NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 L 4.1821 8.1849 120.6327 54.6260 43.5942 177.2906 5 I 3.7343 7.5796 123.1289 58.6056 36.0627 173.7121 6 T 4.5987 8.0527 116.5230 59.4573 71.8311 174.0796 7 E 4.2059 8.7847 120.8592 58.6891 29.7370 176.0246 8 N 5.5475 8.0323 114.5988 51.6426 41.7082 174.0862 9 M 4.9933 8.9846 121.6919 54.0051 36.8033 174.2087 10 H 5.4399 8.8691 117.6502 54.6384 32.6487 173.2412 11 M 5.2626 8.9944 118.7221 53.6571 36.5507 174.6233 12 K 4.9420 8.7380 120.2969 54.5367 36.2650 175.0888 13 L 5.3084 8.4702 124.7216 53.5271 46.1846 174.5789 14 Y 5.3619 8.9296 121.2951 56.5107 41.8729 174.2980 15 M 5.7453 9.2799 122.1245 53.1140 36.3444 173.3633 16 E 4.6477 8.8596 124.5638 53.9137 33.8329 175.3642 17 G 3.9231 6.1699 109.9927 46.3247 0.0000 171.0644 18 T 5.1878 7.7486 114.5457 60.5204 70.9786 173.8637 19 V 4.6228 8.2184 126.2911 62.4813 34.2206 175.3117 20 N 4.2465 9.8952 125.6189 54.6482 36.6425 174.2648 21 N 4.1975 8.3276 108.9080 54.4164 36.2702 174.3496 22 H 4.8666 8.3284 117.2617 54.1733 29.6046 173.6377 23 H 5.2612 8.9279 125.1782 55.9826 31.3763 173.8449 24 F 5.3515 7.6275 116.9450 55.9115 41.2571 172.8213 25 K 5.0944 9.1471 119.0090 55.0438 36.2621 175.1782 26 C 5.7305 9.3881 120.9826 58.2731 32.4265 173.1588 27 T 5.3209 8.8277 111.8028 60.1848 72.0120 172.8697 28 S 5.2026 8.7941 116.2090 57.1981 67.1383 172.5130 29 E 5.1118 8.9754 119.5965 55.1155 33.9720 175.0469 30 G 4.6318 8.7156 108.0209 47.1720 0.0000 171.5253 31 E 5.1583 8.0991 116.3403 55.5790 33.6508 174.4092 32 G 4.3322 8.7728 106.1759 46.0616 0.0000 172.2462 33 K 4.8644 9.2406 119.1464 52.7010 33.1901 175.6214 34 P 3.9949 0.0000 0.0000 65.7517 31.3229 177.8734 35 Y 4.2857 7.9454 112.4806 59.7186 38.1281 176.1341 36 E 4.3516 8.3552 117.7365 55.9496 30.6251 176.3720 37 G 4.4331 8.4213 107.5976 46.4339 0.0000 172.7667 38 T 5.2716 7.5555 108.5697 59.8054 72.0677 172.6662 39 Q 4.7850 7.9301 118.5321 55.8367 32.4345 172.9205 40 T 4.9920 8.5365 117.2068 62.0531 72.8113 172.3734 41 M 4.8785 9.0890 126.1335 53.7254 35.1190 174.3249 42 R 4.8021 9.3233 125.5369 54.5185 32.7280 175.0527 43 I 4.8911 8.2243 125.1092 59.2501 40.7526 174.7293 44 K 5.1706 9.1180 125.6865 54.5871 35.3888 175.3158 45 V 4.5589 8.7099 125.2097 62.6253 31.5647 175.9434 46 V 4.4424 9.1239 121.2418 61.7722 33.3948 175.8860 47 E 4.7051 7.8941 118.8667 55.6867 33.8747 176.8490 48 G 4.3693 8.6982 109.0307 46.1718 0.0000 173.9622 49 G 4.0117 7.6661 107.8466 43.1320 0.0000 172.0555 50 P 4.2455 0.0000 0.0000 62.1102 32.1138 176.8765 51 L 4.0204 8.2835 123.3644 54.4774 41.9793 175.5376 52 P 4.5593 0.0000 0.0000 62.5693 31.3964 175.0259 53 F 4.9672 6.6376 111.6868 54.7781 41.3927 173.9725 54 A 4.0728 8.9277 124.7157 51.7891 18.4765 178.5547 55 F 3.9639 8.7125 124.9701 61.4653 39.3367 176.8199 56 D 4.7250 8.5543 118.4279 57.5524 40.3140 178.4178 57 I 4.5309 7.7613 111.2239 62.6413 38.2468 177.0726 58 L 4.3871 8.0487 120.1326 54.9757 41.8741 177.9522 59 A 4.3138 7.7875 122.5197 55.7732 18.2566 179.5669 60 T 3.9566 7.7643 104.8793 63.7167 69.0292 175.7056 61 S 4.7418 7.8655 117.3712 59.7728 63.8683 174.0152 62 F 4.5346 8.0662 121.7448 57.3117 39.4067 176.4592 *66 S 4.2111 7.6224 112.1844 58.1603 63.2649 174.5035 67 K 3.7814 8.0255 120.2038 59.4087 32.4268 179.3453 68 T 4.1057 8.4090 114.7420 66.1002 69.1410 174.6630 69 F 4.6165 8.2030 121.6913 57.1827 38.4682 175.3753 70 I 4.8365 7.2185 120.2526 59.2835 40.0638 177.0316 71 N 4.4185 9.2607 126.4163 54.1205 39.0913 173.3639 72 H 4.5290 8.7414 124.0633 56.1664 27.8085 176.3224 73 T 3.7390 8.2916 119.0280 66.7994 68.0191 177.1891 74 Q 4.2065 9.1794 127.0862 57.3991 28.0068 176.2919 75 G 4.0298 7.9492 108.4221 45.8360 0.0000 171.7873 76 I 3.4653 7.1879 121.8198 60.0538 37.3328 174.7840 77 P 4.0552 0.0000 0.0000 62.6801 31.5705 176.2801 78 D 4.2103 8.4419 123.3748 52.9804 41.1460 176.1741 79 F 3.8932 8.3587 129.8024 60.8574 39.5127 176.3010 80 F 3.9369 7.8261 116.8170 59.8663 39.1311 178.0460 81 K 4.4408 8.5089 118.1188 59.7015 31.7158 179.3771 82 Q 4.0701 7.8324 117.1175 59.0294 28.8091 178.7836 83 S 4.0617 7.4925 