NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 E 4.2755 8.4449 118.7920 55.2084 32.0616 174.9520 6 K 4.2974 7.5021 121.2986 54.0513 34.1600 174.4561 7 T 4.2783 8.9643 122.3568 63.1837 70.2151 173.7666 8 E 4.8032 8.8845 126.3354 56.3024 31.0431 175.9371 9 V 5.0075 9.2355 123.3479 61.0730 35.6664 174.1334 10 V 4.9027 8.8498 126.2614 61.1598 34.3062 174.0750 11 L 4.9838 9.1327 128.5717 53.6540 43.5959 175.2975 12 L 5.2284 9.1321 126.0347 53.2635 44.9867 174.6938 13 A 5.2791 9.2549 129.1506 49.8990 20.8757 175.3862 14 C 5.1264 9.1503 120.2232 58.4010 30.5393 173.5494 15 G 3.5632 8.0087 107.8633 46.4584 0.0000 173.5828 16 S 4.1651 8.1714 115.5254 59.7565 63.9491 175.0518 17 F 3.5970 7.1378 117.0546 58.8928 36.3308 175.2690 18 N 5.3524 7.6839 118.9345 51.4486 39.0045 170.5310 19 P 5.4016 0.0000 0.0000 59.8303 34.2954 175.7024 20 I 4.0595 8.2090 118.8215 61.3687 38.2944 174.4431 21 T 4.8423 8.4460 114.8681 59.0645 72.1545 174.3350 22 N 4.3908 8.9205 118.2648 56.7449 38.2168 177.6534 23 M 4.0657 7.8189 119.8827 58.7142 31.7781 178.4311 24 H 4.3130 7.7083 115.3635 59.0165 29.0833 177.5390 25 L 4.3514 8.0210 120.2623 57.5976 41.4919 179.4136 26 R 4.0339 8.3655 118.5438 59.1730 30.0160 178.6409 27 L 3.9310 8.1779 118.9229 58.2797 41.6157 179.8579 28 F 4.2204 8.2116 117.3732 60.4810 38.8634 177.6700 29 E 4.2879 8.5192 117.8087 59.4736 29.3412 179.0887 30 L 4.0378 8.3327 118.9318 57.9811 41.6899 179.4960 31 A 4.0613 8.1376 120.5110 55.0032 18.2148 179.6237 32 K 3.8309 8.4595 118.2034 59.7720 32.2090 178.8062 33 D 4.3115 8.2446 119.1869 57.4877 40.7139 178.0224 34 Y 3.9474 8.4493 120.3127 61.0229 38.6513 177.9336 35 M 3.9562 8.2549 118.6929 58.7017 32.5255 178.4399 36 N 4.8793 7.9266 118.0312 55.5328 38.4352 177.7942 37 G 3.5718 8.0899 107.3211 47.7656 0.0000 175.5488 38 T 3.8574 7.4190 111.2362 62.7843 68.6356 175.6190 39 G 3.8915 7.8939 108.3809 45.5477 0.0000 173.8262 40 R 4.3358 8.2136 118.0207 56.1981 31.4162 175.2081 41 Y 5.3066 7.6580 115.6939 56.4973 43.3593 174.3771 42 T 4.8900 8.8616 116.5091 61.9321 72.3210 173.8239 43 V 4.4091 9.1931 128.6791 62.7868 31.2980 176.1138 44 V 4.2551 8.6824 121.9841 61.7057 32.5954 176.2867 45 K 4.7847 7.8335 119.1723 55.6421 35.5497 173.6245 46 G 4.4161 8.9983 113.5444 44.4691 0.0000 172.0509 47 I 5.0275 9.1643 123.8321 59.4000 41.1895 174.2421 48 I 4.4752 8.6951 128.7367 59.9453 38.8562 174.8663 49 S 5.0451 8.6678 122.0830 54.2179 62.9073 171.0101 50 P 5.0841 0.0000 0.0000 61.9646 31.9318 176.5430 51 V 3.8604 8.6717 124.2024 61.5142 32.3476 176.5012 52 G 3.9206 8.6499 111.2352 45.1217 0.0000 174.5102 53 D 4.4539 8.6608 119.1023 56.8111 40.9837 178.7236 54 A 4.2288 8.0271 120.6883 54.2721 18.7905 177.7320 55 Y 3.9804 8.2812 117.6141 58.6792 38.9236 177.3416 56 K 3.9699 8.1353 116.3223 56.7108 30.5792 175.4844 57 K 3.7124 7.4578 119.9743 55.7495 32.6712 176.1124 58 K 4.1517 8.3603 126.5513 57.9850 32.4885 176.9300 59 G 4.2740 8.9606 113.2548 45.3539 0.0000 173.2344 60 L 4.1553 7.6742 122.1677 54.3565 41.9365 176.9028 61 I 4.1968 7.9858 119.2245 58.9665 38.9577 174.2824 62 P 4.6609 0.0000 0.0000 62.2372 32.6642 177.4120 63 A 4.0610 9.1636 123.9516 55.4448 18.3104 179.4990 64 Y 4.0125 8.0520 117.5279 61.3307 38.7941 178.0795 65 H 4.2158 8.1983 116.4867 58.9927 28.9256 177.8956 66 R 3.9664 7.8755 119.9772 59.1071 29.7762 179.2995 67 V 3.4605 8.2193 118.4703 65.9384 31.4296 178.1554 68 I 3.3347 7.2880 119.4249 64.5434 36.8089 178.3049 69 M 3.7593 8.0000 119.5582 58.2695 31.6346 178.7305 70 A 3.7870 7.9196 120.8868 54.8989 18.2448 179.3197 71 E 3.7140 7.9073 117.2950 59.3654 29.7189 178.7631 72 L 4.0207 8.0158 119.0713 57.7100 41.4329 179.3862 73 A 4.0193 8.0254 120.1354 54.2323 18.4951 178.7490 74 T 4.2671 7.2538 106.1162 61.2250 68.8818 176.0464 75 K 3.6994 7.3882 124.1557 60.0174 32.1256 177.2202 76 N 4.7455 7.9673 112.3561 52.9846 38.6085 174.2341 77 S 4.6211 7.6418 114.0542 56.7865 63.3234 174.6604 78 K 4.2661 8.7877 127.1611 58.4012 32.2823 177.4358 79 W 5.0240 7.9306 112.7093 55.3577 30.3614 174.8043 80 V 3.9761 7.0525 121.7403 61.0754 32.0668 174.5009 81 E 4.6229 8.9500 125.5124 54.4528 33.5555 174.2281 82 V 4.6536 8.0824 118.7753 61.0684 33.6069 174.0148 83 D 5.1177 8.9383 127.5111 52.7468 43.6813 176.4007 84 T 4.4164 8.7279 115.2034 61.8147 69.2478 176.1988 85 