NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2604 7.8827 121.4539 61.2344 38.6425 173.8002 17 V 4.3074 8.6869 126.4229 62.0058 32.5247 174.6266 18 G 3.8108 9.1009 114.7959 46.1840 0.0000 173.1728 19 G 4.1945 7.7180 109.6222 44.1089 0.0000 172.6464 20 Y 4.9899 8.0097 116.2645 55.1863 42.4495 174.8500 21 T 4.2433 8.5623 117.2272 64.0612 68.9431 176.0247 22 C 4.0620 8.6527 125.4236 59.2255 37.7271 175.6166 23 G 3.9812 7.7791 103.4043 45.0551 0.0000 172.7391 24 A 4.3176 8.4004 125.5602 53.5521 18.7011 176.9435 25 N 4.2731 8.9298 118.9120 54.4383 36.1583 175.4576 26 T 4.1274 7.7926 108.3648 63.0696 69.8218 174.9908 27 V 4.0795 7.0858 121.8879 60.5440 31.3220 173.6906 28 P 4.4135 0.0000 0.0000 64.0218 32.2705 178.1479 29 Y 4.8656 6.9676 116.2596 57.0971 38.8285 174.7098 30 Q 4.5519 7.4545 123.6400 56.3216 29.4675 175.5700 31 V 4.8393 9.0228 119.3162 59.6911 35.9001 174.1754 32 S 5.0416 8.7915 116.7773 56.6518 64.9114 172.6218 33 L 4.7358 8.5896 127.2646 53.3224 43.4127 174.9696 34 N 5.7605 8.9956 122.3372 50.0684 41.9812 175.0466 *37 S 4.2466 8.5637 121.5377 58.1742 64.2525 174.7327 38 G 4.0352 10.1061 110.8435 46.6176 0.0000 173.2912 39 Y 4.7023 6.7337 115.5221 55.7616 40.4382 173.1700 40 H 4.5559 8.7267 121.5618 56.2941 30.3200 174.8012 41 F 5.0176 8.0589 119.5099 56.6533 39.5921 173.8162 42 C 4.7465 6.8766 115.2229 55.8673 44.8473 173.6745 43 G 4.3223 8.7722 109.6283 45.8085 0.0000 172.1640 44 G 4.6120 7.9391 105.2235 46.4376 0.0000 172.4379 45 S 5.3802 8.8512 115.4730 56.4049 66.7576 173.7780 46 L 4.7367 9.3574 128.3965 55.0708 42.3167 177.1630 47 I 4.3857 9.0067 119.1972 60.3071 39.0877 174.3948 48 N 4.8338 7.6238 117.4115 51.9965 39.7006 174.9497 49 S 4.2301 8.7017 111.7779 60.7379 63.2905 174.8109 50 Q 4.5663 9.1162 121.0112 55.1526 30.9531 174.1832 51 W 5.6191 8.4845 117.1710 55.1293 33.7153 174.2069 52 V 4.9383 9.2055 123.6119 61.1686 34.4221 174.1224 53 V 4.8378 8.8419 127.3983 61.9319 33.2746 174.8080 54 S 4.9257 8.9878 121.2333 57.4365 66.3132 172.0906 55 A 4.5754 8.7330 120.4490 50.3093 19.8033 178.5305 56 A 3.8125 8.3265 124.5904 55.3336 18.4258 179.3858 57 H 4.4237 8.1771 109.6951 57.6652 28.7073 175.4498 58 C 4.7350 7.7385 117.0220 57.3557 40.3399 173.2255 59 Y 4.2598 7.7595 122.3010 57.7957 38.8153 175.4435 60 K 4.1020 7.2286 124.5130 54.3146 36.3107 176.1760 61 S 4.0293 7.9614 115.9793 59.3627 63.6947 174.1519 62 G 3.8173 8.6511 108.8326 46.2130 0.0000 173.7526 63 I 3.8170 7.4783 120.1908 61.1823 38.5057 174.5618 64 Q 4.6597 8.8094 127.6280 54.4067 31.0373 174.3004 65 V 4.3548 8.6242 127.2569 61.9818 33.4878 174.6659 66 R 5.0301 8.9773 127.0957 54.6501 32.4621 174.9516 67 L 4.7236 9.1642 124.8622 52.8469 44.5984 177.8351 *69 G 4.4189 8.3337 108.3118 45.2641 0.0000 172.8801 70 E 4.2844 8.1736 118.7763 55.9215 29.8520 174.2310 71 D 4.8849 7.9700 118.0938 55.4916 44.2581 174.5058 72 N 5.0610 9.1488 120.0108 53.1806 39.1218 176.2217 73 I 3.7248 8.5377 120.1661 62.1926 37.9718 176.2515 74 N 4.8557 8.5951 117.4581 52.7858 39.4552 174.3183 75 V 4.3010 7.3872 117.2837 60.6046 34.0026 175.1365 76 V 4.0086 8.4292 126.8010 62.8976 31.0722 175.1280 77 E 4.3564 9.6063 127.6400 56.1805 30.4749 177.4529 78 G 3.9648 8.8665 107.3616 45.1070 0.0000 173.6087 79 N 4.7223 7.9683 115.9746 52.6373 38.0508 174.1587 80 E 4.9716 7.7371 118.5101 55.9670 31.2581 175.6280 81 Q 4.5503 9.0491 121.5026 54.2062 32.3930 174.2060 82 F 5.5574 8.8371 122.7957 56.0805 40.8706 175.3893 83 I 4.6888 8.8750 124.3642 59.4255 41.1591 175.2632 84 S 4.6776 8.7504 122.6018 58.1748 64.1670 173.4854 85 A 4.4786 8.6296 126.2481 52.3559 18.0859 177.7898 86 S 4.4881 8.9016 117.0842 59.4842 64.6803 174.9352 87 K 4.6833 7.6466 118.9495 54.7721 36.5779 175.5672 88 S 4.9871 8.9323 119.5670 57.1423 65.9043 173.8958 89 I 4.4734 9.2078 127.8061 59.1541 38.7935 175.5084 90 V 3.9992 8.2998 127.4261 62.4834 32.4242 175.1777 91 H 3.8059 8.8265 127.2669 56.1167 29.9593 174.4981 92 P 4.2468 0.0000 0.0000 65.4539 31.3838 