113.2943 58.8678 62.9783 174.0297 84 F 4.8208 7.3328 121.1044 56.0527 39.6755 174.1676 85 P 4.7827 0.0000 0.0000 64.7080 32.0980 177.2895 86 E 3.9560 8.3752 118.6315 59.7277 29.7375 175.9838 87 G 3.3563 8.6612 103.3932 43.9089 0.0000 171.6265 88 F 5.4929 7.7296 112.4903 55.9789 41.9872 173.2377 89 T 5.3107 9.2846 109.2192 59.6798 72.2844 172.8087 90 W 5.8735 8.7128 118.2709 54.9884 32.2777 173.7522 91 E 5.2905 9.3558 120.4372 54.7757 33.0316 174.9373 92 R 5.2549 9.3698 123.3434 54.5498 34.3705 173.8867 93 V 4.9220 8.8829 124.4209 60.1838 34.5893 174.3206 94 T 4.9725 8.8504 121.1415 61.9745 71.5584 172.9766 95 T 4.9654 8.6550 123.3865 61.9652 71.4249 172.8364 96 Y 4.7524 9.1465 124.9983 56.5730 39.3162 176.9718 97 E 4.0918 9.1459 123.7525 58.4368 29.7179 177.4424 98 D 4.8273 9.5792 116.9496 52.1577 39.9995 175.3633 99 G 3.4880 8.0486 115.3390 46.0472 0.0000 175.1299 100 G 2.1080 7.4900 109.8227 45.3666 0.0000 172.2798 101 V 4.9155 8.1451 124.5093 60.8057 34.4341 174.0305 102 L 5.3564 9.5060 130.1460 53.7187 44.5074 175.1711 103 T 5.1982 8.7581 117.1773 60.9460 71.3295 173.7270 104 A 5.2196 8.5106 123.1905 51.2055 23.2951 175.4095 105 T 4.7600 8.5960 111.1154 59.9992 72.7917 172.8200 106 Q 4.5843 8.1723 123.6211 54.6998 32.9715 172.3910 107 D 5.0502 8.8628 126.2795 52.7818 43.6340 174.6307 108 T 5.3392 8.6688 123.3074 61.9198 70.9218 173.7465 109 S 5.0165 9.1812 119.8280 56.7465 67.4198 172.2687 110 L 5.1337 8.6263 121.8656 53.3625 44.2953 175.4416 111 Q 4.3478 9.2348 126.7084 56.0540 32.6161 174.1932 112 D 4.3437 9.8487 125.4405 55.6966 38.2760 174.0833 113 G 3.9188 8.0569 101.9235 46.0378 0.0000 171.7491 114 C 4.8364 8.4601 120.2974 57.0892 34.8768 172.9845 115 L 4.6739 8.6186 126.5329 54.5642 42.7820 175.7605 116 I 4.7661 9.2154 125.1357 59.6863 40.0496 174.0365 117 Y 5.5360 8.9346 125.1887 56.2414 40.8234 174.2226 118 N 5.5244 9.0891 122.5820 51.8640 42.0457 173.1203 119 V 4.7487 8.7733 125.6668 60.9774 35.4204 174.2320 120 K 5.0686 8.7543 125.5723 54.6520 36.1006 175.2042 121 I 5.0835 8.5058 124.1304 59.5181 41.3480 174.7082 122 R 4.6748 9.5405 126.1495 54.8379 33.1799 173.6941 123 G 4.7173 9.5572 114.9211 44.6433 0.0000 172.0566 124 V 4.8644 8.4864 117.1261 59.8798 36.4553 175.5088 125 N 4.2892 8.9724 117.2761 54.3540 37.1892 173.8591 126 F 4.0458 8.1406 115.3602 56.0652 39.3911 173.6812 127 P 4.3121 0.0000 0.0000 63.0338 31.6289 177.6179 128 S 4.2574 8.8424 117.6591 60.6668 63.2778 174.4871 129 N 4.9387 8.1049 117.5554 53.0088 39.0995 174.9907 130 G 4.2070 7.5593 104.5640 42.0829 0.0000 172.6564 131 P 4.2594 0.0000 0.0000 65.2170 30.9604 178.9417 132 V 3.5158 7.6300 118.1752 66.3446 31.4638 177.6938 133 M 4.1886 7.9305 116.3913 57.8618 32.0639 177.6214 134 Q 4.2635 8.1696 115.8046 54.7116 29.6957 175.6458 135 K 3.8122 7.9300 118.0243 57.9791 30.1135 175.5363 136 K 4.7734 8.2267 114.1220 56.6005 31.9455 177.0748 137 T 4.9514 7.7614 108.4101 59.6375 72.1390 174.3619 138 L 4.6396 8.6980 120.9050 54.5082 44.0534 177.0807 139 G 3.8403 8.2910 105.4602 44.6320 0.0000 172.6555 140 W 5.3150 8.1021 117.8406 55.0599 30.8108 176.6793 141 E 4.4747 9.0493 122.7830 55.6310 29.9628 176.5446 142 A 4.3913 8.7416 123.5029 53.0839 19.1787 176.7488 143 S 4.8055 8.8322 113.7187 56.8936 67.5229 172.8768 144 T 5.0315 8.2554 115.6379 61.7492 71.1196 173.5928 145 E 4.4604 9.0285 128.3724 55.7955 31.5816 174.5555 146 M 4.8399 9.1758 126.5051 53.8334 34.5641 174.3569 147 L 5.3350 8.4362 126.3815 53.0468 45.2357 175.1204 148 Y 5.2816 8.2544 120.2019 54.5342 41.6659 172.6187 149 P 4.7771 0.0000 0.0000 63.0456 32.7248 176.1551 150 A 4.2313 9.6095 126.2794 52.0668 21.4067 176.2079 151 D 4.3029 9.9361 125.2647 55.0010 38.1550 174.8548 152 G 4.0080 8.8877 105.6462 45.9869 0.0000 172.2818 153 G 4.2555 8.3270 105.9217 44.8538 0.0000 171.0659 154 L 4.9610 7.6490 117.9154 52.8321 44.6338 176.0562 155 E 4.8526 8.2481 121.4825 54.5292 32.8053 175.2596 156 G 4.6113 8.7985 108.3004 44.7216 0.0000 171.7717 157 R 5.3056 8.7503 119.5515 54.6057 34.7511 174.2636 158 S 4.8060 8.4658 115.2900 57.4926 66.4677 172.7600 159 D 5.4651 8.6428 124.1006 52.8049 