NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 R 4.3086 8.2549 119.7023 55.0903 31.5457 175.0650 5 P 4.0968 0.0000 0.0000 62.1386 31.9080 174.6888 6 R 4.3964 8.5604 120.6974 54.2788 33.5683 175.4841 7 F 4.9558 8.3335 118.1637 55.7183 42.1078 173.9614 8 L 4.8399 9.5368 128.3340 53.0541 44.6893 174.4411 9 E 5.2709 8.9816 126.6029 54.4113 31.8757 174.4696 10 L 4.9967 9.4163 128.9599 53.1649 45.7117 174.6871 11 L 5.2337 8.5884 126.0249 53.2209 45.2210 175.3835 12 K 4.5771 9.1948 125.1792 54.8333 35.3457 175.3219 13 S 5.0574 8.9258 122.0247 57.1943 64.0595 173.2729 14 E 4.7816 9.4713 125.5541 54.7122 32.0121 175.2496 15 C 5.1065 8.6361 120.6342 58.4298 31.0181 172.8763 16 H 4.5809 8.9600 122.2236 53.9209 30.5311 174.0120 17 F 5.2912 8.3811 121.4663 55.5606 41.8405 174.7252 18 F 4.5712 9.0721 121.8631 55.9975 41.9692 174.3943 19 N 4.2838 9.6862 122.6818 54.7747 37.6203 173.7364 20 G 3.9798 7.5496 114.6786 47.0597 0.0000 172.5793 21 T 4.4325 8.1856 113.9538 61.0433 68.8939 175.1711 22 E 3.9931 8.2356 124.1953 59.2919 29.8709 176.7564 23 R 4.6953 8.1263 119.3354 54.4115 32.5865 174.0964 24 V 4.9990 8.5762 125.5501 61.0826 34.7659 174.3532 25 R 4.7178 8.9253 126.9404 54.5223 33.3182 173.3548 26 F 5.5543 9.5509 129.1312 56.6163 41.8367 174.1097 27 L 4.9079 8.7008 125.6779 52.7612 45.2951 174.9328 28 E 4.6527 8.9829 125.7026 54.5351 31.6916 174.5368 29 R 4.8107 8.9214 127.0050 54.4710 33.4750 174.5190 30 Y 4.9263 8.3460 121.2688 56.1737 40.4182 174.7743 31 F 5.5544 9.7212 122.7003 55.9268 43.2595 173.5164 32 H 5.2761 9.6429 122.8394 54.5785 32.2820 173.4571 33 N 4.3874 9.8164 125.8975 54.6916 36.4034 175.4893 34 Q 3.8516 8.3534 113.6657 55.9328 27.4814 173.4948 35 E 4.5871 8.1224 120.1139 54.0440 30.2408 174.4984 36 E 4.1023 9.0262 128.4899 56.0797 30.3083 175.8044 37 F 5.0752 8.6076 120.7505 56.5744 40.7790 175.5396 38 V 4.9819 6.7484 117.2637 60.8420 34.5154 173.0452 39 R 5.3403 8.8871 117.2071 55.4263 33.3495 173.1457 40 F 4.7911 9.2852 122.9951 56.2711 42.1144 173.3452 41 D 5.1605 7.4871 125.1139 52.0687 43.1314 176.4027 42 S 4.1452 9.1338 121.9951 61.4226 62.8606 175.7913 43 D 4.3905 8.7049 120.3860 56.5372 40.9387 177.5072 44 V 3.7438 7.5469 117.5321 64.2392 32.0983 176.8704 45 G 3.9642 9.2384 105.9552 44.9254 0.0000 172.1851 46 E 4.8917 6.7745 115.2157 54.8729 32.4852 174.2861 47 Y 4.6177 9.3445 118.1048 58.1261 38.8046 175.7624 48 R 4.8116 9.1173 121.4911 54.1604 34.2969 174.6575 49 A 4.4483 8.7738 125.6529 52.3294 18.5441 177.3048 50 V 4.1274 8.9338 122.3493 64.1657 32.8320 175.8009 51 T 4.7825 7.6267 108.4907 58.4886 72.2691 173.9703 52 E 3.8920 8.7461 121.4777 59.3547 29.1450 178.4165 53 L 4.0295 8.0544 119.2383 57.2065 42.3331 177.9392 54 G 4.0542 8.1327 104.0084 44.6627 0.0000 175.6108 55 R 3.8948 7.6564 121.2277 59.0389 30.2028 177.1681 56 P 4.1756 0.0000 0.0000 65.2116 31.1990 179.0176 57 V 2.8692 7.3870 116.5104 65.6565 31.4302 177.7686 58 A 3.9430 7.9121 120.7355 55.1445 17.9862 179.4241 59 E 3.8950 7.9345 115.9731 59.5358 29.7262 179.3003 60 S 4.2247 7.8782 112.9806 61.3481 62.4986 176.2928 61 W 4.4192 8.1231 121.7871 59.8449 28.5498 178.1042 62 N 4.7434 8.6126 115.4387 55.1961 38.0696 176.4213 63 S 4.7588 7.7585 114.4914 58.1938 64.6490 175.1833 64 Q 4.4766 7.9374 123.7305 54.0338 28.0760 175.3799 65 K 3.9770 8.4009 126.3524 59.3247 32.4575 177.6018 66 D 4.3609 8.0678 118.9953 56.3182 39.3190 178.2746 67 L 3.8576 7.8155 121.2848 57.8636 42.1732 178.7525 68 L 4.0538 8.0555 118.9135 57.9113 41.3272 179.3824 69 E 3.9842 8.4511 118.1069 59.2457 29.6584 178.9870 70 Q 4.0176 7.8772 119.1278 59.2422 29.2990 178.4908 71 K 3.6705 7.8812 119.4173 59.2271 31.6899 179.2860 72 R 4.4659 8.2750 