NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.3485 7.8833 121.4722 61.2403 38.8675 174.0585 17 I 4.3781 8.6742 127.1701 60.3956 38.3211 174.8114 18 G 3.9241 8.4247 112.0699 46.3909 0.0000 173.1278 19 G 4.3931 7.7792 108.0860 44.3231 0.0000 173.3826 20 R 4.8866 8.4493 115.0753 53.8501 33.2477 174.5287 21 E 4.3766 8.6818 121.7319 56.2708 30.2166 176.7273 22 S 4.3273 8.6854 123.5955 58.0225 63.9056 174.3808 23 R 3.8286 8.5315 123.3731 55.6570 30.3605 174.1895 24 P 3.8838 0.0000 0.0000 64.6763 31.6086 175.5244 25 H 4.1358 8.5841 118.2270 56.8951 26.0931 175.6896 26 S 4.4856 7.7151 113.4572 59.2252 63.9420 174.7033 27 R 4.2323 7.2152 120.0936 53.4100 30.1884 173.8523 28 P 4.6075 0.0000 0.0000 63.6916 31.9095 178.0634 29 Y 4.8205 6.3783 116.2155 56.9862 38.9554 175.0803 30 M 4.9745 7.5336 121.4001 55.5286 32.6954 175.6656 31 A 5.1359 9.5272 124.4958 50.3165 22.9300 174.0399 32 Y 4.6138 8.7624 122.2249 55.6933 41.5344 174.2527 33 L 4.8123 8.2035 126.8191 53.0445 44.4330 175.4825 34 Q 4.1022 8.6421 124.0280 54.5160 29.9236 174.8394 35 I 4.4050 8.3854 126.9286 60.3072 38.5711 174.1649 36 Q 3.7247 8.9631 131.2382 55.1226 28.9691 173.7100 36A S 4.5375 8.1271 115.6728 56.6253 64.5832 172.6004 36B P 4.4470 0.0000 0.0000 61.9341 32.1357 176.1409 37 A 4.0533 8.2024 121.2719 52.2796 15.6817 175.4545 38 G 3.4411 8.3304 112.6538 45.4043 0.0000 172.0616 39 Q 4.0184 7.7445 124.0198 58.4977 29.3144 176.4360 40 S 4.7323 7.1794 108.8868 57.4644 66.3369 174.6999 41 R 4.9703 8.5037 120.9077 55.0066 32.6719 174.3961 42 C 4.9949 8.6065 116.8454 56.2533 45.7729 172.5662 43 G 4.6287 8.6247 108.1556 45.2634 0.0000 172.0591 44 G 4.8663 8.3397 106.1491 47.1173 0.0000 172.3772 45 F 5.7985 8.2002 113.8811 54.9568 41.7429 173.8235 46 L 4.6223 9.4154 124.8671 55.4419 42.5585 177.5141 47 V 4.4235 8.2736 118.1676 61.0163 33.7187 175.1864 48 R 4.5038 7.3538 117.9003 55.4743 32.5708 174.8879 49 E 4.1832 8.6627 121.1432 58.5353 29.7245 177.8487 50 D 5.0028 8.1540 116.4125 52.6469 41.4160 175.1402 51 F 5.3190 8.3392 117.6611 55.9837 43.4743 173.7368 52 V 4.8294 8.9129 122.6842 60.9828 34.5815 173.7268 53 L 4.8682 8.2881 129.8610 54.1507 44.0734 175.2927 54 T 4.9423 8.4549 118.7923 61.5940 71.2704 171.6354 55 A 4.5020 8.4969 123.2315 51.0741 19.9862 178.7021 56 A 3.8491 8.2929 124.7448 55.0487 18.5596 179.2634 57 H 4.5233 8.2526 109.8482 57.2351 28.7477 175.4367 58 C 4.5396 7.6569 117.1478 56.5024 40.1953 173.6128 59 W 4.2451 7.7931 130.7037 57.8706 30.7096 175.1918 60 G 3.5433 6.4858 111.3747 43.8310 0.0000 173.2970 61 S 3.6006 7.8574 114.5195 60.4732 63.5966 173.7030 *63 N 5.1086 7.8281 118.9969 53.3955 40.2652 173.1741 64 I 4.8223 8.0162 125.6980 59.4739 41.1752 173.5596 65 N 4.9189 9.0480 126.7661 52.0282 40.5397 173.5157 66 V 4.5231 8.6796 127.5341 61.9656 33.6598 174.5107 67 T 5.0164 8.9836 124.8295 61.9186 70.8759 173.4318 68 L 4.8629 8.9563 126.5628 53.4217 45.3550 177.2728 69 G 4.0997 9.0534 106.4904 46.4599 0.0000 173.5439 70 A 4.9164 7.9043 121.1681 51.0761 20.6938 175.9403 71 H 4.6915 9.5483 116.6702 57.0511 31.6718 173.2714 72 N 5.2084 9.0325 124.1637 51.7732 38.6077 175.4531 73 I 3.6297 8.3297 119.9788 62.3428 37.7267 176.6304 74 Q 4.4579 8.3187 119.9604 55.6846 28.7117 175.2995 75 R 4.6759 7.3443 115.6992 54.4439 33.8518 176.1742 76 R 4.2826 8.3080 119.9285 55.3986 29.0916 175.4025 77 E 4.4891 8.1509 122.0713 54.7958 30.8980 177.6428 78 N 4.5029 8.6520 119.8520 55.2365 37.7615 175.9063 79 T 4.1634 7.7595 108.3625 62.6155 69.6464 174.1877 80 Q 4.6011 7.6020 121.6637 55.7327 30.1286 175.6051 81 Q 4.3766 8.9696 120.8759 54.6608 32.6524 173.6926 82 H 5.4201 8.7667 121.5645 54.2448 30.6693 174.6383 83 I 4.7497 8.7277 123.9243 59.8655 41.8223 174.6433 84 T 4.6623 8.5216 116.5688 60.9501 70.6849 173.6276 85 A 4.3401 8.4281 126.6677 52.1005 18.3406 177.7710 86 R 4.0868 9.1792 124.6185 58.9509 30.9945 177.0875 87 R 4.7593 7.7822 115.7707 54.5401 34.9935 174.3573 88 A 4.9379 8.8213 124.3835 