NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 116 D 4.5047 8.4645 120.5314 53.1988 43.4160 175.4156 117 R 3.6419 7.8267 118.1761 53.8852 29.6599 176.1817 118 P 4.4793 0.0000 0.0000 61.4513 32.8376 175.9925 119 Q 4.1108 8.5508 119.4156 56.3875 29.2305 176.1512 120 K 4.7171 8.8579 120.5274 53.5052 36.1839 174.2275 121 P 4.3102 0.0000 0.0000 64.1182 31.7710 177.2605 122 F 4.0640 9.2842 118.7373 57.9659 37.8502 177.0509 123 D 4.3849 7.9037 122.0731 57.0462 40.9888 176.4683 124 K 4.4658 7.7557 118.7543 55.4209 35.8370 174.1952 125 F 5.6758 9.2969 127.0273 55.9828 41.5343 174.4608 126 F 5.1642 9.6268 124.0272 56.2765 40.3321 175.0326 127 I 5.5448 8.1486 117.0601 58.7750 40.2337 174.1238 128 D 4.6883 8.2623 121.5609 53.9170 44.9336 172.8383 129 Y 5.2454 8.7356 119.2089 56.4251 40.1971 175.2640 130 I 4.4610 10.4650 125.0955 58.4342 39.5748 176.0934 131 G 4.1356 8.4955 114.2699 42.9552 0.0000 169.8720 132 P 3.6297 0.0000 0.0000 62.2243 32.0162 175.9618 133 L 4.6189 8.2289 122.2721 52.0735 44.2327 174.5321 134 P 4.4253 0.0000 0.0000 62.3415 32.0194 174.9009 135 P 5.0352 0.0000 0.0000 62.3863 31.7379 175.6747 136 S 4.4925 8.5246 117.7916 57.3830 64.1423 173.6903 137 Q 3.2554 9.4429 127.5696 57.2459 26.0972 173.8598 138 G 3.8838 8.0616 99.8647 46.6775 0.0000 173.4163 139 Y 4.8402 7.8647 116.3492 56.1968 40.4692 176.3487 140 L 5.0155 8.8084 117.5189 54.6676 45.4867 175.8015 141 Y 5.2038 8.9636 115.2202 55.9872 42.7033 174.9340 142 V 4.9112 9.2488 120.5629 60.9922 34.3838 174.4587 143 L 4.1185 9.3429 131.8690 54.9076 43.4035 175.6373 144 V 4.6954 8.9556 126.4175 61.2141 34.1856 174.0688 145 V 4.9323 8.9765 128.7839 61.1147 34.1052 174.3253 146 V 5.0126 8.8796 127.6429 60.9795 34.8354 173.7789 147 D 5.1705 9.7020 128.7765 54.0983 41.5167 176.9987 148 G 4.1036 9.5534 114.9114 49.8533 0.0000 174.4516 149 M 4.3587 8.3524 119.2371 57.9437 32.7170 177.0070 150 T 4.1053 8.5437 108.5039 61.8305 69.6454 176.4915 151 G 4.0176 8.7237 109.5337 44.7797 0.0000 173.2712 152 F 4.0366 7.9516 122.6516 58.5015 40.6774 174.0975 153 T 4.9906 7.3376 120.5191 61.6180 71.7358 173.2892 154 W 4.6902 9.6804 126.5536 54.7447 32.1836 174.8350 155 L 5.0780 8.2410 123.0398 53.0981 43.8153 175.5088 156 Y 4.8773 8.8643 121.8003 55.3681 41.1620 173.0908 157 P 5.3875 0.0000 0.0000 62.7510 32.5226 175.4711 158 T 5.2076 9.4695 114.0217 59.9374 72.1515 174.8805 159 K 4.3804 9.0572 119.9959 57.8269 32.7797 176.8855 160 A 4.2155 7.2028 119.7106 50.4126 22.6479 174.8133 161 P 2.9700 0.0000 0.0000 61.3190 30.3123 176.2042 162 S 4.5784 6.8064 114.9948 56.6843 67.6675 174.7257 163 T 3.6976 8.2492 120.0377 67.1431 68.1434 176.4789 164 S 4.0158 7.9964 113.7390 61.4217 62.5222 175.7024 165 A 4.0246 7.7306 123.1076 55.6456 18.0798 179.8040 166 T 3.8695 8.1479 114.2853 66.7329 68.4867 177.2390 167 V 3.1064 8.3298 123.0404 66.1316 31.2874 178.8255 168 K 3.9638 7.9778 122.6054 59.9175 31.8860 180.7549 169 S 4.2281 8.0140 116.6566 61.4873 62.8046 177.0881 170 L 3.9528 8.2711 121.5492 57.4920 41.0384 179.1650 171 N 4.7146 8.3361 117.8647 55.5868 38.6761 177.2738 172 V 3.7273 7.5244 119.7121 65.8483 31.6180 177.9459 173 L 3.8889 7.5187 120.3177 58.2689 42.1370 178.0123 174 T 4.8102 8.8150 106.5453 61.8515 68.7389 175.2612 175 S 4.8081 7.7137 115.7637 58.1430 63.2546 174.6157 176 I 4.3861 7.6516 114.4393 61.8726 39.4960 175.7536 177 A 4.1234 7.4264 120.4007 50.9595 21.6461 174.5563 178 I 4.4238 7.7334 123.3005 58.5376 38.8973 174.2390 179 P 4.1922 0.0000 0.0000 62.0907 32.0925 176.5718 180 K 4.0811 8.9747 120.1331 58.9670 33.3721 177.4535 181 V 4.7259 7.4502 118.1328 61.1327 35.2385 174.2313 182 I 4.8280 8.2605 128.2617 60.0127 39.3074 173.9604 183 H 5.6682 8.9571 127.1672 53.7625 