117.2888 57.8823 30.2782 178.0113 73 G 3.9160 7.7056 104.7724 45.1418 0.0000 175.6555 74 Q 3.8075 7.5802 120.7471 58.8365 28.4647 178.7735 75 V 3.6325 7.8484 112.9481 64.2115 32.1027 177.5868 76 D 4.5127 8.0651 118.5795 56.7430 41.3366 178.4773 77 N 4.5236 8.3579 115.1264 55.3343 38.7146 174.7712 78 Y 4.7064 7.6969 117.7706 59.4242 40.8767 176.7397 79 C 4.1282 8.5934 117.5456 63.1005 28.4170 176.5015 80 R 4.0801 8.5584 119.4766 59.4625 29.8608 178.6747 81 H 4.0735 8.1102 118.0534 59.5686 29.9422 177.0893 82 N 4.3371 8.4209 118.2854 56.3073 38.2817 176.6955 83 Y 3.7377 8.2832 121.1923 60.6913 38.5823 178.6172 84 G 3.6536 7.9696 105.1913 47.7394 0.0000 175.5367 85 V 3.7219 7.3608 119.3264 65.2129 32.0597 177.6804 86 V 3.2244 7.5652 110.3987 60.9770 32.2821 177.5262 87 E 3.4267 7.6688 120.0055 58.5807 28.7664 179.1599 88 S 4.0150 7.8233 112.9527 60.2007 62.5462 174.4139 89 F 4.8148 7.3565 112.2157 56.3789 37.5525 175.3221 90 T 4.4173 6.4641 108.9532 63.1645 70.9389 175.8887 91 V 3.6532 7.5510 123.6837 64.8551 31.8354 177.1567 92 Q 4.4418 7.8179 115.5209 55.4434 28.8097 175.5870 93 R 4.1024 7.7753 120.1757 56.3446 30.4857 176.0511 94 R 5.0564 8.5335 123.5109 54.8907 34.1478 174.4885 95 V 4.6027 9.3185 124.7730 60.9485 34.2089 174.6602 96 H 5.4270 9.3897 123.9012 54.5808 29.2800 173.4216 97 P 4.8884 0.0000 0.0000 62.8012 32.8500 174.9612 98 Q 4.5177 9.1663 123.6044 54.9621 30.4880 174.2682 99 V 4.9965 8.3947 126.2689 61.5377 33.8978 174.3680 100 T 4.8526 8.8397 120.7166 60.8314 71.4060 172.1570 101 V 5.1700 8.6063 125.6621 61.3099 34.2286 174.1584 102 Y 5.0987 8.2646 124.7780 54.6550 41.6937 172.5701 103 P 4.6506 0.0000 0.0000 62.4318 33.0289 175.0923 104 A 4.8608 8.7976 123.3878 50.1434 21.9882 176.0940 105 K 4.2005 8.6377 121.4336 56.3314 33.4762 176.8303 *111 H 4.4988 8.2336 119.9883 56.2552 30.0583 171.9456 112 H 5.0121 7.6835 116.7826 53.8484 33.2468 172.7011 113 N 5.1311 8.5347 118.8121 51.4419 41.0164 174.3224 114 L 4.0634 8.3372 124.2415 54.1169 43.4585 176.2699 115 L 4.1098 7.7234 122.5963 54.2377 43.1821 175.7946 116 V 4.4458 8.1802 123.5973 61.0579 34.3995 173.2125 117 C 5.0906 9.4343 128.8170 55.2523 45.4415 171.9574 118 S 5.0606 9.1989 122.7294 56.8998 64.0223 172.8310 119 V 4.9500 8.9517 127.4085 61.3193 33.8204 174.1900 120 S 5.2029 8.9017 122.2822 56.5608 67.1445 174.4318 121 G 3.9839 8.6885 104.9757 46.3265 0.0000 173.4246 122 F 5.2317 7.3976 114.4329 56.0015 40.6627 173.9944 123 Y 5.2085 8.8488 119.2154 56.1511 42.6327 172.8700 124 P 3.2026 0.0000 0.0000 61.6698 32.6649 176.1581 125 G 2.6105 7.7618 107.6059 47.6088 0.0000 174.3728 126 S 4.0719 7.6060 115.2021 58.4016 63.2598 173.1222 127 I 4.5570 7.7121 123.7075 59.7507 41.0999 172.9897 128 E 4.5973 8.8757 127.0079 54.3838 32.7010 174.1952 129 V 4.7966 8.4926 126.4199 61.1597 33.8865 174.6743 130 R 4.7597 9.2502 126.2556 54.1843 34.3835 174.2740 131 W 5.3730 8.5831 121.1024 55.1917 32.0666 174.9309 132 F 5.3068 9.9456 121.7681 55.7076 43.0577 174.1132 133 R 4.7141 9.6141 122.9983 54.6512 32.4700 175.2320 134 N 4.2560 10.4543 126.5515 54.1972 36.8283 175.7380 135 G 4.0383 8.7614 106.5090 45.1202 0.0000 173.9662 136 Q 4.6407 8.2013 119.9440 53.9338 30.1274 174.7388 137 E 3.7888 8.7335 124.1406 56.0840 30.2223 177.0462 138 E 4.3958 8.5344 127.4412 54.8785 28.0939 176.1397 139 K 4.0864 8.1050 122.2695 58.4796 32.6709 178.1242 140 T 4.5952 7.9043 105.5802 61.0467 69.5539 174.0040 141 G 4.2142 7.8510 109.3016 46.4624 0.0000 173.2894 142 V 5.2044 7.8852 118.7815 60.5873 34.8442 174.7939 143 V 4.6532 8.6177 125.3233 60.1498 34.8508 174.2063 144 S 5.2746 8.4388 115.8642 56.9925 65.5608 173.6612 145 T 4.0308 8.6481 112.7500 62.7153 69.3363 