50.4180 20.6638 175.4027 89 I 4.3540 9.0194 123.4585 60.8033 38.0845 175.9450 90 R 4.5041 8.5148 126.2157 55.5199 31.3464 176.3342 91 H 3.2517 8.3313 122.0585 55.5902 30.1776 174.8188 92 P 4.2767 0.0000 0.0000 65.0831 31.3786 177.0762 93 Q 4.5040 7.7240 115.1381 55.4305 28.6480 174.6257 94 Y 4.1842 7.9939 121.3233 57.7827 39.1375 174.4484 95 N 4.4896 8.1969 126.3504 51.3970 39.5517 174.7907 96 Q 3.5055 7.7966 127.8124 58.5717 29.6245 177.5049 97 R 3.9349 7.8179 117.7143 58.9252 30.0985 177.1375 98 T 4.1528 7.7649 104.3355 60.7256 69.7745 174.0386 99 I 3.1121 7.1966 122.1446 62.4290 35.2527 173.2933 100 Q 4.4640 7.6322 119.3956 55.7431 30.7847 174.1464 101 N 4.3638 8.6474 117.7923 54.6251 36.2186 175.8000 102 D 4.8035 7.8932 117.0228 53.1332 39.6882 174.6738 103 I 4.7459 7.1375 120.9129 59.4074 42.3221 172.8167 104 M 5.3801 9.0316 126.6657 54.4501 36.2999 173.0187 105 L 5.1287 9.3718 125.6063 53.0963 44.6387 175.3451 106 L 5.1221 9.1718 123.9329 53.0558 44.0977 175.4536 107 Q 3.7982 8.8441 127.3439 54.6473 29.1638 175.2092 108 L 4.4511 8.4429 127.9914 54.4827 42.3786 178.6575 109 S 4.4551 8.5920 117.5632 61.0532 63.3923 174.6008 110 R 4.6139 7.2407 115.2068 54.3435 32.1795 174.9315 111 R 4.3249 8.2353 118.5911 56.4018 30.8216 176.9618 112 V 3.9616 8.4828 116.0541 61.2701 32.7115 176.7216 113 R 4.3541 8.6826 121.2357 54.5102 29.6556 176.1719 114 R 4.1496 8.4724 125.5874 56.6155 30.7710 175.2432 115 N 4.7360 8.8323 121.3177 51.8339 40.3665 175.0981 116 R 3.9182 8.7211 114.4085 59.2689 28.9909 177.2834 117 N 4.5389 8.6082 114.6437 53.7941 39.3690 174.6785 118 V 4.7281 8.0799 118.0423 61.4958 33.3482 173.2052 119 N 5.2986 8.5989 123.1525 50.9624 40.7275 172.5125 120 P 5.0277 0.0000 0.0000 63.0198 32.2267 176.0635 121 V 4.3567 8.4568 121.9189 59.9955 33.3487 175.6203 122 A 4.2315 8.3859 124.3067 52.1652 18.9251 177.0461 123 L 4.7422 8.3619 121.4261 52.5903 43.9845 174.5975 124 P 4.5963 0.0000 0.0000 62.0939 32.7042 176.1156 125 R 4.1406 8.4050 118.4708 55.4854 30.7775 176.3980 126 A 4.1348 8.2518 122.9400 53.5714 18.8919 177.4627 127 Q 3.5152 8.3471 121.0066 56.5631 28.2311 172.9023 128 E 4.0903 7.8967 117.8628 55.5228 29.6612 176.9234 129 G 4.0299 8.3642 116.2677 44.5365 0.0000 171.6069 130 L 4.5443 7.9091 119.5940 53.3940 45.0461 175.8787 131 R 4.2431 8.4379 124.8826 54.8264 31.0205 174.3852 132 P 4.2684 0.0000 0.0000 64.0963 31.8332 176.8759 133 G 3.9939 8.9969 110.9845 45.2456 0.0000 174.0973 134 T 4.0512 7.4881 117.8438 63.5118 69.5638 173.6255 135 L 4.8105 8.4114 126.1779 54.5022 42.6682 176.8433 136 C 5.2177 9.0809 120.0754 55.4562 40.0871 172.8846 137 T 5.2866 9.2959 118.3539 61.8015 71.1645 173.8839 138 V 5.2305 8.9074 124.1026 59.0829 34.6573 174.3772 139 A 5.0245 8.4481 122.8113 50.4858 22.8145 175.2422 140 G 3.8647 7.7654 107.4474 46.1442 0.0000 173.7813 141 W 4.8140 9.1017 116.4394 56.3148 29.2687 176.9657 142 G 4.0416 8.5669 109.5356 44.8378 0.0000 174.1632 143 R 4.3152 8.6361 118.6778 56.4077 30.4228 177.6352 144 V 4.7575 8.1662 112.0745 61.1253 32.4551 175.7132 145 S 4.3398 7.3164 112.2282 57.9013 64.9419 175.0421 146 M 4.3915 8.7343 119.2662 58.0301 32.1676 176.8546 147 R 4.3608 8.0026 117.6511 57.2376 31.3626 175.9060 148 R 4.6297 7.9391 112.6648 54.3483 33.0428 174.7699 *151 G 4.2034 8.1696 105.7875 46.0069 0.0000 171.7330 152 T 4.7067 8.2047 113.1172 60.9221 70.5742 174.4353 153 D 4.6307 8.8016 126.5333 55.4879 41.7372 176.1803 154 T 5.8085 7.2160 107.5175 58.4218 71.6826 174.1829 155 L 3.0739 7.9189 124.5175 55.0926 43.3361 175.9000 156 R 5.3489 8.0278 123.5231 54.6561 34.7403 173.6340 157 E 5.1858 8.9737 117.1454 56.0470 33.5011 174.2949 158 V 4.6716 8.5378 118.1157 60.8488 35.1653 172.5866 159 Q 5.0110 8.5943 121.5258 54.8818 29.9489 175.0611 160 L 4.8560 8.9232 123.8335 52.8363 45.8465 175.1845 161 R 4.9679 8.1877 121.3537 54.3688 32.6299 175.3633 162 V 3.9192 8.4084 126.8217 63.2704 32.5415 175.1517 163 Q 4.8801 8.5907 126.7232 53.8568 31.3833 