NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 45 D 4.5542 8.3649 120.1885 53.2975 41.3822 175.5917 46 P 4.0840 0.0000 0.0000 64.9288 30.1582 176.8301 47 L 3.9992 8.0301 118.8787 58.1481 42.4697 179.0436 48 V 4.0114 8.6272 119.0672 65.6802 31.5496 178.0208 49 G 3.6498 7.9908 105.5050 48.0766 0.0000 175.7386 50 V 3.3736 7.1615 121.1797 65.3275 31.3185 177.8263 51 F 4.5944 8.3700 120.6306 61.4817 39.2346 177.0931 52 L 3.7845 7.9130 117.9710 56.8132 41.4442 179.0211 53 W 3.9503 8.0252 128.2770 60.4980 30.0501 177.8259 54 G 2.0000 7.8131 105.4724 46.8281 0.0000 175.2111 55 V 3.7621 6.8803 120.2993 65.3616 31.3161 177.9241 56 A 3.7830 7.9011 120.3724 55.4944 18.1485 178.5994 57 H 3.5039 8.1337 117.7181 59.3555 29.6066 177.1983 58 S 4.1324 9.1922 115.8236 61.8606 62.6041 176.2929 59 I 3.5206 7.7807 122.6772 63.9077 37.1001 177.7416 60 N 4.4695 7.7044 116.9388 55.7761 38.6282 176.9369 61 E 3.8148 7.9655 120.6669 59.5165 29.7766 178.8730 62 L 3.9945 8.6903 119.5547 57.8040 41.3728 179.6606 63 S 4.1673 7.6825 113.4188 61.5143 62.8279 176.2471 64 Q 4.3657 8.0335 120.4218 56.5715 28.7743 176.0843 65 V 3.9496 7.3113 119.9602 60.0933 30.7256 173.2726 66 P 4.1489 0.0000 0.0000 62.1713 31.0548 174.5668 67 P 4.1445 0.0000 0.0000 62.2269 29.9490 174.0202 68 P 4.3633 0.0000 0.0000 62.3760 31.6099 177.6696 69 V 3.8601 8.5011 117.4812 63.3883 31.8082 176.1104 70 M 4.6335 7.3481 117.1855 53.3656 34.5697 174.5041 71 L 4.4727 8.4060 125.7061 53.0501 42.5248 176.3150 72 L 4.4620 8.0823 123.9648 53.2703 42.9725 176.4166 73 P 4.6448 0.0000 0.0000 66.3165 31.2367 178.5461 74 D 4.1855 8.3337 116.9564 57.7047 40.6161 178.6440 75 D 4.3123 7.9401 118.9221 57.1969 40.5648 178.1375 76 F 4.4307 8.6108 116.0700 58.3024 38.7448 175.6592 77 K 4.5634 7.7882 116.6375 56.2397 33.0766 176.0190 78 A 4.5660 8.2074 121.7869 52.2412 19.8524 176.9341 79 S 4.6034 8.0590 112.4146 58.5873 65.7739 175.3586 80 S 4.4714 7.6219 111.1946 57.6063 65.8713 174.0014 81 K 5.3401 8.8859 126.2184 54.8085 35.7411 175.6951 82 I 4.6076 9.0828 123.4091 59.6024 40.7098 174.1023 83 K 4.6723 8.7611 128.5356 54.4788 34.1520 175.3914 84 V 4.1978 7.7305 126.0239 61.0966 34.7238 173.6145 85 N 5.0455 8.6769 124.9365 51.4720 40.6738 173.6428 86 N 4.6756 8.8735 122.6322 52.7865 39.8240 175.3323 87 H 4.5977 9.0142 123.4543 55.5323 29.6506 173.2898 88 L 3.8185 8.5695 127.6327 55.5076 38.1331 175.1017 89 F 4.7973 8.0481 117.2596 57.9911 41.7428 176.2682 90 H 4.6056 8.2617 121.6971 54.8343 32.5183 174.0159 91 R 4.5591 8.5155 116.2787 57.4409 33.4254 176.6471 92 E 4.0516 8.5958 114.9341 58.8145 29.8924 177.1574 93 N 4.8833 7.4828 111.0472 52.2320 40.6349 174.0515 94 L 4.3081 7.2898 118.7973 51.9328 44.5737 174.5728 95 P 4.4273 0.0000 0.0000 62.5929 31.9840 176.5947 96 S 4.3470 8.5944 113.8689 61.1271 63.8590 173.2224 97 H 5.2985 8.5401 116.8465 53.1996 31.8456 172.0962 98 F 5.3251 7.9325 118.0774 55.6745 41.9094 172.7681 99 K 4.9973 9.1466 117.3966 55.3241 