177.2248 93 S 4.5691 8.0410 111.5786 58.1141 63.3260 173.4843 94 Y 4.4188 8.0535 123.5088 58.1252 38.9841 174.7564 95 N 4.4699 8.0827 124.5891 51.3258 40.6055 175.0386 96 S 3.8845 7.8178 120.2727 59.9049 63.5381 175.3069 97 N 4.3876 8.1955 118.9806 55.3042 38.3887 175.8563 98 T 4.1407 7.5761 105.2066 60.2946 70.4096 174.6747 99 L 3.7261 7.9147 120.4890 55.3142 40.0799 174.0555 100 N 4.4489 7.7684 117.7189 54.6937 39.5845 174.4284 101 N 4.7290 8.6142 118.8671 53.9650 36.2085 175.5752 102 D 4.6858 7.6981 118.0029 52.9760 40.0567 174.5920 103 I 4.8770 7.0287 120.6905 59.2545 42.4337 173.3449 104 M 5.4559 9.1843 127.1391 53.9746 36.3282 173.3695 105 L 5.3911 9.2656 124.9926 53.2245 44.6668 175.2707 106 I 4.9193 9.0895 124.8709 59.4091 39.8616 174.4740 107 K 3.5234 8.4727 129.3649 54.8059 33.2236 175.8434 108 L 4.3142 8.2014 128.3710 54.2540 41.7733 177.3318 109 K 4.1458 8.8580 125.0931 58.9988 32.6242 176.9955 110 S 4.6323 7.7229 111.3868 55.7761 66.1467 173.2043 111 A 4.3603 8.3799 123.0926 51.8776 18.7501 177.4566 112 A 4.2755 8.8570 123.9086 52.0327 19.4666 177.5283 113 S 4.4217 9.0221 117.7572 57.9377 63.4983 174.2252 114 L 4.6347 8.5237 125.5881 53.8981 42.7889 175.8677 115 N 4.8858 8.7915 119.1571 52.1552 39.8375 174.9452 116 S 4.1650 8.7093 111.7106 61.1010 63.1502 175.0388 117 R 4.2932 8.3411 118.7163 56.2636 30.8071 176.3154 118 V 4.4610 7.7664 117.3804 61.0144 33.5884 173.6533 119 A 5.1279 8.5979 128.3507 50.4345 22.8527 175.4848 120 S 4.9949 8.7425 114.9626 58.0719 64.8550 173.0012 121 I 4.4354 8.4114 120.9149 59.0190 39.9669 175.3578 122 S 4.4023 8.4332 124.4545 58.2827 63.5214 173.9898 123 L 4.2363 8.1146 123.2728 53.5430 42.2643 175.3779 124 P 4.4854 0.0000 0.0000 63.1216 31.9628 176.3140 125 T 4.1964 8.2205 108.5665 62.2710 70.0923 174.5395 *127 S 4.3071 7.5693 114.8465 57.8980 64.0398 174.1359 128 C 4.3716 8.3863 118.0908 56.7394 40.6090 173.7700 129 A 4.2654 8.0171 124.9114 52.0025 19.2477 177.3369 130 S 4.4476 8.1201 115.6191 56.9273 64.7957 173.6334 *132 A 4.2550 8.2505 125.1952 53.5077 19.2333 177.4501 133 G 3.9464 9.0201 110.6789 45.2867 0.0000 173.8731 134 T 4.1649 7.5127 117.4040 63.1399 69.6739 173.8946 135 Q 4.4969 8.6167 127.4858 56.2213 30.0163 175.4207 136 C 5.3015 9.1757 122.6336 55.0527 45.9002 172.3149 137 L 5.1660 8.9981 122.6088 53.5636 43.9603 175.0066 138 I 5.3432 9.0437 127.4099 58.8684 39.9786 174.8829 139 S 4.8734 8.5864 119.3322 56.4010 66.4641 173.1386 140 G 3.7498 7.5200 108.5708 46.2718 0.0000 172.8526 141 W 4.6278 8.5324 116.8504 56.3861 29.1891 176.9586 142 G 4.2492 8.5919 108.0149 45.2590 0.0000 173.3242 143 N 4.2011 9.2142 119.3264 54.3478 39.0601 174.8693 144 T 5.1751 8.3656 114.2065 60.7014 69.7195 174.3401 145 K 4.6435 7.9853 121.3225 54.8046 34.8401 176.2892 146 S 4.3426 8.5456 116.1181 59.5127 63.7660 174.0852 147 S 4.3799 7.7407 115.0913 57.6574 64.5104 174.0685 148 G 3.8706 9.6952 117.0117 44.6318 0.0000 171.4455 149 T 4.7342 7.9269 107.3627 60.2466 72.0144 173.7640 150 S 4.3849 9.1739 119.9245 57.4635 65.8047 171.8875 151 Y 5.0169 8.6095 125.5654 55.7164 39.2329 174.2265 152 P 4.6739 0.0000 0.0000 62.3555 32.8736 176.0622 153 D 4.5522 8.7751 119.4689 56.6719 41.2310 176.9279 154 V 5.4808 7.3882 109.9165 58.3648 34.6338 175.7392 155 L 3.2184 8.3682 123.3269 55.0508 42.9306 176.0190 156 K 4.9363 8.1889 124.8610 54.9451 35.2704 174.5551 157 C 5.2080 8.4762 118.9999 55.2021 43.9885 173.0448 158 L 5.0449 8.5637 122.6854 53.7384 45.4355 174.8179 159 K 5.0735 9.0968 125.7314 55.7568 33.3222 176.1064 160 A 4.7605 9.0613 126.0827 50.0448 23.1245 173.5861 161 P 5.0351 0.0000 0.0000 61.5186 33.9626 175.3382 162 I 4.1519 8.2959 122.5810 61.8686 37.8713 175.5302 163 L 4.9688 8.6886 127.3241 52.7865 43.6940 176.9161 164 S 4.2345 8.5332 115.5371 58.4426 63.7280 174.8316 165 D 4.3589 8.8829 121.7069 57.6881 40.8703 178.6471 166 S 4.1064 8.0666 113.2405 61.5681 62.5085 176.2418 167 S 4.1415 8.2612 116.9162 61.3326 62.7224 175.6334 168 C 