32.5856 173.1141 184 S 4.7504 7.7377 118.1921 57.1432 66.8937 172.5948 185 D 4.9915 8.4571 119.8385 51.6360 41.4313 175.9088 186 Q 4.2044 8.4523 115.4090 55.8849 29.2952 177.0429 187 G 3.7570 8.4502 106.7412 45.5957 0.0000 175.3887 188 A 3.9760 8.7829 124.9001 54.3078 18.0573 180.1752 189 A 3.7609 7.4035 117.9986 54.6898 18.4571 178.9358 190 F 4.3631 7.3128 115.0521 58.9789 39.6911 177.4017 191 T 4.3052 7.6940 107.7600 60.9114 69.4294 174.7711 192 S 4.4143 7.1815 116.7506 58.4276 63.8573 174.9798 193 S 4.5582 8.4598 115.0136 60.0809 63.1891 176.5746 194 T 3.9046 7.8569 119.9012 66.8847 68.3848 176.0082 195 F 4.3181 8.3618 122.2860 61.1704 39.3580 177.0023 196 A 4.0972 8.3208 122.4822 55.9934 18.2818 180.1611 197 E 3.9945 8.5895 117.1439 60.7196 29.1731 180.7931 198 W 4.2539 8.6846 128.9504 60.7091 30.7166 178.0734 199 A 3.4884 7.9978 120.5776 54.6691 17.8067 179.4810 200 K 3.7640 8.0245 118.3066 59.5586 31.9750 178.7987 201 E 3.8773 7.8022 118.2008 58.9239 29.4220 178.6057 202 R 4.2158 6.8910 113.8690 54.6493 30.3577 176.4419 203 G 3.8441 7.2816 105.8951 46.4797 0.0000 173.8096 204 I 4.1796 7.4407 120.0898 60.2859 38.5157 175.2602 205 H 4.6398 8.9349 127.1252 55.3255 31.2173 173.8619 206 L 4.6649 8.1059 125.3537 53.6650 43.2406 175.6271 207 E 4.4075 8.3033 123.2837 54.3429 32.8415 173.9612 208 F 5.4362 8.6416 125.3660 55.5418 41.1347 175.6317 209 S 4.6418 8.7466 118.6590 57.9052 64.3054 174.2881 210 T 4.0999 8.5620 112.1769 61.1178 69.2526 172.0433 211 P 4.1903 0.0000 0.0000 63.7938 31.8935 177.6576 212 Y 3.8013 8.5130 120.7114 59.4148 36.5940 170.0013 *213 H 4.9413 7.6831 115.6634 52.2031 28.1797 178.2636 214 P 4.6708 0.0000 0.0000 61.7245 30.6822 175.9480 215 Q 4.5432 8.3149 123.3535 55.2941 30.2249 175.7179 216 S 4.6150 8.1088 114.1614 55.3531 66.1779 174.3810 217 S 4.3082 8.1382 116.7478 58.3715 64.4972 175.4110 218 G 3.7382 8.6293 109.6226 48.2576 0.0000 175.6929 219 K 3.8791 7.9659 121.7792 59.1233 32.0980 178.8515 220 V 3.4689 7.1671 118.2356 65.6583 31.3710 177.7448 221 E 4.0139 8.0980 120.8760 60.2314 29.3732 180.1659 222 R 3.9179 7.7772 120.2972 61.2312 29.3779 180.5467 223 K 4.0234 7.9964 120.2587 59.6072 32.4969 178.7110 224 N 4.3082 8.7944 117.4233 55.9693 38.3892 177.4518 225 S 4.1312 7.9872 114.7595 61.3447 62.5573 175.3749 226 D 4.3478 7.9812 121.6404 57.7182 40.5090 179.1557 227 I 3.7594 7.6263 119.6629 64.3667 37.0769 178.2856 228 K 3.8320 7.5017 117.7788 59.7531 31.9142 179.5422 229 R 3.8162 7.8097 117.6249 59.1938 29.7313 178.5438 230 L 3.8562 8.4969 121.0655 58.5045 41.9533 178.7615 231 L 3.8458 8.5951 119.1388 58.3920 41.1104 179.5436 232 T 3.9464 8.2852 117.8534 67.4445 68.2410 177.4787 233 K 4.1600 8.3581 124.7370 58.6147 31.7815 180.1506 234 L 4.9405 7.1851 114.2094 54.3896 43.0110 177.0343 235 L 4.5949 8.2489 121.1059 53.7712 42.0161 175.3910 236 V 4.3060 6.7066 115.1696 60.9546 34.1739 175.2874 237 G 4.3025 9.0388 113.8018 45.7307 0.0000 174.6909 238 R 4.6607 7.2810 116.1525 53.2393 28.9005 173.9432 239 P 4.8741 0.0000 0.0000 64.3792 32.0811 177.4745 240 T 4.6293 8.0236 113.4686 62.2246 68.6486 174.5426 241 K 4.5799 8.0010 121.4476 54.8114 32.1795 183.2851 242 W 4.4339 7.9112 119.2265 59.7314 28.1125 177.4755 243 Y 3.6431 7.3494 121.3122 60.8662 38.0434 177.7187 244 D 4.4700 7.5223 118.0835 56.8091 41.1116 178.0337 245 L 4.2721 7.5454 117.2903 55.9447 41.7254 178.7092 246 L 3.9394 7.5820 119.6752 57.4404 41.5447 177.5213 247 P 4.1526 0.0000 0.0000 65.6143 31.4272 178.8234 248 V 3.6004 7.6771 116.5472 65.7871 31.5045 178.1383 249 V 3.4121 8.0498 118.4313 65.8362 31.3991 177.6787 250 Q 3.6957 8.0898 119.4827 59.1754 28.8783 178.1655 251 L 3.8334 7.6871 119.5990 57.7706 41.4512 179.2311 252 A 2.7188 