43.4429 175.3540 160 M 4.9676 9.1330 121.5398 53.4056 36.6778 174.1985 161 A 5.1833 8.8524 123.3947 50.2359 21.9080 174.8336 162 L 4.1552 9.4097 126.3737 53.5875 43.5823 176.1565 163 K 4.3444 8.9546 127.1127 56.5916 33.1358 175.9442 164 L 4.9774 8.4675 124.4299 52.5244 44.3556 176.1991 165 V 3.4062 7.8673 122.7934 64.1419 31.9570 176.0909 166 G 3.6604 8.8843 116.0999 46.2202 0.0000 172.7119 167 G 3.8004 8.2827 109.9434 44.9343 0.0000 174.4798 168 G 3.9615 9.1534 104.9096 44.8541 0.0000 171.8875 169 H 5.3363 8.0656 114.1076 53.8920 32.8238 173.0343 170 L 4.5573 8.9130 125.0868 54.1897 43.6415 175.3240 171 I 5.1020 8.4441 126.9142 60.3955 39.4839 174.3288 172 C 5.1249 9.2039 119.6383 56.6862 33.7727 171.9783 173 N 5.3371 8.7011 117.5869 51.7482 41.7143 172.8135 174 L 5.0972 8.8647 125.3806 52.8390 44.9785 175.5314 175 K 4.7832 8.9758 122.2763 55.0270 35.2427 175.3007 176 T 4.9639 8.7048 121.7271 61.8220 72.1879 173.2623 177 T 4.6956 8.7766 121.5127 61.9099 71.7653 172.5694 178 Y 5.4161 8.9533 124.4962 56.3983 40.6843 174.8794 179 R 5.1280 9.0637 123.3781 54.3638 33.1882 175.3654 180 S 4.5725 9.1079 118.9499 58.2577 62.8923 173.9157 181 K 4.3670 8.6143 123.7914 57.2903 32.6582 177.8046 182 K 4.1330 7.6657 119.5176 55.3349 32.8155 175.0695 183 P 4.4762 0.0000 0.0000 61.9376 32.5472 176.8990 184 A 3.9697 8.7740 123.1253 55.5442 18.4610 179.9732 185 K 3.9227 8.1025 115.3638 59.7335 32.2720 177.5542 186 N 4.5417 8.1583 113.7614 54.4158 38.5951 174.7320 187 L 4.7476 7.4523 118.5750 52.4808 44.0962 175.7047 188 K 4.3164 9.3429 125.5001 55.3494 32.6619 175.7192 189 M 4.4593 8.4038 126.5426 53.4820 33.1674 174.5044 190 P 4.5960 0.0000 0.0000 62.1755 32.8409 175.7320 191 G 4.0623 8.0282 107.1451 44.4748 0.0000 172.9376 192 V 4.0296 8.4419 120.1123 63.8572 32.1066 176.0525 193 Y 4.9733 8.6383 124.9620 56.0049 42.1660 173.0937 194 Y 5.1024 9.1157 115.0338 56.3582 42.7524 174.9474 195 V 4.7720 8.9241 122.5240 61.3101 34.5656 173.8847 196 D 5.4382 9.0678 128.4061 53.1701 42.8719 175.8098 197 R 5.1754 8.9202 118.3377 54.6945 33.8915 173.9281 198 R 4.7360 8.9433 120.1117 54.6368 33.2377 173.4480 199 L 5.1641 8.7863 128.5730 53.4670 44.0182 175.0596 200 E 4.8495 9.0436 125.7439 54.3979 33.3096 175.4196 201 R 4.3433 8.5616 123.7958 56.0584 30.0587 175.8522 202 I 3.9776 9.0389 129.7000 62.8448 36.9590 176.8509 203 K 4.8085 7.3120 118.8317 54.7317 36.4360 174.1401 204 E 5.0630 8.1327 114.9947 55.8501 31.9647 174.5886 205 A 4.6933 8.5916 123.9719 49.6693 23.2674 174.7864 206 D 4.1728 9.3242 114.7732 55.7960 38.4696 174.2872 207 K 3.4023 8.5367 109.4695 57.8608 29.5379 176.5154 208 E 3.6477 8.1537 115.3674 57.1014 28.7518 174.5062 209 T 4.2894 7.4670 106.1710 62.0174 69.8124 173.3087 210 Y 5.1053 7.5846 123.9517 55.8911 42.1027 174.0138 211 V 4.4470 7.7832 125.0676 60.8539 35.8203 173.2471 212 E 4.7413 8.7505 127.3508 54.2734 32.1799 174.2849 213 Q 5.0441 9.1509 127.9889 54.5315 32.6596 173.4165 214 H 5.4199 9.3658 124.6931 54.4818 33.7893 171.6136 215 E 5.3047 8.7510 123.6851 54.4236 33.6932 174.1384 216 V 4.9533 8.5992 124.7224 59.9160 34.5799 174.4406 217 A 5.1540 8.8479 125.3744 50.5308 22.8145 174.9393 218 V 4.7747 8.8810 122.1808 60.9959 33.6516 174.5032 219 A 5.0316 8.8696 130.2780 51.5640 20.2374 176.2397 220 R 4.8360 9.5290 116.9121 54.5755 33.2278 174.5193 221 Y 5.0912 8.4461 118.9179 57.7675 39.1000 175.2634 222 C 4.2223 9.0650 122.3853 59.7158 31.7508 173.3153 223 D 4.6329 8.6511 126.5899 54.3899 39.9088 176.8954 224 L 4.0921 7.7247 120.5360 53.8588 42.1773 175.1384 225 P 4.3876 0.0000 0.0000 62.9626 31.7801 175.4918 226 S 4.6405 8.2217 113.8326 56.4878 64.6991 174.0645 227 K 4.3279 8.7350 124.7036 57.2370 31.8266 176.9869 228 L 4.2923 7.9044 125.3046 55.0593 42.7292 175.9744 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 4 L 8.18 4.18 0.00 1.67 1.77 1.01 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 5 I 7.58 3.73 1.82 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 -0.00 0.53 0.00 0.00 6 T 8.05 4.60 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 1.23 0.00 0.00 7 E 8.78 4.21 0.00 2.09 