175.6119 146 G 3.8695 8.3634 109.2580 44.0586 0.0000 172.0749 147 L 4.3211 8.1852 120.6904 54.9464 42.8309 176.1042 148 I 4.5680 8.8631 127.2414 59.8120 39.7741 173.9527 149 H 4.6167 8.8978 127.4097 55.1851 30.4079 174.5723 150 N 4.3763 8.5190 122.2575 52.8384 38.8011 176.5733 151 G 3.6849 7.0679 105.9853 45.7871 0.0000 173.4425 152 D 4.8754 6.8297 118.1708 52.7653 39.7517 175.5716 153 W 3.5006 8.5195 115.8482 58.6437 26.4476 174.0420 154 T 5.1320 7.3645 106.1048 60.5330 72.1509 172.0339 155 F 5.1496 8.7838 120.8873 56.0981 43.9278 173.3324 156 Q 5.1531 8.7809 116.6333 56.2677 32.3316 173.1154 157 T 4.8142 9.0460 112.2928 61.2737 71.6124 171.7697 158 L 5.2273 8.6678 127.0865 52.9374 45.0129 175.6173 159 V 4.5034 9.0191 123.5241 61.4858 34.3518 173.5685 160 M 4.9200 9.0889 129.2659 53.9665 34.1351 174.4439 161 L 4.1909 7.9000 128.8776 54.2789 42.0225 176.5019 162 E 4.0590 8.9743 127.0272 58.8516 30.2104 177.9967 163 T 3.7927 7.5203 116.6805 62.9820 68.9778 174.1420 164 V 3.5028 8.1001 126.5098 61.9121 32.0535 173.8845 165 P 4.1498 0.0000 0.0000 62.4528 31.9357 175.7451 166 R 4.6858 9.5401 122.3681 53.7764 32.2251 175.7051 167 S 4.3060 8.8332 117.5628 60.1732 63.1182 173.5550 168 G 4.1336 9.0613 113.0725 45.5408 0.0000 173.8566 169 E 4.4522 8.3650 118.6260 55.5637 31.5451 175.8481 170 V 4.7665 9.0197 122.0171 61.3955 34.3225 173.7784 171 Y 5.3930 9.3208 125.7938 56.6716 40.7163 174.8016 172 T 5.2319 9.5412 120.4010 61.9893 72.4781 171.9559 173 C 4.3085 8.9849 126.8690 54.9040 41.7897 171.8198 174 Q 5.1688 9.3798 128.0993 54.2103 31.5828 174.0664 175 V 4.8058 9.0134 126.0860 61.0903 34.7044 173.7273 176 E 5.0031 8.9736 127.4280 54.9570 32.3680 174.5285 177 H 4.9131 8.4899 121.6214 54.3796 32.9219 172.4271 178 P 4.2587 0.0000 0.0000 65.4979 31.4832 177.8621 179 S 4.4387 8.1740 111.5319 59.6451 63.5657 174.0143 180 V 4.7425 7.6805 114.2287 59.8320 34.6155 175.6653 181 T 4.3345 8.4704 112.0672 62.2766 69.5166 174.6984 182 S 4.6544 7.4714 115.5000 55.7991 66.0022 171.8463 183 P 4.5189 0.0000 0.0000 63.2699 31.9821 175.6844 184 L 4.5834 8.9183 124.5638 54.1770 43.0541 175.9798 185 T 5.6611 8.3358 112.5002 58.7961 72.2641 173.2662 186 V 4.4441 8.1428 122.0523 61.2474 34.7856 173.4160 187 E 5.2242 9.0023 128.5303 54.3762 31.7213 174.5180 188 W 4.7247 9.8177 135.0000 55.7657 33.6062 174.3193 189 R 4.7349 8.2212 126.9174 54.6517 30.4268 176.4081 190 A 4.5300 8.8809 125.9539 52.1776 18.7061 176.9807 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 R 8.25 4.31 0.00 1.81 1.93 0.00 3.20 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.66 0.00 5 P 0.00 4.10 0.00 1.86 1.79 0.00 3.63 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 6 R 8.56 4.40 0.00 1.58 1.67 0.00 3.17 0.00 0.00 3.15 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.60 0.00 7 F 8.33 4.96 0.00 3.04 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 8 L 9.54 4.84 0.00 1.71 1.51 0.96 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.98 5.27 0.00 2.11 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 2.58 0.00 10 L 9.42 5.00 0.00 1.80 1.60 0.89 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.59 5.23 0.00 1.54 1.46 0.06 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 12 K 9.19 4.58 0.00 1.90 1.73 0.00 1.55 0.00 0.00 1.61 0.00 0.00 2.71 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.32 1.35 7.81 13 S 8.93 5.06 0.00 3.93 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 14 E 9.47 4.78 0.00 1.93 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 2.29 2.30 0.00 15 C 8.64 5.11 0.00 2.80 2.37 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 16 H 8.96 4.58 0.00 3.06 2.94 0.00 5.56 