4.3098 8.4326 122.1793 59.6172 41.7194 175.7077 169 K 4.0204 8.4010 120.3606 59.6962 31.3870 179.5815 170 S 4.2366 8.1847 114.4641 61.4568 62.7818 176.2835 171 A 4.0359 7.8735 122.7098 53.7064 19.6907 177.2849 172 Y 4.8427 7.6580 113.5904 55.4464 38.3230 173.1509 173 P 4.6216 0.0000 0.0000 63.3193 32.3385 177.4735 174 G 3.9983 9.0247 109.8873 46.1263 0.0000 173.7201 175 Q 4.5339 8.2327 117.0127 55.4059 30.7257 175.5532 176 I 4.3519 7.8815 119.3976 60.1012 38.1905 175.6536 177 T 4.5047 8.2632 116.2349 59.8381 70.6086 175.5725 178 S 4.2787 8.5300 115.2758 60.7233 63.1231 174.5149 179 N 4.9601 8.1322 118.4715 53.3244 38.4044 173.8962 180 M 5.5718 7.9662 116.9768 53.7376 36.0486 174.5273 181 F 5.1194 8.8770 115.4013 55.8022 42.2768 172.4346 182 C 5.9383 9.2192 115.8184 54.9274 41.2076 172.8038 183 A 5.0390 9.0213 122.1544 50.7586 22.3300 174.0187 184A G 3.9925 7.4016 106.0593 44.3941 0.0000 174.7780 184 Y 4.6300 8.5448 121.7739 56.1175 41.4438 176.0812 185 L 4.1298 8.7394 125.6710 57.4153 41.9853 178.8455 186 E 4.1077 8.2231 115.0533 56.9819 29.9055 177.4652 187 G 3.8666 7.6425 106.8136 45.1029 0.0000 172.9262 188A G 4.0329 9.5050 106.6296 44.8031 0.0000 174.1609 188 K 4.8299 7.3974 117.6333 55.2299 35.6113 175.1184 189 D 4.6924 8.8537 123.4578 53.5553 45.6125 174.7885 190 S 4.9116 8.2156 117.2333 58.3649 64.8418 171.6876 191 C 4.7542 9.0972 118.6486 55.6162 43.0819 172.4328 192 Q 4.3237 8.5436 119.9058 57.8329 28.4396 178.1418 193 G 4.3966 9.3287 110.9484 45.5008 0.0000 173.6816 194 D 4.7300 8.4769 118.8198 54.9180 41.9363 176.7476 195 S 4.4905 8.0758 115.4357 60.5510 63.5574 175.2983 196 G 4.2101 8.8776 112.7424 46.4437 0.0000 173.7973 197 G 4.4787 7.8741 107.4065 44.8555 0.0000 171.1257 198 P 5.1404 0.0000 0.0000 62.2461 33.4976 175.5551 199 V 4.5814 8.6861 121.5479 61.4075 34.1043 174.1330 200 V 4.8197 8.7263 128.9092 61.3695 33.8922 173.8189 201 C 5.0866 8.7249 124.3609 55.9015 44.6216 174.4547 202 S 3.7121 9.8082 117.8797 59.6983 60.0922 173.4175 203 G 3.9300 8.5324 105.3563 45.5660 0.0000 174.1413 204 K 4.6900 7.6426 117.8021 53.0133 35.3984 175.5478 *209 L 4.2555 8.2363 122.2763 55.4718 42.0049 175.7803 210 Q 4.4850 8.9079 126.0710 56.6037 30.9261 175.9169 211 G 5.3182 8.0395 104.3387 45.6076 0.0000 171.4569 212 I 5.2903 8.2307 119.8670 58.8469 40.9211 175.3584 213 V 3.6805 8.9063 127.6542 64.1458 31.8073 174.2083 214 S 4.8246 8.4075 120.8479 58.3283 64.0839 173.8539 215 W 4.9193 7.4046 113.9332 55.5908 32.0592 172.3209 216 G 4.0465 8.3065 106.6298 46.3389 0.0000 173.4176 217 S 4.6354 8.7237 116.9987 57.4150 62.9280 173.5436 *219 G 4.3502 8.0472 116.3764 45.5367 0.0000 171.2587 220 C 4.9204 8.1177 116.4981 56.4754 43.7159 173.8904 221A A 4.2181 9.5095 125.5778 53.2184 16.5224 177.2178 221 Q 4.5604 7.3458 117.2238 55.9805 29.8056 175.7980 222 K 4.1120 8.4756 121.7030 58.1842 32.5854 176.0713 223 N 4.2758 9.1487 121.9509 54.1647 37.0301 175.4907 224 K 4.3240 7.6033 115.2841 54.1888 32.7984 173.8989 225 P 4.6240 0.0000 0.0000 61.9744 33.1972 177.8718 226 G 3.5461 8.4308 107.0869 46.3459 0.0000 172.6074 227 V 4.3474 7.5545 122.3640 60.6853 33.9362 174.1287 228 Y 4.8971 8.0999 124.2319 56.0476 42.3024 174.9156 229 T 4.3740 8.6730 120.0806 63.6411 70.1184 174.2824 230 K 5.1250 9.3486 127.9587 55.2410 31.4684 177.2016 231 V 3.9347 8.8685 126.5873 65.9017 31.4074 174.9450 232 C 4.3309 8.2811 112.5278 58.2328 41.4995 174.8203 233 N 4.2464 7.9758 117.1514 54.4600 38.4001 174.9379 234 Y 4.8113 7.9071 117.7222 57.3770 39.5278 177.5684 235 V 3.6552 8.0394 121.7005 66.1957 31.5105 177.8993 236 S 4.0866 8.0731 112.3508 61.0824 62.2908 175.5340 237 W 4.1855 8.3836 130.5983 60.5862 30.3575 177.7208 238 I 3.2526 8.4378 119.9411 64.3395 36.5956 178.5857 239 K 3.7462 7.9824 119.1365 59.5513 31.7106 179.5404 240 Q 3.8714 8.2017 118.6159 59.0761 28.3505 178.9130 241 T 3.5383 7.2102 116.0918 66.2721 68.7535 176.6091 242 I 2.6855 7.2027 121.6834 64.0310 36.8077 178.3985 243 A 3.9915 7.6691 120.2978 