W 4.2762 8.3547 131.8968 61.2512 30.9180 177.0461 86 E 3.7112 8.4279 117.6980 59.3629 28.7997 179.4489 87 S 4.1981 8.0440 112.4839 60.9507 63.0249 175.4065 88 L 4.3444 7.3148 119.7253 53.7500 41.8931 176.5342 89 Q 3.9425 7.0063 119.8425 55.1926 29.0806 176.6955 90 K 4.1053 8.5471 122.4552 58.0964 32.5473 176.8764 91 E 4.6630 7.7326 117.8875 53.4684 31.8779 175.4397 92 W 4.2393 8.9988 133.2108 57.9902 31.1342 174.8333 93 K 4.0386 7.3116 124.1011 54.0636 33.6126 176.7635 94 E 3.1218 7.6326 122.6539 56.2495 31.2916 178.2705 95 T 3.8638 8.3585 118.8508 66.8691 68.4997 176.4403 96 L 3.8839 8.0328 121.5922 58.3029 42.0981 179.1649 97 K 3.9576 7.7996 117.8231 59.1324 32.0194 179.4089 98 V 3.6463 7.7279 118.7290 65.9643 31.4505 178.0150 99 L 3.7831 8.0022 118.9946 57.6804 41.2833 179.5072 100 R 3.9992 7.8785 120.0761 59.0994 30.0358 177.7828 101 H 3.6716 8.3704 118.2847 59.7508 29.6202 176.9210 102 H 4.0296 8.1662 117.7392 58.5518 28.2551 177.6660 103 Q 4.0173 8.0944 120.9974 59.2023 29.2843 177.6999 104 E 4.2174 8.3654 119.8873 59.2207 28.9603 179.1673 105 K 3.8029 7.8497 119.6946 59.5494 32.0041 178.8859 106 L 4.1632 7.6478 118.0154 57.0646 41.6027 177.5828 107 E 4.5126 7.8077 117.7234 55.7673 30.9229 177.2115 108 A 4.3932 7.4872 118.7318 50.8578 19.4892 178.1187 *147 A 4.2282 8.0435 122.9352 52.6680 20.6387 177.5092 148 V 4.1100 7.5641 115.9368 60.5251 32.4840 173.7317 149 P 4.6212 0.0000 0.0000 63.3272 32.2149 175.4454 150 K 4.9435 9.0971 122.0451 54.7173 34.5448 175.8069 151 V 4.6718 9.0647 125.3120 60.9691 32.7488 175.7029 152 K 4.8044 9.1757 123.2529 54.2903 36.4348 175.0375 153 L 4.6219 8.6459 126.1735 54.8342 42.9821 175.0784 154 L 5.0766 8.9400 129.4658 53.8876 44.1039 175.0535 155 C 4.5515 8.8229 119.9170 57.7957 33.5763 172.3786 156 G 4.5016 8.2841 105.2183 43.4902 0.0000 174.5031 157 A 3.9195 8.4296 120.7796 54.9649 17.9214 179.3309 158 D 4.1802 7.9243 116.2112 57.6263 41.2021 178.5502 159 L 4.0454 7.6606 119.8626 57.9041 42.1477 178.3091 160 L 2.8207 7.1620 120.1036 58.0852 41.9713 179.0020 161 E 2.5400 7.7557 118.2603 58.1587 29.2022 179.0391 162 S 4.3441 7.6009 114.1196 60.4772 62.7783 176.1096 163 F 4.2301 7.6874 121.1447 60.1748 38.6878 176.2055 164 A 4.6677 8.1711 118.0881 51.2898 19.4093 177.3980 165 V 3.7165 7.7541 119.4855 61.6859 32.0064 173.5989 166 P 4.4523 0.0000 0.0000 64.5726 31.4609 176.6961 167 N 4.4773 9.0860 118.2307 53.7144 37.1358 175.2203 168 L 4.0869 8.0797 119.9191 56.8796 42.4198 177.1434 169 W 5.0969 7.9493 116.2159 54.3229 32.7780 174.9131 170 K 4.2673 8.8051 122.4265 56.0485 32.4900 177.8174 171 S 4.1204 9.1397 119.5828 62.1610 62.5807 176.8332 172 E 4.0996 8.1808 120.9686 58.4009 29.1499 179.0046 173 D 4.3649 8.4071 119.9939 57.3939 41.0136 178.2829 174 I 3.2123 7.7114 119.7684 64.7233 36.9984 178.0966 175 T 3.8249 7.7160 116.0479 67.0973 68.2940 176.7406 176 Q 4.0487 8.2349 119.4888 58.7010 28.6539 179.0255 177 I 3.9374 8.1975 121.4977 64.7441 37.0369 178.9563 178 V 3.7145 7.7099 111.4962 64.1299 31.4064 178.1999 179 A 4.0531 7.9621 119.9237 54.2562 18.5576 178.4907 180 N 4.5382 8.2509 112.8477 54.2399 39.5536 174.0383 181 Y 4.4158 8.7232 115.1792 56.2614 41.8028 174.4085 182 G 4.3382 7.4394 103.8489 43.4249 0.0000 172.0711 183 L 5.2800 8.6134 120.2543 52.7759 46.2132 175.9620 184 I 4.6564 9.0394 123.8449 59.8389 40.1844 174.1188 185 C 4.9137 8.9531 129.5735 57.5846 33.1098 172.7394 186 V 4.4388 8.3014 127.3876 62.3218 33.0290 174.5951 187 T 4.1675 8.0304 118.9327 61.9974 71.0670 173.8139 188 R 4.1113 8.7858 123.5388 57.0022 30.5347 176.9505 189 A 4.4847 8.0563 121.8142 50.0038 19.1636 176.4765 190 G 3.5089 8.1378 110.9788 48.3140 0.0000 172.9523 191 N 4.3726 7.9822 116.5114 54.7170 39.5929 176.0329 192 D 4.2995 7.8377 116.9112 57.9918 41.4230 177.6329 193 A 3.9950 7.7227 120.7054 55.2570 18.4467 179.3771 194 Q 4.0144 9.0400 117.7552 59.2272 28.7637 179.4180 195 K 4.0975 7.9079 119.9146 59.5187 32.0528 178.5591 196 F 4.0727 8.1347 119.8624 61.4009 39.6699 176.8934 197 I 3.9482 8.3917 119.8333 64.5944 36.7225 177.8002 198 Y 4.4930 8.2010 119.4821 60.6001 38.7179 177.0894 199 E 3.9854 8.1380 116.7644 55.4886 29.9732 176.1898 200 S 4.4747 7.4213 114.8826 55.6990 64.7985 174.0760 201 D 4.4587 8.8517 128.3710 57.5193 40.3565 179.2400 202 V 3.6767 7.6253 118.0249 64.8269 