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 F 8.38 5.29 0.00 2.88 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 18 F 9.07 4.57 0.00 3.01 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 19 N 9.69 4.28 0.00 3.00 2.84 0.00 0.00 7.09 7.94 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 20 G 7.55 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 0.00 0.00 0.00 21 T 8.19 4.43 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 0.54 0.00 0.00 22 E 8.24 3.99 0.00 2.04 2.29 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 2.35 2.27 0.00 23 R 8.13 4.70 0.00 1.95 1.87 0.00 2.88 0.00 0.00 2.94 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.47 0.00 24 V 8.58 5.00 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 0.64 0.00 0.00 1.07 0.00 0.00 25 R 8.93 4.72 0.00 2.02 1.90 0.00 3.11 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 26 F 9.55 5.55 0.00 3.16 3.05 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 27 L 8.70 4.91 0.00 1.52 1.41 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.98 4.65 0.00 1.55 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 2.18 2.15 0.00 29 R 8.92 4.81 0.00 1.87 1.61 0.00 3.19 0.00 0.00 3.45 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.53 0.00 30 Y 8.35 4.93 0.00 1.98 2.37 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 31 F 9.72 5.55 0.00 3.00 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 32 H 9.64 5.28 0.00 3.27 3.21 0.00 5.73 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 N 9.82 4.39 0.00 2.89 2.87 0.00 0.00 7.18 7.23 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 34 Q 8.35 3.85 0.00 2.29 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 35 E 8.12 4.59 0.00 2.12 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 2.37 2.32 0.00 36 E 9.03 4.10 0.00 1.65 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 1.95 1.47 0.00 37 F 8.61 5.08 0.00 3.21 3.20 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 38 V 6.75 4.98 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 0.17 0.00 0.00 0.98 0.00 0.00 39 R 8.89 5.34 0.00 1.95 2.10 0.00 2.66 0.00 0.00 3.03 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.55 0.00 40 F 9.29 4.79 0.00 2.05 2.61 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 41 D 7.49 5.16 0.00 2.54 2.20 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 42 S 9.13 4.15 0.00 4.04 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 0.00 43 D 8.70 4.39 0.00 2.73 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 44 V 7.55 3.74 1.92 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 0.68 0.00 0.00 0.82 0.00 0.00 45 G 9.24 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 46 E 6.77 4.89 0.00 2.39 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 2.15 2.31 0.00 47 Y 9.34 4.62 0.00 3.27 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 48 R 9.12 4.81 0.00 1.64 1.76 0.00 3.29 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 49 A 8.77 4.45 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 50 V 8.93 4.13 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 0.84 0.00 0.00 0.86 0.00 0.00 51 T 7.63 4.78 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 1.34 0.00 0.00 52 E 8.75 3.89 0.00 2.05 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 0.00 2.35 2.35 0.00 53 L 8.05 4.03 0.00 1.60 1.66 0.75 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.13 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 0.00 0.00 0.00 55 R 7.66 3.89 0.00 1.93 1.96 0.00 3.11 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 56 P 0.00 4.18 0.00 2.00 1.99 0.00 3.63 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 2.01 2.06 0.00 57 V 7.39 2.87 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 -0.64 0.00 0.00 0.64 0.00 0.00 58 A 7.91 3.94 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 59 E 7.93 3.90 0.00 2.10 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 2.34 2.41 0.00 60 S 7.88 4.22 0.00 3.83 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 61 W 8.12 4.42 0.00 3.17 2.81 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 0.00 0.00 0.00 62 N 8.61 4.74 0.00 2.89 3.00 0.00 0.00 7.05 8.