZ2 LYS 169 HZ2 LYS 169 -9.634 8.556 27.458 338 HZ3 LYS 169 HZ3 LYS 169 -9.983 9.712 26.277 339 H MET 170 HN MET 170 -9.284 3.236 22.071 340 H SER 171 HN SER 171 -10.920 1.783 20.646 341 HG SER 171 HG SER 171 -9.894 0.131 19.734 342 H LYS 172 HN LYS 172 -13.173 2.195 21.087 343 HZ1 LYS 172 HZ1 LYS 172 -16.917 0.853 26.118 344 HZ2 LYS 172 HZ2 LYS 172 -16.812 -0.836 26.172 345 HZ3 LYS 172 HZ3 LYS 172 -18.295 -0.091 25.869 346 H ASP 173 HN ASP 173 -13.660 4.147 20.420 347 H GLY 174 HN GLY 174 -14.416 4.970 22.698 348 H LYS 175 HN LYS 175 -16.547 8.215 23.505 349 HZ1 LYS 175 HZ1 LYS 175 -23.313 5.995 27.931 350 HZ2 LYS 175 HZ2 LYS 175 -21.727 5.623 28.360 351 HZ3 LYS 175 HZ3 LYS 175 -22.275 5.309 26.788 352 H LYS 176 HN LYS 176 -20.529 7.165 22.901 353 HZ1 LYS 176 HZ1 LYS 176 -17.696 4.595 17.989 354 HZ2 LYS 176 HZ2 LYS 176 -18.729 3.499 18.771 355 HZ3 LYS 176 HZ3 LYS 176 -18.418 5.006 19.467 356 H LYS 177 HN LYS 177 -22.507 8.185 23.146 357 HZ1 LYS 177 HZ1 LYS 177 -30.266 8.729 26.127 358 HZ2 LYS 177 HZ2 LYS 177 -28.898 8.134 26.920 359 HZ3 LYS 177 HZ3 LYS 177 -29.450 7.382 25.512 360 H LYS 178 HN LYS 178 -23.880 12.303 22.681 361 HZ1 LYS 178 HZ1 LYS 178 -18.614 13.672 21.433 362 HZ2 LYS 178 HZ2 LYS 178 -17.285 12.749 21.906 363 HZ3 LYS 178 HZ3 LYS 178 -17.677 14.154 22.754 364 H LYS 179 HN LYS 179 -23.405 13.984 26.708 365 HZ1 LYS 179 HZ1 LYS 179 -27.825 11.580 31.583 366 HZ2 LYS 179 HZ2 LYS 179 -27.954 13.020 32.463 367 HZ3 LYS 179 HZ3 LYS 179 -26.516 12.134 32.500 368 H LYS 180 HN LYS 180 -27.045 16.663 26.454 369 HZ1 LYS 180 HZ1 LYS 180 -22.727 21.876 24.532 370 HZ2 LYS 180 HZ2 LYS 180 -22.140 20.354 24.101 371 HZ3 LYS 180 HZ3 LYS 180 -22.795 20.600 25.640 372 H SER 181 HN SER 181 -26.309 17.689 28.953 373 HG SER 181 HG SER 181 -29.863 17.798 31.913 374 H LYS 182 HN LYS 182 -27.958 20.691 31.876 375 HZ1 LYS 182 HZ1 LYS 182 -25.709 26.346 35.017 376 HZ2 LYS 182 HZ2 LYS 182 -25.112 27.042 33.601 377 HZ3 LYS 182 HZ3 LYS 182 -24.044 26.367 34.721 378 H THR 183 HN THR 183 -27.448 18.865 33.335 379 HG1 THR 183 HG1 THR 183 -24.858 18.875 35.353 380 H LYS 184 HN LYS 184 -25.699 18.423 37.383 381 HZ1 LYS 184 HZ1 LYS 184 -27.347 15.958 43.932 382 HZ2 LYS 184 HZ2 LYS 184 -28.458 17.208 43.668 383 HZ3 LYS 184 HZ3 LYS 184 -27.162 17.441 44.731 384 H CYS 185 HN CYS 185 -26.717 21.269 40.572 385 HG CYS 185 HG CYS 185 -25.458 23.362 38.521 386 HE21 GLN 418 HE21 GLN 418 14.699 29.480 -16.170 387 HE22 GLN 418 HE22 GLN 418 13.228 29.248 -15.297 388 HE21 GLN 424 HE21 GLN 424 25.094 32.944 -23.343 389 HE22 GLN 424 HE22 GLN 424 24.072 34.317 -23.574 390 HE21 GLN 439 HE21 GLN 439 39.461 17.784 -17.537 391 HE22 GLN 439 HE22 GLN 439 39.998 19.092 -16.540 392 HE21 GLN 453 HE21 GLN 453 48.387 -7.462 -19.902 393 HE22 GLN 453 HE22 GLN 453 49.347 -6.109 -20.394 394 HE21 GLN 460 HE21 GLN 460 45.861 -16.024 -16.372 395 HE22 GLN 460 HE22 GLN 460 46.268 -16.202 -18.040 396 HE21 GLN 464 HE21 GLN 464 44.730 -24.534 -13.386 397 HE22 GLN 464 HE22 GLN 464 43.816 -25.353 -14.606 398 HE21 GLN 472 HE21 GLN 472 45.492 -33.083 -7.401 399 HE22 GLN 472 HE22 GLN 472 46.433 -31.634 -7.500 400 HE21 GLN 482 HE21 GLN 482 32.353 -44.453 -8.418 401 HE22 GLN 482 HE22 GLN 482 32.685 -44.082 -10.073 402 HE21 GLN 487 HE21 GLN 487 26.784 -49.054 2.803 403 HE22 GLN 487 HE22 GLN 487 28.046 -49.192 3.978 404 HE21 GLN 493 HE21 GLN 493 18.410 -55.292 -6.167 405 HE22 GLN 493 HE22 GLN 493 20.137 -55.425 -6.163 406 HE21 GLN 527 HE21 GLN 527 -27.972 -49.883 7.365 407 HE22 GLN 527 HE22 GLN 527 -28.099 -50.994 8.686 408 HAC EWS 237 HAC DRG 203 13.979 6.455 15.605 409 HAD EWS 237 HAD DRG 203 11.937 4.532 14.607 410 HAE EWS 237 HAE DRG 203 12.155 6.306 14.239 411 HAF EWS 237 HAF DRG 203 15.451 4.672 16.260 412 HAG EWS 237 HAG DRG 203 14.425 3.465 15.337 413 HAI EWS 237 HAI DRG 203 16.275 5.638 14.437 414 HAH EWS 237 HAH DRG 203 16.032 3.972 13.749 415 HAJ EWS 237 HAJ DRG 203 13.378 3.860 13.031 416 HAL EWS 237 HAL DRG 203 11.528 4.962 11.977 417 HAK EWS 237 HAK DRG 203 12.456 6.523 11.899 418 HAM EWS 237 HAM DRG 203 12.180 3.040 10.726 419 HAN EWS 237 HAN DRG 203 14.026 6.967 10.303 420 HAO EWS 237 HAO DRG 203 14.984 6.267 8.100 421 HAP EWS 237 HAP DRG 203 13.152 2.345 8.532 422 HAQ EWS 237 HAQ DRG 203 12.517 2.609 17.854 423 HAS EWS 237 HAS DRG 203 9.606 1.264 20.808 424 HAT EWS 237 HAT DRG 203 9.734 3.529 21.883 425 HAX EWS 237 HAX DRG 203 12.653 7.058 20.078 426 HAA EWS 237 HAA DRG 203 11.908 4.845 16.750 427 HAZ EWS 237 HAZ DRG 203 14.718 6.452 13.172 428 HAW EWS 237 HAW DRG 203 10.955 5.941 21.624 429 HAY EWS 237 HAY DRG 203 15.149 5.244 12.173 Start of MODEL 5 1 HE21 GLN 220 HE21 GLN 220 -30.340 36.932 -8.049 2 HE22 GLN 220 HE22 GLN 220 -31.583 38.048 -7.612 3 HE21 GLN 226 HE21 GLN 226 -39.688 32.582 0.073 4 HE22 GLN 226 HE22 GLN 226 -39.195 34.241 0.043 5 HE21 GLN 241 HE21 GLN 241 -49.797 11.197 0.370 6 HE22 GLN 241 HE22 GLN 241 -51.305 11.628 -0.358 7 HE21 GLN 255 HE21 GLN 255 -49.547 -10.676 12.290 8 HE22 GLN 255 HE22 GLN 255 -50.582 -9.702 13.269 9 HE21 GLN 262 HE21 GLN 262 -43.382 -18.227 13.916 10 HE22 GLN 262 HE22 GLN 262 -43.008 -16.960 15.033 11 HE21 GLN 266 HE21 GLN 266 -43.275 -24.793 12.330 12 HE22 GLN 266 HE22 GLN 266 -44.436 -24.347 13.531 13 HE21 GLN 274 HE21 GLN 274 -37.409 -36.586 9.147 14 HE22 GLN 274 HE22 GLN 274 -39.127 -36.410 9.244 15 HE21 GLN 284 HE21 GLN 284 -22.788 -40.074 14.631 16 HE22 GLN 284 HE22 GLN 284 -23.232 -39.222 16.069 17 HE21 GLN 289 HE21 GLN 289 -17.148 -50.119 7.611 18 HE22 GLN 289 HE22 GLN 289 -18.633 -50.001 6.730 19 HE21 GLN 295 HE21 GLN 295 -6.923 -46.817 15.590 20 HE22 GLN 295 HE22 GLN 295 -8.204 -46.190 16.563 21 HE21 GLN 329 HE21 GLN 329 40.792 -35.605 1.059 22 HE22 GLN 329 HE22 GLN 329 40.792 -37.330 1.160 23 H MET 1 HT1 MET 1 2.489 -11.151 16.950 24 H THR 2 HN THR 2 2.250 -9.265 20.752 25 HG1 THR 2 HG1 THR 2 0.222 -8.763 21.007 26 H GLU 3 HN GLU 3 2.757 -5.376 18.454 27 H TYR 4 HN TYR 4 6.255 -3.705 20.816 28 HH TYR 4 HH TYR 4 0.203 -5.613 24.875 29 H LYS 5 HN LYS 5 5.223 0.343 21.218 30 HZ1 LYS 5 HZ1 LYS 5 7.275 -2.036 15.757 31 HZ2 LYS 5 HZ2 LYS 5 8.500 -1.364 16.714 32 HZ3 LYS 5 HZ3 LYS 5 7.984 -0.556 15.323 33 H LEU 6 HN LEU 6 8.874 1.190 23.073 34 H VAL 7 HN VAL 7 8.569 4.759 25.783 35 H VAL 8 HN VAL 8 12.468 5.443 27.127 36 H VAL 9 HN VAL 9 10.754 8.558 29.564 37 H GLY 10 HN GLY 10 14.107 11.255 30.481 38 H ALA 11 HN ALA 11 14.763 12.593 34.535 39 H VAL 12 HN VAL 12 18.721 14.709 34.217 40 H GLY 13 HN GLY 13 21.324 10.975 34.563 41 H VAL 14 HN VAL 14 19.218 10.530 35.998 42 H GLY 15 HN GLY 15 19.213 7.903 35.607 43 H LYS 16 HN LYS 16 18.626 6.743 33.975 44 HZ1 LYS 16 HZ1 LYS 16 16.876 7.565 28.578 45 HZ2 LYS 16 HZ2 LYS 16 16.770 9.203 28.151 46 HZ3 LYS 16 HZ3 LYS 16 15.383 8.371 28.673 47 H SER 17 HN SER 17 19.798 4.933 32.198 48 HG SER 17 HG SER 17 22.870 4.197 32.107 49 H ALA 18 HN ALA 18 20.095 3.130 34.063 50 H LEU 19 HN LEU 19 17.974 1.734 34.008 51 H THR 20 HN THR 20 17.211 0.833 32.044 52 HG1 THR 20 HG1 THR 20 15.972 1.462 30.519 53 H ILE 21 HN ILE 21 19.313 -0.865 31.326 54 H GLN 22 HN GLN 22 18.923 -2.598 33.231 55 HE21 GLN 22 HE21 GLN 22 19.116 -4.066 38.358 56 HE22 GLN 22 HE22 GLN 22 19.946 -5.566 38.580 57 H LEU 23 HN LEU 23 16.743 -3.873 32.583 58 H ILE 24 HN ILE 24 17.214 -4.973 30.423 59 H GLN 25 HN GLN 25 19.566 -6.464 30.328 60 HE21 GLN 25 HE21 GLN 25 22.647 -5.013 28.668 61 HE22 GLN 25 HE22 GLN 25 24.286 -5.067 28.127 62 H ASN 26 HN ASN 26 18.980 -7.581 32.180 63 HD21 ASN 26 HD21 ASN 26 17.941 -12.049 33.061 64 HD22 ASN 26 HD22 ASN 26 16.286 -11.652 33.362 65 H HIS 27 HN HIS 27 21.166 -6.842 33.417 66 HD1 HIS 27 HD1 HIS 27 25.693 -8.084 35.804 67 HE2 HIS 27 HE2 HIS 27 27.814 -4.858 34.783 68 H PHE 28 HN PHE 28 23.326 -5.838 37.076 69 H VAL 29 HN VAL 29 23.336 -1.444 36.029 70 H ASP 30 HN ASP 30 27.685 -0.400 36.701 71 H GLU 31 HN GLU 31 28.492 1.093 36.019 72 H TYR 32 HN TYR 32 29.419 5.524 35.811 73 HH TYR 32 HH TYR 32 26.611 12.440 32.036 74 H ASP 33 HN ASP 33 26.338 5.974 32.645 75 H THR 35 HN THR 35 23.702 9.800 28.247 76 HG1 THR 35 HG1 THR 35 22.998 6.216 26.653 77 H ILE 36 HN ILE 36 23.036 8.292 24.128 78 H GLU 37 HN GLU 37 22.293 7.776 22.198 79 H ASP 38 HN ASP 38 19.289 5.654 22.691 80 H SER 39 HN SER 39 19.329 1.631 21.191 81 HG SER 39 HG SER 39 17.075 0.598 18.955 82 H TYR 40 HN TYR 40 16.066 -0.397 23.397 83 HH TYR 40 HH TYR 40 23.043 -0.018 24.955 84 H ARG 41 HN ARG 41 16.426 -4.190 21.814 85 HE ARG 41 HE ARG 41 13.733 -6.835 18.196 86 HH11 ARG 41 HH11 ARG 41 12.588 -4.908 14.817 87 HH12 ARG 41 HH12 ARG 41 12.123 -4.256 16.429 88 HH21 ARG 41 HH21 ARG 41 14.356 -7.697 16.165 89 HH22 ARG 41 HH22 ARG 41 13.834 -6.841 14.668 90 H LYS 42 HN LYS 42 12.460 -5.932 23.178 91 HZ1 LYS 42 HZ1 LYS 42 15.987 -11.187 28.456 92 HZ2 LYS 42 HZ2 LYS 42 16.642 -9.647 28.200 93 HZ3 LYS 42 HZ3 LYS 42 15.754 -10.408 26.974 94 H GLN 43 HN GLN 43 12.546 -10.172 24.148 95 HE21 GLN 43 HE21 GLN 43 7.971 -13.373 20.682 96 HE22 GLN 43 HE22 GLN 43 8.959 -14.706 20.181 97 H VAL 44 HN VAL 44 8.595 -9.654 25.293 98 H VAL 45 HN VAL 45 7.092 -12.110 28.710 99 H ILE 46 HN ILE 46 3.121 -10.798 27.840 100 H ASP 47 HN ASP 47 1.568 -11.343 31.715 101 H GLY 48 HN GLY 48 1.044 -13.471 30.210 102 H GLU 49 HN GLU 49 -0.423 -12.393 27.994 103 H THR 50 HN THR 50 1.460 -13.585 24.240 104 HG1 THR 50 HG1 THR 50 5.698 -14.692 23.049 105 H CYS 51 HN CYS 51 5.271 -10.980 24.156 106 HG CYS 51 HG CYS 51 5.304 -9.349 25.555 107 H LEU 52 HN LEU 52 5.676 -7.681 21.291 108 H LEU 53 HN LEU 53 9.272 -6.482 22.981 109 H ASP 54 HN ASP 54 9.572 -2.123 22.172 110 H ILE 55 HN ILE 55 13.444 -1.040 23.670 111 H LEU 56 HN LEU 56 12.541 3.116 23.440 112 H ASP 57 HN ASP 57 16.697 4.073 24.169 113 H THR 58 HN THR 58 15.707 7.883 25.301 114 HG1 THR 58 HG1 THR 58 14.316 9.081 23.399 115 H ALA 59 HN ALA 59 18.527 11.208 24.137 116 H GLY 60 HN GLY 60 18.830 13.044 28.372 117 H GLN 61 HN GLN 61 19.188 15.275 28.609 118 HE21 GLN 61 HE21 GLN 61 20.030 19.732 32.519 119 HE22 GLN 61 HE22 GLN 61 21.538 19.136 33.122 120 H GLU 62 HN GLU 62 17.273 17.936 26.446 121 H GLU 63 HN GLU 63 18.625 20.077 22.923 122 H TYR 64 HN TYR 64 15.510 22.775 21.365 123 HH TYR 64 HH TYR 64 9.990 22.237 14.802 124 H SER 65 HN SER 65 14.254 19.484 18.531 125 HG SER 65 HG SER 65 18.098 17.035 16.856 126 H ALA 66 HN ALA 66 15.847 19.181 14.566 127 H MET 67 HN MET 67 15.957 16.507 14.670 128 H ARG 68 HN ARG 68 15.214 15.898 16.824 129 HE ARG 68 HE ARG 68 12.546 17.520 22.821 130 HH11 ARG 68 HH11 ARG 68 15.500 15.362 24.579 131 HH12 ARG 68 HH12 ARG 68 15.662 15.871 22.853 132 HH21 ARG 68 HH21 ARG 68 12.289 16.883 25.015 133 HH22 ARG 68 HH22 ARG 68 13.616 15.931 25.786 134 H ASP 69 HN ASP 69 12.494 16.462 17.265 135 H GLN 70 HN GLN 70 11.632 14.451 15.759 136 HE21 GLN 70 HE21 GLN 70 9.646 13.742 11.168 137 HE22 GLN 70 HE22 GLN 70 7.942 13.740 11.466 138 H TYR 71 HN TYR 71 12.154 12.213 16.879 139 HH TYR 71 HH TYR 71 16.097 13.990 21.635 140 H MET 72 HN MET 72 9.820 11.884 18.227 141 H ARG 73 HN ARG 73 8.182 10.601 17.630 142 HE ARG 73 HE ARG 73 7.147 15.127 15.990 143 HH11 ARG 73 HH11 ARG 73 3.450 16.353 14.826 144 HH12 ARG 73 HH12 ARG 73 3.881 14.605 14.773 145 HH21 ARG 73 HH21 ARG 73 6.610 17.359 16.162 146 HH22 ARG 73 HH22 ARG 73 4.969 17.886 15.605 147 H THR 74 HN THR 74 7.956 8.592 17.673 148 HG1 THR 74 HG1 THR 74 10.291 7.594 17.228 149 H GLY 75 HN GLY 75 7.368 7.198 19.452 150 H GLU 76 HN GLU 76 4.935 4.034 21.752 151 H GLY 77 HN GLY 77 4.357 4.085 23.774 152 H PHE 78 HN PHE 78 3.650 6.641 27.418 153 H LEU 79 HN LEU 79 7.674 6.882 28.963 154 H CYS 80 HN CYS 80 6.311 8.318 32.894 155 HG CYS 80 HG CYS 80 6.413 11.671 31.118 156 H VAL 81 HN VAL 81 10.155 9.624 33.514 157 H PHE 82 HN PHE 82 10.468 9.779 37.926 158 H ALA 83 HN ALA 83 13.291 12.620 39.775 159 H ILE 84 HN ILE 84 12.721 10.337 43.543 160 H ASN 85 HN ASN 85 14.352 12.116 44.528 161 HD21 ASN 85 HD21 ASN 85 18.204 13.945 45.196 162 HD22 ASN 85 HD22 ASN 85 18.476 13.128 43.695 163 H ASN 86 HN ASN 86 14.102 14.297 43.950 164 HD21 ASN 86 HD21 ASN 86 16.748 16.306 40.118 165 HD22 ASN 86 HD22 ASN 86 16.857 18.027 39.982 166 H THR 87 HN THR 87 13.642 18.247 44.426 167 HG1 THR 87 HG1 THR 87 12.723 19.613 45.822 168 H LYS 88 HN LYS 88 13.896 19.245 41.971 169 HZ1 LYS 88 HZ1 LYS 88 13.605 23.648 35.439 170 HZ2 LYS 88 HZ2 LYS 88 12.692 23.273 36.813 171 HZ3 LYS 88 HZ3 LYS 88 13.331 22.030 35.859 172 H SER 89 HN SER 89 13.661 17.444 39.794 173 HG SER 89 HG SER 89 14.950 16.368 37.497 174 H PHE 90 HN PHE 90 11.211 16.900 40.219 175 H GLU 91 HN GLU 91 9.631 18.908 39.596 176 H ASP 92 HN ASP 92 10.151 19.110 37.238 177 H ILE 93 HN ILE 93 8.500 17.431 36.011 178 H HIS 94 HN HIS 94 6.338 18.662 35.077 179 HD1 HIS 94 HD1 HIS 94 2.100 20.931 35.744 180 HE2 HIS 94 HE2 HIS 94 1.567 23.240 32.523 181 H HIS 95 HN HIS 95 7.174 20.043 33.056 182 HD1 HIS 95 HD1 HIS 95 11.335 20.630 31.056 183 HE2 HIS 95 HE2 HIS 95 10.804 22.561 27.578 184 H TYR 96 HN TYR 96 7.842 18.154 31.403 185 HH TYR 96 HH TYR 96 14.617 16.893 29.645 186 H ARG 97 HN ARG 97 5.719 16.981 30.792 187 HE ARG 97 HE ARG 97 -0.665 15.454 30.390 188 HH11 ARG 97 HH11 ARG 97 1.006 12.781 31.910 189 HH12 ARG 97 HH12 ARG 97 -0.518 12.006 32.483 190 HH21 ARG 97 HH21 ARG 97 -2.622 14.517 31.098 191 HH22 ARG 97 HH22 ARG 97 -2.554 12.978 32.037 192 H GLU 98 HN GLU 98 4.212 18.797 29.187 193 H GLN 99 HN GLN 99 5.709 18.610 27.038 194 HE21 GLN 99 HE21 GLN 99 9.808 20.315 24.147 195 HE22 GLN 99 HE22 GLN 99 11.369 19.820 24.712 196 H ILE 100 HN ILE 100 5.479 16.209 26.080 197 H LYS 101 HN LYS 101 2.941 16.271 25.429 198 HZ1 LYS 101 HZ1 LYS 101 -3.856 17.581 26.102 199 HZ2 LYS 101 HZ2 LYS 101 -3.410 17.097 27.663 200 HZ3 LYS 101 HZ3 LYS 101 -2.891 16.205 26.328 201 H ARG 102 HN ARG 102 2.899 17.837 23.227 202 HE ARG 102 HE ARG 102 6.118 20.849 21.694 203 HH11 ARG 102 HH11 ARG 102 5.711 20.124 18.268 204 HH12 ARG 102 HH12 ARG 102 7.230 19.141 18.170 205 HH21 ARG 102 HH21 ARG 102 8.046 19.637 21.607 206 HH22 ARG 102 HH22 ARG 102 8.540 18.885 20.029 207 H VAL 103 HN VAL 103 4.326 16.586 21.304 208 H LYS 104 HN LYS 104 2.784 14.476 20.956 209 HZ1 LYS 104 HZ1 LYS 104 2.978 7.667 20.380 210 HZ2 LYS 104 HZ2 LYS 104 2.037 8.382 19.168 211 HZ3 LYS 104 HZ3 LYS 104 1.316 7.349 20.293 212 H ASP 105 HN ASP 105 1.010 15.430 19.788 213 H SER 106 HN SER 106 -1.381 14.876 21.064 214 HG SER 106 HG SER 106 -2.094 12.709 19.596 215 H GLU 107 HN GLU 107 -5.476 14.125 22.503 216 H ASP 108 HN ASP 108 -5.727 12.680 24.543 217 H VAL 109 HN VAL 109 -2.579 11.174 27.180 218 H MET 111 HN MET 111 -0.379 7.534 29.993 219 H VAL 112 HN VAL 112 3.542 7.263 32.004 220 H LEU 113 HN LEU 113 2.477 7.645 36.133 221 H VAL 114 HN VAL 114 6.815 8.383 36.720 222 H GLY 115 HN GLY 115 7.711 6.668 40.577 223 H ASN 116 HN ASN 116 11.695 8.200 40.465 224 HD21 ASN 116 HD21 ASN 116 15.981 6.662 39.041 225 HD22 ASN 116 HD22 ASN 116 16.674 5.176 39.583 226 H LYS 117 HN LYS 117 14.418 5.210 42.581 227 HZ1 LYS 117 HZ1 LYS 117 20.514 9.187 40.222 228 HZ2 LYS 117 HZ2 LYS 117 20.910 9.109 41.866 229 HZ3 LYS 117 HZ3 LYS 117 19.678 10.145 41.343 230 H CYS 118 HN CYS 118 13.259 5.059 44.928 231 HG CYS 118 HG CYS 118 11.200 2.590 47.230 232 H ASP 119 HN ASP 119 14.800 4.599 46.848 233 H LEU 120 HN LEU 120 15.898 6.372 47.955 234 H SER 122 HN SER 122 17.354 10.280 50.977 235 HG SER 122 HG SER 122 19.029 11.826 51.919 236 H ARG 123 HN ARG 123 14.402 11.567 51.704 237 HE ARG 123 HE ARG 123 9.943 8.557 50.816 238 HH11 ARG 123 HH11 ARG 123 7.996 10.730 48.867 239 HH12 ARG 123 HH12 ARG 123 7.230 9.400 47.921 240 HH21 ARG 123 HH21 ARG 123 7.795 7.206 48.344 241 HH22 ARG 123 HH22 ARG 123 9.022 6.821 49.620 242 H THR 124 HN THR 124 12.870 14.057 48.451 243 HG1 THR 124 HG1 