54.3699 18.2389 178.7637 244 S 4.5451 7.4734 109.9464 58.5711 63.7418 174.1308 245 N 4.6803 7.9507 125.1400 53.7021 39.0563 173.9923 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 16 I 7.88 4.26 1.81 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.58 0.88 0.00 0.00 17 V 8.69 4.31 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 0.93 0.00 0.00 0.96 0.00 0.00 18 G 9.10 3.81 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 0.00 0.00 0.00 19 G 7.72 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 8.01 4.99 0.00 3.01 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 21 T 8.56 4.24 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 1.26 0.00 0.00 22 C 8.65 4.06 0.00 2.74 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 23 G 7.78 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 24 A 8.40 4.32 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 25 N 8.93 4.27 0.00 2.89 2.92 0.00 0.00 7.16 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 26 T 7.79 4.13 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 1.28 0.00 0.00 27 V 7.09 4.08 1.73 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 0.37 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.41 0.00 2.38 2.28 0.00 3.69 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.00 0.00 29 Y 6.97 4.87 0.00 3.28 3.43 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 30 Q 7.45 4.55 0.00 1.74 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.76 0.00 0.00 0.00 0.00 0.00 1.85 2.45 0.00 31 V 9.02 4.84 2.22 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 1.08 0.00 0.00 0.99 0.00 0.00 32 S 8.79 5.04 0.00 3.30 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 33 L 8.59 4.74 0.00 0.46 1.06 0.74 0.29 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 34 N 9.00 5.76 0.00 2.43 2.48 0.00 0.00 6.55 8.17 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 *37 S 8.56 4.25 0.00 3.70 3.55 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 0.00 0.00 0.00 0.00 38 G 10.11 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 39 Y 6.73 4.70 0.00 3.16 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 40 H 8.73 4.56 0.00 2.89 3.19 0.00 5.87 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.06 5.02 0.00 2.97 2.73 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 42 C 6.88 4.75 0.00 2.02 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 43 G 8.77 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 0.00 0.00 0.00 44 G 7.94 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 45 S 8.85 5.38 0.00 3.81 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 46 L 9.36 4.74 0.00 1.85 1.68 1.07 0.69 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 47 I 9.01 4.39 1.91 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.34 1.06 0.00 0.00 48 N 7.62 4.83 0.00 3.01 3.01 0.00 0.00 6.04 8.25 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 49 S 8.70 4.23 0.00 4.21 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 50 Q 9.12 4.57 0.00 2.09 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.74 0.00 0.00 0.00 0.00 0.00 1.95 2.17 0.00 51 W 8.48 5.62 0.00 3.34 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 52 V 9.21 4.94 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 1.15 0.00 0.00 0.98 0.00 0.00 53 V 8.84 4.84 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 1.12 0.00 0.00 1.04 0.00 0.00 54 S 8.99 4.93 0.00 3.88 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 55 A 8.73 4.58 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 56 A 8.33 3.81 0.37 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 57 H 8.18 4.42 0.00 3.36 3.53 0.00 5.56 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 58 C 7.74 4.73 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 59 Y 7.76 4.26 0.00 2.97 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 60 K 7.23 4.10 0.00 1.37 1.29 0.00 0.69 0.00 0.00 1.29 0.00 0.00 2.69 0.00 0.00 2.19 0.00 0.00 0.00 0.00 