32.0127 178.0189 203 L 4.1892 7.9987 119.9477 57.0543 41.4490 179.1785 204 W 3.9709 8.6692 128.7022 60.4502 30.4338 177.6229 205 K 3.9413 8.2946 118.4420 59.2996 31.7179 177.3336 206 H 4.8386 7.7539 114.5837 55.4517 29.5971 176.7005 207 R 4.0672 7.9399 122.5558 59.3390 28.5937 178.2169 208 S 4.1220 7.8990 112.4623 60.4021 63.4776 174.1781 209 N 4.8456 8.5676 118.2662 52.9581 39.6984 174.1757 210 I 4.8294 7.6196 120.4493 59.8865 39.7635 174.6913 211 H 4.7735 8.9721 125.5125 53.9421 30.7612 174.0718 212 V 4.2408 8.2403 124.2481 61.8948 32.6266 175.0442 213 V 3.8874 8.5144 128.5762 60.8388 33.3104 174.5638 214 N 4.7522 8.6420 125.9399 52.9089 39.2468 174.6308 215 E 4.3334 8.1011 120.2025 54.4993 31.3192 176.6731 216 W 4.3753 8.7144 125.2888 58.8946 29.8464 177.6882 217 I 4.0161 7.7426 119.5566 59.1877 34.7841 172.5574 218 A 4.0862 8.0177 122.9792 51.8798 18.8422 177.1954 219 N 4.9068 9.5488 124.6543 54.1845 37.1225 173.7861 220 D 4.1679 8.2629 118.3785 54.1396 44.3679 177.8901 221 I 4.1544 7.4268 119.2616 59.6173 35.9848 176.7117 222 S 4.2638 7.5243 117.8923 58.1838 65.4091 175.4016 223 S 4.0790 8.6256 120.0138 62.2341 62.6474 177.0644 224 T 3.7885 7.8608 117.7802 66.7920 68.1374 176.5296 225 K 4.0686 8.0176 119.8111 58.9920 31.9767 179.6485 226 I 3.6519 7.4768 120.2571 64.4728 37.0590 178.6441 227 R 3.7021 8.0298 119.1363 58.9967 29.6683 179.1613 228 R 3.8647 7.8798 118.4118 59.1629 29.9977 178.3056 229 A 4.2092 8.0785 122.1197 54.6142 18.3547 179.5451 230 L 3.9432 8.0553 117.4299 58.2247 41.5465 180.1223 231 R 4.0871 7.9318 116.3698 58.7609 29.9998 178.3065 232 R 4.4479 7.5301 115.4513 55.2720 30.2508 176.6973 233 G 3.9046 8.0996 106.9457 46.5347 0.0000 174.1756 234 Q 4.4191 8.0227 118.5064 54.1494 30.0599 175.6000 235 S 4.3324 8.3864 115.0942 58.4748 63.3220 173.8102 236 I 4.5517 8.0480 117.6946 60.2014 38.2176 175.0651 237 R 3.8040 7.5359 121.0086 58.2419 30.1117 176.5225 238 Y 3.9095 8.0856 119.8709 58.4284 35.8633 169.7568 239 L 4.5931 7.7852 119.4111 55.0642 43.1948 176.5479 240 V 4.9088 7.3035 109.4337 57.7068 35.8933 173.7974 241 P 4.4174 0.0000 0.0000 62.6087 33.0144 177.2391 242 D 4.3418 8.7156 120.8658 57.9551 40.8630 179.5273 243 L 3.9923 7.9216 118.5062 57.6492 41.5067 179.7212 244 V 3.6646 7.6803 117.9275 65.8575 31.5572 177.6929 245 Q 3.9820 8.2117 119.3604 59.3046 28.8153 178.1503 246 E 3.9534 8.5384 119.9438 59.5214 29.4595 178.6938 247 Y 3.9958 8.2239 119.5979 60.6868 38.7176 178.2189 248 I 3.7735 8.2058 120.9134 64.3487 37.0446 177.9980 249 E 3.9258 8.1850 119.1013 59.2611 29.5639 178.5119 250 K 3.9916 8.1315 118.6832 58.8428 32.2584 177.4885 251 H 4.5720 7.4797 112.9565 54.0602 29.6919 174.2084 252 N 4.1530 7.8763 117.6469 53.7759 36.7413 175.3253 253 L 3.8052 7.9644 118.6150 57.2485 42.1518 177.8640 254 Y 4.7419 7.5731 115.2199 56.1446 39.9772 174.9995 255 S 4.6259 8.7944 118.3515 56.6463 65.9853 175.0631 256 S 4.1899 8.6318 115.6150 61.6398 62.7595 176.0291 257 E 4.0894 8.1170 122.0194 59.3554 29.6132 178.9050 258 S 4.1811 8.0203 114.0395 61.4047 62.7331 176.0121 259 E 4.0636 8.0124 121.7904 58.7727 29.6427 177.6990 260 D 4.5478 7.9145 117.1325 54.2640 41.3736 176.5595 261 R 4.0546 7.3880 119.6525 57.7465 30.7983 176.7334 262 N 4.2652 9.0293 116.7334 53.5022 36.3176 173.9310 263 A 4.1151 7.8502 121.5890 53.8124 18.6984 178.8014 264 G 3.8626 8.7487 108.9003 45.7017 0.0000 173.4151 265 V 4.2802 7.4754 118.9132 60.7605 33.2621 175.3430 266 I 3.9639 7.9248 126.7007 60.1721 38.1603 176.2979 267 L 3.5310 8.2207 125.4417 54.9278 43.3623 177.2708 268 A 3.7909 7.8790 128.8601 55.1619 18.2763 178.2415 269 P 4.0792 0.0000 0.0000 65.5409 31.2483 178.7601 270 L 3.8626 7.4944 117.0449 57.8946 41.7787 179.1074 271 Q 3.8862 7.9372 119.2964 59.3717 28.7500 178.4909 272 R 3.9819 8.1755 118.8735 59.1620 30.1964 177.6302 273 N 4.6259 8.4740 115.7212 55.5440 38.8318 177.5455 274 T 4.0134 8.0368 116.8096 66.3547 68.8172 174.4132 275 A 4.2438 7.6685 126.2247 52.3017 18.8658 176.8929 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 5 E 8.44 4.28 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.30 0.00 6 K 7.50 4.30 0.00 1.71 1.71 0.00 1.71 0.00 0.00 1.82 0.00 0.00 3.06 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.48 7.81 7 T 8.96 4.28 4.36 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 