THR 124 14.515 15.877 49.292 244 H VAL 125 HN VAL 125 10.806 14.043 47.917 245 H ASP 126 HN ASP 126 6.615 14.976 48.724 246 H THR 127 HN THR 127 5.075 10.718 49.617 247 HG1 THR 127 HG1 THR 127 5.449 7.714 48.444 248 H LYS 128 HN LYS 128 2.498 11.673 49.327 249 HZ1 LYS 128 HZ1 LYS 128 -4.266 13.673 50.791 250 HZ2 LYS 128 HZ2 LYS 128 -3.823 13.704 49.164 251 HZ3 LYS 128 HZ3 LYS 128 -4.801 14.932 49.794 252 H GLN 129 HN GLN 129 2.741 13.804 47.829 253 HE21 GLN 129 HE21 GLN 129 4.792 18.688 46.641 254 HE22 GLN 129 HE22 GLN 129 6.351 18.661 47.388 255 H ALA 130 HN ALA 130 3.359 12.967 45.356 256 H GLN 131 HN GLN 131 1.451 11.402 44.842 257 HE21 GLN 131 HE21 GLN 131 -2.418 8.424 45.567 258 HE22 GLN 131 HE22 GLN 131 -2.472 7.253 46.837 259 H ASP 132 HN ASP 132 -0.669 13.095 44.681 260 H LEU 133 HN LEU 133 -0.171 14.470 42.514 261 H ALA 134 HN ALA 134 -0.145 12.644 40.674 262 H ARG 135 HN ARG 135 -2.708 11.868 40.684 263 HE ARG 135 HE ARG 135 -9.208 11.241 41.065 264 HH11 ARG 135 HH11 ARG 135 -7.745 8.053 41.214 265 HH12 ARG 135 HH12 ARG 135 -9.312 7.217 41.524 266 HH21 ARG 135 HH21 ARG 135 -11.230 10.220 41.449 267 HH22 ARG 135 HH22 ARG 135 -11.259 8.429 41.657 268 H SER 136 HN SER 136 -3.919 14.087 39.760 269 HG SER 136 HG SER 136 -4.274 15.971 40.774 270 H TYR 137 HN TYR 137 -3.154 13.779 37.263 271 HH TYR 137 HH TYR 137 1.396 18.855 33.689 272 H GLY 138 HN GLY 138 -4.779 12.318 36.290 273 H ILE 139 HN ILE 139 -3.185 10.199 36.160 274 H PHE 141 HN PHE 141 -0.060 5.821 40.024 275 H ILE 142 HN ILE 142 4.225 5.585 39.691 276 H GLU 143 HN GLU 143 5.509 3.342 43.205 277 H THR 144 HN THR 144 9.827 4.451 42.482 278 HG1 THR 144 HG1 THR 144 10.713 4.413 40.686 279 H SER 145 HN SER 145 12.618 1.037 42.100 280 HG SER 145 HG SER 145 16.154 2.298 45.179 281 H ALA 146 HN ALA 146 16.327 2.644 41.471 282 H LYS 147 HN LYS 147 17.321 0.820 42.971 283 HZ1 LYS 147 HZ1 LYS 147 21.185 2.974 48.541 284 HZ2 LYS 147 HZ2 LYS 147 20.121 1.804 49.132 285 HZ3 LYS 147 HZ3 LYS 147 19.565 2.988 48.053 286 H THR 148 HN THR 148 16.556 -1.171 44.105 287 HG1 THR 148 HG1 THR 148 14.682 -1.802 46.693 288 H ARG 149 HN ARG 149 15.782 -2.013 42.309 289 HE ARG 149 HE ARG 149 15.851 -6.325 38.471 290 HH11 ARG 149 HH11 ARG 149 12.852 -7.284 36.862 291 HH12 ARG 149 HH12 ARG 149 13.715 -8.288 35.627 292 HH21 ARG 149 HH21 ARG 149 16.968 -7.571 36.915 293 HH22 ARG 149 HH22 ARG 149 16.017 -8.445 35.649 294 H GLN 150 HN GLN 150 13.420 -2.064 43.395 295 HE21 GLN 150 HE21 GLN 150 9.169 0.354 45.268 296 HE22 GLN 150 HE22 GLN 150 9.348 1.121 46.807 297 H GLY 151 HN GLY 151 9.274 -3.348 42.460 298 H VAL 152 HN VAL 152 10.569 -2.113 40.412 299 H ASP 153 HN ASP 153 9.956 -3.928 38.466 300 H ASP 154 HN ASP 154 7.385 -3.809 38.570 301 H ALA 155 HN ALA 155 6.940 -1.236 37.731 302 H PHE 156 HN PHE 156 7.427 -1.427 35.012 303 H TYR 157 HN TYR 157 5.496 -3.083 34.205 304 HH TYR 157 HH TYR 157 6.959 -9.628 34.088 305 H THR 158 HN THR 158 3.367 -1.567 34.742 306 HG1 THR 158 HG1 THR 158 2.955 -0.785 36.652 307 H LEU 159 HN LEU 159 3.320 0.316 32.709 308 H VAL 160 HN VAL 160 2.675 -1.120 30.552 309 H ARG 161 HN ARG 161 0.147 -1.782 31.165 310 HE ARG 161 HE ARG 161 -0.858 -4.744 35.536 311 HH11 ARG 161 HH11 ARG 161 -2.733 -5.615 32.687 312 HH12 ARG 161 HH12 ARG 161 -2.252 -7.351 32.762 313 HH21 ARG 161 HH21 ARG 161 -0.219 -6.939 35.647 314 HH22 ARG 161 HH22 ARG 161 -0.860 -8.098 34.410 315 H GLU 162 HN GLU 162 -1.152 0.563 30.865 316 H ILE 163 HN ILE 163 -0.971 1.021 28.252 317 H ARG 164 HN ARG 164 -2.358 -1.009 27.255 318 HE ARG 164 HE ARG 164 -1.826 -6.476 26.307 319 HH11 ARG 164 HH11 ARG 164 -1.583 -7.828 30.132 320 HH12 ARG 164 HH12 ARG 164 -2.651 -6.429 29.716 321 HH21 ARG 164 HH21 ARG 164 -0.446 -8.228 26.750 322 HH22 ARG 164 HH22 ARG 164 -0.339 -8.848 28.441 323 H LYS 165 HN LYS 165 -4.975 -0.612 28.167 324 HZ1 LYS 165 HZ1 LYS 165 -6.399 1.365 33.701 325 HZ2 LYS 165 HZ2 LYS 165 -4.718 1.404 33.517 326 HZ3 LYS 165 HZ3 LYS 165 -5.494 -0.048 33.927 327 H HIS 166 HN HIS 166 -5.313 1.491 26.583 328 HD1 HIS 166 HD1 HIS 166 -4.257 5.074 22.865 329 HE2 HIS 166 HE2 HIS 166 -5.992 8.040 24.937 330 H LYS 167 HN LYS 167 -5.836 0.648 24.204 331 HZ1 LYS 167 HZ1 LYS 167 -1.031 -2.098 19.490 332 HZ2 LYS 167 HZ2 LYS 167 -2.373 -3.096 19.744 333 HZ3 LYS 167 HZ3 LYS 167 -1.333 -2.738 21.027 334 H GLU 168 HN GLU 168 -8.142 -0.352 24.517 335 H LYS 169 HN LYS 169 -9.883 1.519 25.028 336 HZ1 LYS 169 HZ1 LYS 169 -13.689 8.344 26.342 337 HZ2 LYS 169 HZ2 LYS 169 -13.628 6.768 26.939 338 HZ3 LYS 169 HZ3 LYS 169 -13.602 7.037 25.266 339 H MET 170 HN MET 170 -9.696 2.565 22.617 340 H SER 171 HN SER 171 -11.603 1.223 21.411 341 HG SER 171 HG SER 171 -10.616 -0.756 20.526 342 H LYS 172 HN LYS 172 -13.656 2.004 21.652 343 HZ1 LYS 172 HZ1 LYS 172 -18.893 -0.688 25.235 344 HZ2 LYS 172 HZ2 LYS 172 -17.378 -1.440 25.220 345 HZ3 LYS 172 HZ3 LYS 172 -17.922 -0.609 23.854 346 H ASP 173 HN ASP 173 -14.011 4.055 21.520 347 H GLY 174 HN GLY 174 -14.359 7.953 19.385 348 H LYS 175 HN LYS 175 -15.234 9.704 17.248 349 HZ1 LYS 175 HZ1 LYS 175 -10.828 14.674 15.837 350 HZ2 LYS 175 HZ2 LYS 175 -9.189 14.934 15.544 351 HZ3 LYS 175 HZ3 LYS 175 -9.676 14.209 16.985 352 H LYS 176 HN LYS 176 -14.196 12.414 18.993 353 HZ1 LYS 176 HZ1 LYS 176 -19.921 14.891 24.459 354 HZ2 LYS 176 HZ2 LYS 176 -18.357 15.462 24.734 355 HZ3 LYS 176 HZ3 LYS 176 -18.629 13.807 24.508 356 H LYS 177 HN LYS 177 -17.042 15.277 17.225 357 HZ1 LYS 177 HZ1 LYS 177 -17.014 17.859 12.700 358 HZ2 LYS 177 HZ2 LYS 177 -16.637 17.000 11.291 359 HZ3 LYS 177 HZ3 LYS 177 -16.162 18.611 11.450 360 H LYS 178 HN LYS 178 -16.215 19.378 16.031 361 HZ1 LYS 178 HZ1 LYS 178 -15.756 25.203 18.558 362 HZ2 LYS 178 HZ2 LYS 178 -16.393 24.688 17.076 363 HZ3 LYS 178 HZ3 LYS 178 -14.731 24.586 17.365 364 H LYS 179 HN LYS 179 -20.811 19.702 16.083 365 HZ1 LYS 179 HZ1 LYS 179 -19.543 13.052 16.646 366 HZ2 LYS 179 HZ2 LYS 179 -18.251 13.424 15.616 367 HZ3 LYS 179 HZ3 LYS 179 -19.742 12.980 14.967 368 H LYS 180 HN LYS 180 -23.594 17.929 13.233 369 HZ1 LYS 180 HZ1 LYS 180 -29.150 20.572 15.278 370 HZ2 LYS 180 HZ2 LYS 180 -28.357 21.652 16.306 371 HZ3 LYS 180 HZ3 LYS 180 -30.035 21.448 16.422 372 H SER 181 HN SER 181 -24.716 20.976 15.406 373 HG SER 181 HG SER 181 -27.044 23.033 17.187 374 H LYS 182 HN LYS 182 -24.950 23.115 11.933 375 HZ1 LYS 182 HZ1 LYS 182 -22.988 19.754 8.309 376 HZ2 LYS 182 HZ2 LYS 182 -24.456 18.919 8.337 377 HZ3 LYS 182 HZ3 LYS 182 -23.952 19.789 9.698 378 H THR 183 HN THR 183 -24.932 25.560 12.470 379 HG1 THR 183 HG1 THR 183 -23.522 25.968 14.346 380 H LYS 184 HN LYS 184 -24.422 26.930 10.318 381 HZ1 LYS 184 HZ1 LYS 184 -21.436 29.962 5.725 382 HZ2 LYS 184 HZ2 LYS 184 -21.561 31.583 5.237 383 HZ3 LYS 184 HZ3 LYS 184 -22.438 30.384 4.429 384 H CYS 185 HN CYS 185 -21.764 26.970 8.333 385 HG CYS 185 HG CYS 185 -17.308 25.953 9.714 386 HE21 GLN 418 HE21 GLN 418 44.765 3.549 -13.334 387 HE22 GLN 418 HE22 GLN 418 43.732 4.663 -12.513 388 HE21 GLN 424 HE21 GLN 424 52.821 -5.698 -16.250 389 HE22 GLN 424 HE22 GLN 424 53.620 -4.301 -16.887 390 HE21 GLN 439 HE21 GLN 439 47.060 -29.355 -7.371 391 HE22 GLN 439 HE22 GLN 439 48.216 -28.458 -6.452 392 HE21 GLN 453 HE21 GLN 453 29.941 -44.921 -9.536 393 HE22 GLN 453 HE22 GLN 453 31.385 -45.129 -10.461 394 HE21 GLN 460 HE21 GLN 460 19.943 -46.735 -8.587 395 HE22 GLN 460 HE22 GLN 460 20.192 -47.077 -10.263 396 HE21 GLN 464 HE21 GLN 464 14.338 -51.144 -6.948 397 HE22 GLN 464 HE22 GLN 464 16.034 -51.377 -7.199 398 HE21 GLN 472 HE21 GLN 472 3.905 -52.069 2.219 399 HE22 GLN 472 HE22 GLN 472 5.247 -53.036 2.723 400 HE21 GLN 482 HE21 GLN 482 -12.009 -49.014 -5.271 401 HE22 GLN 482 HE22 GLN 482 -11.685 -49.384 -6.928 402 HE21 GLN 487 HE21 GLN 487 -19.451 -45.850 4.588 403 HE22 GLN 487 HE22 GLN 487 -18.802 -46.951 5.755 404 HE21 GLN 493 HE21 GLN 493 -26.586 -42.420 -4.751 405 HE22 GLN 493 HE22 GLN 493 -25.467 -43.202 -5.809 406 HE21 GLN 527 HE21 GLN 527 -51.648 1.070 -3.977 407 HE22 GLN 527 HE22 GLN 527 -52.248 -0.514 -3.635 408 HAC EWS 237 HAC DRG 203 12.127 8.315 16.867 409 HAD EWS 237 HAD DRG 203 12.670 6.063 14.995 410 HAE EWS 237 HAE DRG 203 11.542 7.487 14.819 411 HAF EWS 237 HAF DRG 203 14.173 7.916 18.062 412 HAG EWS 237 HAG DRG 203 14.744 6.783 16.739 413 HAI EWS 237 HAI DRG 203 14.414 9.755 16.838 414 HAH EWS 237 HAH DRG 203 15.730 8.766 16.065 415 HAJ EWS 237 HAJ DRG 203 14.455 7.170 14.222 416 HAL EWS 237 HAL DRG 203 12.815 7.019 12.479 417 HAK EWS 237 HAK DRG 203 12.189 8.679 12.876 418 HAM EWS 237 HAM DRG 203 15.004 6.672 11.600 419 HAN EWS 237 HAN DRG 203 13.203 10.600 12.176 420 HAO EWS 237 HAO DRG 203 14.897 11.592 10.625 421 HAP EWS 237 HAP DRG 203 16.700 7.673 10.063 422 HAQ EWS 237 HAQ DRG 203 13.596 4.034 18.094 423 HAS EWS 237 HAS DRG 203 12.116 0.137 19.371 424 HAT EWS 237 HAT DRG 203 10.169 1.295 20.456 425 HAX EWS 237 HAX DRG 203 9.676 6.189 20.273 426 HAA EWS 237 HAA DRG 203 11.832 5.468 16.902 427 HAZ EWS 237 HAZ DRG 203 13.223 9.693 15.032 428 HAW EWS 237 HAW DRG 203 9.114 3.765 20.849 429 HAY EWS 237 HAY DRG 203 14.669 9.565 14.300 Start of MODEL 6 1 HE21 GLN 220 HE21 GLN 220 24.257 40.014 -12.167 2 HE22 GLN 220 HE22 GLN 220 24.884 41.495 -11.540 3 HE21 GLN 226 HE21 GLN 226 10.742 45.067 -8.990 4 HE22 GLN 226 HE22 GLN 226 11.983 46.171 -8.499 5 HE21 GLN 241 HE21 GLN 241 -7.417 34.698 -18.721 6 HE22 GLN 241 HE22 GLN 241 -7.245 35.495 -20.248 7 HE21 GLN 255 HE21 GLN 255 -27.695 21.530 -11.846 8 HE22 GLN 255 HE22 GLN 255 -28.203 23.123 -11.410 9 HE21 GLN 262 HE21 GLN 262 -28.372 10.895 -7.842 10 HE22 GLN 262 HE22 GLN 262 -27.981 11.978 -6.557 11 HE21 GLN 266 HE21 GLN 266 -33.132 7.589 -10.675 12 HE22 GLN 266 HE22 GLN 266 -33.215 9.305 -10.477 13 HE21 GLN 274 HE21 GLN 274 -35.658 -8.040 -12.803 14 HE22 GLN 274 HE22 GLN 274 -35.773 -7.623 -14.478 15 HE21 GLN 284 HE21 GLN 284 -31.956 -18.149 -1.924 16 HE22 GLN 284 HE22 GLN 284 -32.361 -16.481 -1.722 17 HE21 GLN 289 HE21 GLN 289 -28.840 -31.324 -9.163 18 HE22 GLN 289 HE22 GLN 289 -29.155 -30.416 -10.613 19 HE21 GLN 295 HE21 GLN 295 -25.577 -31.361 4.204 20 HE22 GLN 295 HE22 GLN 295 -26.878 -30.239 3.982 21 HE21 GLN 329 HE21 GLN 329 15.158 -56.674 13.954 22 HE22 GLN 329 HE22 GLN 329 13.525 -57.233 13.862 23 H MET 1 HT1 MET 1 3.743 -12.553 17.239 24 H THR 2 HN THR 2 3.247 -10.116 20.911 25 HG1 THR 2 HG1 THR 2 1.609 -9.484 21.880 26 H GLU 3 HN GLU 3 3.317 -5.797 19.622 27 H TYR 4 HN TYR 4 6.394 -4.135 21.780 28 HH TYR 4 HH TYR 4 0.953 -7.015 23.852 29 H LYS 5 HN LYS 5 5.191 0.042 21.285 30 HZ1 LYS 5 HZ1 LYS 5 4.473 -0.491 16.684 31 HZ2 LYS 5 HZ2 LYS 5 5.526 0.826 16.782 32 HZ3 LYS 5 HZ3 LYS 5 4.151 0.766 17.776 33 H LEU 6 HN LEU 6 9.038 0.891 22.944 34 H VAL 7 HN VAL 7 8.934 4.666 25.116 35 H VAL 8 HN VAL 8 13.005 5.346 26.388 36 H VAL 9 HN VAL 9 11.314 8.520 28.682 37 H GLY 10 HN GLY 10 14.081 12.085 29.295 38 H ALA 11 HN ALA 11 15.220 13.010 33.413 39 H VAL 12 HN VAL 12 18.987 15.303 33.424 40 H GLY 13 HN GLY 13 20.967 11.484 34.555 41 H VAL 14 HN VAL 14 18.783 11.158 35.506 42 H GLY 15 HN GLY 15 18.795 8.478 35.358 43 H LYS 16 HN LYS 16 17.946 7.282 33.875 44 HZ1 LYS 16 HZ1 LYS 16 17.445 8.698 27.896 45 HZ2 LYS 16 HZ2 LYS 16 15.910 8.097 28.294 46 HZ3 LYS 16 HZ3 LYS 16 17.305 7.253 28.774 47 H SER 17 HN SER 17 19.558 5.579 32.441 48 HG SER 17 HG SER 17 21.514 5.822 30.690 49 H ALA 18 HN ALA 18 20.060 3.537 34.323 50 H LEU 19 HN LEU 19 17.631 2.517 34.575 51 H THR 20 HN THR 20 16.805 1.323 32.109 52 HG1 THR 20 HG1 THR 20 15.620 1.861 30.314 53 H ILE 21 HN ILE 21 18.800 -0.572 31.795 54 H GLN 22 HN GLN 22 18.100 -2.090 33.785 55 HE21 GLN 22 HE21 GLN 22 18.420 -2.732 39.053 56 HE22 GLN 22 HE22 GLN 22 19.498 -4.054 39.329 57 H LEU 23 HN LEU 23 16.233 -3.687 32.920 58 H ILE 24 HN ILE 24 16.514 -4.564 30.988 59 H GLN 25 HN GLN 25 18.845 -5.910 31.046 60 HE21 GLN 25 HE21 GLN 25 22.001 -5.258 27.245 61 HE22 GLN 25 HE22 GLN 25 23.690 -5.007 27.507 62 H ASN 26 HN ASN 26 18.342 -6.952 32.785 63 HD21 ASN 26 HD21 ASN 26 17.477 -11.336 33.769 64 HD22 ASN 26 HD22 ASN 26 15.796 -10.933 33.771 65 H HIS 27 HN HIS 27 20.349 -5.841 34.301 66 HD1 HIS 27 HD1 HIS 27 25.084 -7.559 36.154 67 HE2 HIS 27 HE2 HIS 27 27.193 -4.234 35.454 68 H PHE 28 HN PHE 28 22.582 -4.977 37.803 69 H VAL 29 HN VAL 29 22.960 -0.845 36.326 70 H ASP 30 HN ASP 30 27.131 -0.354 37.897 71 H GLU 31 HN GLU 31 27.920 1.470 37.023 72 H TYR 32 HN TYR 32 29.200 5.756 36.136 73 HH TYR 32 HH TYR 32 25.716 12.340 32.263 74 H ASP 33 HN ASP 33 26.505 6.021 32.818 75 H THR 35 HN THR 35 24.436 9.583 29.058 76 HG1 THR 35 HG1 THR 35 23.570 7.645 29.630 77 H ILE 36 HN ILE 36 23.832 7.982 24.900 78 H GLU 37 HN GLU 37 22.977 7.363 22.828 79 H ASP 38 HN ASP 38 19.945 5.413 23.412 80 H SER 39 HN SER 39 20.345 1.236 21.826 81 HG SER 39 HG SER 39 18.956 2.627 19.853 82 H TYR 40 HN TYR 40 16.816 -0.358 23.256 83 HH TYR 40 HH TYR 40 23.299 -0.207 26.362 84 H ARG 41 HN ARG 41 17.440 -4.385 22.138 85 HE ARG 41 HE ARG 41 15.665 -6.220 17.919 86 HH11 ARG 41 HH11 ARG 41 12.733 -5.196 16.293 87 HH12 ARG 41 HH12 ARG 41 13.304 -5.737 14.671 88 HH21 ARG 41 HH21 ARG 41 16.431 -6.940 15.889 89 HH22 ARG 41 HH22 ARG 41 15.375 -6.713 14.443 90 H LYS 42 HN LYS 42 13.704 -6.236 23.386 91 HZ1 LYS 42 HZ1 LYS 42 15.143 -12.100 26.209 92 HZ2 LYS 42 HZ2 LYS 42 14.281 -12.000 27.667 93 HZ3 LYS 42 HZ3 LYS 42 15.631 -13.005 27.549 94 H GLN 43 HN GLN 43 13.671 -10.558 23.688 95 HE21 GLN 43 HE21 GLN 43 9.996 -12.854 20.173 96 HE22 GLN 43 HE22 GLN 43 10.145 -14.577 20.171 97 H VAL 44 HN VAL 44 9.535 -10.325 25.309 98 H VAL 45 HN VAL 45 8.453 -12.351 29.028 99 H ILE 46 HN ILE 46 4.560 -11.042 28.007 100 H ASP 47 HN ASP 47 2.673 -10.568 31.834 101 H GLY 48 HN GLY 48 2.109 -12.889 30.627 102 H GLU 49 HN GLU 49 1.660 -12.287 28.269 103 H THR 50 HN THR 50 2.934 -13.844 24.362 104 HG1 THR 50 HG1 THR 50 7.239 -13.567 23.955 105 H CYS 51 HN CYS 51 6.466 -11.013 24.539 106 HG CYS 51 HG CYS 51 4.410 -9.819 25.733 107 H LEU 52 HN LEU 52 7.026 -8.347 21.123 108 H LEU 53 HN LEU 53 10.764 -6.960 23.099 109 H ASP 54 HN ASP 54 10.419 -2.831 22.056 110 H ILE 55 HN ILE 55 14.023 -1.298 23.490 111 H LEU 56 HN LEU 56 13.157 2.987 23.307 112 H ASP 57 HN ASP 57 17.405 4.105 23.943 113 H THR 58 HN THR 58 16.556 7.757 25.388 114 HG1 THR 58 HG1 THR 58 15.650 8.595 23.362 115 H ALA 59 HN ALA 59 19.446 11.068 24.454 116 H GLY 60 HN GLY 60 20.270 12.924 28.590 117 H GLN 61 HN GLN 61 20.650 15.189 28.862 118 HE21 GLN 61 HE21 GLN 61 21.610 18.052 33.104 119 HE22 GLN 61 HE22 GLN 61 23.204 18.717 33.199 120 H GLU 62 HN GLU 62 18.574 18.047 26.765 121 H GLU 63 HN GLU 63 19.809 20.112 23.339 122 H TYR 64 HN TYR 64 15.814 22.402 22.943 123 HH TYR 64 HH TYR 64 9.966 22.196 16.793 124 H SER 65 HN SER 65 14.636 19.301 20.029 125 HG SER 65 HG SER 65 17.304 19.355 19.866 126 H ALA 66 HN ALA 66 14.757 19.588 15.637 127 H MET 67 HN MET 67 15.102 16.895 15.504 128 H ARG 68 HN ARG 68 14.479 16.017 18.030 129 HE ARG 68 HE ARG 68 14.331 15.879 24.573 130 HH11 ARG 68 HH11 ARG 68 17.636 13.556 24.249 131 HH12 ARG 68 HH12 ARG 68 17.015 14.444 22.804 132 HH21 ARG 68 HH21 ARG 68 16.586 13.765 26.285 133 HH22 ARG 68 HH22 ARG 68 15.126 14.816 26.448 134 H ASP 69 HN ASP 69 11.784 16.167 17.979 135 H GLN 70 HN GLN 70 10.963 14.531 16.246 136 HE21 GLN 70 HE21 GLN 70 10.792 15.268 11.296 137 HE22 GLN 70 HE22 GLN 70 12.365 14.901 10.680 138 H TYR 71 HN TYR 71 11.790 12.008 17.119 139 HH TYR 71 HH TYR 71 14.574 10.836 23.941 140 H MET 72 HN MET 72 10.291 11.795 19.312 141 H ARG 73 HN ARG 73 8.029 11.351 18.253 142 HE ARG 73 HE ARG 73 5.131 14.345 16.441 143 HH11 ARG 73 HH11 ARG 73 6.323 15.003 12.618 144 HH12 ARG 73 HH12 ARG 73 5.333 13.547 13.010 145 HH21 ARG 73 HH21 ARG 73 6.946 16.450 14.277 146 HH22 ARG 73 HH22 ARG 