36.7802 175.5922 100 F 5.0282 8.5397 121.0024 57.4724 43.1291 173.1816 101 K 5.3232 7.5584 126.6684 55.0881 34.5673 174.2538 102 E 4.2992 8.5831 130.0064 55.4045 30.8837 174.7520 103 Y 4.3055 8.8408 126.4711 58.0895 38.3169 176.1183 104 C 4.0897 8.7767 122.8195 59.6811 25.7762 171.8315 105 P 5.2080 0.0000 0.0000 65.4173 31.2568 178.3192 106 Q 3.9034 7.9266 115.9303 58.9656 28.7494 178.6589 107 V 3.2344 7.3463 118.3765 66.2165 31.3409 178.0726 108 F 4.4187 7.6457 116.9748 60.0895 38.6946 177.6297 109 R 3.8421 7.7968 118.7892 59.4409 29.7679 178.0701 110 N 4.1695 7.7769 115.1208 56.6980 38.8248 176.4740 111 L 3.6047 7.8991 119.3791 58.0423 41.9919 179.4825 112 R 4.1014 8.5706 117.9485 59.6512 29.6325 178.3801 113 D 4.3128 7.9126 117.4577 57.7393 40.8023 178.5774 114 R 3.7306 7.6925 116.8915 57.9678 30.3253 177.9789 115 F 4.9915 7.9875 116.3141 57.7044 39.6886 175.8878 116 G 4.0124 8.4990 106.4483 45.8991 0.0000 174.0850 117 I 4.5666 7.5037 118.3260 58.6093 40.7942 175.1597 118 D 4.8662 8.5761 124.4732 52.5742 43.3715 175.8954 119 D 4.6902 8.7958 127.1720 58.2868 41.0846 179.3939 120 Q 3.8889 8.1506 117.7855 59.1442 28.6464 179.2113 121 D 4.3575 7.9799 119.3762 57.4736 40.9169 177.5850 122 Y 4.2197 8.5057 119.5835 61.3613 38.9352 177.5842 123 L 3.8590 9.2704 122.1646 58.0279 41.6282 179.0517 124 V 3.6030 8.0316 118.7119 65.1224 31.0036 178.3394 125 S 4.3839 7.9077 113.0006 60.4956 62.1496 174.9105 126 L 4.8256 7.7779 120.8992 55.6114 40.6526 176.2672 127 T 4.4486 7.8586 106.1932 61.7739 70.1189 173.8140 128 R 4.1879 7.3074 120.5585 56.6451 30.8380 175.7384 129 N 4.2420 7.2382 111.9220 51.9779 42.1293 172.5157 130 P 4.3547 0.0000 0.0000 62.0897 32.1084 174.1634 131 P 4.7390 0.0000 0.0000 63.0824 32.1203 175.8116 132 S 4.7052 8.9024 117.8015 57.5182 64.7389 173.2840 133 E 4.3144 8.6661 124.5389 56.1953 30.1619 175.7706 134 S 4.7152 8.5897 119.2332 56.5122 65.8639 172.3317 135 E 4.5322 8.5908 125.0462 54.4594 31.6847 176.1459 *140 R 4.2304 8.2306 124.2033 56.2798 30.9380 174.0415 141 F 5.4512 7.9231 120.4724 56.3004 44.4622 174.4100 142 L 4.6442 7.9423 112.8479 54.2890 44.5162 172.8636 143 I 4.0650 7.9674 124.8052 60.6706 38.2277 175.7113 144 S 4.5412 9.6959 123.6475 58.5720 63.3814 175.4214 145 Y 4.1088 8.9163 118.8925 60.1977 37.6764 176.9536 146 D 3.9635 7.3327 117.2645 53.6665 41.1374 176.0981 147 R 3.8777 8.3565 118.2264 57.2029 28.7015 177.5280 148 T 4.3922 8.4018 109.9257 62.0484 71.2120 173.9774 149 L 5.0994 7.7377 120.1488 52.5074 45.7016 175.7416 150 V 4.7140 8.9377 121.2396 61.2033 34.7637 174.4433 151 I 4.8646 8.3816 128.3882 59.6371 38.9044 174.2774 152 K 4.9423 8.8588 129.1175 53.8270 33.9122 175.3916 153 E 4.5881 8.8230 128.3348 56.6563 30.5762 175.5854 154 V 4.7060 8.4432 117.8590 60.1099 36.6244 174.5959 155 S 4.7009 9.0492 116.3420 56.9081 64.2044 175.3865 156 S 3.0472 8.3504 116.3838 61.5530 61.8810 176.4991 157 E 3.9591 7.8932 120.9954 58.7321 28.9812 178.7519 158 D 