7.1902 118.7504 54.8092 18.3963 178.9928 253 L 3.8363 7.4667 116.9926 58.2980 41.7596 179.6223 254 N 4.2046 7.9359 114.4702 54.2486 38.2960 175.7723 255 N 5.0749 7.7224 118.1682 53.0758 39.4926 174.2446 256 T 4.4036 7.0981 115.1173 61.4513 70.2271 174.6137 257 Y 4.0780 8.3860 124.3966 58.1799 38.4444 175.8913 258 S 4.3473 8.6025 120.2075 57.1477 62.7826 173.0565 259 P 4.1645 0.0000 0.0000 65.0823 31.3728 176.8606 260 V 3.8882 7.6021 117.8318 63.0881 32.3928 173.9115 261 L 4.0844 8.5589 126.7000 54.1234 40.0588 175.1239 262 K 4.4750 7.3177 116.1223 57.8303 29.9181 173.8332 263 Y 5.4205 7.2400 116.6234 56.5043 40.9879 176.1677 264 T 4.3643 8.8847 113.7608 60.4558 71.5343 174.1075 265 P 4.4552 0.0000 0.0000 65.4729 31.2864 178.2847 266 H 4.4045 8.6006 116.9988 59.6509 29.7789 177.3876 267 Q 4.3310 7.7896 121.2178 58.5358 28.3281 178.7623 268 L 3.9521 7.8368 118.9047 57.0013 41.6524 178.9421 269 L 3.7468 7.4313 119.9101 57.1332 41.5801 177.8693 270 F 4.8938 7.9923 115.4950 56.0261 39.9581 176.6873 271 G 3.7585 8.4966 106.8808 45.9969 0.0000 173.0811 272 I 4.7148 7.0936 108.6694 58.7127 40.9526 173.9939 273 D 4.5994 8.5006 120.4474 54.0474 41.4143 176.3304 274 S 4.6703 8.1558 115.4444 57.0772 64.8312 174.0950 275 N 4.5685 8.4799 117.6179 54.3315 38.7305 175.9892 276 T 4.3246 7.3319 108.7856 58.7709 68.4641 171.9267 277 P 4.6013 0.0000 0.0000 62.8447 32.8951 177.1116 278 F 4.3079 8.3333 116.8030 57.8856 39.8960 174.8931 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 116 D 8.46 4.50 0.00 2.68 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 7.83 3.64 0.00 1.91 1.79 0.00 3.27 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.25 0.00 118 P 0.00 4.48 0.00 2.18 2.10 0.00 3.75 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 119 Q 8.55 4.11 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.84 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 120 K 8.86 4.72 0.00 2.04 1.64 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.58 1.53 7.81 121 P 0.00 4.31 0.00 1.35 1.31 0.00 3.67 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.90 0.00 122 F 9.28 4.06 0.00 3.27 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 D 7.90 4.38 0.00 2.92 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 K 7.76 4.47 0.00 1.73 1.59 0.00 1.63 0.00 0.00 1.39 0.00 0.00 2.71 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.53 1.12 7.81 125 F 9.30 5.68 0.00 2.89 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 F 9.63 5.16 0.00 2.94 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 I 8.15 5.54 1.71 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.36 0.96 0.00 0.00 128 D 8.26 4.69 0.00 2.81 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 Y 8.74 5.25 0.00 3.02 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 I 10.46 4.46 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.77 0.80 0.00 0.00 131 G 8.50 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 P 0.00 3.63 0.00 1.85 1.55 0.00 3.42 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.15 0.00 133 L 8.23 4.62 0.00 1.34 1.23 -0.26 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 4.43 0.00 2.35 2.08 0.00 3.67 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.17 0.00 135 P 0.00 5.04 0.00 2.06 2.04 0.00 3.73 0.00 0.00 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.07 0.00 136 S 8.52 4.49 0.00 2.77 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 Q 9.44 3.26 0.00 1.79 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.63 0.00 0.00 0.00 0.00 0.00 1.96 1.37 0.00 138 G 8.06 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 Y 7.86 4.84 0.00 3.10 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 L 8.81 5.02 0.00 1.71 1.38 