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 2.40 2.46 0.00 8 N 8.03 5.55 0.00 2.64 2.70 0.00 0.00 6.66 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 9 M 8.98 4.99 0.00 1.94 1.94 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.71 0.00 10 H 8.87 5.44 0.00 3.11 3.20 0.00 5.75 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 M 8.99 5.26 0.00 1.31 1.74 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.64 0.00 12 K 8.74 4.94 0.00 1.53 1.37 0.00 1.59 0.00 0.00 1.58 0.00 0.00 2.78 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.28 7.81 13 L 8.47 5.31 0.00 1.90 1.56 1.25 1.05 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 14 Y 8.93 5.36 0.00 2.94 2.85 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 0.00 0.00 0.00 0.00 15 M 9.28 5.75 0.00 2.13 1.78 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 16 E 8.86 4.65 0.00 1.96 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 2.17 2.23 0.00 17 G 6.17 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 18 T 7.75 5.19 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 1.25 0.00 0.00 19 V 8.22 4.62 1.15 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 0.11 0.00 0.00 0.22 0.00 0.00 20 N 9.90 4.25 0.00 2.89 2.89 0.00 0.00 7.11 8.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.33 4.20 0.00 2.83 2.87 0.00 0.00 7.06 8.16 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 22 H 8.33 4.87 0.00 3.52 3.44 0.00 5.81 0.00 0.00 0.00 0.00 6.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 8.93 5.26 0.00 3.23 3.24 0.00 5.74 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 F 7.63 5.35 0.00 3.32 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 25 K 9.15 5.09 0.00 1.76 1.76 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.25 1.38 7.81 26 C 9.39 5.73 0.00 3.21 3.24 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 0.00 27 T 8.83 5.32 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 1.37 0.00 0.00 28 S 8.79 5.20 0.00 4.04 4.12 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 29 E 8.98 5.11 0.00 1.86 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 2.22 2.40 0.00 30 G 8.72 4.63 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 0.00 0.00 0.00 31 E 8.10 5.16 0.00 1.97 1.85 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 0.00 2.22 2.22 0.00 32 G 8.77 4.33 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 0.00 0.00 0.00 33 K 9.24 4.86 0.00 1.74 1.84 0.00 1.84 0.00 0.00 1.88 0.00 0.00 2.91 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.30 7.81 34 P 0.00 3.99 0.00 1.46 1.64 0.00 3.86 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 1.87 1.22 0.00 35 Y 7.95 4.29 0.00 2.97 3.03 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 0.00 0.00 0.00 36 E 8.36 4.35 0.00 2.04 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 2.32 2.39 0.00 37 G 8.42 4.43 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 0.00 38 T 7.56 5.27 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 1.27 0.00 0.00 39 Q 7.93 4.79 0.00 1.47 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 40 T 8.54 4.99 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 1.25 0.00 0.00 41 M 9.09 4.88 0.00 1.99 1.88 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.63 0.00 42 R 9.32 4.80 0.00 1.86 1.85 0.00 3.22 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.54 0.00 43 I 8.22 4.89 1.48 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.55 0.93 0.00 0.00 44 K 9.12 5.17 0.00 1.76 1.78 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.64 1.54 7.81 45 V 8.71 4.56 2.17 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 0.94 0.00 0.00 1.16 0.00 0.00 46 V 9.12 4.44 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 0.82 0.00 0.00 1.04 0.00 0.00 47 E 7.89 4.71 0.00 1.93 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 2.36 2.37 0.00 48 G 8.70 4.37 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 0.00 0.00 0.00 49 G 7.67 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 0.00 0.00 0.00 50 P 0.00 4.25 0.00 2.01 2.12 0.00 3.68 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 