175.7886 164 R 4.0783 8.4985 119.6412 56.2412 30.9811 177.6811 165 D 4.4743 9.0718 122.3694 57.8557 40.6446 179.0066 166 R 3.8876 8.1876 117.2935 59.8477 30.0241 178.0597 167 Q 4.0711 8.2167 117.7421 59.3031 28.8452 177.9924 168 C 4.2168 7.8298 116.9285 59.5665 39.9449 175.4826 169 L 4.1266 7.9188 122.0202 57.3459 41.6233 177.6665 170 R 4.4828 7.5629 112.0256 55.8900 30.2856 176.4786 171 I 3.9713 7.4181 118.7085 61.8112 38.8313 175.7050 172 F 5.0401 8.3290 120.1119 55.2411 40.7636 176.5880 173 G 3.7157 9.2068 115.3269 48.5227 0.0000 174.0984 174 S 4.7295 8.0689 113.2206 58.0484 63.0931 173.4142 175 Y 4.3789 7.8283 122.5559 57.6947 39.0086 175.0656 176 D 4.5302 8.9519 126.3712 51.3290 42.4628 174.1404 177 P 4.0268 0.0000 0.0000 65.3273 31.1765 177.7366 178 R 4.1686 7.9228 116.7849 57.5271 30.5307 176.9556 179 R 4.5994 8.0967 114.9639 55.6204 32.6234 175.0042 180 Q 5.3056 7.9026 116.0849 54.0924 33.3299 174.3561 181 I 4.8472 8.9790 120.0952 59.8875 41.5185 173.9393 182 C 5.1363 8.9238 125.9019 55.3950 42.1510 172.3638 183 V 4.5972 9.0536 125.8004 62.2008 35.0802 174.8780 184A G 4.1109 9.2301 114.9429 46.0926 0.0000 172.7032 184 D 4.5114 8.6108 124.6257 53.4960 41.7758 177.1765 185 R 4.0640 8.5610 123.2633 58.7456 29.6579 177.6636 186 R 4.1757 8.0748 116.4721 57.1691 30.4013 176.0812 187 E 4.7354 7.7557 116.9726 54.6148 32.5921 177.0082 188A R 4.3543 8.1624 122.4371 54.8333 28.8253 175.2100 188 K 5.0902 7.2613 115.9637 54.7658 36.1902 176.5378 189 A 4.5965 8.3603 124.0739 51.3631 23.3335 175.2092 190 A 4.6615 9.4672 121.9777 52.0462 20.0089 177.1704 191 F 4.8994 9.1311 119.4423 57.2677 42.1358 172.9957 192 K 4.0496 7.2466 119.8316 58.8367 31.6811 177.5398 193 G 4.0878 8.9544 112.4206 45.6681 0.0000 173.5414 194 D 4.7242 8.4135 118.7348 54.7829 41.7472 176.7141 195 S 4.3599 7.9311 116.2728 60.5587 63.4049 175.3406 196 G 4.3495 8.5770 112.8497 46.1890 0.0000 173.7803 197 G 4.3288 7.9313 107.4549 45.5028 0.0000 171.7368 198 P 4.7337 0.0000 0.0000 62.1361 33.4666 174.9926 199 L 4.8691 8.5772 123.7008 53.6529 44.0152 175.0164 200 L 5.0006 9.1384 128.2705 53.4898 43.6963 175.2127 201 C 5.0268 8.8123 122.2768 55.1220 42.8689 174.4102 202 N 4.3690 9.5103 122.9417 54.6502 35.6680 174.5055 203 N 4.2687 8.4489 109.5498 53.7725 36.6830 174.4355 204 V 4.1347 7.4169 117.3070 60.9280 33.8967 174.3731 *209 A 4.4637 8.3412 127.4790 52.5938 18.3953 175.3892 210 H 4.4507 9.1383 119.2669 58.2525 30.5583 175.3569 211 G 5.1868 7.9519 103.6509 45.6774 0.0000 171.3936 212 I 5.4557 8.4025 119.4864 58.9352 41.0432 175.5277 213 V 2.4610 8.6876 127.4310 63.5424 31.7703 174.1847 214 S 4.8239 8.2838 120.8740 58.5249 64.2168 173.3907 215 Y 4.6828 7.7958 114.3767 56.8353 42.0682 172.9163 216 G 3.7886 8.0250 105.6030 45.4191 0.0000 173.2222 217 K 4.3756 8.5327 118.6201 56.1823 32.6537 178.3473 218 S 4.2933 8.8837 117.2272 61.4339 62.9945 176.0109 219 S 4.1907 8.1307 114.8940 59.5321 62.8514 175.2182 220 G 3.9434 8.3799 107.9979 44.7853 0.0000 173.2358 221 V 3.5641 7.4881 120.5376 61.7528 31.4728 173.6197 *224 P 4.3069 0.0000 0.0000 61.8702 32.2790 173.8733 225 P 4.9429 0.0000 0.0000 62.3223 32.9070 174.6713 226 E 4.7870 9.3210 119.3699 54.6609 33.6502 174.1576 227 V 4.8374 8.2367 119.1946 61.1551 33.8096 174.4202 228 F 5.2606 9.2114 125.8285 55.8233 42.8006 174.7285 229 T 4.4683 8.9348 119.0013 63.5139 70.0285 174.2548 230 R 4.6753 9.3810 127.6087 55.3588 30.1883 176.7619 231 V 3.9096 8.9076 128.5490 66.1140 31.7530 178.5114 232 S 4.3135 8.2155 113.3316 60.8603 62.9279 175.7732 233 S 4.1849 7.8522 115.6160 59.8678 62.8765 174.6537 234 F 4.9273 8.2836 118.2255 56.9796 39.8377 176.9128 235 L 4.0662 8.3668 122.9101 57.8652 41.3635 177.5509 236 P 4.2443 0.0000 0.0000 65.3907 31.3085 178.5177 237 W 4.2024 8.3220 126.7609 60.2764 30.7239 178.0947 238 I 3.2856 8.2614 120.3036 64.4130 36.6351 178.6846 239 R 3.8235 8.5633 119.2257 59.3928 29.7902 179.3868 240 T 3.8306 7.8135 115.6610 66.8604 68.2425 