4.3032 7.9843 119.2643 57.0569 41.1478 178.3300 159 I 3.4933 7.3055 119.5992 64.1045 36.5929 177.7547 160 A 3.7646 7.1970 120.4762 55.5416 18.1332 179.2193 161 D 4.2443 7.4880 115.6874 57.6948 40.8692 178.6212 162 M 3.7247 7.7054 118.4281 59.3586 31.9615 178.2319 163 H 4.5919 7.9537 113.9706 58.3315 28.9359 177.6449 164 S 4.2164 7.3921 115.0801 61.3596 63.0101 175.5316 165 N 4.5620 8.1088 120.2107 54.7175 38.7588 176.2281 166 L 4.4805 8.2863 122.6542 58.6734 41.9778 178.5726 167 S 4.2252 8.0788 111.9625 61.5045 62.1497 175.4435 168 N 4.5337 8.1804 118.3395 56.9594 38.1038 176.2164 169 Y 4.2210 9.3693 121.4401 61.4916 38.2748 178.0702 170 H 4.1830 9.0821 119.3269 59.3044 29.9437 177.2898 171 Q 3.9708 9.0109 121.0300 58.8935 28.5181 177.1189 172 Y 4.0225 8.8602 121.8455 60.8528 38.6633 178.0787 173 I 3.3134 7.4568 120.1440 64.3729 37.0946 178.4279 174 V 3.4409 7.0524 117.6804 66.1831 31.1271 178.3809 175 K 4.0398 7.3017 116.4070 59.3275 31.9828 178.6760 176 C 3.8570 7.7101 117.9482 60.2719 31.3589 173.8121 177 H 4.0664 7.7333 114.3690 56.1603 26.5256 174.7478 178 G 4.0110 8.2580 105.6720 46.5419 0.0000 175.4638 179 N 4.9880 7.6503 112.7627 51.2595 37.5711 173.6104 180 T 4.6392 7.4211 110.4273 60.9079 71.7953 175.4598 181 L 4.4034 8.8943 120.8548 55.3505 41.8448 177.0702 182 L 4.7874 8.3318 119.6959 53.0703 42.9202 175.0110 183 P 4.0232 0.0000 0.0000 63.5689 32.1931 177.1463 184 Q 4.1869 8.3360 122.7053 54.6385 28.4015 173.4524 185 F 4.7285 10.0904 122.7133 57.9118 38.9419 174.9730 186 L 4.7770 9.1936 124.4826 55.1629 43.1452 176.4817 187 G 3.6166 7.8213 104.3244 45.9542 0.0000 172.3767 188 M 4.8189 6.3623 117.5929 55.1593 35.5484 172.8884 189 Y 5.1809 9.2128 123.7849 56.9747 43.3136 174.4879 190 R 4.7547 8.5803 120.9480 55.8368 32.7284 174.0758 191 V 4.4199 8.5249 127.5881 60.5870 33.3704 175.2210 192 S 5.0387 8.5437 120.8907 56.6913 66.3901 173.1788 193 V 4.4696 8.7858 121.2456 62.4343 35.2511 172.5645 194 D 4.5140 8.4854 126.5295 56.6390 39.7889 172.5852 195 N 4.2360 8.1477 107.3579 53.1403 37.1690 174.4463 196 E 4.5189 8.1962 115.9470 56.0220 32.0865 173.5178 197 D 4.8799 8.6030 124.0474 53.3734 42.4929 176.1205 198 S 4.6703 8.8084 118.4226 56.8874 66.8582 172.4460 199 Y 5.0192 8.6794 121.6302 56.7877 39.9306 174.5660 200 M 5.2286 8.6596 122.0876 53.4238 36.2814 174.4971 201 L 5.2024 8.6604 122.0537 53.4767 46.2458 175.0033 202 V 5.1275 8.7198 125.5186 61.6445 33.8962 174.2349 203 M 5.4361 9.6369 127.2159 53.0675 36.2674 174.9706 204 R 4.1825 8.3273 122.1387 56.9657 31.1168 175.4898 205 N 4.3555 8.9284 124.4231 53.3901 38.8164 174.7532 206 M 4.1332 8.6947 126.6480 58.5182 32.2659 176.9552 207 F 4.2805 7.5690 115.0977 56.2844 39.7038 174.2376 208 S 4.1291 7.0765 115.9844 57.4283 62.5690 174.6042 209 H 4.4168 8.7206 123.1034 57.4627 28.1181 175.7323 210 R 4.0419 6.4144 119.7798 57.7351 30.7106 175.9212 211 L 4.1137 8.3318 122.5629 53.3092 41.6981 175.5973 212 P 4.4455 0.0000 0.0000 