51 L 8.28 4.02 0.00 1.09 0.37 0.53 0.95 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 52 P 0.00 4.56 0.00 2.04 2.04 0.00 3.64 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 1.70 1.85 0.00 53 F 6.64 4.97 0.00 3.02 2.88 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 54 A 8.93 4.07 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 55 F 8.71 3.96 0.00 3.29 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 56 D 8.55 4.72 0.00 2.74 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 57 I 7.76 4.53 1.97 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.44 0.86 0.00 0.00 58 L 8.05 4.39 0.00 1.44 1.61 0.30 0.98 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 59 A 7.79 4.31 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 T 7.76 3.96 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 0.76 0.00 0.00 61 S 7.87 4.74 0.00 3.96 3.96 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 62 F 8.07 4.53 0.00 3.23 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 *66 S 7.62 4.21 0.00 3.94 3.96 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 67 K 8.03 3.78 0.00 1.14 0.74 0.00 1.45 0.00 0.00 1.32 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 0.71 7.81 68 T 8.41 4.11 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 1.00 0.00 0.00 69 F 8.20 4.62 0.00 3.13 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 70 I 7.22 4.84 1.93 0.00 0.00 0.62 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 0.61 0.88 0.00 0.00 71 N 9.26 4.42 0.00 2.90 2.77 0.00 0.00 6.86 7.43 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 72 H 8.74 4.53 0.00 3.12 3.35 0.00 5.98 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 8.29 3.74 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 1.22 0.00 0.00 74 Q 9.18 4.21 0.00 2.20 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.25 0.00 0.00 0.00 0.00 0.00 2.49 2.43 0.00 75 G 7.95 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 76 I 7.19 3.47 1.53 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.17 0.33 -0.01 0.00 0.00 77 P 0.00 4.06 0.00 2.06 2.00 0.00 3.58 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.07 0.00 78 D 8.44 4.21 0.00 2.57 2.50 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 79 F 8.36 3.89 0.00 2.64 2.17 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 80 F 7.83 3.94 0.00 3.23 2.80 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 81 K 8.51 4.44 0.00 1.83 1.90 0.00 1.52 0.00 0.00 1.14 0.00 0.00 2.13 0.00 0.00 2.49 0.00 0.00 0.00 0.00 1.36 1.53 7.81 82 Q 7.83 4.07 0.00 1.95 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.95 0.00 0.00 0.00 0.00 0.00 2.37 2.51 0.00 83 S 7.49 4.06 0.00 3.71 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.33 4.82 0.00 3.11 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 85 P 0.00 4.78 0.00 2.25 2.26 0.00 3.82 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 2.01 2.03 0.00 86 E 8.38 3.96 0.00 1.89 2.04 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 2.30 2.38 0.00 87 G 8.66 3.36 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 0.00 0.00 0.00 0.00 88 F 7.73 5.49 0.00 3.27 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 89 T 9.28 5.31 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 1.21 0.00 0.00 90 W 8.71 5.87 0.00 3.31 3.52 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 91 E 9.36 5.29 0.00 1.90 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 2.22 0.00 92 R 9.37 5.25 0.00 1.94 1.98 0.00 2.91 0.00 0.00 3.06 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 93 V 8.88 4.92 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 0.66 0.00 0.00 0.94 0.00 0.00 94 T 8.85 4.97 4.43 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 0.99 0.00 0.00 95 T 8.65 4.97 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 1.19 0.00 0.00 96 Y 9.15 4.75 0.00 2.97 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 97 E 9.15 4.09 0.00 2.03 2.04 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 2.36 2.43 0.00 98 D 9.58 4.83 0.00 2.79 2.78 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 99 G 8.05 