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 S 7.76 4.76 0.00 4.01 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 64 Q 7.94 4.48 0.00 2.26 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.80 0.00 0.00 0.00 0.00 0.00 2.56 2.55 0.00 65 K 8.40 3.98 0.00 1.82 1.84 0.00 1.76 0.00 0.00 2.30 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.48 7.81 66 D 8.07 4.36 0.00 2.90 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 67 L 7.82 3.86 0.00 1.72 1.93 0.70 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.06 4.05 0.00 1.96 1.84 1.07 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 69 E 8.45 3.98 0.00 2.10 2.01 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 2.37 2.51 0.00 70 Q 7.88 4.02 0.00 2.06 2.22 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 2.21 2.30 0.00 71 K 7.88 3.67 0.00 1.09 0.74 0.00 1.64 0.00 0.00 1.40 0.00 0.00 2.78 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.15 7.81 72 R 8.28 4.47 0.00 1.95 2.08 0.00 3.28 0.00 0.00 3.31 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.06 0.00 73 G 7.71 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 74 Q 7.58 3.81 0.00 1.11 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.69 0.00 0.00 0.00 0.00 0.00 2.21 1.75 0.00 75 V 7.85 3.63 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 0.92 0.00 0.00 0.97 0.00 0.00 76 D 8.07 4.51 0.00 2.85 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 77 N 8.36 4.52 0.00 2.80 2.86 0.00 0.00 6.87 7.77 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 78 Y 7.70 4.71 0.00 2.97 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 79 C 8.59 4.13 0.00 3.22 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 80 R 8.56 4.08 0.00 2.10 2.03 0.00 3.40 0.00 0.00 3.12 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.94 0.00 81 H 8.11 4.07 0.00 3.24 3.56 0.00 5.79 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 82 N 8.42 4.34 0.00 2.75 2.79 0.00 0.00 6.75 7.32 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 83 Y 8.28 3.74 0.00 2.55 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 84 G 7.97 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.36 3.72 2.18 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 0.92 0.00 0.00 0.88 0.00 0.00 86 V 7.57 3.22 1.25 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 0.90 0.00 0.00 0.63 0.00 0.00 87 E 7.67 3.43 0.00 1.70 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 2.17 2.00 0.00 88 S 7.82 4.01 0.00 3.82 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.36 4.81 0.00 2.92 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 90 T 6.46 4.42 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 0.96 0.00 0.00 91 V 7.55 3.65 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 0.82 0.00 0.00 0.48 0.00 0.00 92 Q 7.82 4.44 0.00 2.28 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.60 0.00 0.00 0.00 0.00 0.00 2.32 2.48 0.00 93 R 7.78 4.10 0.00 1.82 2.13 0.00 2.76 0.00 0.00 2.42 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.53 0.00 94 R 8.53 5.06 0.00 1.77 1.90 0.00 3.25 0.00 0.00 3.32 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 95 V 9.32 4.60 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 