8 E 8.88 4.80 0.00 1.97 1.91 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 2.43 2.33 0.00 9 V 9.24 5.01 2.10 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 1.02 0.00 0.00 0.98 0.00 0.00 10 V 8.85 4.90 2.15 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 1.05 0.00 0.00 1.00 0.00 0.00 11 L 9.13 4.98 0.00 1.97 1.61 1.19 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 12 L 9.13 5.23 0.00 1.70 1.65 0.85 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 13 A 9.25 5.28 1.45 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 0.00 0.00 14 C 9.15 5.13 0.00 2.96 2.93 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 0.00 0.00 0.00 15 G 8.01 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 0.00 0.00 0.00 16 S 8.17 4.17 0.00 3.82 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 17 F 7.14 3.60 0.00 3.28 2.97 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 18 N 7.68 5.35 0.00 2.71 2.75 0.00 0.00 7.22 7.69 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 19 P 0.00 5.40 0.00 2.33 2.34 0.00 3.20 0.00 0.00 5.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.79 0.00 20 I 8.21 4.06 1.92 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.03 0.92 0.00 0.00 21 T 8.45 4.84 4.25 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 22 N 8.92 4.39 0.00 2.87 2.95 0.00 0.00 7.46 7.17 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 23 M 7.82 4.07 0.00 1.95 2.06 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.71 0.00 24 H 7.71 4.31 0.00 3.43 3.72 0.00 5.85 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.02 4.35 0.00 1.88 1.74 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 26 R 8.37 4.03 0.00 1.95 2.03 0.00 3.40 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.86 0.00 27 L 8.18 3.93 0.00 2.03 1.52 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 28 F 8.21 4.22 0.00 3.27 3.17 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 0.00 29 E 8.52 4.29 0.00 2.24 2.15 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 2.83 2.50 0.00 30 L 8.33 4.04 0.00 1.85 1.74 0.92 1.33 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 31 A 8.14 4.06 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 K 8.46 3.83 0.00 1.66 1.90 0.00 0.61 0.00 0.00 0.79 0.00 0.00 2.48 0.00 0.00 2.39 0.00 0.00 0.00 0.00 1.12 1.03 7.81 33 D 8.24 4.31 0.00 2.95 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Y 8.45 3.95 0.00 3.12 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 M 8.25 3.96 0.00 1.93 2.16 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.95 0.00 36 N 7.93 4.88 0.00 2.75 2.81 0.00 0.00 6.45 7.70 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 37 G 8.09 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.42 3.86 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 0.94 0.00 0.00 39 G 7.89 3.89 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 0.00 0.00 0.00 40 R 8.21 4.34 0.00 1.18 1.42 0.00 2.92 0.00 0.00 3.09 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.61 0.00 41 Y 7.66 5.31 0.00 3.05 2.84 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 42 T 8.86 4.89 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 43 V 9.19 4.41 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.92 0.00 0.00 44 V 8.68 4.26 2.14 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 0.81 0.00 0.00 1.06 0.00 0.00 45 K 7.83 4.78 0.00 1.89 1.69 0.00 1.70 0.00 0.00 2.02 0.00 0.00 2.86 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.42 7.81 46 G 9.00 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 I 9.16 5.03 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.81 0.86 0.00 0.00 48 I 8.70 4.48 1.49 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.15 -0.06 0.00 0.00 49 S 8.67 5.05 0.00 3.90 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 50 P 0.00 5.08 0.00 2.02 2.11 0.00 3.71 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 1.91 1.84 0.00 51 V 8.67 3.86 2.10 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 0.67 0.00 0.00 0.89 0.00 0.00 52 G 8.65 3.92 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 0.00 0.00 0.00 53 D 8.66 4.45 0.00 2.75 2.77 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 54 A 8.03 4.23 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 Y 8.28 3.98 0.00 3.10 