1.03 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 141 Y 8.96 5.20 0.00 3.02 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 V 9.25 4.91 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.81 0.00 0.00 143 L 9.34 4.12 0.00 1.59 1.75 0.46 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 144 V 8.96 4.70 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.92 0.00 0.00 145 V 8.98 4.93 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 1.08 0.00 0.00 146 V 8.88 5.01 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.93 0.00 0.00 147 D 9.70 5.17 0.00 3.16 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 9.55 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 M 8.35 4.36 0.00 1.99 2.21 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.48 0.00 150 T 8.54 4.11 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 151 G 8.72 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 F 7.95 4.04 0.00 2.93 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 T 7.34 4.99 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 154 W 9.68 4.69 0.00 3.26 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 L 8.24 5.08 0.00 1.36 1.47 0.81 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 156 Y 8.86 4.88 0.00 2.96 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 P 0.00 5.39 0.00 1.63 2.10 0.00 3.82 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.61 0.00 158 T 9.47 5.21 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 159 K 9.06 4.38 0.00 1.79 1.91 0.00 1.66 0.00 0.00 1.53 0.00 0.00 2.13 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.36 1.24 7.81 160 A 7.20 4.22 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 2.97 0.00 1.45 0.84 0.00 3.15 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.95 0.00 162 S 6.81 4.58 0.00 3.89 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 T 8.25 3.70 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 164 S 8.00 4.02 0.00 3.88 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 A 7.73 4.02 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 T 8.15 3.87 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 167 V 8.33 3.11 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.65 0.00 0.00 168 K 7.98 3.96 0.00 1.89 1.71 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.39 1.36 7.81 169 S 8.01 4.23 0.00 3.99 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 L 8.27 3.95 0.00 1.33 1.80 0.98 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 171 N 8.34 4.71 0.00 2.98 2.97 0.00 0.00 6.91 7.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 V 7.52 3.73 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.99 0.00 0.00 173 L 7.52 3.89 0.00 1.60 1.68 -0.27 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 174 T 8.81 4.81 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 175 S 7.71 4.81 0.00 3.99 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 I 7.65 4.39 1.94 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.67 1.08 0.00 0.00 177 A 7.43 4.12 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 I 7.73 4.42 1.64 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.49 0.67 0.00 0.00 179 P 0.00 4.19 0.00 1.82 0.49 0.00 3.55 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 180 K 8.97 4.08 0.00 1.79 1.82 0.00 1.70 0.00 0.00 1.53 0.00 0.00 2.73 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.31 7.81 181 V 7.45 4.73 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.89 0.00 0.00 182 I 8.26 4.83 1.91 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.63 0.96 0.00 0.00 183 H 8.96 5.67 0.00 3.02 2.38 0.00 5.83 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 S 7.74 4.75 0.00 3.16 