1.03 1.01 7.81 61 S 7.96 4.03 0.00 3.96 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 62 G 8.65 3.82 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 0.00 0.00 0.00 63 I 7.48 3.82 1.82 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.70 0.87 0.00 0.00 64 Q 8.81 4.66 0.00 2.01 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.94 0.00 0.00 0.00 0.00 0.00 2.05 2.20 0.00 65 V 8.62 4.35 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 1.05 0.00 0.00 0.88 0.00 0.00 66 R 8.98 5.03 0.00 1.50 1.83 0.00 2.64 0.00 0.00 2.46 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 1.09 0.00 67 L 9.16 4.72 0.00 1.65 1.62 1.02 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.33 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 70 E 8.17 4.28 0.00 2.16 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 2.36 2.04 0.00 71 D 7.97 4.88 0.00 2.78 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 72 N 9.15 5.06 0.00 2.82 2.81 0.00 0.00 7.21 7.40 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 73 I 8.54 3.72 1.45 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.52 -0.44 0.00 0.00 74 N 8.60 4.86 0.00 2.79 2.85 0.00 0.00 7.01 8.31 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 75 V 7.39 4.30 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 0.86 0.00 0.00 0.99 0.00 0.00 76 V 8.43 4.01 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 0.86 0.00 0.00 0.93 0.00 0.00 77 E 9.61 4.36 0.00 2.15 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 0.00 2.28 2.44 0.00 78 G 8.87 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 79 N 7.97 4.72 0.00 3.11 3.06 0.00 0.00 6.21 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 80 E 7.74 4.97 0.00 1.64 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 2.41 2.46 0.00 81 Q 9.05 4.55 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.03 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 82 F 8.84 5.56 0.00 2.75 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 83 I 8.87 4.69 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.89 0.94 0.00 0.00 84 S 8.75 4.68 0.00 3.75 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 85 A 8.63 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 86 S 8.90 4.49 0.00 3.78 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.65 4.68 0.00 1.58 1.72 0.00 1.62 0.00 0.00 2.01 0.00 0.00 2.83 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.39 7.81 88 S 8.93 4.99 0.00 3.92 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 89 I 9.21 4.47 2.09 0.00 0.00 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 1.24 0.98 1.10 0.00 0.00 90 V 8.30 4.00 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 0.80 0.00 0.00 0.84 0.00 0.00 91 H 8.83 3.81 0.00 2.81 3.05 0.00 5.84 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.25 0.00 2.10 2.15 0.00 3.43 0.00 0.00 3.94 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 93 S 8.04 4.57 0.00 3.90 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 94 Y 8.05 4.42 0.00 3.06 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 95 N 8.08 4.47 0.00 2.57 2.42 0.00 0.00 6.58 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 96 S 7.82 3.88 0.00 3.97 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 97 N 8.20 4.39 0.00 2.78 2.81 0.00 0.00 6.91 7.06 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 98 T 7.58 4.14 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 1.12 0.00 0.00 99 L 7.91 3.73 0.00 1.50 1.83 0.27 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.77 4.45 0.00 2.82 2.65 0.00 0.00 7.21 6.27 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 0.00 101 N 8.61 4.73 0.00 3.08 2.56 0.00 0.00 7.39 8.05 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 0.00 102 D 7.70 4.69 0.00 3.17 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 0.00 103 I 7.03 4.88 1.40 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.23 -0.06 0.00 0.00 104 M 9.18 5.46 0.00 2.20 1.83 