62.2577 32.1779 176.2696 213 V 4.0295 8.1884 120.1720 63.2056 32.4038 174.9596 214 H 4.7530 9.8438 123.8499 56.6800 30.6478 175.2668 215 R 4.6604 7.6822 117.5230 53.9658 32.8307 175.1467 216 K 5.0967 8.1743 122.0152 54.2995 36.3901 174.7621 217 Y 5.2107 8.4188 118.8674 56.4560 42.2563 174.2637 218 D 4.9210 9.1382 122.9685 53.0249 41.8516 175.0151 219 L 4.2203 8.3126 125.0450 53.3116 43.9460 175.6061 220 K 4.4499 8.4436 120.3980 55.2223 35.3136 175.6398 221 G 3.9673 7.4171 110.3345 46.1978 0.0000 173.3986 *239 T 4.3122 7.9600 113.0913 62.7156 68.8297 175.1925 240 L 4.1806 7.8977 120.8779 55.1737 43.1473 179.3466 241 R 4.6349 9.0158 123.0841 56.1192 31.2830 177.0240 242 D 4.8253 8.8506 117.8033 55.3515 39.7813 176.9052 243 M 4.4274 8.0715 119.9711 57.4800 32.9303 177.9594 244 D 4.4537 8.1316 118.8948 56.6095 41.1327 177.8450 245 F 4.0179 8.3613 112.4893 57.4136 38.4733 176.4606 246 L 3.7799 7.1839 122.5753 55.9733 42.5089 177.0032 247 N 4.3159 7.8525 114.4073 53.9911 37.9482 176.3802 248 K 4.1031 7.3090 119.9080 55.8892 33.8745 175.0192 249 N 3.8476 7.2898 116.4919 53.7628 36.5822 172.2142 250 Q 4.2622 7.5293 121.9571 55.7632 30.4357 174.6991 251 K 4.5611 8.3546 117.6935 54.6905 34.0798 177.0040 252 V 3.8182 8.4504 122.3262 63.2086 31.2499 174.7548 253 Y 4.4799 7.4427 116.6300 56.7404 37.9805 174.0139 254 I 4.1779 8.1211 123.0590 61.6682 39.8191 176.0626 255 G 4.1360 7.3937 106.2433 44.5403 0.0000 170.9863 256 E 4.1721 7.9817 119.6745 57.8538 30.2293 177.2337 257 E 4.1131 7.9580 123.2275 57.9414 30.4799 177.3590 258 E 4.5196 8.1061 116.3721 56.6774 29.8658 176.6803 259 K 4.4506 7.6778 120.5308 56.6373 33.0822 178.1170 260 K 3.9815 7.9082 119.7432 59.8031 32.3615 178.3869 261 I 4.2448 7.7032 120.7495 64.0792 37.1139 177.7601 262 F 4.1436 8.4930 120.7928 61.6444 38.9236 177.1522 263 L 3.8364 7.9321 117.5931 58.5758 41.4405 179.2556 264 E 3.7405 8.2598 117.7464 59.7898 29.2922 179.5540 265 K 3.8411 8.4422 118.2669 59.4525 32.0035 179.2385 266 L 3.7275 7.5790 120.8631 58.8625 42.5672 178.7047 267 K 3.9542 8.6807 120.6751 58.9632 31.6040 178.4157 268 R 3.9901 8.3243 115.2893 59.7069 29.4748 178.7264 269 D 4.4472 8.4353 119.5319 57.2997 40.6843 179.0677 270 V 3.6490 7.9009 118.5032 65.7173 31.5395 177.2121 271 E 4.2729 7.9449 115.5804 57.8164 29.4306 178.0880 272 F 4.3309 8.3429 122.8112 60.6557 39.2972 176.9063 273 L 3.1992 7.3299 118.9748 58.3634 40.1569 179.3439 274 V 3.8622 7.2812 119.0204 66.2329 31.2945 177.8616 275 Q 4.1384 7.9201 116.5207 58.9740 28.5797 178.3903 276 L 4.1366 7.4289 116.9465 54.0419 41.5418 177.0644 277 K 3.8461 8.1086 118.7617 56.8607 31.2960 175.3433 278 I 3.6720 8.4829 119.7232 61.6897 36.4576 175.0992 279 M 4.1394 8.0503 125.2445 55.0490 32.0445 175.0641 280 D 4.3605 7.8048 123.3636 51.3633 42.9714 175.1781 281 Y 5.1525 7.7611 123.8502 54.5759 41.5511 174.3386 282 S 4.8689 8.7656 115.2650 56.8672 67.4886 172.4687 283 L 5.0302 9.2058 123.6785 53.5398 43.8950 174.8086 