73 6.457 16.150 15.995 147 H THR 74 HN THR 74 7.874 9.024 17.913 148 HG1 THR 74 HG1 THR 74 9.088 8.756 16.087 149 H GLY 75 HN GLY 75 7.409 7.492 19.623 150 H GLU 76 HN GLU 76 5.335 4.094 21.947 151 H GLY 77 HN GLY 77 3.769 3.710 24.255 152 H PHE 78 HN PHE 78 3.410 6.850 27.563 153 H LEU 79 HN LEU 79 7.449 7.173 29.392 154 H CYS 80 HN CYS 80 5.911 8.697 33.202 155 HG CYS 80 HG CYS 80 3.993 11.157 32.174 156 H VAL 81 HN VAL 81 9.682 9.897 33.632 157 H PHE 82 HN PHE 82 9.995 10.199 38.051 158 H ALA 83 HN ALA 83 12.838 13.121 39.773 159 H ILE 84 HN ILE 84 12.573 10.489 43.355 160 H ASN 85 HN ASN 85 14.153 12.162 44.439 161 HD21 ASN 85 HD21 ASN 85 15.475 10.193 45.319 162 HD22 ASN 85 HD22 ASN 85 16.386 10.103 43.851 163 H ASN 86 HN ASN 86 13.809 14.374 43.951 164 HD21 ASN 86 HD21 ASN 86 17.791 15.688 40.721 165 HD22 ASN 86 HD22 ASN 86 17.930 17.361 40.309 166 H THR 87 HN THR 87 13.838 18.182 44.316 167 HG1 THR 87 HG1 THR 87 11.575 18.244 45.697 168 H LYS 88 HN LYS 88 14.021 19.288 41.919 169 HZ1 LYS 88 HZ1 LYS 88 12.847 22.729 35.384 170 HZ2 LYS 88 HZ2 LYS 88 12.389 22.210 36.919 171 HZ3 LYS 88 HZ3 LYS 88 13.267 21.175 35.905 172 H SER 89 HN SER 89 13.490 17.474 39.890 173 HG SER 89 HG SER 89 12.903 15.587 40.294 174 H PHE 90 HN PHE 90 11.032 17.231 40.374 175 H GLU 91 HN GLU 91 9.755 19.194 39.501 176 H ASP 92 HN ASP 92 10.110 19.071 37.211 177 H ILE 93 HN ILE 93 8.117 17.618 36.296 178 H HIS 94 HN HIS 94 5.901 19.022 35.137 179 HD1 HIS 94 HD1 HIS 94 1.459 20.484 34.716 180 HE2 HIS 94 HE2 HIS 94 1.212 23.314 31.884 181 H HIS 95 HN HIS 95 6.932 20.005 32.872 182 HD1 HIS 95 HD1 HIS 95 10.968 19.946 29.913 183 HE2 HIS 95 HE2 HIS 95 9.979 22.532 27.024 184 H TYR 96 HN TYR 96 7.231 17.804 31.595 185 HH TYR 96 HH TYR 96 13.363 16.076 32.563 186 H ARG 97 HN ARG 97 4.929 16.442 30.999 187 HE ARG 97 HE ARG 97 -0.076 13.058 30.859 188 HH11 ARG 97 HH11 ARG 97 -2.065 15.665 32.121 189 HH12 ARG 97 HH12 ARG 97 -3.561 14.657 32.173 190 HH21 ARG 97 HH21 ARG 97 -1.962 11.752 30.865 191 HH22 ARG 97 HH22 ARG 97 -3.502 12.471 31.468 192 H GLU 98 HN GLU 98 3.637 18.444 29.449 193 H GLN 99 HN GLN 99 5.250 18.246 27.292 194 HE21 GLN 99 HE21 GLN 99 8.974 16.359 26.315 195 HE22 GLN 99 HE22 GLN 99 10.658 16.730 26.439 196 H ILE 100 HN ILE 100 5.022 15.796 26.200 197 H LYS 101 HN LYS 101 2.424 15.986 25.591 198 HZ1 LYS 101 HZ1 LYS 101 -2.533 18.488 29.160 199 HZ2 LYS 101 HZ2 LYS 101 -2.613 19.822 28.131 200 HZ3 LYS 101 HZ3 LYS 101 -1.128 19.368 28.813 201 H ARG 102 HN ARG 102 2.551 17.638 23.465 202 HE ARG 102 HE ARG 102 5.440 21.502 22.260 203 HH11 ARG 102 HH11 ARG 102 5.078 20.006 19.068 204 HH12 ARG 102 HH12 ARG 102 6.638 19.096 19.203 205 HH21 ARG 102 HH21 ARG 102 7.935 19.319 21.089 206 HH22 ARG 102 HH22 ARG 102 7.425 20.410 22.431 207 H VAL 103 HN VAL 103 3.987 16.631 21.668 208 H LYS 104 HN LYS 104 2.501 14.516 20.841 209 HZ1 LYS 104 HZ1 LYS 104 1.353 7.812 20.082 210 HZ2 LYS 104 HZ2 LYS 104 1.701 7.081 21.564 211 HZ3 LYS 104 HZ3 LYS 104 2.947 7.367 20.447 212 H ASP 105 HN ASP 105 0.888 15.712 19.847 213 H SER 106 HN SER 106 -1.365 15.147 21.193 214 HG SER 106 HG SER 106 -3.664 13.813 19.114 215 H GLU 107 HN GLU 107 -5.215 14.401 23.103 216 H ASP 108 HN ASP 108 -4.564 12.395 23.883 217 H VAL 109 HN VAL 109 -2.810 11.396 25.172 218 H MET 111 HN MET 111 -0.649 7.710 30.156 219 H VAL 112 HN VAL 112 3.363 7.354 31.894 220 H LEU 113 HN LEU 113 2.332 7.768 36.074 221 H VAL 114 HN VAL 114 6.643 8.702 36.914 222 H GLY 115 HN GLY 115 7.645 6.940 40.680 223 H ASN 116 HN ASN 116 11.677 8.501 40.491 224 HD21 ASN 116 HD21 ASN 116 15.905 6.759 38.888 225 HD22 ASN 116 HD22 ASN 116 16.432 5.151 39.244 226 H LYS 117 HN LYS 117 14.412 5.365 42.317 227 HZ1 LYS 117 HZ1 LYS 117 19.614 10.460 41.403 228 HZ2 LYS 117 HZ2 LYS 117 20.116 9.873 39.901 229 HZ3 LYS 117 HZ3 LYS 117 20.882 9.345 41.315 230 H CYS 118 HN CYS 118 13.372 5.092 44.787 231 HG CYS 118 HG CYS 118 11.641 2.496 47.013 232 H ASP 119 HN ASP 119 15.054 4.599 46.616 233 H LEU 120 HN LEU 120 16.101 6.510 47.634 234 H SER 122 HN SER 122 17.857 10.620 50.671 235 HG SER 122 HG SER 122 19.887 12.449 51.287 236 H ARG 123 HN ARG 123 14.761 11.767 51.353 237 HE ARG 123 HE ARG 123 10.791 8.832 50.042 238 HH11 ARG 123 HH11 ARG 123 8.037 10.621 48.788 239 HH12 ARG 123 HH12 ARG 123 7.395 9.216 47.856 240 HH21 ARG 123 HH21 ARG 123 8.484 7.179 47.928 241 HH22 ARG 123 HH22 ARG 123 9.980 6.999 48.935 242 H THR 124 HN THR 124 12.959 14.314 48.136 243 HG1 THR 124 HG1 THR 124 14.834 16.448 47.767 244 H VAL 125 HN VAL 125 11.092 14.434 47.466 245 H ASP 126 HN ASP 126 6.861 15.263 48.377 246 H THR 127 HN THR 127 5.477 11.044 49.558 247 HG1 THR 127 HG1 THR 127 4.574 8.988 50.597 248 H LYS 128 HN LYS 128 2.833 11.765 49.566 249 HZ1 LYS 128 HZ1 LYS 128 -1.544 16.776 52.541 250 HZ2 LYS 128 HZ2 LYS 128 -2.219 15.518 53.445 251 HZ3 LYS 128 HZ3 LYS 128 -3.216 16.548 52.549 252 H GLN 129 HN GLN 129 2.876 13.978 47.992 253 HE21 GLN 129 HE21 GLN 129 4.079 18.766 49.348 254 HE22 GLN 129 HE22 GLN 129 5.799 18.851 49.210 255 H ALA 130 HN ALA 130 3.543 13.218 45.622 256 H GLN 131 HN GLN 131 1.631 11.439 44.959 257 HE21 GLN 131 HE21 GLN 131 -0.979 9.434 47.184 258 HE22 GLN 131 HE22 GLN 131 -1.095 7.929 48.023 259 H ASP 132 HN ASP 132 -0.521 13.098 44.839 260 H LEU 133 HN LEU 133 -0.020 14.566 42.701 261 H ALA 134 HN ALA 134 -0.249 12.742 40.807 262 H ARG 135 HN ARG 135 -2.766 11.853 40.880 263 HE ARG 135 HE ARG 135 -9.120 12.132 40.571 264 HH11 ARG 135 HH11 ARG 135 -8.851 8.731 41.450 265 HH12 ARG 135 HH12 ARG 135 -10.631 8.460 41.355 266 HH21 ARG 135 HH21 ARG 135 -11.378 11.826 40.460 267 HH22 ARG 135 HH22 ARG 135 -12.044 10.184 40.807 268 H SER 136 HN SER 136 -4.023 14.182 40.102 269 HG SER 136 HG SER 136 -4.011 16.091 41.319 270 H TYR 137 HN TYR 137 -3.550 14.023 37.564 271 HH TYR 137 HH TYR 137 0.470 19.731 36.575 272 H GLY 138 HN GLY 138 -4.597 12.348 36.502 273 H ILE 139 HN ILE 139 -3.268 10.642 36.024 274 H PHE 141 HN PHE 141 -0.309 5.984 39.842 275 H ILE 142 HN ILE 142 4.039 5.794 39.529 276 H GLU 143 HN GLU 143 5.346 3.258 42.812 277 H THR 144 HN THR 144 9.675 4.634 42.418 278 HG1 THR 144 HG1 THR 144 10.176 4.948 40.654 279 H SER 145 HN SER 145 12.376 1.234 41.678 280 HG SER 145 HG SER 145 15.891 2.413 44.837 281 H ALA 146 HN ALA 146 15.828 2.565 40.752 282 H LYS 147 HN LYS 147 17.462 1.312 42.279 283 HZ1 LYS 147 HZ1 LYS 147 22.827 -0.798 47.641 284 HZ2 LYS 147 HZ2 LYS 147 21.446 -1.147 46.736 285 HZ3 LYS 147 HZ3 LYS 147 21.295 -0.464 48.275 286 H THR 148 HN THR 148 16.503 -0.552 43.830 287 HG1 THR 148 HG1 THR 148 15.010 -0.195 45.566 288 H ARG 149 HN ARG 149 15.854 -1.864 42.171 289 HE ARG 149 HE ARG 149 15.800 -7.117 37.364 290 HH11 ARG 149 HH11 ARG 149 11.743 -7.090 37.228 291 HH12 ARG 149 HH12 ARG 149 12.598 -6.697 38.774 292 HH21 ARG 149 HH21 ARG 149 14.756 -7.701 35.413 293 HH22 ARG 149 HH22 ARG 149 12.948 -7.656 35.360 294 H GLN 150 HN GLN 150 13.400 -1.871 42.977 295 HE21 GLN 150 HE21 GLN 150 8.238 -2.542 46.806 296 HE22 GLN 150 HE22 GLN 150 8.834 -1.680 48.181 297 H GLY 151 HN GLY 151 9.085 -2.818 42.020 298 H VAL 152 HN VAL 152 10.641 -1.461 39.848 299 H ASP 153 HN ASP 153 9.749 -3.687 38.193 300 H ASP 154 HN ASP 154 7.013 -3.645 38.464 301 H ALA 155 HN ALA 155 6.556 -1.148 37.460 302 H PHE 156 HN PHE 156 7.031 -1.326 34.702 303 H TYR 157 HN TYR 157 5.123 -3.101 33.989 304 HH TYR 157 HH TYR 157 7.855 -8.460 34.734 305 H THR 158 HN THR 158 2.992 -1.618 34.493 306 HG1 THR 158 HG1 THR 158 2.405 -0.979 36.317 307 H LEU 159 HN LEU 159 2.948 0.329 32.583 308 H VAL 160 HN VAL 160 2.502 -1.149 30.260 309 H ARG 161 HN ARG 161 -0.043 -1.985 30.814 310 HE ARG 161 HE ARG 161 -1.465 -6.332 32.990 311 HH11 ARG 161 HH11 ARG 161 -1.958 -4.537 35.985 312 HH12 ARG 161 HH12 ARG 161 -1.467 -5.924 37.025 313 HH21 ARG 161 HH21 ARG 161 -0.832 -7.923 36.061 314 HH22 ARG 161 HH22 ARG 161 -0.848 -8.116 34.262 315 H GLU 162 HN GLU 162 -1.411 0.305 30.885 316 H ILE 163 HN ILE 163 -1.314 1.149 28.302 317 H ARG 164 HN ARG 164 -2.728 -0.792 27.290 318 HE ARG 164 HE ARG 164 -1.760 -6.148 26.187 319 HH11 ARG 164 HH11 ARG 164 -1.109 -7.231 30.047 320 HH12 ARG 164 HH12 ARG 164 -2.365 -6.003 29.634 321 HH21 ARG 164 HH21 ARG 164 -0.187 -7.753 26.621 322 HH22 ARG 164 HH22 ARG 164 0.116 -8.219 28.336 323 H LYS 165 HN LYS 165 -5.371 -0.502 28.133 324 HZ1 LYS 165 HZ1 LYS 165 -6.271 0.095 33.925 325 HZ2 LYS 165 HZ2 LYS 165 -6.715 1.657 33.465 326 HZ3 LYS 165 HZ3 LYS 165 -5.076 1.227 33.521 327 H HIS 166 HN HIS 166 -5.740 1.710 26.854 328 HD1 HIS 166 HD1 HIS 166 -4.035 4.244 23.084 329 HE2 HIS 166 HE2 HIS 166 -6.057 7.690 23.074 330 H LYS 167 HN LYS 167 -5.888 0.989 24.320 331 HZ1 LYS 167 HZ1 LYS 167 -1.703 -2.982 22.621 332 HZ2 LYS 167 HZ2 LYS 167 -0.332 -1.997 22.523 333 HZ3 LYS 167 HZ3 LYS 167 -1.127 -2.485 21.111 334 H GLU 168 HN GLU 168 -8.086 -0.343 24.244 335 H LYS 169 HN LYS 169 -9.906 1.583 24.800 336 HZ1 LYS 169 HZ1 LYS 169 -13.774 5.649 27.101 337 HZ2 LYS 169 HZ2 LYS 169 -14.356 6.549 25.787 338 HZ3 LYS 169 HZ3 LYS 169 -14.401 7.197 27.354 339 H MET 170 HN MET 170 -9.816 2.969 22.453 340 H SER 171 HN SER 171 -11.462 1.434 21.136 341 HG SER 171 HG SER 171 -10.501 0.019 20.191 342 H LYS 172 HN LYS 172 -13.654 1.760 21.566 343 HZ1 LYS 172 HZ1 LYS 172 -16.792 -0.125 26.871 344 HZ2 LYS 172 HZ2 LYS 172 -17.512 0.224 25.386 345 HZ3 LYS 172 HZ3 LYS 172 -17.640 1.326 26.663 346 H ASP 173 HN ASP 173 -14.389 4.049 21.813 347 H GLY 174 HN GLY 174 -15.768 5.363 18.486 348 H LYS 175 HN LYS 175 -12.962 8.287 17.300 349 HZ1 LYS 175 HZ1 LYS 175 -13.420 15.247 17.053 350 HZ2 LYS 175 HZ2 LYS 175 -14.851 15.413 17.937 351 HZ3 LYS 175 HZ3 LYS 175 -14.882 15.540 16.251 352 H LYS 176 HN LYS 176 -15.032 8.180 14.223 353 HZ1 LYS 176 HZ1 LYS 176 -11.961 4.509 14.403 354 HZ2 LYS 176 HZ2 LYS 176 -11.254 3.004 14.101 355 HZ3 LYS 176 HZ3 LYS 176 -12.916 3.116 14.383 356 H LYS 177 HN LYS 177 -13.388 9.812 10.322 357 HZ1 LYS 177 HZ1 LYS 177 -12.643 16.042 12.229 358 HZ2 LYS 177 HZ2 LYS 177 -13.261 16.064 10.660 359 HZ3 LYS 177 HZ3 LYS 177 -12.085 14.924 11.093 360 H LYS 178 HN LYS 178 -17.546 10.615 9.534 361 HZ1 LYS 178 HZ1 LYS 178 -17.497 3.942 9.095 362 HZ2 LYS 178 HZ2 LYS 178 -17.632 5.409 8.268 363 HZ3 LYS 178 HZ3 LYS 178 -19.015 4.498 8.602 364 H LYS 179 HN LYS 179 -20.195 8.699 6.712 365 HZ1 LYS 179 HZ1 LYS 179 -26.610 11.162 1.851 366 HZ2 LYS 179 HZ2 LYS 179 -26.096 9.578 2.117 367 HZ3 LYS 179 HZ3 LYS 179 -25.051 10.698 1.398 368 H LYS 180 HN LYS 180 -23.037 11.399 8.721 369 HZ1 LYS 180 HZ1 LYS 180 -20.705 11.348 15.108 370 HZ2 LYS 180 HZ2 LYS 180 -20.496 10.156 13.924 371 HZ3 LYS 180 HZ3 LYS 180 -21.902 10.178 14.862 372 H SER 181 HN SER 181 -24.737 7.540 9.992 373 HG SER 181 HG SER 181 -24.382 7.365 7.594 374 H LYS 182 HN LYS 182 -28.579 5.699 8.824 375 HZ1 LYS 182 HZ1 LYS 182 -32.983 4.307 13.088 376 HZ2 LYS 182 HZ2 LYS 182 -34.518 3.923 12.498 377 HZ3 LYS 182 HZ3 LYS 182 -34.190 5.494 13.033 378 H THR 183 HN THR 183 -27.118 3.461 11.943 379 HG1 THR 183 HG1 THR 183 -24.958 2.050 13.457 380 H LYS 184 HN LYS 184 -27.643 1.587 13.603 381 HZ1 LYS 184 HZ1 LYS 184 -28.855 -4.636 15.624 382 HZ2 LYS 184 HZ2 LYS 184 -28.868 -5.710 16.932 383 HZ3 LYS 184 HZ3 LYS 184 -27.399 -5.230 16.249 384 H CYS 185 HN CYS 185 -31.345 -0.711 14.268 385 HG CYS 185 HG CYS 185 -33.303 -0.713 17.752 386 HE21 GLN 418 HE21 GLN 418 53.096 -32.608 12.445 387 HE22 GLN 418 HE22 GLN 418 52.025 -31.282 12.753 388 HE21 GLN 424 HE21 GLN 424 50.951 -45.790 11.367 389 HE22 GLN 424 HE22 GLN 424 52.431 -46.689 11.311 390 HE21 GLN 439 HE21 GLN 439 29.165 -56.528 12.109 391 HE22 GLN 439 HE22 GLN 439 30.658 -56.562 12.978 392 HE21 GLN 453 HE21 GLN 453 8.734 -59.174 -1.327 393 HE22 GLN 453 HE22 GLN 453 9.877 -60.448 -1.583 394 HE21 GLN 460 HE21 GLN 460 0.726 -53.684 -6.162 395 HE22 GLN 460 HE22 GLN 460 2.143 -54.430 -6.822 396 HE21 GLN 464 HE21 GLN 464 -7.191 -52.793 -6.131 397 HE22 GLN 464 HE22 GLN 464 -6.713 -54.456 -6.175 398 HE21 GLN 472 HE21 GLN 472 -16.642 -46.824 -5.485 399 HE22 GLN 472 HE22 GLN 472 -15.997 -48.373 -5.070 400 HE21 GLN 482 HE21 GLN 482 -20.540 -33.422 -17.830 401 HE22 GLN 482 HE22 GLN 482 -19.492 -34.593 -18.549 402 HE21 GLN 487 HE21 GLN 487 -30.228 -26.801 -12.148 403 HE22 GLN 487 HE22 GLN 487 -29.989 -28.113 -11.043 404 HE21 GLN 493 HE21 GLN 493 -23.891 -20.171 -22.915 405 HE22 GLN 493 HE22 GLN 493 -24.686 -21.697 -23.032 406 HE21 GLN 527 HE21 GLN 527 -14.399 26.784 -26.181 407 HE22 GLN 527 HE22 GLN 527 -13.918 25.862 -27.559 408 HAC EWS 237 HAC DRG 203 12.137 8.062 16.121 409 HAD EWS 237 HAD DRG 203 11.335 5.936 14.195 410 HAE EWS 237 HAE DRG 203 10.661 7.615 14.435 411 HAF EWS 237 HAF DRG 203 14.276 7.030 16.487 412 HAG EWS 237 HAG DRG 203 14.004 5.919 15.054 413 HAI EWS 237 HAI DRG 203 14.569 8.851 15.248 414 HAH EWS 237 HAH DRG 203 15.197 7.633 14.053 415 HAJ EWS 237 HAJ DRG 203 12.964 6.608 12.815 416 HAL EWS 237 HAL DRG 203 10.842 7.058 11.794 417 HAK EWS 237 HAK DRG 203 10.883 8.778 12.382 418 HAM EWS 237 HAM DRG 203 12.390 6.237 10.178 419 HAN EWS 237 HAN DRG 203 12.076 10.426 11.347 420 HAO EWS 237 HAO DRG 203 13.317 11.085 9.277 421 HAP EWS 237 HAP DRG 203 13.641 6.904 8.120 422 HAQ EWS 237 HAQ DRG 203 12.693 3.448 16.753 423 HAS EWS 237 HAS DRG 203 10.739 -0.031 18.509 424 HAT EWS 237 HAT DRG 203 9.705 1.485 20.223 425 HAX EWS 237 HAX DRG 203 10.559 6.332 20.201 426 HAA EWS 237 HAA DRG 203 11.095 5.400 16.280 427 HAZ EWS 237 HAZ DRG 203 12.850 9.275 14.003 428 HAW EWS 237 HAW DRG 203 9.587 4.096 20.959 429 HAY EWS 237 HAY DRG 203 13.848 8.846 12.793 Start of MODEL 7 1 HE21 GLN 220 HE21 GLN 220 47.868 -7.674 -4.827 2 HE22 GLN 220 HE22 GLN 220 49.537 -7.304 -4.576 3 HE21 GLN 226 HE21 GLN 226 50.802 5.223 -3.052 4 HE22 GLN 226 HE22 GLN 226 51.894 4.076 -2.358 5 HE21 GLN 241 HE21 GLN 241 42.041 23.855 -13.578 6 HE22 GLN 241 HE22 GLN 241 43.689 24.142 -14.013 7 HE21 GLN 255 HE21 GLN 255 24.903 41.913 -10.860 8 HE22 GLN 255 HE22 GLN 255 26.277 42.632 -10.092 9 HE21 GLN 262 HE21 GLN 262 14.688 42.472 -8.279 10 HE22 GLN 262 HE22 GLN 262 16.138 42.307 -7.350 11 HE21 GLN 266 HE21 GLN 266 7.928 46.040 -9.715 12 HE22 GLN 266 HE22 GLN 266 9.022 47.071 -8.859 13 HE21 GLN 274 HE21 GLN 274 -3.557 47.435 -16.655 14 HE22 GLN 274 HE22 GLN 274 -2.203 48.343 -17.238 15 HE21 GLN 284 HE21 GLN 284 -16.828 42.171 -5.804 16 HE22 GLN 284 HE22 GLN 284 -15.364 42.814 -5.152 17 HE21 GLN 289 HE21 GLN 289 -28.743 38.021 -14.359 18 HE22 GLN 289 HE22 GLN 289 -27.916 36.748 -15.200 19 HE21 GLN 295 HE21 GLN 295 -30.321 33.966 -1.632 20 HE22 GLN 295 HE22 GLN 295 -29.271 35.231 -1.097 21 HE21 GLN 329 HE21 GLN 329 -53.799 -9.350 5.122 22 HE22 GLN 329 HE22 GLN 329 -54.849 -8.186 4.395 23 H MET 1 HT1 MET 1 3.128 -11.136 16.513 24 H THR 2 HN THR 2 2.259 -9.400 20.449 25 HG1 THR 2 HG1 THR 2 1.188 -8.641 22.155 26 H GLU 3 HN GLU 3 2.551 -5.130 18.852 27 H TYR 4 HN TYR 4 5.895 -3.675 21.280 28 HH TYR 4 HH TYR 4 -1.406 -3.720 22.981 29 H LYS 5 HN LYS 5 5.494 0.464 21.105 30 HZ1 LYS 5 HZ1 LYS 5 6.141 3.101 16.114 31 HZ2 LYS 5 HZ2 LYS 5 5.928 1.853 14.993 32 HZ3 LYS 5 HZ3 LYS 5 7.463 2.520 15.233 33 H LEU 6 HN LEU 6 9.227 0.955 23.451 34 H VAL 7 HN VAL 7 8.681 4.922 24.381 35 H VAL 8 HN VAL 8 12.546 5.630 26.226 36 H VAL 9 HN VAL 9 11.091 9.040 28.584 37 H GLY 10 HN GLY 10 14.007 12.409 29.356 38 H ALA 11 HN ALA 11 15.334 13.067 33.486 39 H VAL 12 HN VAL 12 19.190 15.007 33.832 40 H GLY 13 HN GLY 13 21.330 11.399 35.540 41 H VAL 14 HN VAL 14 19.128 10.802 36.312 42 H GLY 15 HN GLY 15 17.209 6.886 37.268 43 H LYS 16 HN LYS 16 18.246 6.926 34.362 44 HZ1 LYS 16 HZ1 LYS 16 16.879 8.075 29.072 45 HZ2 LYS 16 HZ2 LYS 16 16.500 9.604 28.440 46 HZ3 LYS 16 HZ3 LYS 16 15.277 8.632 29.082 47 H SER 17 HN SER 17 19.787 5.545 