3.49 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 G 7.49 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 0.00 0.00 0.00 0.00 0.00 0.00 101 V 8.15 4.92 2.05 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 0.95 0.00 0.00 0.88 0.00 0.00 102 L 9.51 5.36 0.00 2.12 1.80 0.92 0.77 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 0.00 103 T 8.76 5.20 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 1.24 0.00 0.00 104 A 8.51 5.22 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 0.00 105 T 8.60 4.76 4.09 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 0.00 0.00 0.00 1.15 0.00 0.00 106 Q 8.17 4.58 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.81 0.00 0.00 0.00 0.00 0.00 2.03 1.96 0.00 107 D 8.86 5.05 0.00 2.66 2.44 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 0.00 108 T 8.67 5.34 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 1.27 0.00 0.00 109 S 9.18 5.02 0.00 3.90 3.93 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 0.00 110 L 8.63 5.13 0.00 1.79 1.71 0.69 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 111 Q 9.23 4.35 0.00 2.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.93 0.00 0.00 0.00 0.00 0.00 2.26 2.48 0.00 112 D 9.85 4.34 0.00 2.78 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 0.00 113 G 8.06 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 0.00 114 C 8.46 4.84 0.00 2.90 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 0.00 115 L 8.62 4.67 0.00 1.69 1.32 0.97 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 116 I 9.22 4.77 1.93 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 1.39 1.25 1.09 0.00 0.00 117 Y 8.93 5.54 0.00 2.90 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 0.00 118 N 9.09 5.52 0.00 2.88 2.63 0.00 0.00 6.23 7.86 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 0.00 119 V 8.77 4.75 1.96 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 0.80 0.00 0.00 0.87 0.00 0.00 120 K 8.75 5.07 0.00 1.61 1.55 0.00 1.57 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.26 1.30 7.81 121 I 8.51 5.08 2.05 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 1.14 1.29 1.07 0.00 0.00 122 R 9.54 4.67 0.00 1.78 1.76 0.00 3.05 0.00 0.00 3.18 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 123 G 9.56 4.72 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 0.00 0.00 0.00 124 V 8.49 4.86 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 0.75 0.00 0.00 0.94 0.00 0.00 125 N 8.97 4.29 0.00 2.79 2.77 0.00 0.00 7.03 7.02 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 0.00 126 F 8.14 4.05 0.00 3.14 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 0.00 127 P 0.00 4.31 0.00 2.21 2.02 0.00 3.66 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.16 0.00 128 S 8.84 4.26 0.00 4.01 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 0.00 129 N 8.10 4.94 0.00 2.71 2.86 0.00 0.00 6.71 7.65 0.00 0.00 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 G 7.56 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 0.00 0.00 0.00 0.00 131 P 0.00 4.26 0.00 2.25 2.31 0.00 3.72 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.03 0.00 132 V 7.63 3.52 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 0.71 0.00 0.00 0.75 0.00 0.00 133 M 7.93 4.19 0.00 2.07 2.38 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.69 0.00 134 Q 8.17 4.26 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 135 K 7.93 3.81 0.00 1.85 1.82 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.22 1.39 7.81 136 K 8.23 4.77 0.00 1.58 1.73 0.00 1.60 0.00 0.00 1.67 0.00 0.00 3.11 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.55 1.48 7.81 137 T 7.76 4.95 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 1.16 0.00 0.00 138 L 8.70 4.64 0.00 1.39 1.58 0.88 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 139 G 8.29 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 0.00 140 W 8.10 5.31 0.00 3.25 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 0.00 141 E 9.05 4.47 0.00 1.99 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 2.59 2.46 0.00 142 A 8.74 4.39 