177.0925 241 T 3.6017 7.1660 116.5700 66.5717 68.3578 176.2970 242 M 3.3969 7.1904 119.6081 57.5073 32.1084 178.5022 243 R 3.9651 7.6136 118.2930 59.3748 30.4768 176.3989 244 S 4.2781 7.9424 116.5759 58.4997 63.0735 173.7254 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 4.35 1.88 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 1.59 0.76 0.93 0.00 0.00 17 I 8.67 4.38 1.89 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.99 0.85 0.00 0.00 18 G 8.42 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 19 G 7.78 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 R 8.45 4.89 0.00 1.82 1.97 0.00 2.76 0.00 0.00 3.08 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.51 0.00 21 E 8.68 4.38 0.00 1.99 1.89 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 2.33 2.46 0.00 22 S 8.69 4.33 0.00 3.71 3.70 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 23 R 8.53 3.83 0.00 1.81 1.78 0.00 3.19 0.00 0.00 3.32 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 24 P 0.00 3.88 0.00 1.96 1.69 0.00 3.78 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 1.88 1.62 0.00 25 H 8.58 4.14 0.00 3.31 3.39 0.00 5.69 0.00 0.00 0.00 0.00 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 S 7.72 4.49 0.00 3.91 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 27 R 7.22 4.23 0.00 1.53 1.17 0.00 3.04 0.00 0.00 3.42 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.46 0.00 28 P 0.00 4.61 0.00 2.33 2.42 0.00 3.69 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 2.22 1.96 0.00 29 Y 6.38 4.82 0.00 3.43 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 30 M 7.53 4.97 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.41 0.00 31 A 9.53 5.14 1.32 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 32 Y 8.76 4.61 0.00 1.90 2.43 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 33 L 8.20 4.81 0.00 1.37 1.35 0.89 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 8.64 4.10 0.00 1.87 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.78 0.00 0.00 0.00 0.00 0.00 2.29 2.00 0.00 35 I 8.39 4.41 1.85 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.74 0.70 0.00 0.00 36 Q 8.96 3.72 0.00 2.22 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.81 0.00 0.00 0.00 0.00 0.00 2.08 2.08 0.00 36A S 8.13 4.54 0.00 3.81 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 36B P 0.00 4.45 0.00 2.19 2.19 0.00 3.67 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 37 A 8.20 4.05 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 38 G 8.33 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Q 7.74 4.02 0.00 2.24 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.64 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 40 S 7.18 4.73 0.00 3.85 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 41 R 8.50 4.97 0.00 1.49 1.71 0.00 3.24 0.00 0.00 3.21 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.66 0.00 42 C 8.61 4.99 0.00 2.78 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 43 G 8.62 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 44 G 8.34 4.87 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 45 F 8.20 5.80 0.00 3.30 3.29 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 46 L 9.42 4.62 0.00 1.94 1.78 1.05 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.27 4.42 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 0.78 0.00 0.00 0.98 0.00 0.00 48 R 7.35 4.50 0.00 1.85 2.00 0.00 3.23 0.00 0.00 3.36 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 49 E 8.66 4.18 0.00 2.14 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 2.42 2.40 0.00 50 D 8.15 5.00 0.00 2.42 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 51 F 8.34 5.32 0.00 2.93 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 52 V 8.91 4.83 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.95 0.00 0.00 53 L 8.29 4.87 0.00 1.37 0.24 0.99 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.45 4.94 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 