1.16 0.00 0.00 1.04 0.00 0.00 96 H 9.39 5.43 0.00 3.24 3.33 0.00 5.18 0.00 0.00 0.00 0.00 6.68 0.00 0.00 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0.00 0.00 105 K 8.64 4.20 0.00 1.75 1.72 0.00 1.77 0.00 0.00 1.60 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.42 7.81 *111 H 8.23 4.50 0.00 3.11 3.16 0.00 5.68 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 H 7.68 5.01 0.00 3.11 3.06 0.00 5.69 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.53 5.13 0.00 2.48 2.63 0.00 0.00 7.00 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 0.00 114 L 8.34 4.06 0.00 1.46 1.47 0.80 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 115 L 7.72 4.11 0.00 0.61 1.05 0.17 -0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 116 V 8.18 4.45 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 0.00 0.00 0.74 0.00 0.00 0.69 0.00 0.00 117 C 9.43 5.09 0.00 2.65 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 0.00 118 S 9.20 5.06 0.00 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0.00 0.00 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 7.71 4.56 1.52 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.55 0.80 0.00 0.00 128 E 8.88 4.60 0.00 2.05 1.68 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 2.17 2.24 0.00 129 V 8.49 4.80 2.02 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 0.68 0.00 0.00 0.82 0.00 0.00 130 R 9.25 4.76 0.00 1.84 1.65 0.00 3.24 0.00 0.00 3.34 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 131 W 8.58 5.37 0.00 3.24 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 0.00 132 F 9.95 5.31 0.00 2.97 2.99 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 0.00 0.00 0.00 0.00 133 R 9.61 4.71 0.00 1.93 1.84 0.00 3.45 0.00 0.00 3.44 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.38 0.00 134 N 10.45 4.26 0.00 2.79 2.82 0.00 0.00 7.30 8.32 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 0.00 135 G 8.76 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 0.00 0.00 0.00 136 Q 8.20 4.64 0.00 2.22 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.95 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 137 E 8.73 3.79 0.00 1.16 1.63 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 2.11 1.86 0.00 138 E 8.53 4.40 0.00 1.98 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 2.35 2.46 0.00 139 K 8.10 4.09 0.00 1.70 1.84 0.00 1.66 0.00 0.00 1.73 0.00 0.00 3.16 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.34 7.81 140 T 7.90 4.60 4.22 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 1.19 0.00 0.00 141 G 7.85 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 0.00 142 V 7.89 5.20 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 1.02 0.00 0.00 1.09 0.00 0.00 143 V 8.62 4.65 2.20 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 0.85 0.00 0.00 0.93 0.00 0.00 144 S 8.44 5.27 0.00 3.87 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 0.00 145 T 8.65 4.03 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 1.25 0.00 0.00 146 G 8.36 3.87 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 0.00 0.00 0.00 147 L 8.19 4.32 0.00 1.69 1.63 1.04 0.76 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 0.00 148 I 8.86 4.57 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 1.16 0.77 0.92 0.00 0.00 149 H 8.90 4.62 0.00 3.17 3.15 0.00 5.74 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 N 8.52 4.38 0.00 2.90 2.69 0.00 0.00 6.56 8.55 0.00 0.00 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 G 7.07 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 0.00 0.00 0.00 152 D 6.83 4.88 0.00 2.84 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 0.00 153 W 8.52 3.50 0.00 