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.64 0.00 105 L 9.27 5.39 0.00 1.82 1.98 0.32 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.09 4.92 1.90 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.87 0.85 0.00 0.00 107 K 8.47 3.52 0.00 0.79 1.05 0.00 1.42 0.00 0.00 1.38 0.00 0.00 2.69 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.76 0.21 7.81 108 L 8.20 4.31 0.00 1.45 1.57 0.96 0.72 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 0.00 109 K 8.86 4.15 0.00 1.77 1.79 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.35 7.81 110 S 7.72 4.63 0.00 3.93 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 0.00 111 A 8.38 4.36 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 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.86 4.28 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 0.00 113 S 9.02 4.42 0.00 3.87 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 0.00 114 L 8.52 4.63 0.00 1.65 1.62 0.96 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.79 4.89 0.00 2.89 2.92 0.00 0.00 6.54 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 0.00 116 S 8.71 4.16 0.00 4.02 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 0.00 117 R 8.34 4.29 0.00 1.97 2.03 0.00 3.12 0.00 0.00 3.16 7.36 0.00 0.00 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0.00 1.20 0.00 0.00 *127 S 7.57 4.31 0.00 3.99 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 0.00 128 C 8.39 4.37 0.00 2.93 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 0.00 129 A 8.02 4.27 0.99 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 0.00 0.00 130 S 8.12 4.45 0.00 3.83 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 *132 A 8.25 4.25 1.24 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 0.00 0.00 133 G 9.02 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 0.00 0.00 0.00 134 T 7.51 4.16 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 1.16 0.00 0.00 135 Q 8.62 4.50 0.00 2.07 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 136 C 9.18 5.30 0.00 2.91 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 0.00 137 L 9.00 5.17 0.00 1.75 1.57 1.03 1.16 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 0.00 138 I 9.04 5.34 1.88 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 1.59 1.01 0.00 0.00 139 S 8.59 4.87 0.00 3.54 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 0.00 140 G 7.52 3.75 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 0.00 0.00 0.00 141 W 8.53 4.63 0.00 3.21 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 0.00 142 G 8.59 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 0.00 0.00 0.00 0.00 143 N 9.21 4.20 0.00 2.57 2.68 0.00 0.00 7.05 7.84 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 0.00 144 T 8.37 5.18 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 1.30 0.00 0.00 145 K 7.99 4.64 0.00 1.78 1.83 0.00 1.68 0.00 0.00 1.86 0.00 0.00 3.05 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.28 1.30 7.81 146 S 8.55 4.34 0.00 4.26 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 0.00 147 S 7.74 4.38 0.00 3.79 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 0.00 148 G 9.70 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 0.00 149 T 7.93 4.73 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 150 S 9.17 4.38 0.00 3.79 3.61 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 0.00 151 Y 8.61 5.02 0.00 3.00 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 0.00 152 P 0.00 4.67 0.00 2.46 2.10 0.00 4.19 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.05 0.00 153 D 8.78 4.55 0.00 2.80 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 0.00 154 V 7.39 5.48 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 1.07 0.00 0.00 0.97 0.00 0.00 155 L 8.37 3.22 0.00 1.35 1.25 -0.80 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.19 4.94 0.00 1.68 1.51 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.48 7.81 157 C 8.48 5.21 0.00 1.55 