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 D 8.46 4.99 0.00 2.84 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 Q 8.45 4.20 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 187 G 8.45 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 A 8.78 3.98 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 A 7.40 3.76 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 F 7.31 4.36 0.00 3.28 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 T 7.69 4.31 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 192 S 7.18 4.41 0.00 4.16 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 S 8.46 4.56 0.00 4.11 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 T 7.86 3.90 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 195 F 8.36 4.32 0.00 3.24 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 A 8.32 4.10 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 E 8.59 3.99 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.19 0.00 198 W 8.68 4.25 0.00 3.37 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 A 8.00 3.49 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 K 8.02 3.76 0.00 1.81 1.76 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.44 7.81 201 E 7.80 3.88 0.00 1.96 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 202 R 6.89 4.22 0.00 1.26 1.54 0.00 2.48 0.00 0.00 2.80 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.50 0.00 203 G 7.28 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 I 7.44 4.18 1.65 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.27 0.82 0.00 0.00 205 H 8.93 4.64 0.00 3.11 3.09 0.00 5.57 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 L 8.11 4.66 0.00 1.41 1.06 1.17 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.48 0.00 216 S 8.11 4.61 0.00 3.03 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 S 8.14 4.31 0.00 4.04 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 G 8.63 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 K 7.97 3.88 0.00 1.81 1.78 0.00 1.72 0.00 0.00 1.75 0.00 0.00 3.12 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.48 7.81 220 V 7.17 3.47 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.60 0.00 0.00 221 E 8.10 4.01 0.00 2.16 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 222 R 7.78 3.92 0.00 1.85 1.95 0.00 3.27 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.52 0.00 223 K 8.00 4.02 0.00 1.90 1.91 0.00 1.36 0.00 0.00 1.54 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.34 1.43 7.81 224 N 8.79 4.31 0.00 2.84 2.83 0.00 0.00 6.78 5.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 S 7.99 4.13 0.00 3.99 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 D 7.98 4.35 0.00 2.82 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 I 7.63 3.76 1.80 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.10 0.82 0.00 0.00 228 K 7.50 3.83 0.00 1.97 1.83 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.66 7.81 229 R 7.81 3.82 0.00 1.97 1.93 0.00 3.12 0.00 0.00 3.07 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.74 0.00 230 L 8.50 3.86 0.00 1.71 1.75 0.83 -0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 231 L 8.60 3.85 0.00 1.85 1.55 0.70 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 232 T 8.29 3.95 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 233 K 8.36 4.16 0.00 1.82 1.73 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.35 7.81 234 L 7.19 4.94 0.00 1.59 1.70 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 235 L 8.25 4.59 0.00 1.64 1.68 0.83 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 236 V 6.71 4.31 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.93 0.00 0.00 237 G 9.04 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 