32.415 48 HG SER 17 HG SER 17 22.333 5.924 30.378 49 H ALA 18 HN ALA 18 19.716 3.558 33.927 50 H LEU 19 HN LEU 19 17.620 2.228 34.520 51 H THR 20 HN THR 20 17.264 1.038 32.063 52 HG1 THR 20 HG1 THR 20 17.528 2.151 30.316 53 H ILE 21 HN ILE 21 19.355 -0.719 31.482 54 H GLN 22 HN GLN 22 18.782 -2.244 33.530 55 HE21 GLN 22 HE21 GLN 22 19.117 -3.243 38.719 56 HE22 GLN 22 HE22 GLN 22 19.910 -4.758 38.971 57 H LEU 23 HN LEU 23 16.822 -3.649 32.714 58 H ILE 24 HN ILE 24 16.973 -4.719 30.648 59 H GLN 25 HN GLN 25 19.271 -6.099 30.845 60 HE21 GLN 25 HE21 GLN 25 22.880 -4.544 29.366 61 HE22 GLN 25 HE22 GLN 25 24.489 -4.836 28.813 62 H ASN 26 HN ASN 26 18.765 -7.111 32.669 63 HD21 ASN 26 HD21 ASN 26 16.486 -9.955 34.002 64 HD22 ASN 26 HD22 ASN 26 15.694 -10.116 35.535 65 H HIS 27 HN HIS 27 20.678 -6.052 34.148 66 HD1 HIS 27 HD1 HIS 27 25.260 -6.827 36.833 67 HE2 HIS 27 HE2 HIS 27 27.161 -3.666 35.277 68 H PHE 28 HN PHE 28 22.954 -4.836 37.647 69 H VAL 29 HN VAL 29 23.282 -0.815 35.967 70 H ASP 30 HN ASP 30 27.651 0.050 37.206 71 H GLU 31 HN GLU 31 28.252 1.837 36.639 72 H TYR 32 HN TYR 32 29.670 6.121 36.083 73 HH TYR 32 HH TYR 32 26.037 12.225 31.472 74 H ASP 33 HN ASP 33 26.101 6.574 33.351 75 H THR 35 HN THR 35 23.512 9.800 27.624 76 HG1 THR 35 HG1 THR 35 23.202 6.451 27.836 77 H ILE 36 HN ILE 36 23.219 8.240 23.770 78 H GLU 37 HN GLU 37 22.043 7.563 22.042 79 H ASP 38 HN ASP 38 19.408 5.499 22.938 80 H SER 39 HN SER 39 19.129 1.597 21.219 81 HG SER 39 HG SER 39 17.004 0.213 19.414 82 H TYR 40 HN TYR 40 16.134 -0.434 23.828 83 HH TYR 40 HH TYR 40 23.121 0.036 25.274 84 H ARG 41 HN ARG 41 16.649 -4.670 23.005 85 HE ARG 41 HE ARG 41 14.163 -7.734 19.449 86 HH11 ARG 41 HH11 ARG 41 14.260 -5.008 16.461 87 HH12 ARG 41 HH12 ARG 41 13.181 -4.768 17.890 88 HH21 ARG 41 HH21 ARG 41 15.596 -8.081 17.682 89 HH22 ARG 41 HH22 ARG 41 15.624 -6.862 16.348 90 H LYS 42 HN LYS 42 12.608 -6.172 24.174 91 HZ1 LYS 42 HZ1 LYS 42 13.894 -10.314 31.837 92 HZ2 LYS 42 HZ2 LYS 42 12.916 -8.961 31.556 93 HZ3 LYS 42 HZ3 LYS 42 14.602 -8.826 31.459 94 H GLN 43 HN GLN 43 12.633 -10.384 24.697 95 HE21 GLN 43 HE21 GLN 43 9.951 -12.762 20.389 96 HE22 GLN 43 HE22 GLN 43 10.298 -14.453 20.322 97 H VAL 44 HN VAL 44 8.526 -9.804 25.658 98 H VAL 45 HN VAL 45 6.878 -12.480 28.791 99 H ILE 46 HN ILE 46 2.953 -10.614 28.139 100 H ASP 47 HN ASP 47 1.365 -10.521 32.109 101 H GLY 48 HN GLY 48 0.647 -12.592 30.534 102 H GLU 49 HN GLU 49 -0.187 -11.856 28.285 103 H THR 50 HN THR 50 1.585 -13.206 24.429 104 HG1 THR 50 HG1 THR 50 6.019 -13.735 23.735 105 H CYS 51 HN CYS 51 5.200 -10.381 24.711 106 HG CYS 51 HG CYS 51 4.679 -8.976 26.296 107 H LEU 52 HN LEU 52 5.657 -7.560 21.485 108 H LEU 53 HN LEU 53 9.257 -6.648 23.719 109 H ASP 54 HN ASP 54 9.519 -2.440 22.798 110 H ILE 55 HN ILE 55 13.470 -1.258 24.037 111 H LEU 56 HN LEU 56 12.876 3.043 24.047 112 H ASP 57 HN ASP 57 17.060 4.231 24.658 113 H THR 58 HN THR 58 15.269 7.729 25.753 114 HG1 THR 58 HG1 THR 58 14.252 9.625 25.897 115 H ALA 59 HN ALA 59 17.642 11.369 24.303 116 H GLY 60 HN GLY 60 17.922 14.486 27.636 117 H GLN 61 HN GLN 61 18.238 16.426 28.150 118 HE21 GLN 61 HE21 GLN 61 19.776 21.801 30.949 119 HE22 GLN 61 HE22 GLN 61 21.356 21.414 31.538 120 H GLU 62 HN GLU 62 16.557 18.696 25.746 121 H GLU 63 HN GLU 63 17.705 20.714 21.966 122 H TYR 64 HN TYR 64 15.580 23.187 19.787 123 HH TYR 64 HH TYR 64 9.382 23.045 13.784 124 H SER 65 HN SER 65 13.596 19.942 17.313 125 HG SER 65 HG SER 65 17.648 17.259 16.103 126 H ALA 66 HN ALA 66 15.264 18.796 13.603 127 H MET 67 HN MET 67 15.585 16.395 14.333 128 H ARG 68 HN ARG 68 14.853 16.048 16.492 129 HE ARG 68 HE ARG 68 12.864 16.667 22.692 130 HH11 ARG 68 HH11 ARG 68 15.379 13.849 24.156 131 HH12 ARG 68 HH12 ARG 68 15.555 14.427 22.453 132 HH21 ARG 68 HH21 ARG 68 12.575 15.942 24.864 133 HH22 ARG 68 HH22 ARG 68 13.722 14.704 25.502 134 H ASP 69 HN ASP 69 12.069 16.228 16.633 135 H GLN 70 HN GLN 70 11.891 13.636 16.030 136 HE21 GLN 70 HE21 GLN 70 12.976 11.489 10.875 137 HE22 GLN 70 HE22 GLN 70 11.603 11.955 9.933 138 H TYR 71 HN TYR 71 12.534 11.220 16.738 139 HH TYR 71 HH TYR 71 16.443 14.008 19.763 140 H MET 72 HN MET 72 10.680 11.704 18.516 141 H ARG 73 HN ARG 73 8.657 10.503 17.746 142 HE ARG 73 HE ARG 73 6.431 14.048 15.914 143 HH11 ARG 73 HH11 ARG 73 3.136 16.140 14.809 144 HH12 ARG 73 HH12 ARG 73 3.246 14.373 14.477 145 HH21 ARG 73 HH21 ARG 73 6.354 16.305 16.343 146 HH22 ARG 73 HH22 ARG 73 4.878 17.222 15.853 147 H THR 74 HN THR 74 8.374 8.611 17.495 148 HG1 THR 74 HG1 THR 74 10.365 7.449 15.691 149 H GLY 75 HN GLY 75 7.296 7.462 19.385 150 H GLU 76 HN GLU 76 5.459 4.286 22.129 151 H GLY 77 HN GLY 77 4.644 3.878 24.074 152 H PHE 78 HN PHE 78 3.740 6.596 27.527 153 H LEU 79 HN LEU 79 7.647 6.864 29.406 154 H CYS 80 HN CYS 80 6.074 8.488 33.220 155 HG CYS 80 HG CYS 80 5.890 10.928 31.209 156 H VAL 81 HN VAL 81 9.896 9.800 33.861 157 H PHE 82 HN PHE 82 10.318 9.944 38.317 158 H ALA 83 HN ALA 83 13.423 12.593 39.788 159 H ILE 84 HN ILE 84 12.516 10.553 43.662 160 H ASN 85 HN ASN 85 14.196 12.125 44.816 161 HD21 ASN 85 HD21 ASN 85 18.343 13.744 46.419 162 HD22 ASN 85 HD22 ASN 85 18.846 13.377 44.807 163 H ASN 86 HN ASN 86 14.022 14.375 44.180 164 HD21 ASN 86 HD21 ASN 86 16.519 16.346 40.276 165 HD22 ASN 86 HD22 ASN 86 16.739 18.057 40.170 166 H THR 87 HN THR 87 13.587 18.198 44.815 167 HG1 THR 87 HG1 THR 87 12.742 20.055 46.154 168 H LYS 88 HN LYS 88 13.811 19.319 42.281 169 HZ1 LYS 88 HZ1 LYS 88 14.554 24.578 36.932 170 HZ2 LYS 88 HZ2 LYS 88 14.699 24.344 38.600 171 HZ3 LYS 88 HZ3 LYS 88 13.709 23.321 37.686 172 H SER 89 HN SER 89 13.422 17.471 40.381 173 HG SER 89 HG SER 89 14.870 15.882 38.249 174 H PHE 90 HN PHE 90 10.925 17.078 40.611 175 H GLU 91 HN GLU 91 9.741 19.097 39.707 176 H ASP 92 HN ASP 92 10.201 18.945 37.327 177 H ILE 93 HN ILE 93 8.179 17.646 36.400 178 H HIS 94 HN HIS 94 5.867 18.742 35.277 179 HD1 HIS 94 HD1 HIS 94 1.348 19.788 34.031 180 HE2 HIS 94 HE2 HIS 94 1.425 23.162 31.882 181 H HIS 95 HN HIS 95 7.005 19.785 33.190 182 HD1 HIS 95 HD1 HIS 95 11.408 20.063 31.275 183 HE2 HIS 95 HE2 HIS 95 10.907 21.791 27.699 184 H TYR 96 HN TYR 96 7.869 17.806 31.533 185 HH TYR 96 HH TYR 96 14.513 16.422 30.920 186 H ARG 97 HN ARG 97 5.624 16.843 31.079 187 HE ARG 97 HE ARG 97 -0.861 15.948 30.926 188 HH11 ARG 97 HH11 ARG 97 0.473 12.732 31.484 189 HH12 ARG 97 HH12 ARG 97 -1.151 12.004 31.798 190 HH21 ARG 97 HH21 ARG 97 -2.915 15.052 31.370 191 HH22 ARG 97 HH22 ARG 97 -3.021 13.289 31.742 192 H GLU 98 HN GLU 98 4.052 18.548 29.456 193 H GLN 99 HN GLN 99 5.600 18.298 27.472 194 HE21 GLN 99 HE21 GLN 99 10.183 19.666 25.529 195 HE22 GLN 99 HE22 GLN 99 11.592 18.824 26.078 196 H ILE 100 HN ILE 100 5.471 15.861 26.367 197 H LYS 101 HN LYS 101 3.036 16.048 25.629 198 HZ1 LYS 101 HZ1 LYS 101 -2.631 19.664 27.149 199 HZ2 LYS 101 HZ2 LYS 101 -1.152 19.474 27.948 200 HZ3 LYS 101 HZ3 LYS 101 -2.540 18.692 28.525 201 H ARG 102 HN ARG 102 3.174 17.618 23.559 202 HE ARG 102 HE ARG 102 6.965 20.492 21.809 203 HH11 ARG 102 HH11 ARG 102 5.728 19.947 18.536 204 HH12 ARG 102 HH12 ARG 102 7.110 18.868 18.079 205 HH21 ARG 102 HH21 ARG 102 8.719 19.147 21.240 206 HH22 ARG 102 HH22 ARG 102 8.770 18.440 19.570 207 H VAL 103 HN VAL 103 4.511 16.426 21.597 208 H LYS 104 HN LYS 104 2.710 14.594 21.038 209 HZ1 LYS 104 HZ1 LYS 104 0.995 7.619 18.794 210 HZ2 LYS 104 HZ2 LYS 104 2.582 7.109 19.090 211 HZ3 LYS 104 HZ3 LYS 104 2.299 8.504 18.177 212 H ASP 105 HN ASP 105 0.975 15.704 20.082 213 H SER 106 HN SER 106 -1.258 14.838 21.252 214 HG SER 106 HG SER 106 -2.144 12.964 19.700 215 H GLU 107 HN GLU 107 -5.455 14.522 22.670 216 H ASP 108 HN ASP 108 -5.184 12.752 24.149 217 H VAL 109 HN VAL 109 -2.608 11.182 26.928 218 H MET 111 HN MET 111 -0.375 7.356 30.074 219 H VAL 112 HN VAL 112 3.511 7.373 32.153 220 H LEU 113 HN LEU 113 2.397 7.574 36.275 221 H VAL 114 HN VAL 114 6.709 8.533 36.933 222 H GLY 115 HN GLY 115 7.775 6.588 40.663 223 H ASN 116 HN ASN 116 11.663 8.747 41.506 224 HD21 ASN 116 HD21 ASN 116 16.070 7.759 39.625 225 HD22 ASN 116 HD22 ASN 116 16.967 6.346 40.059 226 H LYS 117 HN LYS 117 14.562 5.672 43.007 227 HZ1 LYS 117 HZ1 LYS 117 20.408 9.811 40.773 228 HZ2 LYS 117 HZ2 LYS 117 20.891 9.748 42.394 229 HZ3 LYS 117 HZ3 LYS 117 19.574 10.703 41.943 230 H CYS 118 HN CYS 118 13.486 5.222 45.526 231 HG CYS 118 HG CYS 118 12.640 2.918 47.066 232 H ASP 119 HN ASP 119 14.857 4.673 47.416 233 H LEU 120 HN LEU 120 15.838 6.522 48.590 234 H SER 122 HN SER 122 15.834 10.475 51.057 235 HG SER 122 HG SER 122 16.564 14.412 49.455 236 H ARG 123 HN ARG 123 13.910 11.590 51.601 237 HE ARG 123 HE ARG 123 10.325 8.694 51.158 238 HH11 ARG 123 HH11 ARG 123 7.768 9.513 48.896 239 HH12 ARG 123 HH12 ARG 123 7.694 7.847 48.195 240 HH21 ARG 123 HH21 ARG 123 9.086 6.207 48.952 241 HH22 ARG 123 HH22 ARG 123 10.281 6.563 50.267 242 H THR 124 HN THR 124 12.619 14.194 48.473 243 HG1 THR 124 HG1 THR 124 14.447 16.719 47.701 244 H VAL 125 HN VAL 125 10.556 14.451 47.564 245 H ASP 126 HN ASP 126 6.374 15.387 48.597 246 H THR 127 HN THR 127 4.795 11.241 49.868 247 HG1 THR 127 HG1 THR 127 5.576 8.562 48.757 248 H LYS 128 HN LYS 128 2.235 11.794 49.625 249 HZ1 LYS 128 HZ1 LYS 128 -5.444 13.714 50.614 250 HZ2 LYS 128 HZ2 LYS 128 -4.473 12.348 50.823 251 HZ3 LYS 128 HZ3 LYS 128 -4.338 13.275 49.414 252 H GLN 129 HN GLN 129 2.373 13.870 47.972 253 HE21 GLN 129 HE21 GLN 129 2.966 19.031 47.268 254 HE22 GLN 129 HE22 GLN 129 4.574 19.561 47.629 255 H ALA 130 HN ALA 130 3.258 13.111 45.592 256 H GLN 131 HN GLN 131 1.350 11.329 44.978 257 HE21 GLN 131 HE21 GLN 131 -2.262 8.739 46.466 258 HE22 GLN 131 HE22 GLN 131 -2.025 7.624 47.762 259 H ASP 132 HN ASP 132 -0.695 12.999 44.685 260 H LEU 133 HN LEU 133 -0.170 14.433 42.510 261 H ALA 134 HN ALA 134 -0.216 12.526 40.681 262 H ARG 135 HN ARG 135 -2.799 11.764 40.690 263 HE ARG 135 HE ARG 135 -8.883 9.813 39.882 264 HH11 ARG 135 HH11 ARG 135 -7.420 8.289 42.698 265 HH12 ARG 135 HH12 ARG 135 -8.968 7.530 43.228 266 HH21 ARG 135 HH21 ARG 135 -10.843 8.844 40.501 267 HH22 ARG 135 HH22 ARG 135 -10.876 7.841 42.001 268 H SER 136 HN SER 136 -3.707 13.895 39.505 269 HG SER 136 HG SER 136 -5.795 17.498 38.808 270 H TYR 137 HN TYR 137 -3.097 13.791 37.144 271 HH TYR 137 HH TYR 137 1.243 18.782 35.889 272 H GLY 138 HN GLY 138 -4.329 11.973 36.269 273 H ILE 139 HN ILE 139 -3.129 10.193 35.949 274 H PHE 141 HN PHE 141 -0.163 5.841 40.057 275 H ILE 142 HN ILE 142 4.143 5.551 39.555 276 H GLU 143 HN GLU 143 5.286 3.698 43.186 277 H THR 144 HN THR 144 9.548 4.591 42.239 278 HG1 THR 144 HG1 THR 144 10.605 4.371 40.576 279 H SER 145 HN SER 145 12.483 1.296 42.201 280 HG SER 145 HG SER 145 15.921 2.560 45.518 281 H ALA 146 HN ALA 146 16.106 3.117 41.558 282 H LYS 147 HN LYS 147 17.243 1.431 43.073 283 HZ1 LYS 147 HZ1 LYS 147 22.683 1.346 49.463 284 HZ2 LYS 147 HZ2 LYS 147 21.433 2.423 49.094 285 HZ3 LYS 147 HZ3 LYS 147 22.858 2.445 48.189 286 H THR 148 HN THR 148 16.488 -0.307 44.350 287 HG1 THR 148 HG1 THR 148 14.352 -0.272 46.338 288 H ARG 149 HN ARG 149 15.699 -1.478 42.647 289 HE ARG 149 HE ARG 149 16.369 -6.276 37.421 290 HH11 ARG 149 HH11 ARG 149 13.099 -6.391 38.721 291 HH12 ARG 149 HH12 ARG 149 12.342 -6.756 37.124 292 HH21 ARG 149 HH21 ARG 149 15.472 -6.714 35.370 293 HH22 ARG 149 HH22 ARG 149 13.685 -6.949 35.239 294 H GLN 150 HN GLN 150 13.275 -1.876 43.403 295 HE21 GLN 150 HE21 GLN 150 8.956 -0.897 46.752 296 HE22 GLN 150 HE22 GLN 150 9.333 -1.226 48.407 297 H GLY 151 HN GLY 151 9.261 -3.400 42.129 298 H VAL 152 HN VAL 152 10.542 -2.096 40.205 299 H ASP 153 HN ASP 153 9.796 -3.885 38.225 300 H ASP 154 HN ASP 154 7.218 -3.518 38.309 301 H ALA 155 HN ALA 155 6.905 -0.989 37.411 302 H PHE 156 HN PHE 156 7.416 -1.256 34.685 303 H TYR 157 HN TYR 157 5.684 -2.962 33.893 304 HH TYR 157 HH TYR 157 6.119 -10.052 32.303 305 H THR 158 HN THR 158 3.381 -1.709 34.463 306 HG1 THR 158 HG1 THR 158 2.161 -0.963 36.917 307 H LEU 159 HN LEU 159 3.395 0.252 32.591 308 H VAL 160 HN VAL 160 2.926 -1.050 30.290 309 H ARG 161 HN ARG 161 0.425 -1.761 30.769 310 HE ARG 161 HE ARG 161 -1.110 -2.806 34.887 311 HH11 ARG 161 HH11 ARG 161 -0.771 -6.102 33.691 312 HH12 ARG 161 HH12 ARG 161 0.676 -6.440 34.716 313 HH21 ARG 161 HH21 ARG 161 0.728 -3.195 36.207 314 HH22 ARG 161 HH22 ARG 161 1.515 -4.817 36.118 315 H GLU 162 HN GLU 162 -0.855 0.539 30.604 316 H ILE 163 HN ILE 163 -0.767 1.090 28.059 317 H ARG 164 HN ARG 164 -2.197 -0.825 27.072 318 HE ARG 164 HE ARG 164 -1.418 -6.237 26.644 319 HH11 ARG 164 HH11 ARG 164 -1.934 -6.821 30.632 320 HH12 ARG 164 HH12 ARG 164 -3.052 -5.729 29.717 321 HH21 ARG 164 HH21 ARG 164 0.007 -7.644 27.741 322 HH22 ARG 164 HH22 ARG 164 -0.231 -7.897 29.509 323 H LYS 165 HN LYS 165 -4.884 -0.456 28.063 324 HZ1 LYS 165 HZ1 LYS 165 -5.830 1.630 33.379 325 HZ2 LYS 165 HZ2 LYS 165 -4.194 1.237 33.198 326 HZ3 LYS 165 HZ3 LYS 165 -5.290 0.076 33.771 327 H HIS 166 HN HIS 166 -5.216 1.808 26.645 328 HD1 HIS 166 HD1 HIS 166 -3.721 5.208 23.114 329 HE2 HIS 166 HE2 HIS 166 -6.143 8.220 24.148 330 H LYS 167 HN LYS 167 -5.261 1.221 24.057 331 HZ1 LYS 167 HZ1 LYS 167 0.464 0.378 19.861 332 HZ2 LYS 167 HZ2 LYS 167 -0.828 -0.027 18.836 333 HZ3 LYS 167 HZ3 LYS 167 -0.421 -1.051 20.114 334 H GLU 168 HN GLU 168 -7.289 -0.284 24.037 335 H LYS 169 HN LYS 169 -9.300 1.284 24.417 336 HZ1 LYS 169 HZ1 LYS 169 -14.224 7.310 26.321 337 HZ2 LYS 169 HZ2 LYS 169 -13.673 5.979 27.205 338 HZ3 LYS 169 HZ3 LYS 169 -14.132 5.787 25.582 339 H MET 170 HN MET 170 -9.513 2.520 22.187 340 H SER 171 HN SER 171 -11.106 0.798 20.890 341 HG SER 171 HG SER 171 -10.317 -1.686 18.868 342 H LYS 172 HN LYS 172 -13.499 1.458 20.894 343 HZ1 LYS 172 HZ1 LYS 172 -15.879 -3.367 22.783 344 HZ2 LYS 172 HZ2 LYS 172 -16.292 -3.095 21.169 345 HZ3 LYS 172 HZ3 LYS 172 -17.062 -4.325 22.043 346 H ASP 173 HN ASP 173 -14.030 3.293 21.401 347 H GLY 174 HN GLY 174 -15.316 6.387 18.825 348 H LYS 175 HN LYS 175 -12.053 8.583 16.591 349 HZ1 LYS 175 HZ1 LYS 175 -6.633 12.511 17.994 350 HZ2 LYS 175 HZ2 LYS 175 -8.011 12.858 18.905 351 HZ3 LYS 175 HZ3 LYS 175 -6.889 14.079 18.573 352 H LYS 176 HN LYS 176 -13.539 11.303 19.426 353 HZ1 LYS 176 HZ1 LYS 176 -21.308 13.393 21.628 354 HZ2 LYS 176 HZ2 LYS 176 -19.971 13.577 22.641 355 HZ3 LYS 176 HZ3 LYS 176 -20.384 12.043 22.060 356 H LYS 177 HN LYS 177 -15.591 13.928 16.504 357 HZ1 LYS 177 HZ1 LYS 177 -15.864 17.337 12.736 358 HZ2 LYS 177 HZ2 LYS 177 -15.698 16.492 11.282 359 HZ3 LYS 177 HZ3 LYS 177 -15.115 18.071 11.409 360 H LYS 178 HN LYS 178 -15.037 18.268 15.931 361 HZ1 LYS 178 HZ1 LYS 178 -13.939 21.939 20.188 362 HZ2 LYS 178 HZ2 LYS 178 -15.379 22.147 19.330 363 HZ3 LYS 178 HZ3 LYS 178 -13.922 22.695 18.675 364 H LYS 179 HN LYS 179 -19.567 18.196 15.762 365 HZ1 LYS 179 HZ1 LYS 179 -18.263 11.540 15.872 366 HZ2 LYS 179 HZ2 LYS 179 -18.407 11.483 14.187 367 HZ3 LYS 179 HZ3 LYS 179 -19.791 11.435 15.156 368 H LYS 180 HN LYS 180 -21.895 17.716 12.093 369 HZ1 LYS 180 HZ1 LYS 180 -28.375 19.412 16.129 370 HZ2 LYS 180 HZ2 LYS 180 -29.557 19.354 14.924 371 HZ3 LYS 180 HZ3 LYS 180 -27.961 19.740 14.524 372 H SER 181 HN SER 181 -22.847 20.132 14.731 373 HG SER 181 HG SER 181 -21.856 21.681 16.836 374 H LYS 182 HN LYS 182 -23.832 22.868 11.810 375 HZ1 LYS 182 HZ1 LYS 182 -21.889 22.323 5.354 376 HZ2 LYS 182 HZ2 LYS 182 -21.134 20.834 5.608 377 HZ3 LYS 182 HZ3 LYS 182 -20.964 22.068 6.746 378 H THR 183 HN THR 183 -23.806 25.403 11.901 379 HG1 THR 183 HG1 THR 183 -21.805 25.651 13.784 380 H LYS 184 HN LYS 184 -23.899 27.195 9.879 381 HZ1 LYS 184 HZ1 LYS 184 -21.832 31.174 6.793 382 HZ2 LYS 184 HZ2 LYS 184 -21.571 31.693 5.206 383 HZ3 LYS 184 HZ3 LYS 184 -21.756 30.042 5.531 384 H CYS 185 HN CYS 185 -22.200 26.939 