1.18 0.00 0.00 55 A 8.50 4.50 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 56 A 8.29 3.85 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.25 4.52 0.00 3.38 3.68 0.00 5.55 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.66 4.54 0.00 3.09 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 59 W 7.79 4.25 0.00 3.29 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 60 G 6.49 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 0.00 0.00 0.00 61 S 7.86 3.60 0.00 3.90 3.94 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 *63 N 7.83 5.11 0.00 2.71 2.65 0.00 0.00 7.44 7.82 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 64 I 8.02 4.82 1.73 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.28 0.78 0.00 0.00 65 N 9.05 4.92 0.00 2.74 2.60 0.00 0.00 6.35 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 V 8.68 4.52 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 0.98 0.00 0.00 0.88 0.00 0.00 67 T 8.98 5.02 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 1.19 0.00 0.00 68 L 8.96 4.86 0.00 1.52 1.57 1.04 0.59 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 69 G 9.05 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 7.90 4.92 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 71 H 9.55 4.69 0.00 3.00 3.40 0.00 5.77 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 9.03 5.21 0.00 2.78 2.87 0.00 0.00 7.11 7.64 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 73 I 8.33 3.63 0.88 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.25 0.14 -0.54 0.00 0.00 74 Q 8.32 4.46 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.72 0.00 0.00 0.00 0.00 0.00 2.26 2.61 0.00 75 R 7.34 4.68 0.00 1.75 1.77 0.00 3.16 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 76 R 8.31 4.28 0.00 1.80 1.91 0.00 3.19 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 77 E 8.15 4.49 0.00 2.05 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 2.39 2.48 0.00 78 N 8.65 4.50 0.00 2.82 2.94 0.00 0.00 6.12 7.71 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 79 T 7.76 4.16 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 80 Q 7.60 4.60 0.00 2.12 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.68 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 81 Q 8.97 4.38 0.00 1.90 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 82 H 8.77 5.42 0.00 3.02 3.18 0.00 5.67 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.73 4.75 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.75 0.90 0.00 0.00 84 T 8.52 4.66 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 1.17 0.00 0.00 85 A 8.43 4.34 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 R 9.18 4.09 0.00 1.80 1.98 0.00 3.19 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 87 R 7.78 4.76 0.00 1.74 1.78 0.00 3.16 0.00 0.00 3.37 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 88 A 8.82 4.94 1.36 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 89 I 9.02 4.35 2.01 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.85 1.13 0.00 0.00 90 R 8.51 4.50 0.00 1.60 1.70 0.00 2.89 0.00 0.00 2.61 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.59 0.00 91 H 8.33 3.25 0.00 2.59 2.95 0.00 5.59 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 92 P 0.00 4.28 0.00 2.00 2.09 0.00 2.50 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.18 0.00 93 Q 7.72 4.50 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.93 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 94 Y 7.99 4.18 0.00 2.94 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 95 N 8.20 4.49 0.00 2.58 2.45 0.00 0.00 6.40 6.62 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 96 Q 7.80 3.51 0.00 1.83 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.85 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 97 R 7.82 3.93 0.00 1.74 1.99 0.00 3.25 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.50 0.00 98 T 7.76 4.15 