R 7.28 4.66 0.00 2.00 2.07 0.00 3.01 0.00 0.00 3.42 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 239 P 0.00 4.87 0.00 2.27 2.32 0.00 3.36 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.95 0.00 240 T 8.02 4.63 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 241 K 8.00 4.58 0.00 1.70 1.72 0.00 1.84 0.00 0.00 1.87 0.00 0.00 2.91 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.35 0.96 7.81 242 W 7.91 4.43 0.00 3.57 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 243 Y 7.35 3.64 0.00 2.46 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 D 7.52 4.47 0.00 2.76 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 L 7.55 4.27 0.00 1.95 1.73 0.98 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 246 L 7.58 3.94 0.00 1.54 1.60 0.89 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 247 P 0.00 4.15 0.00 2.12 2.07 0.00 3.59 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.05 0.00 248 V 7.68 3.60 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.97 0.00 0.00 249 V 8.05 3.41 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.93 0.00 0.00 250 Q 8.09 3.70 0.00 2.20 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.54 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 251 L 7.69 3.83 0.00 1.75 1.80 0.97 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 252 A 7.19 2.72 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 253 L 7.47 3.84 0.00 1.57 1.49 0.74 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 254 N 7.94 4.20 0.00 2.27 2.23 0.00 0.00 6.91 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 255 N 7.72 5.07 0.00 2.92 2.83 0.00 0.00 6.85 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 256 T 7.10 4.40 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 257 Y 8.39 4.08 0.00 3.06 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 258 S 8.60 4.35 0.00 3.88 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 259 P 0.00 4.16 0.00 2.07 2.10 0.00 3.72 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 260 V 7.60 3.89 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.92 0.00 0.00 261 L 8.56 4.08 0.00 1.91 2.06 0.98 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.00 0.00 262 K 7.32 4.47 0.00 1.57 1.68 0.00 1.58 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.18 1.49 7.81 263 Y 7.24 5.42 0.00 3.23 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 264 T 8.88 4.36 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 265 P 0.00 4.46 0.00 2.16 2.13 0.00 3.94 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.05 0.00 266 H 8.60 4.40 0.00 3.51 3.39 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 267 Q 7.79 4.33 0.00 2.32 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.58 0.00 0.00 0.00 0.00 0.00 2.67 2.37 0.00 268 L 7.84 3.95 0.00 1.59 1.67 1.03 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 269 L 7.43 3.75 0.00 1.17 0.82 0.43 -0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 270 F 7.99 4.89 0.00 3.06 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 271 G 8.50 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 272 I 7.09 4.71 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.99 0.94 0.00 0.00 273 D 8.50 4.60 0.00 2.74 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 274 S 8.16 4.67 0.00 3.49 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 275 N 8.48 4.57 0.00 2.70 2.87 0.00 0.00 6.72 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 276 T 7.33 4.32 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 277 P 0.00 4.60 0.00 2.15 2.08 0.00 3.27 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.06 0.00 278 F 8.33 4.31 0.00 3.10 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.