3.04 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 0.00 56 K 8.14 3.97 0.00 1.75 1.75 0.00 1.79 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.43 7.81 57 K 7.46 3.71 0.00 1.45 1.69 0.00 1.92 0.00 0.00 1.85 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.32 7.81 58 K 8.36 4.15 0.00 1.69 1.66 0.00 1.89 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.55 7.81 59 G 8.96 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 L 7.67 4.16 0.00 1.82 1.68 1.04 1.05 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 61 I 7.99 4.20 1.81 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.77 0.76 0.00 0.00 62 P 0.00 4.66 0.00 2.26 2.08 0.00 3.95 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.06 0.00 63 A 9.16 4.06 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 Y 8.05 4.01 0.00 3.01 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 65 H 8.20 4.22 0.00 3.46 3.39 0.00 5.69 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 66 R 7.88 3.97 0.00 1.97 2.19 0.00 3.52 0.00 0.00 3.44 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.88 0.00 67 V 8.22 3.46 2.06 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 0.98 0.00 0.00 0.91 0.00 0.00 68 I 7.29 3.33 1.40 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.06 0.32 0.00 0.00 69 M 8.00 3.76 0.00 2.00 2.18 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.44 0.00 70 A 7.92 3.79 1.11 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 0.00 0.00 71 E 7.91 3.71 0.00 1.93 1.82 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 2.21 2.27 0.00 72 L 8.02 4.02 0.00 1.76 1.62 0.73 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 73 A 8.03 4.02 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 74 T 7.25 4.27 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 75 K 7.39 3.70 0.00 1.86 1.90 0.00 1.75 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.43 1.39 7.81 76 N 7.97 4.75 0.00 2.73 2.81 0.00 0.00 6.77 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 7.64 4.62 0.00 3.65 3.63 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 78 K 8.79 4.27 0.00 1.94 1.94 0.00 1.87 0.00 0.00 2.10 0.00 0.00 3.28 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.55 1.57 7.81 79 W 7.93 5.02 0.00 3.49 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 V 7.05 3.98 1.31 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 -0.37 0.00 0.00 -1.03 0.00 0.00 81 E 8.95 4.62 0.00 1.86 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.13 0.00 82 V 8.08 4.65 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.71 0.00 0.00 83 D 8.94 5.12 0.00 2.85 2.56 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 84 T 8.73 4.42 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 85 W 8.35 4.28 0.00 3.32 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 E 8.43 3.71 0.00 2.11 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.61 0.00 87 S 8.04 4.20 0.00 4.03 4.01 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 88 L 7.31 4.34 0.00 1.63 1.64 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 89 Q 7.01 3.94 0.00 1.76 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 7.02 0.00 0.00 0.00 0.00 0.00 1.79 1.46 0.00 90 K 8.55 4.11 0.00 1.70 1.85 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.41 1.40 7.81 91 E 7.73 4.66 0.00 1.88 1.86 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 2.19 2.20 0.00 92 W 9.00 4.24 0.00 3.29 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 K 7.31 4.04 0.00 1.33 1.43 0.00 1.55 0.00 0.00 1.37 0.00 0.00 3.07 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.36 1.43 7.81 94 E 7.63 3.12 0.00 1.85 1.76 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 2.57 2.40 0.00 95 T 8.36 3.86 4.64 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 1.40 0.00 0.00 96 L 8.03 3.88 0.00 1.83 1.71 1.03 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.80 3.96 0.00 1.95 1.90 0.00 1.65 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.45 7.81 98 V 7.73 3.65 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 1.18 0.00 0.00 99 L 8.00 3.78 0.00 1.30 0.52 0.77 0.83 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 0.00 100 R 7.88 4.00 0.00 1.97 2.04 0.00 3.17 0.00 0.00 3.21 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 101 H 8.37 3.67 0.00 2.21 2.77 0.00 