284 L 5.0000 8.7776 129.8440 54.3543 43.4106 175.2009 285 L 5.1395 8.7651 128.1525 53.5888 45.1452 175.3042 286 G 3.9381 8.2974 110.0990 44.5614 0.0000 171.4722 287 I 5.4166 9.2220 126.9070 58.8227 41.3227 174.6249 288 H 5.2007 8.0797 124.4747 54.4397 32.5573 172.2774 289 D 4.4524 8.2597 125.4081 54.8520 41.2043 174.5120 290 I 4.2104 7.3595 121.6506 62.2205 40.1771 175.1041 *366 E 3.7790 7.7698 117.9098 55.9619 30.7875 175.2802 367 V 3.4843 7.0068 120.6040 61.7560 33.5321 174.0923 368 Y 5.4646 7.5023 122.5826 55.2128 40.8923 175.2372 369 F 5.1812 8.2203 121.9534 55.8206 41.5309 173.4095 370 M 6.1512 8.0740 119.9959 52.4028 34.3286 175.1559 371 G 4.3221 8.4184 106.5261 45.7820 0.0000 172.2526 372 L 5.0502 8.5952 121.8180 55.0031 41.7225 177.7112 373 I 4.6158 8.7094 113.2578 60.8269 40.4162 174.7332 374 D 4.8694 8.2209 121.0707 54.4202 41.0974 175.9022 375 I 4.1741 7.7118 108.8778 60.5603 38.4087 177.2795 376 L 3.7851 8.0935 127.3178 57.5985 40.3267 174.9391 *404 H 4.7046 7.5810 112.9719 55.1103 29.9431 172.4762 405 P 4.8036 0.0000 0.0000 65.4059 31.0906 178.6177 406 E 3.9117 8.3885 116.5870 60.3839 29.6162 178.6568 407 Q 4.1143 7.8691 118.6842 58.4620 28.8273 177.6207 408 Y 4.1634 8.1224 120.0583 60.8122 38.9211 178.4481 409 A 3.4716 8.5210 122.3163 55.1786 18.4263 179.4538 410 K 3.8715 7.9653 117.6710 59.8572 31.9337 179.0776 411 R 4.1371 7.6234 117.3348 59.6676 29.4318 177.5285 412 F 4.4687 8.3417 121.3850 58.9799 39.0836 177.1236 413 L 3.4575 7.7897 117.2046 58.2488 41.7665 178.9204 414 D 4.2916 7.5162 115.4421 57.5154 41.0433 178.4560 415 F 4.2140 9.3052 120.5439 60.7905 39.7715 177.0062 416 I 4.1073 7.3224 108.8510 62.3834 37.8932 176.2379 417 T 4.2277 7.8756 123.0440 63.9841 68.5583 174.0742 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 45 D 8.36 4.55 0.00 2.65 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 P 0.00 4.08 0.00 2.26 2.02 0.00 3.64 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 47 L 8.03 4.00 0.00 1.75 1.66 0.95 0.81 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 48 V 8.63 4.01 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 1.00 0.00 0.00 0.93 0.00 0.00 49 G 7.99 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 50 V 7.16 3.37 2.24 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 1.39 0.00 0.00 0.28 0.00 0.00 51 F 8.37 4.59 0.00 3.11 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 7.91 3.78 0.00 1.68 1.57 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 53 W 8.03 3.95 0.00 3.23 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 G 7.81 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 0.00 0.00 0.00 0.00 0.00 0.00 55 V 6.88 3.76 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 0.87 0.00 0.00 -0.01 0.00 0.00 56 A 7.90 3.78 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 57 H 8.13 3.50 0.00 1.88 2.56 0.00 5.80 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 9.19 4.13 0.00 4.27 4.41 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 59 I 7.78 3.52 1.97 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.75 0.94 0.00 0.00 60 N 7.70 4.47 0.00 2.69 2.75 0.00 0.00 6.52 8.