3.33 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 0.00 154 T 7.36 5.13 4.22 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 1.27 0.00 0.00 155 F 8.78 5.15 0.00 1.68 2.61 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 0.00 156 Q 8.78 5.15 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.69 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 157 T 9.05 4.81 4.44 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 1.35 0.00 0.00 158 L 8.67 5.23 0.00 1.69 1.58 1.03 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 159 V 9.02 4.50 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 1.08 0.00 0.00 0.95 0.00 0.00 160 M 9.09 4.92 0.00 2.07 1.85 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.30 0.00 161 L 7.90 4.19 0.00 0.27 0.37 0.67 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 162 E 8.97 4.06 0.00 1.81 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 2.25 2.37 0.00 163 T 7.52 3.79 4.07 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 0.00 0.00 0.00 1.24 0.00 0.00 164 V 8.10 3.50 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 0.52 0.00 0.00 0.81 0.00 0.00 165 P 0.00 4.15 0.00 2.02 1.71 0.00 3.50 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.45 0.00 166 R 9.54 4.69 0.00 2.02 1.88 0.00 3.34 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.75 0.00 167 S 8.83 4.31 0.00 4.02 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 0.00 168 G 9.06 4.13 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 0.00 169 E 8.37 4.45 0.00 1.97 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 2.23 2.25 0.00 170 V 9.02 4.77 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 1.10 0.00 0.00 0.91 0.00 0.00 171 Y 9.32 5.39 0.00 3.23 3.07 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 0.00 0.00 0.00 0.00 172 T 9.54 5.23 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 1.25 0.00 0.00 173 C 8.98 4.31 0.00 1.49 2.49 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 0.00 174 Q 9.38 5.17 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.53 0.00 0.00 0.00 0.00 0.00 2.24 2.19 0.00 175 V 9.01 4.81 1.98 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 0.81 0.00 0.00 0.79 0.00 0.00 176 E 8.97 5.00 0.00 1.87 1.77 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 2.20 2.20 0.00 177 H 8.49 4.91 0.00 2.97 3.00 0.00 5.69 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 P 0.00 4.26 0.00 1.96 2.06 0.00 2.94 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 1.85 1.97 0.00 179 S 8.17 4.44 0.00 4.13 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 0.00 180 V 7.68 4.74 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 0.77 0.00 0.00 1.06 0.00 0.00 181 T 8.47 4.33 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 1.21 0.00 0.00 182 S 7.47 4.65 0.00 3.91 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 0.00 183 P 0.00 4.52 0.00 1.90 2.00 0.00 3.63 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 2.00 2.11 0.00 184 L 8.92 4.58 0.00 1.53 1.55 0.93 0.35 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 0.00 185 T 8.34 5.66 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 1.12 0.00 0.00 186 V 8.14 4.44 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 1.19 0.00 0.00 1.00 0.00 0.00 187 E 9.00 5.22 0.00 2.06 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 2.28 2.38 0.00 188 W 9.82 4.72 0.00 3.69 3.20 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 0.00 189 R 8.22 4.73 0.00 1.56 1.82 0.00 3.20 0.00 0.00 3.28 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 190 A 8.88 4.53 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 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.