6.903 385 HG CYS 185 HG CYS 185 -20.073 25.914 9.045 386 HE21 GLN 418 HE21 GLN 418 -25.730 -42.594 8.165 387 HE22 GLN 418 HE22 GLN 418 -25.145 -41.006 8.525 388 HE21 GLN 424 HE21 GLN 424 -38.496 -42.888 3.134 389 HE22 GLN 424 HE22 GLN 424 -38.085 -44.564 3.151 390 HE21 GLN 439 HE21 GLN 439 -49.375 -21.213 4.116 391 HE22 GLN 439 HE22 GLN 439 -49.176 -22.666 5.030 392 HE21 GLN 453 HE21 GLN 453 -52.370 -2.378 -12.238 393 HE22 GLN 453 HE22 GLN 453 -53.438 -3.667 -12.671 394 HE21 GLN 460 HE21 GLN 460 -48.271 6.576 -14.782 395 HE22 GLN 460 HE22 GLN 460 -48.863 5.212 -15.659 396 HE21 GLN 464 HE21 GLN 464 -47.348 15.141 -15.598 397 HE22 GLN 464 HE22 GLN 464 -49.015 14.658 -15.677 398 HE21 GLN 472 HE21 GLN 472 -43.038 24.835 -14.387 399 HE22 GLN 472 HE22 GLN 472 -44.564 24.111 -14.026 400 HE21 GLN 482 HE21 GLN 482 -29.258 29.890 -23.242 401 HE22 GLN 482 HE22 GLN 482 -29.736 29.275 -24.784 402 HE21 GLN 487 HE21 GLN 487 -23.182 38.038 -16.823 403 HE22 GLN 487 HE22 GLN 487 -24.818 38.096 -16.267 404 HE21 GLN 493 HE21 GLN 493 -14.423 35.732 -27.481 405 HE22 GLN 493 HE22 GLN 493 -16.143 35.803 -27.661 406 HE21 GLN 527 HE21 GLN 527 34.148 29.081 -20.716 407 HE22 GLN 527 HE22 GLN 527 33.257 30.474 -21.218 408 HAC EWS 237 HAC DRG 203 12.032 5.886 14.918 409 HAD EWS 237 HAD DRG 203 11.850 2.920 14.718 410 HAE EWS 237 HAE DRG 203 10.841 4.213 13.918 411 HAF EWS 237 HAF DRG 203 14.288 5.769 15.740 412 HAG EWS 237 HAG DRG 203 14.376 3.994 15.291 413 HAI EWS 237 HAI DRG 203 14.335 6.488 13.638 414 HAH EWS 237 HAH DRG 203 15.301 4.965 13.403 415 HAJ EWS 237 HAJ DRG 203 13.440 2.955 13.143 416 HAL EWS 237 HAL DRG 203 11.378 2.234 12.154 417 HAK EWS 237 HAK DRG 203 11.025 3.920 11.574 418 HAM EWS 237 HAM DRG 203 13.204 0.961 11.302 419 HAN EWS 237 HAN DRG 203 11.965 4.821 9.699 420 HAO EWS 237 HAO DRG 203 13.244 4.348 7.601 421 HAP EWS 237 HAP DRG 203 14.490 0.503 9.210 422 HAQ EWS 237 HAQ DRG 203 13.420 2.835 18.197 423 HAS EWS 237 HAS DRG 203 12.027 0.796 21.790 424 HAT EWS 237 HAT DRG 203 10.557 2.773 22.275 425 HAX EWS 237 HAX DRG 203 10.443 6.674 19.275 426 HAA EWS 237 HAA DRG 203 11.522 3.711 16.708 427 HAZ EWS 237 HAZ DRG 203 12.693 5.698 12.470 428 HAW EWS 237 HAW DRG 203 9.860 5.201 21.278 429 HAY EWS 237 HAY DRG 203 13.867 4.853 11.727 Start of MODEL 8 1 HE21 GLN 220 HE21 GLN 220 20.446 34.497 -19.864 2 HE22 GLN 220 HE22 GLN 220 19.965 35.903 -20.752 3 HE21 GLN 226 HE21 GLN 226 8.123 38.423 -20.178 4 HE22 GLN 226 HE22 GLN 226 9.484 39.434 -19.842 5 HE21 GLN 241 HE21 GLN 241 -10.359 26.131 -27.699 6 HE22 GLN 241 HE22 GLN 241 -10.780 24.982 -28.913 7 HE21 GLN 255 HE21 GLN 255 -30.021 14.536 -19.946 8 HE22 GLN 255 HE22 GLN 255 -30.115 16.263 -19.964 9 HE21 GLN 262 HE21 GLN 262 -32.102 5.309 -15.628 10 HE22 GLN 262 HE22 GLN 262 -31.892 6.988 -15.260 11 HE21 GLN 266 HE21 GLN 266 -36.626 -1.189 -15.687 12 HE22 GLN 266 HE22 GLN 266 -37.622 0.200 -15.388 13 HE21 GLN 274 HE21 GLN 274 -39.091 -13.999 -17.058 14 HE22 GLN 274 HE22 GLN 274 -39.805 -12.894 -18.180 15 HE21 GLN 284 HE21 GLN 284 -35.806 -24.516 -4.313 16 HE22 GLN 284 HE22 GLN 284 -36.704 -23.786 -3.030 17 HE21 GLN 289 HE21 GLN 289 -32.722 -36.018 -8.189 18 HE22 GLN 289 HE22 GLN 289 -33.243 -35.581 -9.778 19 HE21 GLN 295 HE21 GLN 295 -30.802 -36.251 3.845 20 HE22 GLN 295 HE22 GLN 295 -31.692 -34.800 3.544 21 HE21 GLN 329 HE21 GLN 329 12.118 -57.264 22.418 22 HE22 GLN 329 HE22 GLN 329 10.693 -58.244 22.424 23 H MET 1 HT1 MET 1 0.987 -11.503 17.681 24 H THR 2 HN THR 2 1.195 -8.994 20.587 25 HG1 THR 2 HG1 THR 2 -1.399 -7.051 20.101 26 H GLU 3 HN GLU 3 2.890 -5.208 18.626 27 H TYR 4 HN TYR 4 5.850 -3.683 21.667 28 HH TYR 4 HH TYR 4 -0.661 -5.346 24.279 29 H LYS 5 HN LYS 5 5.273 0.377 20.997 30 HZ1 LYS 5 HZ1 LYS 5 3.891 1.078 16.567 31 HZ2 LYS 5 HZ2 LYS 5 4.461 -0.471 16.960 32 HZ3 LYS 5 HZ3 LYS 5 5.298 0.489 15.838 33 H LEU 6 HN LEU 6 8.911 1.345 23.291 34 H VAL 7 HN VAL 7 8.648 5.051 25.777 35 H VAL 8 HN VAL 8 12.617 5.786 27.137 36 H VAL 9 HN VAL 9 10.879 8.886 29.651 37 H GLY 10 HN GLY 10 13.559 12.481 30.183 38 H ALA 11 HN ALA 11 14.379 13.834 34.230 39 H VAL 12 HN VAL 12 18.617 15.463 33.816 40 H GLY 13 HN GLY 13 20.826 11.589 34.871 41 H VAL 14 HN VAL 14 18.452 11.547 36.284 42 H GLY 15 HN GLY 15 18.658 8.859 35.782 43 H LYS 16 HN LYS 16 18.044 7.636 34.056 44 HZ1 LYS 16 HZ1 LYS 16 16.891 8.644 28.630 45 HZ2 LYS 16 HZ2 LYS 16 16.617 10.282 28.312 46 HZ3 LYS 16 HZ3 LYS 16 15.318 9.271 28.726 47 H SER 17 HN SER 17 19.215 5.798 32.471 48 HG SER 17 HG SER 17 22.322 5.197 32.325 49 H ALA 18 HN ALA 18 19.741 3.984 34.262 50 H LEU 19 HN LEU 19 17.310 2.851 34.933 51 H THR 20 HN THR 20 16.947 1.415 32.700 52 HG1 THR 20 HG1 THR 20 16.133 2.255 31.143 53 H ILE 21 HN ILE 21 18.832 -0.262 32.053 54 H GLN 22 HN GLN 22 18.424 -1.756 34.188 55 HE21 GLN 22 HE21 GLN 22 16.705 -3.954 39.999 56 HE22 GLN 22 HE22 GLN 22 18.028 -5.032 40.254 57 H LEU 23 HN LEU 23 16.488 -3.196 33.441 58 H ILE 24 HN ILE 24 16.994 -4.515 31.762 59 H GLN 25 HN GLN 25 19.030 -5.935 31.836 60 HE21 GLN 25 HE21 GLN 25 23.128 -8.890 29.099 61 HE22 GLN 25 HE22 GLN 25 24.539 -7.910 28.900 62 H ASN 26 HN ASN 26 18.539 -6.680 33.686 63 HD21 ASN 26 HD21 ASN 26 17.238 -10.616 37.196 64 HD22 ASN 26 HD22 ASN 26 15.689 -10.356 36.471 65 H HIS 27 HN HIS 27 20.683 -5.764 34.757 66 HD1 HIS 27 HD1 HIS 27 25.507 -7.083 36.470 67 HE2 HIS 27 HE2 HIS 27 27.299 -3.594 35.728 68 H PHE 28 HN PHE 28 22.859 -4.437 38.278 69 H VAL 29 HN VAL 29 23.028 -0.205 36.827 70 H ASP 30 HN ASP 30 27.427 0.839 37.493 71 H GLU 31 HN GLU 31 28.530 2.191 36.974 72 H TYR 32 HN TYR 32 29.742 6.375 35.518 73 HH TYR 32 HH TYR 32 23.543 12.524 36.151 74 H ASP 33 HN ASP 33 26.960 5.885 32.976 75 H THR 35 HN THR 35 23.665 8.964 28.777 76 HG1 THR 35 HG1 THR 35 22.249 6.190 25.786 77 H ILE 36 HN ILE 36 23.406 7.964 24.395 78 H GLU 37 HN GLU 37 22.100 7.646 22.293 79 H ASP 38 HN ASP 38 18.961 5.671 23.059 80 H SER 39 HN SER 39 18.752 1.646 21.458 81 HG SER 39 HG SER 39 16.219 2.283 19.647 82 H TYR 40 HN TYR 40 15.604 -0.191 24.054 83 HH TYR 40 HH TYR 40 21.573 1.760 26.689 84 H ARG 41 HN ARG 41 16.445 -4.109 22.983 85 HE ARG 41 HE ARG 41 13.840 -7.119 18.637 86 HH11 ARG 41 HH11 ARG 41 13.101 -3.705 18.186 87 HH12 ARG 41 HH12 ARG 41 13.838 -3.658 16.534 88 HH21 ARG 41 HH21 ARG 41 14.768 -5.587 15.609 89 HH22 ARG 41 HH22 ARG 41 14.733 -7.134 16.533 90 H LYS 42 HN LYS 42 12.414 -5.989 23.981 91 HZ1 LYS 42 HZ1 LYS 42 14.403 -10.524 29.128 92 HZ2 LYS 42 HZ2 LYS 42 14.809 -10.367 30.765 93 HZ3 LYS 42 HZ3 LYS 42 15.461 -9.304 29.625 94 H GLN 43 HN GLN 43 12.517 -10.088 25.090 95 HE21 GLN 43 HE21 GLN 43 11.586 -13.237 22.315 96 HE22 GLN 43 HE22 GLN 43 10.812 -14.248 21.148 97 H VAL 44 HN VAL 44 8.250 -9.889 25.905 98 H VAL 45 HN VAL 45 6.652 -12.338 29.192 99 H ILE 46 HN ILE 46 2.764 -10.614 28.127 100 H ASP 47 HN ASP 47 0.654 -10.172 31.874 101 H GLY 48 HN GLY 48 0.211 -12.467 30.691 102 H GLU 49 HN GLU 49 -0.367 -11.945 28.169 103 H THR 50 HN THR 50 1.964 -13.460 24.800 104 HG1 THR 50 HG1 THR 50 6.428 -13.210 24.212 105 H CYS 51 HN CYS 51 4.993 -10.034 25.307 106 HG CYS 51 HG CYS 51 1.936 -9.227 25.201 107 H LEU 52 HN LEU 52 5.331 -7.551 21.788 108 H LEU 53 HN LEU 53 9.073 -6.543 23.829 109 H ASP 54 HN ASP 54 9.254 -2.301 22.903 110 H ILE 55 HN ILE 55 12.978 -1.035 24.158 111 H LEU 56 HN LEU 56 12.456 3.170 23.579 112 H ASP 57 HN ASP 57 16.479 5.236 23.936 113 H THR 58 HN THR 58 15.668 9.096 25.510 114 HG1 THR 58 HG1 THR 58 14.905 11.758 23.316 115 H ALA 59 HN ALA 59 18.363 12.312 24.294 116 H GLY 60 HN GLY 60 17.760 14.493 28.289 117 H GLN 61 HN GLN 61 18.354 16.694 27.893 118 HE21 GLN 61 HE21 GLN 61 19.431 19.967 31.899 119 HE22 GLN 61 HE22 GLN 61 18.191 21.168 31.784 120 H GLU 62 HN GLU 62 16.559 19.142 25.445 121 H GLU 63 HN GLU 63 17.936 21.081 21.905 122 H TYR 64 HN TYR 64 14.983 23.652 20.012 123 HH TYR 64 HH TYR 64 9.794 22.760 13.297 124 H SER 65 HN SER 65 13.851 19.997 18.028 125 HG SER 65 HG SER 65 16.989 19.194 18.782 126 H ALA 66 HN ALA 66 14.805 19.387 13.888 127 H MET 67 HN MET 67 15.376 16.731 13.967 128 H ARG 68 HN ARG 68 14.802 16.055 16.507 129 HE ARG 68 HE ARG 68 12.325 17.283 22.704 130 HH11 ARG 68 HH11 ARG 68 15.572 15.864 22.663 131 HH12 ARG 68 HH12 ARG 68 15.456 15.327 24.389 132 HH21 ARG 68 HH21 ARG 68 12.169 16.630 24.852 133 HH22 ARG 68 HH22 ARG 68 13.560 15.755 25.603 134 H ASP 69 HN ASP 69 12.187 16.467 16.746 135 H GLN 70 HN GLN 70 11.352 14.531 15.181 136 HE21 GLN 70 HE21 GLN 70 9.634 13.317 10.259 137 HE22 GLN 70 HE22 GLN 70 7.912 13.379 10.418 138 H TYR 71 HN TYR 71 12.085 12.375 16.205 139 HH TYR 71 HH TYR 71 15.624 14.067 21.580 140 H MET 72 HN MET 72 10.528 11.749 18.519 141 H ARG 73 HN ARG 73 8.628 10.159 17.234 142 HE ARG 73 HE ARG 73 4.275 13.656 15.836 143 HH11 ARG 73 HH11 ARG 73 7.559 15.064 13.920 144 HH12 ARG 73 HH12 ARG 73 6.910 13.431 13.514 145 HH21 ARG 73 HH21 ARG 73 5.067 15.714 16.397 146 HH22 ARG 73 HH22 ARG 73 6.536 16.357 15.557 147 H THR 74 HN THR 74 8.104 8.036 17.525 148 HG1 THR 74 HG1 THR 74 9.961 7.014 17.057 149 H GLY 75 HN GLY 75 6.839 7.068 19.132 150 H GLU 76 HN GLU 76 4.851 3.806 21.630 151 H GLY 77 HN GLY 77 4.228 4.017 23.783 152 H PHE 78 HN PHE 78 4.095 6.977 27.048 153 H LEU 79 HN LEU 79 8.190 6.889 28.811 154 H CYS 80 HN CYS 80 6.981 8.303 32.853 155 HG CYS 80 HG CYS 80 7.152 10.831 30.619 156 H VAL 81 HN VAL 81 10.757 9.794 33.715 157 H PHE 82 HN PHE 82 10.633 9.821 38.171 158 H ALA 83 HN ALA 83 13.523 12.570 40.014 159 H ILE 84 HN ILE 84 13.120 10.100 43.820 160 H ASN 85 HN ASN 85 14.520 11.988 45.043 161 HD21 ASN 85 HD21 ASN 85 16.056 10.552 47.475 162 HD22 ASN 85 HD22 ASN 85 16.846 9.852 46.099 163 H ASN 86 HN ASN 86 13.817 14.234 44.104 164 HD21 ASN 86 HD21 ASN 86 17.850 15.694 41.978 165 HD22 ASN 86 HD22 ASN 86 18.009 17.006 40.862 166 H THR 87 HN THR 87 14.210 18.173 44.231 167 HG1 THR 87 HG1 THR 87 12.613 19.600 46.325 168 H LYS 88 HN LYS 88 13.996 19.622 41.784 169 HZ1 LYS 88 HZ1 LYS 88 15.560 21.613 34.251 170 HZ2 LYS 88 HZ2 LYS 88 14.388 20.776 35.141 171 HZ3 LYS 88 HZ3 LYS 88 16.034 20.561 35.491 172 H SER 89 HN SER 89 13.515 17.526 40.096 173 HG SER 89 HG SER 89 14.944 16.051 39.142 174 H PHE 90 HN PHE 90 10.937 16.980 40.518 175 H GLU 91 HN GLU 91 9.667 18.980 39.611 176 H ASP 92 HN ASP 92 10.124 18.728 37.250 177 H ILE 93 HN ILE 93 8.273 17.309 36.273 178 H HIS 94 HN HIS 94 5.857 18.322 35.200 179 HD1 HIS 94 HD1 HIS 94 3.118 22.493 33.852 180 HE2 HIS 94 HE2 HIS 94 0.041 20.625 32.118 181 H HIS 95 HN HIS 95 7.054 19.607 33.279 182 HD1 HIS 95 HD1 HIS 95 11.515 19.943 31.523 183 HE2 HIS 95 HE2 HIS 95 11.256 22.198 28.215 184 H TYR 96 HN TYR 96 7.855 17.726 31.496 185 HH TYR 96 HH TYR 96 14.426 17.812 30.509 186 H ARG 97 HN ARG 97 5.780 16.554 30.853 187 HE ARG 97 HE ARG 97 -0.893 15.477 31.237 188 HH11 ARG 97 HH11 ARG 97 -0.303 11.463 31.095 189 HH12 ARG 97 HH12 ARG 97 1.081 12.561 31.465 190 HH21 ARG 97 HH21 ARG 97 -2.665 14.099 30.792 191 HH22 ARG 97 HH22 ARG 97 -2.387 12.320 30.717 192 H GLU 98 HN GLU 98 4.346 18.414 29.330 193 H GLN 99 HN GLN 99 5.795 18.398 27.084 194 HE21 GLN 99 HE21 GLN 99 9.821 20.293 24.801 195 HE22 GLN 99 HE22 GLN 99 11.382 19.603 25.087 196 H ILE 100 HN ILE 100 5.488 16.006 26.086 197 H LYS 101 HN LYS 101 2.905 16.105 25.423 198 HZ1 LYS 101 HZ1 LYS 101 -1.883 18.546 29.172 199 HZ2 LYS 101 HZ2 LYS 101 -1.801 19.860 28.118 200 HZ3 LYS 101 HZ3 LYS 101 -0.376 19.219 28.783 201 H ARG 102 HN ARG 102 3.001 17.576 23.265 202 HE ARG 102 HE ARG 102 4.563 21.560 18.056 203 HH11 ARG 102 HH11 ARG 102 6.242 19.284 20.140 204 HH12 ARG 102 HH12 ARG 102 7.134 18.502 18.771 205 HH21 ARG 102 HH21 ARG 102 6.799 19.205 16.634 206 HH22 ARG 102 HH22 ARG 102 5.642 20.553 16.285 207 H VAL 103 HN VAL 103 4.432 16.486 21.463 208 H LYS 104 HN LYS 104 3.018 14.363 20.910 209 HZ1 LYS 104 HZ1 LYS 104 1.701 8.235 18.828 210 HZ2 LYS 104 HZ2 LYS 104 0.960 7.269 20.006 211 HZ3 LYS 104 HZ3 LYS 104 2.651 7.345 19.909 212 H ASP 105 HN ASP 105 1.291 15.305 19.660 213 H SER 106 HN SER 106 -0.882 14.795 21.096 214 HG SER 106 HG SER 106 -2.732 12.843 19.404 215 H GLU 107 HN GLU 107 -4.694 14.955 22.933 216 H ASP 108 HN ASP 108 -4.621 13.070 24.287 217 H VAL 109 HN VAL 109 -2.182 11.279 26.735 218 H MET 111 HN MET 111 -0.217 7.202 30.032 219 H VAL 112 HN VAL 112 3.640 6.946 31.946 220 H LEU 113 HN LEU 113 2.484 7.748 36.018 221 H VAL 114 HN VAL 114 6.853 8.213 36.612 222 H GLY 115 HN GLY 115 7.762 6.587 40.489 223 H ASN 116 HN ASN 116 11.887 8.413 41.143 224 HD21 ASN 116 HD21 ASN 116 16.043 6.583 38.818 225 HD22 ASN 116 HD22 ASN 116 16.631 5.015 39.249 226 H LYS 117 HN LYS 117 14.826 5.319 42.456 227 HZ1 LYS 117 HZ1 LYS 117 19.739 9.048 39.792 228 HZ2 LYS 117 HZ2 LYS 117 18.788 7.795 40.424 229 HZ3 LYS 117 HZ3 LYS 117 20.157 8.327 41.266 230 H CYS 118 HN CYS 118 13.564 5.040 44.662 231 HG CYS 118 HG CYS 118 10.493 2.730 45.508 232 H ASP 119 HN ASP 119 15.326 4.337 46.463 233 H LEU 120 HN LEU 120 16.233 5.827 47.916 234 H SER 122 HN SER 122 17.757 9.725 51.139 235 HG SER 122 HG SER 122 17.997 13.474 52.097 236 H ARG 123 HN ARG 123 14.478 12.696 51.622 237 HE ARG 123 HE ARG 123 11.016 8.707 50.660 238 HH11 ARG 123 HH11 ARG 123 8.070 7.765 48.038 239 HH12 ARG 123 HH12 ARG 123 8.235 9.455 48.657 240 HH21 ARG 123 HH21 ARG 123 10.839 6.538 49.932 241 HH22 ARG 123 HH22 ARG 123 9.521 6.130 48.751 242 H THR 124 HN THR 124 12.875 14.248 48.345 243 HG1 THR 124 HG1 THR 124 12.813 16.735 46.475 244 H VAL 125 HN VAL 125 10.922 14.523 47.427 245 H ASP 126 HN ASP 126 6.800 14.886 48.776 246 H THR 127 HN THR 127 5.580 10.485 49.486 247 HG1 THR 127 HG1 THR 127 5.977 7.547 48.270 248 H LYS 128 HN LYS 128 2.922 11.301 49.288 249 HZ1 LYS 128 HZ1 LYS 128 -4.174 14.800 49.344 250 HZ2 LYS 128 HZ2 LYS 128 -3.471 13.266 49.337 251 HZ3 LYS 128 HZ3 LYS 128 -2.844 14.490 48.346 252 H GLN 129 HN GLN 129 2.925 13.608 47.875 253 HE21 GLN 129 HE21 GLN 129 4.685 18.579 46.772 254 HE22 GLN 129 HE22 GLN 129 6.255 18.596 47.500 255 H ALA 130 HN ALA 130 3.554 12.771 45.298 256 H GLN 131 HN GLN 131 1.691 11.004 44.671 257 HE21 GLN 131 HE21 GLN 131 -1.778 7.976 45.965 258 HE22 GLN 131 HE22 GLN 131 -1.877 6.256 45.836 259 H ASP 132 HN ASP 132 -0.401 12.691 44.670 260 H LEU 133 HN LEU 133 -0.036 14.357 42.572 261 H ALA 134 HN ALA 134 -0.060 12.554 40.625 262 H ARG 135 HN ARG 135 -2.669 11.563 40.591 263 HE ARG 135 HE ARG 135 -9.111 11.019 41.765 264 HH11 ARG 135 HH11 ARG 135 -9.346 7.820 44.228 265 HH12 ARG 135 HH12 ARG 135 -7.732 8.446 43.722 266 HH21 ARG 135 HH21 ARG 135 -11.173 10.237 42.359 267 HH22 ARG 135 HH22 ARG 135 -11.267 8.823 43.474 268 H SER 136 HN SER 136 -3.797 13.759 39.679 269 HG SER 136 HG SER 136 -3.658 15.810 40.829 270 H TYR 137 HN TYR 137 -3.274 13.673 37.146 271 HH TYR 137 HH TYR 137 1.059 18.623 36.282 272 H GLY 138 HN GLY 138 -4.471 11.962 36.345 273 H ILE 139 HN ILE 139 -3.147 10.313 35.863 274 H PHE 141 HN PHE 141 0.166 5.364 39.635 275 H ILE 142 HN ILE 142 4.318 5.386 39.450 276 H GLU 143 HN GLU 143 5.498 3.508 43.161 277 H THR 144 HN THR 144 9.615 4.387 41.954 278 HG1 THR 144 HG1 THR 144 10.742 3.980 40.215 279 H SER 145 HN SER 145 12.531 1.075 41.922 280 HG SER 145 HG SER 145 16.359 2.450 44.617 281 H ALA 146 HN ALA 146 16.239 2.564 41.020 282 H LYS 147 HN LYS 147 17.419 1.039 42.641 283 HZ1 LYS 147 HZ1 LYS 147 22.754 0.475 46.042 284 HZ2 LYS 147 HZ2 LYS 147 23.371 0.730 47.594 285 HZ3 LYS 147 HZ3 LYS 147 22.341 1.874 46.897 286 H THR 148 HN THR 148 16.465 -0.458 44.420 287 HG1 THR 148 HG1 THR 148 14.642 0.101 46.111 288 H ARG 149 HN ARG 149 15.246 -1.634 42.799 289 HE ARG 149 HE ARG 149 12.375 -6.841 38.786 290 HH11 ARG 149 HH11 ARG 149 15.820 -6.893 38.106 291 HH12 ARG 149 HH12 ARG 149 15.596 -7.483 36.418 292 