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 0.00 0.00 0.00 158 L 8.56 5.04 0.00 1.72 1.47 1.04 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.10 5.07 0.00 1.82 1.82 0.00 1.89 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.66 1.47 7.81 160 A 9.06 4.76 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 0.00 161 P 0.00 5.04 0.00 2.02 2.08 0.00 3.03 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.72 0.00 162 I 8.30 4.15 1.95 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.72 0.81 0.00 0.00 163 L 8.69 4.97 0.00 1.66 1.60 0.93 1.04 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 0.00 164 S 8.53 4.23 0.00 4.01 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 0.00 165 D 8.88 4.36 0.00 2.84 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 0.00 166 S 8.07 4.11 0.00 3.94 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 0.00 167 S 8.26 4.14 0.00 4.10 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 0.00 168 C 8.43 4.31 0.00 3.20 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 0.00 169 K 8.40 4.02 0.00 1.87 1.90 0.00 1.85 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.54 1.67 7.81 170 S 8.18 4.24 0.00 3.97 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 0.00 171 A 7.87 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.66 4.84 0.00 3.07 3.09 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 0.00 173 P 0.00 4.62 0.00 2.08 2.04 0.00 3.89 0.00 0.00 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.07 0.00 174 G 9.02 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 0.00 0.00 0.00 175 Q 8.23 4.53 0.00 2.50 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.55 6.66 0.00 0.00 0.00 0.00 0.00 2.28 2.57 0.00 176 I 7.88 4.35 1.98 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 1.84 1.04 0.99 0.00 0.00 177 T 8.26 4.50 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 1.28 0.00 0.00 178 S 8.53 4.28 0.00 4.00 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 0.00 179 N 8.13 4.96 0.00 3.07 3.11 0.00 0.00 6.45 8.85 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 0.00 180 M 7.97 5.57 0.00 1.88 2.10 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.61 0.00 181 F 8.88 5.12 0.00 3.10 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 C 9.22 5.94 0.00 2.97 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 9.02 5.04 1.16 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 0.00 0.00 184A G 7.40 3.99 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 0.00 0.00 0.00 184 Y 8.54 4.63 0.00 2.99 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 0.00 185 L 8.74 4.13 0.00 1.74 1.74 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.22 4.11 0.00 2.10 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 0.00 2.33 2.27 0.00 187 G 7.64 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 188A G 9.51 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 0.00 188 K 7.40 4.83 0.00 1.45 1.75 0.00 1.04 0.00 0.00 1.32 0.00 0.00 2.56 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.24 7.81 189 D 8.85 4.69 0.00 2.84 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.22 4.91 0.00 4.19 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 0.00 191 C 9.10 4.75 0.00 2.97 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 0.00 192 Q 8.54 4.32 0.00 2.35 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 5.23 0.00 0.00 0.00 0.00 0.00 2.56 2.54 0.00 193 G 9.33 4.40 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.48 4.73 0.00 2.92 2.79 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 0.00 195 S 8.08 4.49 0.00 3.98 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 0.00 196 G 8.88 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 0.00 197 G 7.87 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.14 0.00 2.35 2.40 0.00 3.75 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.16 0.00 199 V 8.69 4.58 2.22 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 1.02 0.00 0.00 0.50 