5.83 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 0.00 102 H 8.17 4.03 0.00 3.17 3.31 0.00 5.67 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 Q 8.09 4.02 0.00 2.39 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.96 0.00 0.00 0.00 0.00 0.00 2.51 2.65 0.00 104 E 8.37 4.22 0.00 2.02 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.47 0.00 105 K 7.85 3.80 0.00 1.64 1.83 0.00 1.45 0.00 0.00 1.50 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.37 7.81 106 L 7.65 4.16 0.00 1.86 1.74 0.97 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 107 E 7.81 4.51 0.00 2.11 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 108 A 7.49 4.39 1.21 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 0.00 0.00 *147 A 8.04 4.23 1.31 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 0.00 0.00 0.00 0.00 0.00 0.00 148 V 7.56 4.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.93 0.00 0.00 149 P 0.00 4.62 0.00 2.02 2.04 0.00 3.72 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.36 0.00 150 K 9.10 4.94 0.00 1.74 1.76 0.00 1.74 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.41 7.81 151 V 9.06 4.67 2.15 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 0.95 0.00 0.00 0.96 0.00 0.00 152 K 9.18 4.80 0.00 1.62 1.71 0.00 1.78 0.00 0.00 1.66 0.00 0.00 2.78 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.42 7.81 153 L 8.65 4.62 0.00 1.83 1.69 1.04 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 154 L 8.94 5.08 0.00 1.54 1.28 -0.14 0.56 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 0.00 155 C 8.82 4.55 0.00 2.92 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 0.00 156 G 8.28 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 A 8.43 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 D 7.92 4.18 0.00 2.56 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 0.00 159 L 7.66 4.05 0.00 1.66 1.64 1.04 0.46 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 0.00 160 L 7.16 2.82 0.00 1.35 1.44 0.63 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 161 E 7.76 2.54 0.00 1.75 1.53 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 1.47 1.74 0.00 162 S 7.60 4.34 0.00 4.29 4.34 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.69 4.23 0.00 3.22 3.10 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 0.00 164 A 8.17 4.67 1.58 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 0.00 0.00 0.00 0.00 0.00 0.00 165 V 7.75 3.72 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.06 0.00 0.00 166 P 0.00 4.45 0.00 2.11 2.05 0.00 3.88 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.19 0.00 167 N 9.09 4.48 0.00 2.90 3.00 0.00 0.00 7.05 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 L 8.08 4.09 0.00 1.70 2.09 0.79 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 169 W 7.95 5.10 0.00 3.19 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.81 4.27 0.00 1.91 2.13 0.00 1.75 0.00 0.00 1.93 0.00 0.00 3.16 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.60 1.53 7.81 171 S 9.14 4.12 0.00 4.04 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 0.00 172 E 8.18 4.10 0.00 2.11 2.06 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 2.42 2.48 0.00 173 D 8.41 4.36 0.00 3.10 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 0.00 174 I 7.71 3.21 1.79 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.06 0.53 0.51 0.00 0.00 175 T 7.72 3.82 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 176 Q 8.23 4.05 0.00 2.18 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.82 0.00 0.00 0.00 0.00 0.00 2.41 2.53 0.00 177 I 8.20 3.94 2.04 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.10 1.03 0.00 0.00 178 V 7.71 3.71 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 0.98 0.00 0.00 179 A 7.96 4.05 1.10 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 0.00 180 N 8.25 4.54 0.00 2.54 2.38 0.00 0.00 6.84 7.45 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 0.00 181 Y 8.72 4.42 0.00 3.24 3.02 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 0.00 182 G 7.44 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 L 8.61 5.28 0.00 1.56 1.47 0.89 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 184 I 9.04 4.66 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 1.07 0.71 0.82 0.00 0.00 185 C 8.95 4.91 0.00 2.82 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.30 4.44 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 0.75 0.00 0.00 0.82 0.00 0.00 187 T 8.03 4.17 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 1.15 0.00 0.00 188 R 8.79 4.11 0.00 1.75 1.87 0.00 3.16 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 189 A 8.06 4.48 1.21 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 0.00 0.00 190 G 8.14 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.98 4.37 0.00 2.75 2.82 0.00 0.00 6.87 8.