HH21 ARG 149 HH21 ARG 149 12.036 -7.594 36.642 293 HH22 ARG 149 HH22 ARG 149 13.487 -7.881 35.596 294 H GLN 150 HN GLN 150 12.931 -1.757 43.651 295 HE21 GLN 150 HE21 GLN 150 10.796 -1.407 48.219 296 HE22 GLN 150 HE22 GLN 150 9.994 0.038 48.724 297 H GLY 151 HN GLY 151 8.960 -3.461 42.698 298 H VAL 152 HN VAL 152 10.301 -2.237 40.587 299 H ASP 153 HN ASP 153 9.573 -4.175 38.738 300 H ASP 154 HN ASP 154 6.873 -3.945 38.467 301 H ALA 155 HN ALA 155 6.792 -1.588 37.585 302 H PHE 156 HN PHE 156 7.534 -1.192 34.850 303 H TYR 157 HN TYR 157 5.596 -2.683 34.052 304 HH TYR 157 HH TYR 157 7.626 -8.944 32.635 305 H THR 158 HN THR 158 3.385 -1.404 34.471 306 HG1 THR 158 HG1 THR 158 2.675 -0.833 36.315 307 H LEU 159 HN LEU 159 3.351 0.390 32.416 308 H VAL 160 HN VAL 160 2.759 -1.079 30.328 309 H ARG 161 HN ARG 161 0.283 -1.842 30.807 310 HE ARG 161 HE ARG 161 -0.190 -3.330 35.318 311 HH11 ARG 161 HH11 ARG 161 -0.198 -7.186 34.072 312 HH12 ARG 161 HH12 ARG 161 -1.390 -6.019 33.386 313 HH21 ARG 161 HH21 ARG 161 1.346 -4.783 36.225 314 HH22 ARG 161 HH22 ARG 161 1.318 -6.500 35.650 315 H GLU 162 HN GLU 162 -0.935 0.483 30.522 316 H ILE 163 HN ILE 163 -0.783 1.015 27.877 317 H ARG 164 HN ARG 164 -2.216 -0.960 26.979 318 HE ARG 164 HE ARG 164 -0.697 -5.814 27.464 319 HH11 ARG 164 HH11 ARG 164 -3.170 -8.839 26.354 320 HH12 ARG 164 HH12 ARG 164 -3.849 -7.230 26.817 321 HH21 ARG 164 HH21 ARG 164 0.223 -7.835 26.866 322 HH22 ARG 164 HH22 ARG 164 -0.889 -9.171 26.397 323 H LYS 165 HN LYS 165 -4.818 -0.496 27.836 324 HZ1 LYS 165 HZ1 LYS 165 -5.039 2.609 32.839 325 HZ2 LYS 165 HZ2 LYS 165 -6.047 1.450 33.557 326 HZ3 LYS 165 HZ3 LYS 165 -6.711 2.632 32.546 327 H HIS 166 HN HIS 166 -5.062 1.571 26.267 328 HD1 HIS 166 HD1 HIS 166 -4.168 5.168 22.520 329 HE2 HIS 166 HE2 HIS 166 -5.477 8.165 24.833 330 H LYS 167 HN LYS 167 -5.304 0.798 23.811 331 HZ1 LYS 167 HZ1 LYS 167 -1.164 -1.349 19.515 332 HZ2 LYS 167 HZ2 LYS 167 -0.223 -0.400 20.558 333 HZ3 LYS 167 HZ3 LYS 167 -1.799 0.081 20.166 334 H GLU 168 HN GLU 168 -7.572 -0.504 23.796 335 H LYS 169 HN LYS 169 -9.161 1.468 24.420 336 HZ1 LYS 169 HZ1 LYS 169 -12.401 6.975 25.555 337 HZ2 LYS 169 HZ2 LYS 169 -12.249 8.453 26.362 338 HZ3 LYS 169 HZ3 LYS 169 -12.118 7.005 27.219 339 H MET 170 HN MET 170 -9.237 2.797 22.041 340 H SER 171 HN SER 171 -10.718 1.270 20.487 341 HG SER 171 HG SER 171 -10.456 -0.742 18.384 342 H LYS 172 HN LYS 172 -12.954 1.643 21.560 343 HZ1 LYS 172 HZ1 LYS 172 -13.861 1.537 27.710 344 HZ2 LYS 172 HZ2 LYS 172 -13.050 0.231 26.993 345 HZ3 LYS 172 HZ3 LYS 172 -14.488 -0.026 27.851 346 H ASP 173 HN ASP 173 -13.740 3.670 20.302 347 H GLY 174 HN GLY 174 -14.430 4.841 18.154 348 H LYS 175 HN LYS 175 -18.043 4.992 15.646 349 HZ1 LYS 175 HZ1 LYS 175 -22.828 1.287 16.382 350 HZ2 LYS 175 HZ2 LYS 175 -22.418 -0.134 17.207 351 HZ3 LYS 175 HZ3 LYS 175 -22.981 -0.211 15.614 352 H LYS 176 HN LYS 176 -16.096 1.784 13.311 353 HZ1 LYS 176 HZ1 LYS 176 -11.422 4.983 8.215 354 HZ2 LYS 176 HZ2 LYS 176 -11.190 6.512 8.893 355 HZ3 LYS 176 HZ3 LYS 176 -12.713 6.069 8.320 356 H LYS 177 HN LYS 177 -17.085 0.483 11.998 357 HZ1 LYS 177 HZ1 LYS 177 -15.545 -4.523 9.306 358 HZ2 LYS 177 HZ2 LYS 177 -16.176 -5.992 8.749 359 HZ3 LYS 177 HZ3 LYS 177 -16.831 -5.262 10.121 360 H LYS 178 HN LYS 178 -19.054 0.901 8.355 361 HZ1 LYS 178 HZ1 LYS 178 -20.297 7.296 9.067 362 HZ2 LYS 178 HZ2 LYS 178 -19.553 7.223 10.582 363 HZ3 LYS 178 HZ3 LYS 178 -20.823 6.172 10.218 364 H LYS 179 HN LYS 179 -22.933 -0.465 9.203 365 HZ1 LYS 179 HZ1 LYS 179 -27.066 -3.488 12.452 366 HZ2 LYS 179 HZ2 LYS 179 -28.238 -3.846 11.288 367 HZ3 LYS 179 HZ3 LYS 179 -28.504 -2.602 12.402 368 H LYS 180 HN LYS 180 -24.394 -2.451 5.273 369 HZ1 LYS 180 HZ1 LYS 180 -25.617 2.983 0.863 370 HZ2 LYS 180 HZ2 LYS 180 -25.515 4.102 2.128 371 HZ3 LYS 180 HZ3 LYS 180 -26.679 4.300 0.925 372 H SER 181 HN SER 181 -24.450 -2.863 3.060 373 HG SER 181 HG SER 181 -27.125 -2.195 1.195 374 H LYS 182 HN LYS 182 -26.515 -6.435 1.542 375 HZ1 LYS 182 HZ1 LYS 182 -24.076 -5.729 -2.181 376 HZ2 LYS 182 HZ2 LYS 182 -23.218 -5.613 -3.629 377 HZ3 LYS 182 HZ3 LYS 182 -22.507 -5.099 -2.183 378 H THR 183 HN THR 183 -26.606 -8.662 3.716 379 HG1 THR 183 HG1 THR 183 -26.481 -6.849 4.957 380 H LYS 184 HN LYS 184 -27.156 -10.515 4.227 381 HZ1 LYS 184 HZ1 LYS 184 -28.783 -15.955 3.216 382 HZ2 LYS 184 HZ2 LYS 184 -28.625 -17.466 3.965 383 HZ3 LYS 184 HZ3 LYS 184 -27.721 -16.150 4.522 384 H CYS 185 HN CYS 185 -28.418 -11.605 3.101 385 HG CYS 185 HG CYS 185 -26.902 -14.512 -1.520 386 HE21 GLN 418 HE21 GLN 418 48.108 -33.273 19.874 387 HE22 GLN 418 HE22 GLN 418 46.602 -32.424 19.856 388 HE21 GLN 424 HE21 GLN 424 47.545 -47.374 18.237 389 HE22 GLN 424 HE22 GLN 424 49.217 -47.041 18.536 390 HE21 GLN 439 HE21 GLN 439 24.934 -56.152 21.366 391 HE22 GLN 439 HE22 GLN 439 26.289 -55.989 22.433 392 HE21 GLN 453 HE21 GLN 453 6.144 -62.774 7.467 393 HE22 GLN 453 HE22 GLN 453 7.292 -64.007 7.859 394 HE21 GLN 460 HE21 GLN 460 -1.523 -58.719 1.623 395 HE22 GLN 460 HE22 GLN 460 -0.037 -59.570 1.375 396 HE21 GLN 464 HE21 GLN 464 -8.550 -57.584 -0.290 397 HE22 GLN 464 HE22 GLN 464 -7.730 -59.106 -0.211 398 HE21 GLN 472 HE21 GLN 472 -19.264 -51.592 -0.370 399 HE22 GLN 472 HE22 GLN 472 -18.778 -53.066 0.391 400 HE21 GLN 482 HE21 GLN 482 -23.704 -41.690 -14.732 401 HE22 GLN 482 HE22 GLN 482 -23.138 -42.800 -15.931 402 HE21 GLN 487 HE21 GLN 487 -31.306 -32.224 -11.435 403 HE22 GLN 487 HE22 GLN 487 -32.017 -33.174 -10.178 404 HE21 GLN 493 HE21 GLN 493 -28.487 -28.354 -22.984 405 HE22 GLN 493 HE22 GLN 493 -27.735 -29.808 -23.540 406 HE21 GLN 527 HE21 GLN 527 -16.043 19.793 -33.056 407 HE22 GLN 527 HE22 GLN 527 -17.688 19.346 -33.347 408 HAC EWS 237 HAC DRG 203 12.939 8.415 17.118 409 HAD EWS 237 HAD DRG 203 12.705 6.126 15.228 410 HAE EWS 237 HAE DRG 203 11.875 7.751 15.209 411 HAF EWS 237 HAF DRG 203 15.029 7.595 17.974 412 HAG EWS 237 HAG DRG 203 15.137 6.388 16.599 413 HAI EWS 237 HAI DRG 203 15.433 9.363 16.692 414 HAH EWS 237 HAH DRG 203 16.379 8.140 15.735 415 HAJ EWS 237 HAJ DRG 203 14.527 6.860 14.154 416 HAL EWS 237 HAL DRG 203 12.630 7.068 12.702 417 HAK EWS 237 HAK DRG 203 12.424 8.814 13.163 418 HAM EWS 237 HAM DRG 203 14.532 6.297 11.489 419 HAN EWS 237 HAN DRG 203 13.678 10.500 12.271 420 HAO EWS 237 HAO DRG 203 15.262 11.150 10.447 421 HAP EWS 237 HAP DRG 203 16.123 6.955 9.679 422 HAQ EWS 237 HAQ DRG 203 13.694 3.909 18.175 423 HAS EWS 237 HAS DRG 203 11.685 0.375 19.750 424 HAT EWS 237 HAT DRG 203 10.214 1.888 21.113 425 HAX EWS 237 HAX DRG 203 10.695 6.782 20.916 426 HAA EWS 237 HAA DRG 203 12.086 5.687 17.256 427 HAZ EWS 237 HAZ DRG 203 13.977 9.568 15.103 428 HAW EWS 237 HAW DRG 203 9.756 4.515 21.623 429 HAY EWS 237 HAY DRG 203 15.230 9.161 14.149 Start of MODEL 9 1 HE21 GLN 220 HE21 GLN 220 -4.164 49.335 -11.488 2 HE22 GLN 220 HE22 GLN 220 -4.207 51.028 -11.151 3 HE21 GLN 226 HE21 GLN 226 -14.899 50.974 -3.030 4 HE22 GLN 226 HE22 GLN 226 -13.703 52.223 -3.098 5 HE21 GLN 241 HE21 GLN 241 -32.672 38.154 -2.322 6 HE22 GLN 241 HE22 GLN 241 -33.282 39.589 -3.066 7 HE21 GLN 255 HE21 GLN 255 -44.604 19.814 8.152 8 HE22 GLN 255 HE22 GLN 255 -45.026 21.149 9.171 9 HE21 GLN 262 HE21 GLN 262 -42.833 8.730 12.788 10 HE22 GLN 262 HE22 GLN 262 -41.862 9.786 13.753 11 HE21 GLN 266 HE21 GLN 266 -45.540 2.779 12.125 12 HE22 GLN 266 HE22 GLN 266 -46.261 4.238 12.714 13 HE21 GLN 274 HE21 GLN 274 -46.643 -11.318 8.844 14 HE22 GLN 274 HE22 GLN 274 -47.987 -10.256 8.614 15 HE21 GLN 284 HE21 GLN 284 -35.278 -21.535 16.165 16 HE22 GLN 284 HE22 GLN 284 -35.776 -20.032 16.859 17 HE21 GLN 289 HE21 GLN 289 -34.237 -31.488 7.848 18 HE22 GLN 289 HE22 GLN 289 -35.796 -31.008 7.276 19 HE21 GLN 295 HE21 GLN 295 -23.448 -32.015 17.134 20 HE22 GLN 295 HE22 GLN 295 -24.974 -31.528 17.783 21 HE21 GLN 329 HE21 GLN 329 21.697 -46.522 3.039 22 HE22 GLN 329 HE22 GLN 329 20.502 -47.746 3.270 23 H MET 1 HT1 MET 1 4.534 -10.017 15.738 24 H THR 2 HN THR 2 2.922 -9.670 19.750 25 HG1 THR 2 HG1 THR 2 1.978 -9.282 21.958 26 H GLU 3 HN GLU 3 4.157 -5.936 18.350 27 H TYR 4 HN TYR 4 6.510 -3.862 21.603 28 HH TYR 4 HH TYR 4 -0.553 -4.722 22.124 29 H LYS 5 HN LYS 5 5.813 0.012 20.415 30 HZ1 LYS 5 HZ1 LYS 5 8.717 -1.326 17.075 31 HZ2 LYS 5 HZ2 LYS 5 9.733 -0.456 18.132 32 HZ3 LYS 5 HZ3 LYS 5 10.272 -0.866 16.584 33 H LEU 6 HN LEU 6 9.323 1.466 22.661 34 H VAL 7 HN VAL 7 9.334 5.378 24.604 35 H VAL 8 HN VAL 8 13.338 5.600 26.312 36 H VAL 9 HN VAL 9 11.959 8.532 29.550 37 H GLY 10 HN GLY 10 14.053 12.418 30.032 38 H ALA 11 HN ALA 11 14.975 13.512 34.103 39 H VAL 12 HN VAL 12 19.107 15.323 33.135 40 H GLY 13 HN GLY 13 19.988 11.598 34.623 41 H VAL 14 HN VAL 14 18.480 11.469 35.835 42 H GLY 15 HN GLY 15 19.279 8.846 35.931 43 H LYS 16 HN LYS 16 19.087 7.717 33.814 44 HZ1 LYS 16 HZ1 LYS 16 18.577 8.971 28.974 45 HZ2 LYS 16 HZ2 LYS 16 17.473 9.285 27.724 46 HZ3 LYS 16 HZ3 LYS 16 18.069 7.714 27.954 47 H SER 17 HN SER 17 20.059 5.467 31.809 48 HG SER 17 HG SER 17 20.022 4.875 29.609 49 H ALA 18 HN ALA 18 19.387 3.991 33.841 50 H LEU 19 HN LEU 19 17.213 2.615 34.394 51 H THR 20 HN THR 20 17.282 1.287 32.425 52 HG1 THR 20 HG1 THR 20 16.200 2.113 30.531 53 H ILE 21 HN ILE 21 19.261 -0.452 31.865 54 H GLN 22 HN GLN 22 18.519 -1.982 33.811 55 HE21 GLN 22 HE21 GLN 22 18.558 -2.900 39.015 56 HE22 GLN 22 HE22 GLN 22 19.440 -4.357 39.307 57 H LEU 23 HN LEU 23 16.606 -3.406 32.817 58 H ILE 24 HN ILE 24 17.037 -4.437 30.908 59 H GLN 25 HN GLN 25 19.482 -5.781 30.825 60 HE21 GLN 25 HE21 GLN 25 23.546 -5.066 28.992 61 HE22 GLN 25 HE22 GLN 25 25.183 -5.632 28.989 62 H ASN 26 HN ASN 26 18.686 -6.850 32.700 63 HD21 ASN 26 HD21 ASN 26 17.895 -11.503 33.929 64 HD22 ASN 26 HD22 ASN 26 16.264 -11.186 33.453 65 H HIS 27 HN HIS 27 20.672 -5.940 34.205 66 HD1 HIS 27 HD1 HIS 27 25.071 -7.449 36.743 67 HE2 HIS 27 HE2 HIS 27 27.213 -4.105 36.290 68 H PHE 28 HN PHE 28 22.811 -5.062 37.967 69 H VAL 29 HN VAL 29 23.040 -0.787 36.849 70 H ASP 30 HN ASP 30 27.325 0.554 37.737 71 H GLU 31 HN GLU 31 28.081 1.958 37.060 72 H TYR 32 HN TYR 32 29.505 6.256 36.231 73 HH TYR 32 HH TYR 32 24.313 13.040 35.679 74 H ASP 33 HN ASP 33 26.478 5.774 33.584 75 H THR 35 HN THR 35 23.434 8.356 28.357 76 HG1 THR 35 HG1 THR 35 23.571 6.062 28.319 77 H ILE 36 HN ILE 36 23.964 8.589 24.032 78 H GLU 37 HN GLU 37 22.916 8.351 21.792 79 H ASP 38 HN ASP 38 19.937 5.868 22.383 80 H SER 39 HN SER 39 20.819 1.497 21.837 81 HG SER 39 HG SER 39 19.663 2.395 19.701 82 H TYR 40 HN TYR 40 16.756 -0.137 22.324 83 HH TYR 40 HH TYR 40 23.075 -1.123 26.723 84 H ARG 41 HN ARG 41 16.782 -4.323 23.300 85 HE ARG 41 HE ARG 41 14.525 -6.004 18.873 86 HH11 ARG 41 HH11 ARG 41 11.743 -4.676 17.186 87 HH12 ARG 41 HH12 ARG 41 12.172 -5.474 15.625 88 HH21 ARG 41 HH21 ARG 41 15.154 -6.974 16.907 89 HH22 ARG 41 HH22 ARG 41 14.084 -6.768 15.467 90 H LYS 42 HN LYS 42 12.915 -5.710 24.082 91 HZ1 LYS 42 HZ1 LYS 42 15.048 -10.362 31.114 92 HZ2 LYS 42 HZ2 LYS 42 13.555 -9.571 31.171 93 HZ3 LYS 42 HZ3 LYS 42 14.961 -8.690 30.855 94 H GLN 43 HN GLN 43 12.779 -10.034 24.608 95 HE21 GLN 43 HE21 GLN 43 10.856 -12.945 21.916 96 HE22 GLN 43 HE22 GLN 43 10.377 -14.605 21.881 97 H VAL 44 HN VAL 44 8.394 -9.722 25.670 98 H VAL 45 HN VAL 45 6.979 -11.519 29.444 99 H ILE 46 HN ILE 46 3.413 -10.305 28.351 100 H ASP 47 HN ASP 47 1.325 -10.955 32.025 101 H GLY 48 HN GLY 48 1.023 -13.147 30.795 102 H GLU 49 HN GLU 49 0.027 -12.358 28.335 103 H THR 50 HN THR 50 1.833 -13.406 24.370 104 HG1 THR 50 HG1 THR 50 6.115 -13.070 23.969 105 H CYS 51 HN CYS 51 5.393 -10.580 24.964 106 HG CYS 51 HG CYS 51 3.106 -9.773 26.184 107 H LEU 52 HN LEU 52 5.969 -7.448 22.080 108 H LEU 53 HN LEU 53 9.627 -6.526 24.241 109 H ASP 54 HN ASP 54 9.220 -2.695 22.644 110 H ILE 55 HN ILE 55 13.167 -1.238 23.266 111 H LEU 56 HN LEU 56 13.352 2.325 22.230 112 H ASP 57 HN ASP 57 17.610 3.840 23.326 113 H THR 58 HN THR 58 15.792 7.134 24.989 114 HG1 THR 58 HG1 THR 58 14.561 8.894 25.244 115 H ALA 59 HN ALA 59 18.594 10.488 23.866 116 H GLY 60 HN GLY 60 18.667 12.867 27.856 117 H GLN 61 HN GLN 61 19.247 15.070 27.763 118 HE21 GLN 61 HE21 GLN 61 21.771 20.872 29.034 119 HE22 GLN 61 HE22 GLN 61 23.300 20.339 29.636 120 H GLU 62 HN GLU 62 17.557 18.220 25.604 121 H GLU 63 HN GLU 63 18.605 20.137 22.052 122 H TYR 64 HN TYR 64 15.191 22.615 20.671 123 HH TYR 64 HH TYR 64 9.744 21.621 14.140 124 H SER 65 HN SER 65 15.221 19.374 18.019 125 HG SER 65 HG SER 65 17.939 17.436 17.515 126 H ALA 66 HN ALA 66 16.871 19.100 13.929 127 H MET 67 HN MET 67 16.716 16.672 14.472 128 H ARG 68 HN ARG 68 15.773 16.275 16.604 129 HE ARG 68 HE ARG 68 13.932 16.594 22.752 130 HH11 ARG 68 HH11 ARG 68 16.267 13.465 23.860 131 HH12 ARG 68 HH12 ARG 68 16.147 13.939 22.116 132 HH21 ARG 68 HH21 ARG 68 15.098 14.638 25.452 133 HH22 ARG 68 HH22 ARG 68 14.049 16.025 24.981 134 H ASP 69 HN ASP 69 12.742 16.981 16.864 135 H GLN 70 HN GLN 70 12.287 15.063 15.241 136 HE21 GLN 70 HE21 GLN 70 12.725 9.714 12.486 137 HE22 GLN 70 HE22 GLN 70 14.334 9.560 13.104 138 H TYR 71 HN TYR 71 12.661 12.448 15.927 139 HH TYR 71 HH TYR 71 16.874 13.616 20.065 140 H MET 72 HN MET 72 10.926 12.410 17.803 141 H ARG 73 HN ARG 73 8.150 9.538 18.499 142 HE ARG 73 HE ARG 73 6.553 13.098 16.726 143 HH11 ARG 73 HH11 ARG 73 4.524 14.957 14.532 144 HH12 ARG 73 HH12 ARG 73 5.180 16.543 15.091 145 HH21 ARG 73 HH21 ARG 73 7.430 15.079 17.432 146 HH22 ARG 73 HH22 ARG 73 6.824 16.621 16.715 147 H THR 74 HN THR 74 7.963 8.213 17.250 148 HG1 THR 74 HG1 THR 74 9.612 7.287 17.299 149 H GLY 75 HN GLY 75 7.161 7.087 19.672 150 H GLU 76 HN GLU 76 4.609 4.033 21.943 151 H GLY 77 HN GLY 77 3.985 4.076 24.124 152 H PHE 78 HN PHE 78 3.550 6.501 27.917 153 H LEU 79 HN LEU 79 7.660 7.212 29.334 154 H CYS 80 HN CYS 80 6.513 8.651 33.164 155 HG CYS 80 HG CYS 80 7.665 12.780 31.786 156 H VAL 81 HN VAL 81 10.541 9.789 33.656 157 H PHE 82 HN PHE 82 10.521 9.833 38.030 158 H ALA 83 HN ALA 83 12.851 12.847 40.321 159 H ILE 84 HN ILE 84 12.617 10.244 43.906 160 H ASN 85 HN ASN 85 14.142 11.951 44.969 161 HD21 ASN 85 HD21 ASN 85 15.438 9.952 46.223 162 HD22 ASN 85 HD22 ASN 85 16.354 9.715 44.777 163 H ASN 86 HN ASN 86 13.779 14.195 44.486 164 HD21 ASN 86 HD21 ASN 86 17.764 16.894 42.901 165 HD22 ASN 86 HD22 ASN 86 17.559 18.012 41.597 166 H THR 87 HN THR 87 13.670 17.857 44.868 167 HG1 THR 87 HG1 THR 87 12.581 19.430 46.547 168 H LYS 88 HN LYS 88 13.925 19.003 42.426 169 HZ1 LYS 88 HZ1 LYS 88 16.536 19.104 36.125 170 HZ2 LYS 88 HZ2 LYS 88 16.364 20.408 35.068 171 HZ3 LYS 88 HZ3 LYS 88 15.092 19.998 36.116 172 H SER 89 HN SER 89 13.697 17.277 40.226 173 HG SER 89 HG SER 89 13.194 15.392 40.714 174 H PHE 90 HN PHE 90 11.079 16.897 40.659 175 H GLU 91 HN GLU 91 9.728 18.963 39.816 176 H ASP 92 HN ASP 92 10.269 18.824 37.581 177 H ILE 93 HN ILE 93 8.583 17.234 36.340 178 H HIS 94 HN HIS 94 6.405 18.637 35.230 179 HD1 HIS 94 HD1 HIS 94 2.010 20.498 34.830 180 HE2 HIS 94 HE2 HIS 94 2.191 23.503 32.207 181 H HIS 95 HN HIS 95 7.405 19.820 32.886 182 HD1 HIS 95 HD1 HIS 95 11.008 20.394 29.232 183 HE2 HIS 95 HE2 HIS 95 9.485 23.659 27.493 184 H TYR 96 HN TYR 96 7.988 17.740 31.344 185 HH TYR 96 HH TYR 96 13.382 17.675 33.041 186 H ARG 97 HN ARG 97 5.678 16.487 30.947 187 HE ARG 97 HE ARG 97 1.291 13.868 32.489 188 HH11 ARG 97 HH11 ARG 97 -1.382 15.605 30.997 189 HH12 ARG 97 HH12 ARG 97 -2.411 14.131 30.842 190 HH21 ARG 97 HH21 ARG 97 0.014 11.973 32.322 191 HH22 ARG 97 HH22 ARG 97 -1.628 12.092 31.587 192 H GLU 98 HN GLU 98 4.191 18.370 29.453 193 H GLN 99 HN GLN 99 5.607 18.195 27.264 194 HE21 GLN 99 HE21 GLN 99 9.854 19.826 25.111 195 HE22 GLN 99 HE22 GLN 99 11.337 18.986 25.398 196 H ILE 100 HN ILE 100 5.209 15.844 26.204 197 H LYS 101 HN LYS 101 2.619 16.002 25.587 198 HZ1 