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 1.15 0.00 0.00 99 I 7.20 3.11 1.23 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.06 0.85 0.00 0.00 100 Q 7.63 4.46 0.00 2.08 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.90 6.41 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 101 N 8.65 4.36 0.00 2.91 2.67 0.00 0.00 6.93 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 7.89 4.80 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 0.00 103 I 7.14 4.75 1.34 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.11 -0.03 0.00 0.00 104 M 9.03 5.38 0.00 2.09 1.77 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.61 0.00 105 L 9.37 5.13 0.00 1.57 1.64 0.23 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 106 L 9.17 5.12 0.00 1.60 1.54 0.87 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 107 Q 8.84 3.80 0.00 1.82 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.98 0.00 0.00 0.00 0.00 0.00 1.90 1.32 0.00 108 L 8.44 4.45 0.00 1.51 1.57 0.88 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 109 S 8.59 4.46 0.00 3.84 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 0.00 110 R 7.24 4.61 0.00 2.05 1.85 0.00 3.05 0.00 0.00 3.20 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 111 R 8.24 4.32 0.00 1.71 1.90 0.00 3.20 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 112 V 8.48 3.96 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 0.74 0.00 0.00 1.01 0.00 0.00 113 R 8.68 4.35 0.00 1.82 1.98 0.00 3.07 0.00 0.00 3.14 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 114 R 8.47 4.15 0.00 1.81 1.90 0.00 3.30 0.00 0.00 3.30 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 115 N 8.83 4.74 0.00 2.96 2.89 0.00 0.00 6.35 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 0.00 116 R 8.72 3.92 0.00 1.95 2.14 0.00 3.18 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 117 N 8.61 4.54 0.00 2.91 2.87 0.00 0.00 6.28 7.30 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 0.00 118 V 8.08 4.73 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 1.06 0.00 0.00 0.95 0.00 0.00 119 N 8.60 5.30 0.00 2.92 2.90 0.00 0.00 6.68 8.42 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 0.00 120 P 0.00 5.03 0.00 2.03 1.99 0.00 3.73 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 2.09 2.17 0.00 121 V 8.46 4.36 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 0.73 0.00 0.00 0.26 0.00 0.00 122 A 8.39 4.23 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 0.00 123 L 8.36 4.74 0.00 1.56 1.63 0.95 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 124 P 0.00 4.60 0.00 2.02 1.74 0.00 3.78 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.90 0.00 125 R 8.40 4.14 0.00 1.87 1.89 0.00 3.29 0.00 0.00 3.34 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.57 0.00 126 A 8.25 4.13 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 0.00 127 Q 8.35 3.52 0.00 2.11 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.84 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 128 E 7.90 4.09 0.00 1.98 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 2.48 2.37 0.00 129 G 8.36 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 0.00 130 L 7.91 4.54 0.00 1.48 1.45 0.67 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 131 R 8.44 4.24 0.00 1.94 1.81 0.00 3.20 0.00 0.00 3.31 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 132 P 0.00 4.27 0.00 2.03 2.05 0.00 3.63 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 2.03 2.09 0.00 133 G 9.00 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 0.00 134 T 7.49 4.05 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 1.16 0.00 0.00 135 L 8.41 4.81 0.00 1.50 1.57 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 136 C 9.08 5.22 0.00 2.70 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 T 9.30 5.29 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 0.00 138 V 8.91 5.23 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 1.14 0.00 0.00 139 A 