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 D 7.84 4.30 0.00 2.74 2.74 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 0.00 193 A 7.72 3.99 1.30 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 0.00 194 Q 9.04 4.01 0.00 1.98 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.76 0.00 0.00 0.00 0.00 0.00 2.59 2.56 0.00 195 K 7.91 4.10 0.00 2.09 2.08 0.00 1.70 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.58 1.57 7.81 196 F 8.13 4.07 0.00 3.19 3.25 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.39 3.95 2.19 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.26 1.01 0.00 0.00 198 Y 8.20 4.49 0.00 3.12 3.32 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 0.00 199 E 8.14 3.99 0.00 1.79 1.80 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 2.26 2.60 0.00 200 S 7.42 4.47 0.00 3.57 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 D 8.85 4.46 0.00 2.78 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 V 7.63 3.68 2.10 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 0.79 0.00 0.00 0.98 0.00 0.00 203 L 8.00 4.19 0.00 1.80 1.85 1.16 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 204 W 8.67 3.97 0.00 3.60 3.14 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 0.00 205 K 8.29 3.94 0.00 1.88 2.04 0.00 1.82 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.08 1.43 7.81 206 H 7.75 4.84 0.00 3.24 3.25 0.00 5.69 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 R 7.94 4.07 0.00 1.68 1.85 0.00 2.21 0.00 0.00 2.25 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.25 0.00 208 S 7.90 4.12 0.00 3.98 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 0.00 209 N 8.57 4.85 0.00 2.78 2.93 0.00 0.00 6.60 7.53 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 0.00 210 I 7.62 4.83 1.81 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.76 0.87 0.00 0.00 211 H 8.97 4.77 0.00 2.95 3.17 0.00 5.60 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 V 8.24 4.24 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.87 0.00 0.00 213 V 8.51 3.89 1.84 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 0.83 0.00 0.00 0.31 0.00 0.00 214 N 8.64 4.75 0.00 2.32 1.44 0.00 0.00 6.95 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 E 8.10 4.33 0.00 1.97 1.88 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 2.06 2.11 0.00 216 W 8.71 4.38 0.00 3.34 3.32 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 0.00 217 I 7.74 4.02 1.93 0.00 0.00 0.95 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 0.44 0.95 0.00 0.00 218 A 8.02 4.09 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.55 4.91 0.00 2.80 2.67 0.00 0.00 6.31 8.06 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 0.00 220 D 8.26 4.17 0.00 2.68 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 I 7.43 4.15 1.85 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.65 0.90 0.00 0.00 222 S 7.52 4.26 0.00 4.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 S 8.63 4.08 0.00 3.85 4.06 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 0.00 224 T 7.86 3.79 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 1.18 0.00 0.00 225 K 8.02 4.07 0.00 1.93 1.83 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.45 7.81 226 I 7.48 3.65 1.91 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.82 0.82 0.00 0.00 227 R 8.03 3.70 0.00 1.71 1.87 0.00 3.08 0.00 0.00 3.04 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 1.47 0.00 228 R 7.88 3.86 0.00 1.88 2.04 0.00 3.10 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 229 A 8.08 4.21 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 L 8.06 3.94 0.00 1.90 1.82 1.02 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 231 R 7.93 4.09 0.00 1.94 2.02 0.00 3.22 0.00 0.00 3.36 