LYS 101 HZ1 LYS 101 -2.012 18.996 29.009 199 HZ2 LYS 101 HZ2 LYS 101 -2.658 19.880 27.729 200 HZ3 LYS 101 HZ3 LYS 101 -0.980 19.881 27.996 201 H ARG 102 HN ARG 102 2.776 17.639 23.407 202 HE ARG 102 HE ARG 102 6.282 20.663 21.821 203 HH11 ARG 102 HH11 ARG 102 7.010 19.132 18.133 204 HH12 ARG 102 HH12 ARG 102 5.531 20.139 18.415 205 HH21 ARG 102 HH21 ARG 102 8.491 18.751 19.834 206 HH22 ARG 102 HH22 ARG 102 8.181 19.436 21.482 207 H VAL 103 HN VAL 103 4.189 16.499 21.466 208 H LYS 104 HN LYS 104 2.582 14.393 20.973 209 HZ1 LYS 104 HZ1 LYS 104 1.892 8.294 18.406 210 HZ2 LYS 104 HZ2 LYS 104 0.924 7.315 19.382 211 HZ3 LYS 104 HZ3 LYS 104 2.596 7.403 19.656 212 H ASP 105 HN ASP 105 0.791 15.412 20.031 213 H SER 106 HN SER 106 -1.597 15.155 21.600 214 HG SER 106 HG SER 106 -5.529 12.635 21.284 215 H GLU 107 HN GLU 107 -5.263 14.935 23.507 216 H ASP 108 HN ASP 108 -4.811 12.744 24.480 217 H VAL 109 HN VAL 109 -2.735 11.104 27.063 218 H MET 111 HN MET 111 -0.498 8.029 30.063 219 H VAL 112 HN VAL 112 3.606 7.211 31.696 220 H LEU 113 HN LEU 113 2.607 7.506 35.827 221 H VAL 114 HN VAL 114 6.847 8.329 36.838 222 H GLY 115 HN GLY 115 7.493 6.953 40.784 223 H ASN 116 HN ASN 116 11.666 8.231 40.719 224 HD21 ASN 116 HD21 ASN 116 12.487 4.266 39.142 225 HD22 ASN 116 HD22 ASN 116 13.693 3.076 39.480 226 H LYS 117 HN LYS 117 14.332 5.172 42.717 227 HZ1 LYS 117 HZ1 LYS 117 18.704 10.292 40.768 228 HZ2 LYS 117 HZ2 LYS 117 19.852 9.407 39.894 229 HZ3 LYS 117 HZ3 LYS 117 20.103 9.737 41.535 230 H CYS 118 HN CYS 118 13.009 5.212 45.060 231 HG CYS 118 HG CYS 118 9.844 3.194 46.608 232 H ASP 119 HN ASP 119 14.570 4.586 46.999 233 H LEU 120 HN LEU 120 15.514 6.369 48.271 234 H SER 122 HN SER 122 17.345 10.271 51.026 235 HG SER 122 HG SER 122 19.722 11.551 49.864 236 H ARG 123 HN ARG 123 14.607 11.437 51.684 237 HE ARG 123 HE ARG 123 8.544 10.609 49.281 238 HH11 ARG 123 HH11 ARG 123 9.901 7.950 51.169 239 HH12 ARG 123 HH12 ARG 123 8.969 6.687 50.279 240 HH21 ARG 123 HH21 ARG 123 7.369 9.028 48.102 241 HH22 ARG 123 HH22 ARG 123 7.550 7.286 48.552 242 H THR 124 HN THR 124 12.535 14.012 48.594 243 HG1 THR 124 HG1 THR 124 12.424 16.843 46.701 244 H VAL 125 HN VAL 125 10.706 14.076 48.158 245 H ASP 126 HN ASP 126 6.500 14.804 48.980 246 H THR 127 HN THR 127 4.699 10.728 50.065 247 HG1 THR 127 HG1 THR 127 5.336 8.408 49.405 248 H LYS 128 HN LYS 128 2.170 11.499 49.546 249 HZ1 LYS 128 HZ1 LYS 128 -2.460 16.355 48.820 250 HZ2 LYS 128 HZ2 LYS 128 -4.132 16.509 49.013 251 HZ3 LYS 128 HZ3 LYS 128 -3.511 15.397 47.900 252 H GLN 129 HN GLN 129 2.708 13.635 47.970 253 HE21 GLN 129 HE21 GLN 129 4.662 18.590 47.009 254 HE22 GLN 129 HE22 GLN 129 6.254 18.639 47.688 255 H ALA 130 HN ALA 130 3.431 12.767 45.469 256 H GLN 131 HN GLN 131 1.554 11.232 44.935 257 HE21 GLN 131 HE21 GLN 131 0.177 6.026 45.813 258 HE22 GLN 131 HE22 GLN 131 -0.253 6.035 47.486 259 H ASP 132 HN ASP 132 -0.585 12.898 44.772 260 H LEU 133 HN LEU 133 -0.058 14.296 42.727 261 H ALA 134 HN ALA 134 -0.078 12.558 40.593 262 H ARG 135 HN ARG 135 -2.643 12.032 40.681 263 HE ARG 135 HE ARG 135 -8.970 11.026 43.027 264 HH11 ARG 135 HH11 ARG 135 -6.077 9.194 43.809 265 HH12 ARG 135 HH12 ARG 135 -7.000 7.712 44.262 266 HH21 ARG 135 HH21 ARG 135 -9.304 7.686 44.117 267 HH22 ARG 135 HH22 ARG 135 -10.194 9.150 43.543 268 H SER 136 HN SER 136 -3.809 14.287 39.644 269 HG SER 136 HG SER 136 -2.675 15.888 38.953 270 H TYR 137 HN TYR 137 -3.382 13.846 37.214 271 HH TYR 137 HH TYR 137 1.174 18.465 36.398 272 H GLY 138 HN GLY 138 -4.613 12.088 36.364 273 H ILE 139 HN ILE 139 -3.454 10.376 35.837 274 H PHE 141 HN PHE 141 -0.332 5.806 39.996 275 H ILE 142 HN ILE 142 3.963 5.640 39.547 276 H GLU 143 HN GLU 143 5.086 3.303 43.030 277 H THR 144 HN THR 144 9.385 4.564 42.518 278 HG1 THR 144 HG1 THR 144 10.191 4.663 40.817 279 H SER 145 HN SER 145 12.167 1.126 42.162 280 HG SER 145 HG SER 145 15.642 2.353 45.320 281 H ALA 146 HN ALA 146 15.732 2.664 41.428 282 H LYS 147 HN LYS 147 17.398 1.419 42.862 283 HZ1 LYS 147 HZ1 LYS 147 22.702 0.736 47.432 284 HZ2 LYS 147 HZ2 LYS 147 24.005 1.314 46.525 285 HZ3 LYS 147 HZ3 LYS 147 22.833 0.341 45.793 286 H THR 148 HN THR 148 16.409 -0.624 44.613 287 HG1 THR 148 HG1 THR 148 15.894 -0.521 46.474 288 H ARG 149 HN ARG 149 15.767 -1.843 42.707 289 HE ARG 149 HE ARG 149 16.158 -6.565 37.556 290 HH11 ARG 149 HH11 ARG 149 12.858 -6.618 38.783 291 HH12 ARG 149 HH12 ARG 149 12.125 -6.916 37.156 292 HH21 ARG 149 HH21 ARG 149 13.486 -7.097 35.303 293 HH22 ARG 149 HH22 ARG 149 15.278 -6.916 35.466 294 H GLN 150 HN GLN 150 13.221 -1.860 43.333 295 HE21 GLN 150 HE21 GLN 150 11.087 -3.856 47.541 296 HE22 GLN 150 HE22 GLN 150 10.688 -2.829 48.874 297 H GLY 151 HN GLY 151 9.093 -3.221 42.267 298 H VAL 152 HN VAL 152 10.465 -2.264 40.199 299 H ASP 153 HN ASP 153 9.711 -4.085 38.171 300 H ASP 154 HN ASP 154 7.227 -3.653 38.479 301 H ALA 155 HN ALA 155 6.789 -1.146 37.434 302 H PHE 156 HN PHE 156 7.025 -1.479 34.704 303 H TYR 157 HN TYR 157 5.035 -3.196 34.241 304 HH TYR 157 HH TYR 157 7.818 -8.299 35.041 305 H THR 158 HN THR 158 2.849 -1.710 34.757 306 HG1 THR 158 HG1 THR 158 2.341 -0.856 36.616 307 H LEU 159 HN LEU 159 2.966 0.196 32.798 308 H VAL 160 HN VAL 160 2.560 -1.313 30.420 309 H ARG 161 HN ARG 161 -0.010 -2.094 30.956 310 HE ARG 161 HE ARG 161 -1.867 -6.677 33.086 311 HH11 ARG 161 HH11 ARG 161 -0.060 -5.680 36.583 312 HH12 ARG 161 HH12 ARG 161 -0.964 -4.432 35.645 313 HH21 ARG 161 HH21 ARG 161 -0.745 -8.300 34.248 314 HH22 ARG 161 HH22 ARG 161 0.066 -7.845 35.803 315 H GLU 162 HN GLU 162 -1.259 0.196 30.844 316 H ILE 163 HN ILE 163 -1.167 0.936 28.364 317 H ARG 164 HN ARG 164 -2.660 -0.909 27.216 318 HE ARG 164 HE ARG 164 -1.534 -5.792 26.560 319 HH11 ARG 164 HH11 ARG 164 -1.952 -7.595 30.186 320 HH12 ARG 164 HH12 ARG 164 -2.994 -6.195 29.717 321 HH21 ARG 164 HH21 ARG 164 -0.356 -8.382 28.657 322 HH22 ARG 164 HH22 ARG 164 -0.194 -7.576 27.050 323 H LYS 165 HN LYS 165 -5.226 -0.330 28.090 324 HZ1 LYS 165 HZ1 LYS 165 -6.476 0.726 34.026 325 HZ2 LYS 165 HZ2 LYS 165 -7.223 2.135 33.462 326 HZ3 LYS 165 HZ3 LYS 165 -5.534 2.063 33.591 327 H HIS 166 HN HIS 166 -5.446 1.933 26.790 328 HD1 HIS 166 HD1 HIS 166 -3.927 4.486 22.876 329 HE2 HIS 166 HE2 HIS 166 -5.505 8.128 23.336 330 H LYS 167 HN LYS 167 -5.623 1.240 24.288 331 HZ1 LYS 167 HZ1 LYS 167 -2.368 0.786 20.018 332 HZ2 LYS 167 HZ2 LYS 167 -1.855 -0.662 19.313 333 HZ3 LYS 167 HZ3 LYS 167 -0.733 0.346 20.088 334 H GLU 168 HN GLU 168 -7.900 -0.109 24.178 335 H LYS 169 HN LYS 169 -9.399 1.930 24.598 336 HZ1 LYS 169 HZ1 LYS 169 -10.657 5.394 28.157 337 HZ2 LYS 169 HZ2 LYS 169 -10.592 6.700 29.229 338 HZ3 LYS 169 HZ3 LYS 169 -9.171 6.123 28.520 339 H MET 170 HN MET 170 -9.465 3.172 22.273 340 H SER 171 HN SER 171 -11.213 1.818 21.188 341 HG SER 171 HG SER 171 -10.210 0.328 20.114 342 H LYS 172 HN LYS 172 -13.493 1.908 21.702 343 HZ1 LYS 172 HZ1 LYS 172 -14.830 0.779 27.350 344 HZ2 LYS 172 HZ2 LYS 172 -13.978 -0.617 26.914 345 HZ3 LYS 172 HZ3 LYS 172 -15.673 -0.609 26.870 346 H ASP 173 HN ASP 173 -13.871 3.960 21.810 347 H GLY 174 HN GLY 174 -15.051 8.315 22.141 348 H LYS 175 HN LYS 175 -18.513 9.831 24.105 349 HZ1 LYS 175 HZ1 LYS 175 -22.868 12.733 20.495 350 HZ2 LYS 175 HZ2 LYS 175 -23.492 11.336 19.782 351 HZ3 LYS 175 HZ3 LYS 175 -21.828 11.479 20.038 352 H LYS 176 HN LYS 176 -18.074 12.011 25.938 353 HZ1 LYS 176 HZ1 LYS 176 -13.481 15.966 27.651 354 HZ2 LYS 176 HZ2 LYS 176 -14.479 16.817 28.725 355 HZ3 LYS 176 HZ3 LYS 176 -13.073 17.539 28.122 356 H LYS 177 HN LYS 177 -14.499 13.229 27.617 357 HZ1 LYS 177 HZ1 LYS 177 -7.826 11.303 29.986 358 HZ2 LYS 177 HZ2 LYS 177 -8.394 10.333 28.720 359 HZ3 LYS 177 HZ3 LYS 177 -8.917 10.051 30.308 360 H LYS 178 HN LYS 178 -14.945 12.026 31.966 361 HZ1 LYS 178 HZ1 LYS 178 -18.705 16.840 33.011 362 HZ2 LYS 178 HZ2 LYS 178 -19.884 15.638 32.867 363 HZ3 LYS 178 HZ3 LYS 178 -20.011 17.059 31.956 364 H LYS 179 HN LYS 179 -13.410 14.933 34.910 365 HZ1 LYS 179 HZ1 LYS 179 -8.599 14.530 41.329 366 HZ2 LYS 179 HZ2 LYS 179 -9.756 13.613 40.509 367 HZ3 LYS 179 HZ3 LYS 179 -10.112 15.195 40.977 368 H LYS 180 HN LYS 180 -14.695 13.765 36.763 369 HZ1 LYS 180 HZ1 LYS 180 -15.467 17.159 41.961 370 HZ2 LYS 180 HZ2 LYS 180 -17.064 16.703 41.641 371 HZ3 LYS 180 HZ3 LYS 180 -16.313 17.878 40.684 372 H SER 181 HN SER 181 -15.465 9.677 37.537 373 HG SER 181 HG SER 181 -14.764 7.616 36.551 374 H LYS 182 HN LYS 182 -19.358 9.107 35.126 375 HZ1 LYS 182 HZ1 LYS 182 -22.991 12.093 31.679 376 HZ2 LYS 182 HZ2 LYS 182 -24.563 11.722 32.181 377 HZ3 LYS 182 HZ3 LYS 182 -23.318 10.596 32.395 378 H THR 183 HN THR 183 -23.068 8.236 37.452 379 HG1 THR 183 HG1 THR 183 -24.973 7.073 39.192 380 H LYS 184 HN LYS 184 -24.695 8.356 35.298 381 HZ1 LYS 184 HZ1 LYS 184 -30.937 10.702 34.546 382 HZ2 LYS 184 HZ2 LYS 184 -30.005 11.664 35.580 383 HZ3 LYS 184 HZ3 LYS 184 -31.150 10.597 36.221 384 H CYS 185 HN CYS 185 -25.117 7.193 30.863 385 HG CYS 185 HG CYS 185 -22.716 4.610 28.591 386 HE21 GLN 418 HE21 GLN 418 45.214 -14.980 -12.145 387 HE22 GLN 418 HE22 GLN 418 44.902 -13.427 -11.450 388 HE21 GLN 424 HE21 GLN 424 47.808 -28.618 -15.256 389 HE22 GLN 424 HE22 GLN 424 49.332 -28.194 -15.952 390 HE21 GLN 439 HE21 GLN 439 32.652 -40.806 -3.203 391 HE22 GLN 439 HE22 GLN 439 33.799 -41.562 -2.155 392 HE21 GLN 453 HE21 GLN 453 9.827 -50.593 -7.018 393 HE22 GLN 453 HE22 GLN 453 11.146 -51.467 -7.714 394 HE21 GLN 460 HE21 GLN 460 -0.866 -47.307 -6.858 395 HE22 GLN 460 HE22 GLN 460 0.264 -47.867 -8.039 396 HE21 GLN 464 HE21 GLN 464 -6.328 -47.925 -3.846 397 HE22 GLN 464 HE22 GLN 464 -5.210 -48.813 -4.816 398 HE21 GLN 472 HE21 GLN 472 -17.612 -44.767 2.538 399 HE22 GLN 472 HE22 GLN 472 -16.781 -46.274 2.689 400 HE21 GLN 482 HE21 GLN 482 -28.638 -34.059 -4.235 401 HE22 GLN 482 HE22 GLN 482 -27.654 -34.680 -5.512 402 HE21 GLN 487 HE21 GLN 487 -35.283 -26.626 5.140 403 HE22 GLN 487 HE22 GLN 487 -35.694 -27.535 6.555 404 HE21 GLN 493 HE21 GLN 493 -39.557 -21.139 -4.318 405 HE22 GLN 493 HE22 GLN 493 -39.002 -22.517 -5.204 406 HE21 GLN 527 HE21 GLN 527 -39.148 27.985 -6.275 407 HE22 GLN 527 HE22 GLN 527 -40.830 27.877 -5.901 408 HAC EWS 237 HAC DRG 203 14.185 2.346 15.542 409 HAD EWS 237 HAD DRG 203 11.384 3.168 14.956 410 HAE EWS 237 HAE DRG 203 12.823 3.031 13.842 411 HAF EWS 237 HAF DRG 203 13.524 1.273 17.588 412 HAG EWS 237 HAG DRG 203 11.760 1.413 17.111 413 HAI EWS 237 HAI DRG 203 13.992 -0.295 16.086 414 HAH EWS 237 HAH DRG 203 12.245 -0.721 16.354 415 HAJ EWS 237 HAJ DRG 203 10.819 1.011 14.761 416 HAL EWS 237 HAL DRG 203 10.610 2.069 12.619 417 HAK EWS 237 HAK DRG 203 12.262 1.490 12.132 418 HAM EWS 237 HAM DRG 203 8.800 0.561 12.988 419 HAN EWS 237 HAN DRG 203 12.677 -0.628 11.387 420 HAO EWS 237 HAO DRG 203 11.663 -2.753 10.540 421 HAP EWS 237 HAP DRG 203 7.799 -1.569 12.151 422 HAQ EWS 237 HAQ DRG 203 11.203 4.270 18.607 423 HAS EWS 237 HAS DRG 203 9.995 8.119 20.259 424 HAT EWS 237 HAT DRG 203 12.342 8.942 19.911 425 HAX EWS 237 HAX DRG 203 15.807 6.043 17.957 426 HAA EWS 237 HAA DRG 203 12.425 4.450 16.358 427 HAZ EWS 237 HAZ DRG 203 13.582 0.365 14.065 428 HAW EWS 237 HAW DRG 203 14.758 8.142 18.965 429 HAY EWS 237 HAY DRG 203 12.375 -0.720 14.149 Start of MODEL 10 1 HE21 GLN 220 HE21 GLN 220 56.972 -11.433 2.346 2 HE22 GLN 220 HE22 GLN 220 58.055 -10.167 1.867 3 HE21 GLN 226 HE21 GLN 226 58.372 -0.323 4.589 4 HE22 GLN 226 HE22 GLN 226 59.283 -1.442 5.539 5 HE21 GLN 241 HE21 GLN 241 49.935 16.409 -8.962 6 HE22 GLN 241 HE22 GLN 241 51.082 15.222 -8.445 7 HE21 GLN 255 HE21 GLN 255 32.235 34.157 -10.203 8 HE22 GLN 255 HE22 GLN 255 33.879 34.522 -9.807 9 HE21 GLN 262 HE21 GLN 262 22.569 33.506 -11.478 10 HE22 GLN 262 HE22 GLN 262 22.972 34.190 -9.942 11 HE21 GLN 266 HE21 GLN 266 16.267 36.912 -13.049 12 HE22 GLN 266 HE22 GLN 266 17.625 37.657 -12.286 13 HE21 GLN 274 HE21 GLN 274 4.285 39.206 -17.702 14 HE22 GLN 274 HE22 GLN 274 4.665 40.382 -18.915 15 HE21 GLN 284 HE21 GLN 284 -9.922 33.210 -14.598 16 HE22 GLN 284 HE22 GLN 284 -9.834 34.184 -13.175 17 HE21 GLN 289 HE21 GLN 289 -19.026 25.783 -22.734 18 HE22 GLN 289 HE22 GLN 289 -17.960 25.433 -24.057 19 HE21 GLN 295 HE21 GLN 295 -24.599 25.173 -12.390 20 HE22 GLN 295 HE22 GLN 295 -23.711 26.387 -11.536 21 HE21 GLN 329 HE21 GLN 329 -44.170 -20.133 -2.465 22 HE22 GLN 329 HE22 GLN 329 -45.287 -19.094 -3.274 23 H MET 1 HT1 MET 1 2.662 -11.527 17.156 24 H THR 2 HN THR 2 1.789 -8.801 20.507 25 HG1 THR 2 HG1 THR 2 -0.149 -8.001 19.386 26 H GLU 3 HN GLU 3 3.480 -5.328 18.263 27 H TYR 4 HN TYR 4 5.674 -4.108 21.867 28 HH TYR 4 HH TYR 4 -0.955 -5.072 22.876 29 H LYS 5 HN LYS 5 5.173 0.095 20.994 30 HZ1 LYS 5 HZ1 LYS 5 5.823 2.502 15.111 31 HZ2 LYS 5 HZ2 LYS 5 4.565 3.183 16.015 32 HZ3 LYS 5 HZ3 LYS 5 4.260 1.864 15.007 33 H LEU 6 HN LEU 6 8.496 0.555 23.479 34 H VAL 7 HN VAL 7 8.154 4.396 25.816 35 H VAL 8 HN VAL 8 12.128 5.852 26.959 36 H VAL 9 HN VAL 9 10.464 8.702 29.827 37 H GLY 10 HN GLY 10 13.408 12.026 30.352 38 H ALA 11 HN ALA 11 14.086 13.465 34.371 39 H VAL 12 HN VAL 12 18.129 15.368 33.195 40 H GLY 13 HN GLY 13 19.270 11.746 34.919 41 H VAL 14 HN VAL 14 17.801 11.431 35.940 42 H GLY 15 HN GLY 15 18.683 9.054 36.177 43 H LYS 16 HN LYS 16 18.751 7.810 34.007 44 HZ1 LYS 16 HZ1 LYS 16 16.205 9.257 29.137 45 HZ2 LYS 16 HZ2 LYS 16 14.881 8.388 28.551 46 HZ3 LYS 16 HZ3 LYS 16 16.365 7.600 28.803 47 H SER 17 HN SER 17 19.771 5.704 31.892 48 HG SER 17 HG SER 17 21.741 5.419 30.582 49 H ALA 18 HN ALA 18 19.434 4.157 33.968 50 H LEU 19 HN LEU 19 17.038 2.982 34.801 51 H THR 20 HN THR 20 16.928 1.566 32.714 52 HG1 THR 20 HG1 THR 20 15.913 2.309 31.174 53 H ILE 21 HN ILE 21 18.839 -0.171 32.067 54 H GLN 22 HN GLN 22 18.236 -1.628 34.164 55 HE21 GLN 22 HE21 GLN 22 19.178 -2.542 39.288 56 HE22 GLN 22 HE22 GLN 22 20.081 -4.020 39.307 57 H LEU 23 HN LEU 23 16.448 -3.243 33.230 58 H ILE 24 HN ILE 24 16.814 -4.404 31.516 59 H GLN 25 HN GLN 25 19.331 -5.719 31.031 60 HE21 GLN 25 HE21 GLN 25 22.422 -4.265 29.797 61 HE22 GLN 25 HE22 GLN 25 24.044 -4.339 29.199 62 H ASN 26 HN ASN 26 18.787 -6.451 33.171 63 HD21 ASN 26 HD21 ASN 26 17.807 -10.889 34.755 64 HD22 ASN 26 HD22 ASN 26 16.187 -10.483 34.317 65 H HIS 27 HN HIS 27 20.454 -5.093 34.950 66 HD1 HIS 27 HD1 HIS 27 24.924 -6.209 37.377 67 HE2 HIS 27 HE2 HIS 27 27.350 -3.313 36.059 68 H PHE 28 HN PHE 28 23.034 -4.000 38.230 69 H VAL 29 HN VAL 29 22.904 0.278 36.969 70 H ASP 30 HN ASP 30 27.228 1.379 37.745 71 H GLU 31 HN GLU 31 28.022 2.856 36.906 72 H TYR 32 HN TYR 32 29.122 7.233 36.057 73 HH TYR 32 HH TYR 32 24.754 14.115 33.579 74 H ASP 33 HN ASP 33 25.939 6.827 33.557 75 H THR 35 HN THR 35 22.291 9.733 28.252 76 HG1 THR 35 HG1 THR 35 22.702 6.761 28.124 77 H ILE 36 HN ILE 36 22.759 8.732 24.090 78 H GLU 37 HN GLU 37 21.549 7.920 22.440 79 H ASP 38 HN ASP 38 18.347 5.570 22.519 80 H SER 39 HN SER 39 18.856 1.463 21.425 81 HG SER 39 HG SER 39 17.290 0.141 19.224 82 H TYR 40 HN TYR 40 15.684 -0.282 23.805 83 HH TYR 40 HH TYR 40 21.820 1.578 25.692 84 H ARG 41 HN ARG 41 16.256 -4.378 22.849 85 HE ARG 41 HE ARG 41 14.264 -5.184 18.965 86 HH11 ARG 41 HH11 ARG 41 11.225 -4.885 16.311 87 HH12 ARG 41 HH12 ARG 41 10.871 -4.996 18.072 88 HH21 ARG 41 HH21 ARG 41 14.763 -5.088 16.748 89 HH22 ARG 41 HH22 ARG 41 13.412 -4.943 15.568 90 H LYS 42 HN LYS 42 12.125 -5.875 24.081 91 HZ1 LYS 42 HZ1 LYS 42 14.967 -10.224 30.900 92 HZ2 LYS 42 HZ2 LYS 42 15.208 -8.563 31.114 93 HZ3 LYS 42 HZ3 LYS 42 15.741 -9.319 29.696 94 H GLN 43 HN GLN 43 12.007 -9.825 25.902 95 HE21 GLN 43 HE21 GLN 43 9.758 -14.272 23.026 96 HE22 GLN 43 HE22 GLN 43 8.875 -15.153 24.222 97 H VAL 44 HN VAL 44 7.859 -9.688 26.415 98 H VAL 45 HN VAL 45 6.338 -12.415 29.552 99 H ILE 46 HN ILE 46 2.439 -10.638 28.350 100 