8.45 5.02 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.77 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 9.10 4.81 0.00 3.55 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 0.00 142 G 8.57 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 0.00 143 R 8.64 4.32 0.00 2.18 2.43 0.00 3.17 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.82 0.00 144 V 8.17 4.76 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 0.79 0.00 0.00 1.02 0.00 0.00 145 S 7.32 4.34 0.00 3.88 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 0.00 146 M 8.73 4.39 0.00 2.05 2.20 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.69 0.00 147 R 8.00 4.36 0.00 1.83 1.95 0.00 3.26 0.00 0.00 3.29 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 148 R 7.94 4.63 0.00 2.05 1.97 0.00 2.87 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 *151 G 8.17 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 T 8.20 4.71 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 1.42 0.00 0.00 153 D 8.80 4.63 0.00 2.76 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 0.00 154 T 7.22 5.81 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 1.22 0.00 0.00 155 L 7.92 3.07 0.00 1.01 1.21 -0.41 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 156 R 8.03 5.35 0.00 1.69 1.84 0.00 3.19 0.00 0.00 3.20 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.54 0.00 157 E 8.97 5.19 0.00 2.03 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.22 0.00 158 V 8.54 4.67 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.96 0.00 0.00 159 Q 8.59 5.01 0.00 1.94 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 160 L 8.92 4.86 0.00 1.45 1.48 1.06 0.71 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 0.00 161 R 8.19 4.97 0.00 1.85 1.74 0.00 3.16 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 162 V 8.41 3.92 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 0.71 0.00 0.00 0.90 0.00 0.00 163 Q 8.59 4.88 0.00 1.93 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.60 0.00 0.00 0.00 0.00 0.00 2.29 2.50 0.00 164 R 8.50 4.08 0.00 1.87 1.86 0.00 3.14 0.00 0.00 3.33 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 165 D 9.07 4.47 0.00 2.80 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 0.00 166 R 8.19 3.89 0.00 1.82 2.01 0.00 3.24 0.00 0.00 3.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.78 0.00 167 Q 8.22 4.07 0.00 2.20 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 168 C 7.83 4.22 0.00 1.82 2.28 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 0.00 169 L 7.92 4.13 0.00 1.91 1.84 1.29 1.07 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 0.00 170 R 7.56 4.48 0.00 1.90 1.99 0.00 3.06 0.00 0.00 3.18 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.52 0.00 171 I 7.42 3.97 1.11 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.60 0.27 0.00 0.00 172 F 8.33 5.04 0.00 3.18 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 0.00 173 G 9.21 3.72 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 0.00 174 S 8.07 4.73 0.00 3.93 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 0.00 175 Y 7.83 4.38 0.00 3.10 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 0.00 176 D 8.95 4.53 0.00 2.52 2.35 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 0.00 177 P 0.00 4.03 0.00 2.23 2.31 0.00 3.70 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.05 0.00 178 R 7.92 4.17 0.00 1.96 1.93 0.00 3.05 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 179 R 8.10 4.60 0.00 1.68 2.03 0.00 3.23 0.00 0.00 3.05 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.41 0.00 180 Q 7.90 5.31 0.00 1.64 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.71 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 181 I 8.98 4.85 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.85 0.92 0.00 0.00 182 C 8.92 5.14 0.00 2.83 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 0.00 183 V 9.05 4.60 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 