0.00 0.00 200 V 8.73 4.82 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 0.81 0.00 0.00 0.67 0.00 0.00 201 C 8.72 5.09 0.00 2.77 2.83 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 0.00 202 S 9.81 3.71 0.00 3.95 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 0.00 203 G 8.53 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 0.00 0.00 0.00 204 K 7.64 4.69 0.00 1.70 1.64 0.00 1.84 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.40 7.81 *209 L 8.24 4.26 0.00 1.50 1.64 1.02 0.76 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 0.00 210 Q 8.91 4.48 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.66 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 211 G 8.04 5.32 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 0.00 0.00 0.00 212 I 8.23 5.29 1.93 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 0.92 1.00 0.00 0.00 213 V 8.91 3.68 2.38 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 1.00 0.00 0.00 1.23 0.00 0.00 214 S 8.41 4.82 0.00 4.01 3.81 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 0.00 215 W 7.40 4.92 0.00 3.34 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 0.00 216 G 8.31 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 0.00 217 S 8.72 4.64 0.00 4.06 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 *219 G 8.05 4.35 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 0.00 0.00 0.00 220 C 8.12 4.92 0.00 2.95 2.95 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 221A A 9.51 4.22 1.37 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 0.00 221 Q 7.35 4.56 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.93 0.00 0.00 0.00 0.00 0.00 2.51 2.46 0.00 222 K 8.48 4.11 0.00 1.72 1.72 0.00 1.93 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.63 7.81 223 N 9.15 4.28 0.00 2.81 2.80 0.00 0.00 6.75 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 K 7.60 4.32 0.00 1.62 1.72 0.00 1.34 0.00 0.00 1.19 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.45 7.81 225 P 0.00 4.62 0.00 2.14 2.11 0.00 3.73 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.02 0.00 226 G 8.43 3.55 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.55 4.35 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 -0.92 0.00 0.00 228 Y 8.10 4.90 0.00 1.43 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 0.00 0.00 0.00 0.00 229 T 8.67 4.37 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 1.27 0.00 0.00 230 K 9.35 5.12 0.00 2.14 1.91 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.50 1.59 7.81 231 V 8.87 3.93 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 1.32 0.00 0.00 1.15 0.00 0.00 232 C 8.28 4.33 0.00 3.15 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 0.00 233 N 7.98 4.25 0.00 2.29 2.33 0.00 0.00 6.64 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 Y 7.91 4.81 0.00 3.23 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 V 8.04 3.66 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 1.13 0.00 0.00 1.04 0.00 0.00 236 S 8.07 4.09 0.00 3.96 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 W 8.38 4.19 0.00 3.59 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 0.00 238 I 8.44 3.25 2.05 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.07 0.78 0.00 0.00 239 K 7.98 3.75 0.00 1.86 1.76 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.57 7.81 240 Q 8.20 3.87 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.85 0.00 0.00 0.00 0.00 0.00 2.33 2.47 0.00 241 T 7.21 3.54 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 0.79 0.00 0.00 242 I 7.20 2.69 1.45 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.08 0.47 0.00 0.00 243 A 7.67 3.99 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 0.00 244 S 7.47 4.55 0.00 3.96 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 0.00 245 N 7.95 4.68 0.00 3.13 3.01 0.00 0.00 7.04 6.86 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 * Residues marked with a * may have inaccurate shift predictions.