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 0.00 143 S 8.83 4.81 0.00 3.84 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 0.00 144 T 8.26 5.03 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 1.32 0.00 0.00 145 E 9.03 4.46 0.00 1.98 1.71 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 2.20 2.31 0.00 146 M 9.18 4.84 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.40 0.00 147 L 8.44 5.33 0.00 0.63 1.11 0.50 0.32 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 0.00 148 Y 8.25 5.28 0.00 2.94 2.85 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 0.00 0.00 0.00 0.00 149 P 0.00 4.78 0.00 2.10 2.09 0.00 3.91 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 150 A 9.61 4.23 1.13 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 0.00 0.00 151 D 9.94 4.30 0.00 2.90 2.78 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 0.00 152 G 8.89 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 0.00 0.00 0.00 153 G 8.33 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 0.00 0.00 0.00 0.00 154 L 7.65 4.96 0.00 1.26 1.28 0.42 0.76 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 0.00 155 E 8.25 4.85 0.00 1.16 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 2.01 1.94 0.00 156 G 8.80 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 R 8.75 5.31 0.00 1.76 1.79 0.00 3.35 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.78 0.00 158 S 8.47 4.81 0.00 3.74 3.54 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 0.00 0.00 0.00 0.00 159 D 8.64 5.47 0.00 2.55 2.52 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 0.00 160 M 9.13 4.97 0.00 1.70 1.68 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 161 A 8.85 5.18 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 0.00 162 L 9.41 4.16 0.00 1.14 1.51 -0.45 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 163 K 8.95 4.34 0.00 1.70 1.62 0.00 1.66 0.00 0.00 1.64 0.00 0.00 3.12 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.50 7.81 164 L 8.47 4.98 0.00 1.67 1.50 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 165 V 7.87 3.41 2.05 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 0.68 0.00 0.00 0.89 0.00 0.00 166 G 8.88 3.66 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 0.00 0.00 0.00 167 G 8.28 3.80 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 0.00 168 G 9.15 3.96 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 0.00 0.00 0.00 169 H 8.07 5.34 0.00 2.97 3.20 0.00 5.89 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 0.00 170 L 8.91 4.56 0.00 1.81 1.60 1.09 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 171 I 8.44 5.10 2.07 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.05 0.99 0.00 0.00 172 C 9.20 5.12 0.00 2.45 2.30 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 0.00 173 N 8.70 5.34 0.00 2.72 2.59 0.00 0.00 7.41 6.30 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 0.00 174 L 8.86 5.10 0.00 1.50 1.39 0.69 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 175 K 8.98 4.78 0.00 1.62 1.65 0.00 1.59 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.35 7.81 176 T 8.70 4.96 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 0.59 0.00 0.00 177 T 8.78 4.70 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 1.17 0.00 0.00 178 Y 8.95 5.42 0.00 2.70 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 0.00 179 R 9.06 5.13 0.00 1.88 1.91 0.00 3.18 0.00 0.00 3.14 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 180 S 9.11 4.57 0.00 3.04 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 0.00 181 K 8.61 4.37 0.00 1.78 1.82 0.00 1.88 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.43 1.42 7.81 182 K 7.67 4.13 0.00 1.63 1.63 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.10 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.62 7.81 183 P 0.00 4.48 0.00 2.20 2.15 0.00 3.69 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.94 0.00 184 A 8.77 3.97 1.34 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 0.00 185 K 8.10 3.92 0.00 1.72 1.85 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.41 7.81 186 N 8.16 4.54 0.00 2.93 