0.60 0.00 0.00 0.54 0.00 0.00 184A G 9.23 4.11 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 0.00 184 D 8.61 4.51 0.00 2.68 2.55 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 0.00 185 R 8.56 4.06 0.00 1.95 2.04 0.00 3.06 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 186 R 8.07 4.18 0.00 1.92 2.01 0.00 3.09 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 187 E 7.76 4.74 0.00 1.94 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.22 0.00 188A R 8.16 4.35 0.00 1.84 1.84 0.00 3.04 0.00 0.00 3.31 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 188 K 7.26 5.09 0.00 1.58 1.67 0.00 1.78 0.00 0.00 1.86 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.41 7.81 189 A 8.36 4.60 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 A 9.47 4.66 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 F 9.13 4.90 0.00 3.03 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 K 7.25 4.05 0.00 1.40 1.51 0.00 1.19 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.13 0.21 7.81 193 G 8.95 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 0.00 0.00 0.00 0.00 194 D 8.41 4.72 0.00 2.92 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 0.00 195 S 7.93 4.36 0.00 3.89 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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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 0.00 0.00 0.00 0.00 0.00 217 K 8.53 4.38 0.00 1.96 1.86 0.00 1.87 0.00 0.00 1.90 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.65 1.62 7.81 218 S 8.88 4.29 0.00 4.05 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 0.00 219 S 8.13 4.19 0.00 4.04 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 G 8.38 3.94 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 0.00 0.00 0.00 221 V 7.49 3.56 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 0.90 0.00 0.00 0.94 0.00 0.00 *224 P 0.00 4.31 0.00 2.42 2.13 0.00 3.85 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.15 0.00 225 P 0.00 4.94 0.00 2.14 2.24 0.00 3.70 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 2.02 1.94 0.00 226 E 9.32 4.79 0.00 2.10 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 2.51 2.59 0.00 227 V 8.24 4.84 0.75 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 0.98 0.00 0.00 0.08 0.00 0.00 228 F 9.21 5.26 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 0.00 229 T 8.93 4.47 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 1.18 0.00 0.00 230 R 9.38 4.68 0.00 1.94 1.97 0.00 3.12 0.00 0.00 3.13 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 231 V 8.91 3.91 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 1.09 0.00 0.00 1.21 0.00 0.00 232 S 8.22 4.31 0.00 4.23 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 S 7.85 4.18 0.00 3.44 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 F 8.28 4.93 0.00 3.24 3.31 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 0.00 235 L 8.37 4.07 0.00 1.70 1.78 0.99 1.18 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 0.00 236 P 0.00 4.24 0.00 2.24 2.14 0.00 3.67 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.17 0.00 237 W 8.32 4.20 0.00 3.52 3.60 0.00 0.00 0.00 0.00 0.00 0.00 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 8.26 3.29 2.06 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 1.60 1.18 0.79 0.00 0.00 239 R 8.56 3.82 0.00 1.76 1.91 0.00 3.10 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.79 0.00 240 T 7.81 3.83 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 241 T 7.17 3.60 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 0.87 0.00 0.00 242 M 7.19 3.40 0.00 1.50 1.71 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.81 0.00 243 R 7.61 3.97 0.00 1.80 1.94 0.00 3.23 0.00 0.00 3.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 244 S 7.94 4.28 0.00 4.00 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 * Residues marked with a * may have inaccurate shift predictions.