H ASP 47 HN ASP 47 0.496 -10.035 32.028 101 H GLY 48 HN GLY 48 -0.120 -12.415 31.209 102 H GLU 49 HN GLU 49 -0.456 -12.060 28.652 103 H THR 50 HN THR 50 1.601 -14.010 25.413 104 HG1 THR 50 HG1 THR 50 6.097 -13.565 24.887 105 H CYS 51 HN CYS 51 4.881 -10.809 25.351 106 HG CYS 51 HG CYS 51 4.244 -9.037 26.333 107 H LEU 52 HN LEU 52 5.547 -8.276 21.805 108 H LEU 53 HN LEU 53 9.317 -6.492 23.403 109 H ASP 54 HN ASP 54 9.343 -2.277 22.287 110 H ILE 55 HN ILE 55 13.072 -1.288 24.073 111 H LEU 56 HN LEU 56 12.302 3.008 23.943 112 H ASP 57 HN ASP 57 16.541 4.221 24.467 113 H THR 58 HN THR 58 15.263 7.803 26.249 114 HG1 THR 58 HG1 THR 58 13.457 10.686 25.723 115 H ALA 59 HN ALA 59 17.341 11.537 24.780 116 H GLY 60 HN GLY 60 18.376 13.345 28.855 117 H GLN 61 HN GLN 61 18.912 15.751 29.290 118 HE21 GLN 61 HE21 GLN 61 19.457 18.365 33.371 119 HE22 GLN 61 HE22 GLN 61 21.140 18.384 33.766 120 H GLU 62 HN GLU 62 17.081 18.297 26.822 121 H GLU 63 HN GLU 63 18.587 20.236 23.381 122 H TYR 64 HN TYR 64 15.123 22.782 21.923 123 HH TYR 64 HH TYR 64 9.651 22.385 15.315 124 H SER 65 HN SER 65 14.415 19.346 19.248 125 HG SER 65 HG SER 65 18.268 17.368 17.328 126 H ALA 66 HN ALA 66 15.848 19.279 15.140 127 H MET 67 HN MET 67 16.298 16.603 15.030 128 H ARG 68 HN ARG 68 15.332 15.851 17.356 129 HE ARG 68 HE ARG 68 12.572 16.528 23.531 130 HH11 ARG 68 HH11 ARG 68 15.636 14.377 25.106 131 HH12 ARG 68 HH12 ARG 68 15.784 15.055 23.430 132 HH21 ARG 68 HH21 ARG 68 12.342 15.648 25.643 133 HH22 ARG 68 HH22 ARG 68 13.724 14.706 26.329 134 H ASP 69 HN ASP 69 12.798 16.303 17.437 135 H GLN 70 HN GLN 70 12.370 14.332 15.972 136 HE21 GLN 70 HE21 GLN 70 14.619 10.717 13.014 137 HE22 GLN 70 HE22 GLN 70 15.507 11.263 11.637 138 H TYR 71 HN TYR 71 12.689 11.979 16.714 139 HH TYR 71 HH TYR 71 15.994 13.359 21.718 140 H MET 72 HN MET 72 10.970 11.678 18.837 141 H ARG 73 HN ARG 73 7.876 9.180 18.416 142 HE ARG 73 HE ARG 73 7.146 13.149 15.605 143 HH11 ARG 73 HH11 ARG 73 4.714 16.200 14.499 144 HH12 ARG 73 HH12 ARG 73 4.270 14.494 14.119 145 HH21 ARG 73 HH21 ARG 73 7.766 15.266 16.126 146 HH22 ARG 73 HH22 ARG 73 6.693 16.634 15.638 147 H THR 74 HN THR 74 7.443 8.041 17.045 148 HG1 THR 74 HG1 THR 74 8.586 5.254 17.693 149 H GLY 75 HN GLY 75 7.099 6.914 19.120 150 H GLU 76 HN GLU 76 4.988 3.757 21.713 151 H GLY 77 HN GLY 77 4.729 4.027 23.840 152 H PHE 78 HN PHE 78 4.172 6.772 27.040 153 H LEU 79 HN LEU 79 7.962 6.317 28.980 154 H CYS 80 HN CYS 80 6.443 8.182 32.809 155 HG CYS 80 HG CYS 80 5.533 9.654 31.284 156 H VAL 81 HN VAL 81 10.208 9.421 33.383 157 H PHE 82 HN PHE 82 10.480 9.728 37.818 158 H ALA 83 HN ALA 83 13.452 12.589 39.393 159 H ILE 84 HN ILE 84 12.754 10.263 43.071 160 H ASN 85 HN ASN 85 14.458 11.873 44.233 161 HD21 ASN 85 HD21 ASN 85 18.428 13.539 46.528 162 HD22 ASN 85 HD22 ASN 85 19.199 13.717 44.990 163 H ASN 86 HN ASN 86 14.475 14.101 43.779 164 HD21 ASN 86 HD21 ASN 86 17.376 16.708 40.502 165 HD22 ASN 86 HD22 ASN 86 17.575 18.413 40.724 166 H THR 87 HN THR 87 14.094 18.156 44.728 167 HG1 THR 87 HG1 THR 87 11.795 19.110 46.449 168 H LYS 88 HN LYS 88 14.339 19.334 42.305 169 HZ1 LYS 88 HZ1 LYS 88 12.746 22.459 36.395 170 HZ2 LYS 88 HZ2 LYS 88 13.011 21.085 37.346 171 HZ3 LYS 88 HZ3 LYS 88 13.349 21.043 35.684 172 H SER 89 HN SER 89 13.825 17.400 40.552 173 HG SER 89 HG SER 89 12.770 14.436 37.744 174 H PHE 90 HN PHE 90 11.414 16.803 40.758 175 H GLU 91 HN GLU 91 10.034 18.853 39.788 176 H ASP 92 HN ASP 92 10.541 18.655 37.336 177 H ILE 93 HN ILE 93 8.652 17.217 36.214 178 H HIS 94 HN HIS 94 6.605 18.561 35.184 179 HD1 HIS 94 HD1 HIS 94 2.178 19.846 35.190 180 HE2 HIS 94 HE2 HIS 94 1.568 23.004 32.803 181 H HIS 95 HN HIS 95 7.687 19.403 33.067 182 HD1 HIS 95 HD1 HIS 95 11.947 19.484 31.285 183 HE2 HIS 95 HE2 HIS 95 11.729 20.982 27.563 184 H TYR 96 HN TYR 96 8.225 17.628 31.405 185 HH TYR 96 HH TYR 96 14.451 17.346 30.961 186 H ARG 97 HN ARG 97 5.926 16.909 30.915 187 HE ARG 97 HE ARG 97 -0.527 15.812 30.880 188 HH11 ARG 97 HH11 ARG 97 1.101 12.741 31.408 189 HH12 ARG 97 HH12 ARG 97 -0.440 11.823 31.601 190 HH21 ARG 97 HH21 ARG 97 -2.499 14.707 31.168 191 HH22 ARG 97 HH22 ARG 97 -2.460 12.931 31.484 192 H GLU 98 HN GLU 98 4.437 18.753 29.291 193 H GLN 99 HN GLN 99 5.934 18.356 27.204 194 HE21 GLN 99 HE21 GLN 99 10.314 19.292 24.464 195 HE22 GLN 99 HE22 GLN 99 11.763 18.647 25.156 196 H ILE 100 HN ILE 100 5.672 15.777 26.212 197 H LYS 101 HN LYS 101 3.063 15.906 25.543 198 HZ1 LYS 101 HZ1 LYS 101 -3.261 17.258 27.828 199 HZ2 LYS 101 HZ2 LYS 101 -2.655 16.137 26.721 200 HZ3 LYS 101 HZ3 LYS 101 -3.328 17.592 26.167 201 H ARG 102 HN ARG 102 3.215 17.557 23.504 202 HE ARG 102 HE ARG 102 6.993 20.429 22.239 203 HH11 ARG 102 HH11 ARG 102 6.343 20.152 18.782 204 HH12 ARG 102 HH12 ARG 102 7.829 19.166 18.462 205 HH21 ARG 102 HH21 ARG 102 8.908 19.236 21.858 206 HH22 ARG 102 HH22 ARG 102 9.268 18.662 20.174 207 H VAL 103 HN VAL 103 4.660 16.437 21.472 208 H LYS 104 HN LYS 104 2.997 14.417 20.853 209 HZ1 LYS 104 HZ1 LYS 104 2.991 7.492 19.899 210 HZ2 LYS 104 HZ2 LYS 104 2.855 8.319 18.425 211 HZ3 LYS 104 HZ3 LYS 104 1.536 7.453 19.036 212 H ASP 105 HN ASP 105 1.252 15.568 19.782 213 H SER 106 HN SER 106 -1.001 14.931 21.032 214 HG SER 106 HG SER 106 -2.241 13.003 19.361 215 H GLU 107 HN GLU 107 -5.150 14.529 22.511 216 H ASP 108 HN ASP 108 -5.225 12.888 24.133 217 H VAL 109 HN VAL 109 -2.443 11.282 26.881 218 H MET 111 HN MET 111 -0.289 7.535 29.739 219 H VAL 112 HN VAL 112 3.570 7.210 31.852 220 H LEU 113 HN LEU 113 2.529 7.619 36.029 221 H VAL 114 HN VAL 114 6.890 8.459 36.619 222 H GLY 115 HN GLY 115 7.733 6.620 40.369 223 H ASN 116 HN ASN 116 11.607 8.173 40.237 224 HD21 ASN 116 HD21 ASN 116 16.039 6.801 39.055 225 HD22 ASN 116 HD22 ASN 116 16.662 5.239 39.477 226 H LYS 117 HN LYS 117 14.521 5.370 42.364 227 HZ1 LYS 117 HZ1 LYS 117 20.118 10.565 42.016 228 HZ2 LYS 117 HZ2 LYS 117 18.708 11.471 41.827 229 HZ3 LYS 117 HZ3 LYS 117 19.569 10.952 40.461 230 H CYS 118 HN CYS 118 13.318 4.959 44.577 231 HG CYS 118 HG CYS 118 11.994 2.148 47.032 232 H ASP 119 HN ASP 119 14.851 4.255 46.484 233 H LEU 120 HN LEU 120 15.914 6.076 47.576 234 H SER 122 HN SER 122 17.906 10.292 50.634 235 HG SER 122 HG SER 122 19.200 12.318 51.869 236 H ARG 123 HN ARG 123 14.648 11.414 51.347 237 HE ARG 123 HE ARG 123 10.501 8.549 50.937 238 HH11 ARG 123 HH11 ARG 123 8.428 9.834 48.392 239 HH12 ARG 123 HH12 ARG 123 7.970 8.187 47.795 240 HH21 ARG 123 HH21 ARG 123 8.812 6.310 48.807 241 HH22 ARG 123 HH22 ARG 123 9.940 6.471 50.217 242 H THR 124 HN THR 124 13.014 13.875 48.045 243 HG1 THR 124 HG1 THR 124 14.307 15.861 46.919 244 H VAL 125 HN VAL 125 11.141 14.061 47.274 245 H ASP 126 HN ASP 126 7.044 14.915 48.458 246 H THR 127 HN THR 127 5.583 10.683 49.512 247 HG1 THR 127 HG1 THR 127 5.921 8.054 48.319 248 H LYS 128 HN LYS 128 3.038 11.781 49.473 249 HZ1 LYS 128 HZ1 LYS 128 -2.917 14.894 52.377 250 HZ2 LYS 128 HZ2 LYS 128 -2.941 13.922 50.993 251 HZ3 LYS 128 HZ3 LYS 128 -3.871 15.332 51.048 252 H GLN 129 HN GLN 129 3.065 13.853 47.797 253 HE21 GLN 129 HE21 GLN 129 4.328 18.858 46.877 254 HE22 GLN 129 HE22 GLN 129 6.002 19.014 47.277 255 H ALA 130 HN ALA 130 3.771 12.963 45.431 256 H GLN 131 HN GLN 131 1.708 11.168 44.854 257 HE21 GLN 131 HE21 GLN 131 -2.056 8.139 45.582 258 HE22 GLN 131 HE22 GLN 131 -1.950 6.964 46.847 259 H ASP 132 HN ASP 132 -0.225 12.930 44.714 260 H LEU 133 HN LEU 133 0.170 14.538 42.559 261 H ALA 134 HN ALA 134 0.074 12.729 40.676 262 H ARG 135 HN ARG 135 -2.503 12.111 40.673 263 HE ARG 135 HE ARG 135 -8.917 11.479 41.881 264 HH11 ARG 135 HH11 ARG 135 -7.211 8.460 42.496 265 HH12 ARG 135 HH12 ARG 135 -8.579 7.765 43.445 266 HH21 ARG 135 HH21 ARG 135 -10.644 10.655 43.110 267 HH22 ARG 135 HH22 ARG 135 -10.501 8.984 43.783 268 H SER 136 HN SER 136 -3.638 14.262 39.599 269 HG SER 136 HG SER 136 -5.131 17.177 40.108 270 H TYR 137 HN TYR 137 -2.772 14.175 37.060 271 HH TYR 137 HH TYR 137 2.675 17.923 36.230 272 H GLY 138 HN GLY 138 -4.198 12.292 36.296 273 H ILE 139 HN ILE 139 -2.964 10.334 36.002 274 H PHE 141 HN PHE 141 0.096 5.735 39.884 275 H ILE 142 HN ILE 142 4.390 5.458 39.513 276 H GLU 143 HN GLU 143 5.559 3.606 43.169 277 H THR 144 HN THR 144 9.830 4.501 42.097 278 HG1 THR 144 HG1 THR 144 11.639 4.047 40.380 279 H SER 145 HN SER 145 12.601 1.060 41.765 280 HG SER 145 HG SER 145 16.312 2.422 44.750 281 H ALA 146 HN ALA 146 16.258 2.406 40.871 282 H LYS 147 HN LYS 147 17.529 0.988 42.515 283 HZ1 LYS 147 HZ1 LYS 147 22.029 2.121 48.368 284 HZ2 LYS 147 HZ2 LYS 147 22.654 0.758 49.145 285 HZ3 LYS 147 HZ3 LYS 147 20.984 1.025 49.116 286 H THR 148 HN THR 148 16.610 -0.609 44.192 287 HG1 THR 148 HG1 THR 148 14.987 -0.156 46.443 288 H ARG 149 HN ARG 149 15.676 -1.987 42.538 289 HE ARG 149 HE ARG 149 16.161 -6.186 37.596 290 HH11 ARG 149 HH11 ARG 149 13.460 -6.646 39.824 291 HH12 ARG 149 HH12 ARG 149 12.225 -6.597 38.501 292 HH21 ARG 149 HH21 ARG 149 14.628 -6.178 35.907 293 HH22 ARG 149 HH22 ARG 149 12.871 -6.360 36.328 294 H GLN 150 HN GLN 150 13.187 -1.929 43.203 295 HE21 GLN 150 HE21 GLN 150 9.172 0.696 45.026 296 HE22 GLN 150 HE22 GLN 150 9.180 1.141 46.697 297 H GLY 151 HN GLY 151 9.179 -3.256 41.884 298 H VAL 152 HN VAL 152 10.720 -2.293 39.915 299 H ASP 153 HN ASP 153 10.084 -4.031 37.853 300 H ASP 154 HN ASP 154 7.596 -3.725 37.929 301 H ALA 155 HN ALA 155 7.253 -1.278 36.817 302 H PHE 156 HN PHE 156 7.432 -1.509 34.106 303 H TYR 157 HN TYR 157 5.630 -3.132 33.665 304 HH TYR 157 HH TYR 157 5.042 -10.397 32.260 305 H THR 158 HN THR 158 3.345 -1.768 34.253 306 HG1 THR 158 HG1 THR 158 2.712 -1.013 36.269 307 H LEU 159 HN LEU 159 3.372 0.008 32.357 308 H VAL 160 HN VAL 160 2.985 -1.340 29.947 309 H ARG 161 HN ARG 161 0.465 -2.176 30.411 310 HE ARG 161 HE ARG 161 -0.736 -3.708 34.134 311 HH11 ARG 161 HH11 ARG 161 -1.472 -7.100 33.484 312 HH12 ARG 161 HH12 ARG 161 -0.193 -7.698 34.609 313 HH21 ARG 161 HH21 ARG 161 0.875 -4.443 35.590 314 HH22 ARG 161 HH22 ARG 161 1.107 -6.223 35.785 315 H GLU 162 HN GLU 162 -0.829 0.093 30.410 316 H ILE 163 HN ILE 163 -0.790 0.805 27.847 317 H ARG 164 HN ARG 164 -2.219 -1.103 26.670 318 HE ARG 164 HE ARG 164 -0.942 -5.836 25.108 319 HH11 ARG 164 HH11 ARG 164 -1.000 -8.491 28.161 320 HH12 ARG 164 HH12 ARG 164 -2.139 -7.090 28.161 321 HH21 ARG 164 HH21 ARG 164 0.508 -7.584 25.068 322 HH22 ARG 164 HH22 ARG 164 0.479 -8.768 26.425 323 H LYS 165 HN LYS 165 -4.740 -0.624 27.672 324 HZ1 LYS 165 HZ1 LYS 165 -6.162 1.233 33.276 325 HZ2 LYS 165 HZ2 LYS 165 -4.520 1.559 33.047 326 HZ3 LYS 165 HZ3 LYS 165 -5.013 0.040 33.633 327 H HIS 166 HN HIS 166 -5.151 1.574 26.419 328 HD1 HIS 166 HD1 HIS 166 -4.080 5.131 22.889 329 HE2 HIS 166 HE2 HIS 166 -6.125 8.205 24.454 330 H LYS 167 HN LYS 167 -5.370 1.088 23.887 331 HZ1 LYS 167 HZ1 LYS 167 0.002 -0.547 19.469 332 HZ2 LYS 167 HZ2 LYS 167 -1.388 -1.344 18.912 333 HZ3 LYS 167 HZ3 LYS 167 -0.614 -1.879 20.317 334 H GLU 168 HN GLU 168 -7.691 -0.131 23.802 335 H LYS 169 HN LYS 169 -9.371 1.717 24.438 336 HZ1 LYS 169 HZ1 LYS 169 -13.345 7.891 27.221 337 HZ2 LYS 169 HZ2 LYS 169 -12.730 6.625 28.160 338 HZ3 LYS 169 HZ3 LYS 169 -13.243 6.329 26.579 339 H MET 170 HN MET 170 -9.155 3.279 22.308 340 H SER 171 HN SER 171 -10.640 1.951 20.723 341 HG SER 171 HG SER 171 -9.686 0.230 19.772 342 H LYS 172 HN LYS 172 -12.821 2.701 21.162 343 HZ1 LYS 172 HZ1 LYS 172 -17.757 2.207 25.829 344 HZ2 LYS 172 HZ2 LYS 172 -17.180 0.622 25.714 345 HZ3 LYS 172 HZ3 LYS 172 -17.369 1.554 24.318 346 H ASP 173 HN ASP 173 -13.603 4.845 21.421 347 H GLY 174 HN GLY 174 -14.780 6.665 18.080 348 H LYS 175 HN LYS 175 -14.197 9.279 16.342 349 HZ1 LYS 175 HZ1 LYS 175 -8.706 15.495 15.291 350 HZ2 LYS 175 HZ2 LYS 175 -8.496 13.838 15.029 351 HZ3 LYS 175 HZ3 LYS 175 -9.486 14.375 16.285 352 H LYS 176 HN LYS 176 -14.214 12.365 18.675 353 HZ1 LYS 176 HZ1 LYS 176 -20.208 15.990 23.124 354 HZ2 LYS 176 HZ2 LYS 176 -18.568 15.720 23.433 355 HZ3 LYS 176 HZ3 LYS 176 -19.648 14.421 23.417 356 H LYS 177 HN LYS 177 -17.361 14.061 16.067 357 HZ1 LYS 177 HZ1 LYS 177 -19.234 16.647 11.988 358 HZ2 LYS 177 HZ2 LYS 177 -19.418 15.476 10.782 359 HZ3 LYS 177 HZ3 LYS 177 -19.038 17.068 10.361 360 H LYS 178 HN LYS 178 -17.280 18.293 14.676 361 HZ1 LYS 178 HZ1 LYS 178 -17.298 24.124 18.080 362 HZ2 LYS 178 HZ2 LYS 178 -18.296 23.709 16.780 363 HZ3 LYS 178 HZ3 LYS 178 -16.623 23.484 16.671 364 H LYS 179 HN LYS 179 -21.753 18.618 15.665 365 HZ1 LYS 179 HZ1 LYS 179 -22.445 11.362 16.040 366 HZ2 LYS 179 HZ2 LYS 179 -21.187 11.501 17.157 367 HZ3 LYS 179 HZ3 LYS 179 -20.889 11.769 15.515 368 H LYS 180 HN LYS 180 -25.106 17.495 13.153 369 HZ1 LYS 180 HZ1 LYS 180 -28.961 21.250 16.952 370 HZ2 LYS 180 HZ2 LYS 180 -27.551 21.242 17.889 371 HZ3 LYS 180 HZ3 LYS 180 -28.982 21.882 18.521 372 H SER 181 HN SER 181 -25.297 20.318 15.650 373 HG SER 181 HG SER 181 -25.483 22.299 18.164 374 H LYS 182 HN LYS 182 -26.823 23.739 13.130 375 HZ1 LYS 182 HZ1 LYS 182 -25.996 21.476 6.854 376 HZ2 LYS 182 HZ2 LYS 182 -26.459 19.852 6.967 377 HZ3 LYS 182 HZ3 LYS 182 -25.458 20.520 8.146 378 H THR 183 HN THR 183 -26.680 26.066 12.475 379 HG1 THR 183 HG1 THR 183 -23.816 26.268 14.585 380 H LYS 184 HN LYS 184 -26.188 27.478 10.221 381 HZ1 LYS 184 HZ1 LYS 184 -25.624 32.122 6.669 382 HZ2 LYS 184 HZ2 LYS 184 -26.202 32.362 5.097 383 HZ3 LYS 184 HZ3 LYS 184 -25.530 30.871 5.534 384 H CYS 185 HN CYS 185 -24.056 26.772 7.797 385 HG CYS 185 HG CYS 185 -22.637 25.933 10.445 386 HE21 GLN 418 HE21 GLN 418 -15.928 -52.006 9.567 387 HE22 GLN 418 HE22 GLN 418 -15.219 -50.545 10.167 388 HE21 GLN 424 HE21 GLN 424 -28.784 -53.062 2.955 389 HE22 GLN 424 HE22 GLN 424 -28.271 -54.633 3.458 390 HE21 GLN 439 HE21 GLN 439 -38.767 -32.915 -0.872 391 HE22 GLN 439 HE22 GLN 439 -39.416 -33.971 0.335 392 HE21 GLN 453 HE21 GLN 453 -42.270 -15.773 -18.264 393 HE22 GLN 453 HE22 GLN 453 -42.953 -17.348 -18.458 394 HE21 GLN 460 HE21 GLN 460 -36.848 -6.794 -22.489 395 HE22 GLN 460 HE22 GLN 460 -37.006 -8.373 -23.176 396 HE21 GLN 464 HE21 GLN 464 -36.579 1.222 -23.987 397 HE22 GLN 464 HE22 GLN 464 -37.904 0.588 -24.905 398 HE21 GLN 472 HE21 GLN 472 -33.286 12.815 -22.680 399 HE22 GLN 472 HE22 GLN 472 -34.919 12.329 -22.396 400 HE21 GLN 482 HE21 GLN 482 -17.518 14.432 -28.616 401 HE22 GLN 482 HE22 GLN 482 -17.820 13.226 -29.819 402 HE21 GLN 487 HE21 GLN 487 -11.266 26.385 -25.471 403 HE22 GLN 487 HE22 GLN 487 -11.420 28.104 -25.449 404 HE21 GLN 493 HE21 GLN 493 -3.644 20.784 -32.410 405 HE22 GLN 493 HE22 GLN 493 -4.955 21.321 -33.405 406 HE21 GLN 527 HE21 GLN 527 44.364 20.638 -17.479 407 HE22 GLN 527 HE22 GLN 527 43.642 22.089 -18.078 408 HAC EWS 237 HAC DRG 203 11.245 7.900 16.419 409 HAD EWS 237 HAD DRG 203 9.819 5.912 14.720 410 HAE EWS 237 HAE DRG 203 9.377 7.635 15.130 411 HAF EWS 237 HAF DRG 203 13.307 6.677 16.252 412 HAG EWS 237 HAG DRG 203 12.602 5.639 14.916 413 HAI EWS 237 HAI DRG 203 13.462 8.504 14.997 414 HAH EWS 237 HAH DRG 203 13.675 7.274 13.675 415 HAJ EWS 237 HAJ DRG 203 11.128 6.484 12.997 416 HAL EWS 237 HAL DRG 203 8.874 7.147 12.518 417 HAK EWS 237 HAK DRG 203 9.210 8.837 13.095 418 HAM EWS 237 HAM DRG 203 11.086 6.338 11.067 419 HAN EWS 237 HAN DRG 203 9.177 10.248 11.335 420 HAO EWS 237 HAO DRG 203 10.016 10.803 9.044 421 HAP EWS 237 HAP DRG 203 11.932 6.905 8.787 422 HAQ EWS 237 HAQ DRG 203 11.513 3.238 16.855 423 HAS EWS 237 HAS DRG 203 9.723 -0.113 18.993 424 HAT EWS 237 HAT DRG 203 9.268 1.432 20.920 425 HAX EWS 237 HAX DRG 203 10.530 6.186 20.741 426 HAA EWS 237 HAA DRG 203 10.033 5.334 16.797 427 HAZ EWS 237 HAZ DRG 203 11.543 9.113 14.203 428 HAW EWS 237 HAW DRG 203 9.566 4.019 21.688 429 HAY EWS 237 HAY DRG 203 12.182 8.637 12.786
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