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.94 0.00 232 R 7.53 4.45 0.00 1.87 1.96 0.00 3.27 0.00 0.00 3.23 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 233 G 8.10 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 Q 8.02 4.42 0.00 2.23 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.94 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 235 S 8.39 4.33 0.00 3.84 3.78 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 0.00 0.00 0.00 236 I 8.05 4.55 1.86 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.56 0.91 0.00 0.00 237 R 7.54 3.80 0.00 1.57 1.59 0.00 3.21 0.00 0.00 2.95 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 238 Y 8.09 3.91 0.00 3.23 3.12 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 0.00 0.00 0.00 0.00 239 L 7.79 4.59 0.00 1.88 1.70 0.94 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 240 V 7.30 4.91 2.11 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 0.82 0.00 0.00 0.93 0.00 0.00 241 P 0.00 4.42 0.00 2.14 1.97 0.00 3.63 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.19 0.00 242 D 8.72 4.34 0.00 2.68 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.92 3.99 0.00 1.67 1.72 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 244 V 7.68 3.66 2.26 0.00 0.00 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 0.94 0.00 0.00 245 Q 8.21 3.98 0.00 2.11 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 246 E 8.54 3.95 0.00 2.07 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.30 0.00 247 Y 8.22 4.00 0.00 3.24 3.13 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 0.00 0.00 0.00 0.00 248 I 8.21 3.77 2.13 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.84 1.07 0.00 0.00 249 E 8.18 3.93 0.00 2.06 2.11 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 2.30 2.31 0.00 250 K 8.13 3.99 0.00 1.70 1.72 0.00 1.72 0.00 0.00 1.49 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.05 1.31 7.81 251 H 7.48 4.57 0.00 2.81 3.06 0.00 5.85 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 252 N 7.88 4.15 0.00 2.70 2.80 0.00 0.00 6.91 7.74 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 0.00 253 L 7.96 3.81 0.00 1.23 0.94 0.94 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 254 Y 7.57 4.74 0.00 2.98 2.87 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.79 4.63 0.00 3.95 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 0.00 256 S 8.63 4.19 0.00 3.87 3.98 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 0.00 257 E 8.12 4.09 0.00 2.03 1.94 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 2.37 2.36 0.00 258 S 8.02 4.18 0.00 4.13 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 0.00 259 E 8.01 4.06 0.00 2.22 2.15 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 2.34 2.41 0.00 260 D 7.91 4.55 0.00 2.89 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 0.00 261 R 7.39 4.05 0.00 1.96 1.86 0.00 3.25 0.00 0.00 3.47 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 262 N 9.03 4.27 0.00 2.88 2.98 0.00 0.00 6.98 7.10 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 0.00 263 A 7.85 4.12 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.75 3.86 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 0.00 0.00 0.00 265 V 7.48 4.28 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 0.74 0.00 0.00 0.89 0.00 0.00 266 I 7.92 3.96 1.79 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.60 0.84 0.00 0.00 267 L 8.22 3.53 0.00 1.44 1.22 -0.08 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 268 A 7.88 3.79 1.06 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 0.00 0.00 269 P 0.00 4.08 0.00 1.86 1.83 0.00 3.04 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.44 0.00 270 L 7.49 3.86 0.00 1.70 1.63 0.83 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 271 Q 7.94 3.89 0.00 2.09 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 272 R 8.18 3.98 0.00 1.95 2.03 0.00 3.63 0.00 0.00 3.32 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 273 N 8.47 4.63 0.00 2.88 2.89 0.00 0.00 7.07 7.39 0.00 0.00 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 T 8.04 4.01 4.31 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 0.00 0.00 0.00 1.21 0.00 0.00 275 A 7.67 4.24 1.31 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 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.