2.82 0.00 0.00 6.88 7.25 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 0.00 187 L 7.45 4.75 0.00 1.52 1.50 0.71 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 188 K 9.34 4.32 0.00 1.65 1.82 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.40 7.81 189 M 8.40 4.46 0.00 2.07 1.99 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.51 0.00 190 P 0.00 4.60 0.00 2.21 1.98 0.00 3.76 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 2.07 2.02 0.00 191 G 8.03 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 0.00 0.00 0.00 192 V 8.44 4.03 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 0.69 0.00 0.00 0.96 0.00 0.00 193 Y 8.64 4.97 0.00 3.21 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 0.00 194 Y 9.12 5.10 0.00 3.01 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 0.00 195 V 8.92 4.77 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 0.99 0.00 0.00 0.88 0.00 0.00 196 D 9.07 5.44 0.00 2.64 2.57 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 0.00 197 R 8.92 5.18 0.00 1.79 1.92 0.00 2.76 0.00 0.00 3.01 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.49 0.00 198 R 8.94 4.74 0.00 1.89 1.81 0.00 3.17 0.00 0.00 3.28 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 199 L 8.79 5.16 0.00 1.65 1.57 0.91 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 200 E 9.04 4.85 0.00 1.97 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.27 0.00 201 R 8.56 4.34 0.00 1.83 1.84 0.00 3.16 0.00 0.00 3.07 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.65 0.00 202 I 9.04 3.98 1.83 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 1.21 0.90 0.89 0.00 0.00 203 K 7.31 4.81 0.00 1.67 1.73 0.00 2.07 0.00 0.00 1.91 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.39 7.81 204 E 8.13 5.06 0.00 1.78 1.67 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 2.03 2.19 0.00 205 A 8.59 4.69 1.26 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 0.00 0.00 206 D 9.32 4.17 0.00 2.83 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 0.00 207 K 8.54 3.40 0.00 1.88 1.87 0.00 1.82 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.39 7.81 208 E 8.15 3.65 0.00 2.05 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 1.95 2.08 0.00 209 T 7.47 4.29 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 1.29 0.00 0.00 210 Y 7.58 5.11 0.00 2.90 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 0.00 211 V 7.78 4.45 1.19 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 0.53 0.00 0.00 -0.12 0.00 0.00 212 E 8.75 4.74 0.00 1.82 1.74 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 2.11 2.10 0.00 213 Q 9.15 5.04 0.00 1.94 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.50 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 214 H 9.37 5.42 0.00 3.20 3.07 0.00 5.78 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 E 8.75 5.30 0.00 1.98 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.20 0.00 216 V 8.60 4.95 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 0.82 0.00 0.00 0.96 0.00 0.00 217 A 8.85 5.15 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 0.00 218 V 8.88 4.77 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 1.04 0.00 0.00 0.95 0.00 0.00 219 A 8.87 5.03 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 9.53 4.84 0.00 1.88 2.03 0.00 2.81 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.77 0.00 221 Y 8.45 5.09 0.00 2.93 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 0.00 222 C 9.07 4.22 0.00 2.99 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 0.00 223 D 8.65 4.63 0.00 2.83 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 0.00 224 L 7.72 4.09 0.00 1.64 1.64 0.88 1.01 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 0.00 225 P 0.00 4.39 0.00 2.17 2.06 0.00 3.70 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 1.98 1.96 0.00 226 S 8.22 4.64 0.00 3.79 3.73 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.73 4.33 0.00 1.76 1.82 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.44 1.52 7.81 228 L 7.90 4.29 0.00 1.57 1.48 0.91 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.