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 E 7.97 3.81 0.00 2.09 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 0.00 2.30 2.37 0.00 62 L 8.69 3.99 0.00 1.94 1.73 0.99 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 63 S 7.68 4.17 0.00 4.04 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 64 Q 8.03 4.37 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.97 0.00 0.00 0.00 0.00 0.00 2.61 2.48 0.00 65 V 7.31 3.95 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 0.78 0.00 0.00 0.97 0.00 0.00 66 P 0.00 4.15 0.00 2.20 2.09 0.00 3.83 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 1.99 1.98 0.00 67 P 0.00 4.14 0.00 2.17 2.11 0.00 3.75 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 1.98 1.97 0.00 68 P 0.00 4.36 0.00 2.41 2.20 0.00 3.66 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.92 0.00 69 V 8.50 3.86 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 0.67 0.00 0.00 0.92 0.00 0.00 70 M 7.35 4.63 0.00 1.90 1.88 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.51 0.00 71 L 8.41 4.47 0.00 1.68 1.65 0.50 0.89 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 72 L 8.08 4.46 0.00 1.76 1.60 0.92 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 73 P 0.00 4.64 0.00 2.22 2.18 0.00 3.67 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.24 0.00 74 D 8.33 4.19 0.00 2.69 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 75 D 7.94 4.31 0.00 2.39 2.40 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 76 F 8.61 4.43 0.00 3.08 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 77 K 7.79 4.56 0.00 1.85 1.87 0.00 1.64 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.53 1.45 7.81 78 A 8.21 4.57 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 79 S 8.06 4.60 0.00 3.75 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 80 S 7.62 4.47 0.00 3.72 3.71 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 81 K 8.89 5.34 0.00 1.64 1.66 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.72 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.25 1.38 7.81 82 I 9.08 4.61 2.20 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.54 1.13 0.00 0.00 83 K 8.76 4.67 0.00 1.70 1.62 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.72 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.20 1.33 7.81 84 V 7.73 4.20 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 0.00 0.00 0.80 0.00 0.00 0.48 0.00 0.00 85 N 8.68 5.05 0.00 2.53 2.55 0.00 0.00 7.16 8.00 0.00 0.00 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 N 8.87 4.68 0.00 2.61 2.88 0.00 0.00 6.81 8.91 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 87 H 9.01 4.60 0.00 3.09 3.23 0.00 5.76 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 L 8.57 3.82 0.00 1.85 1.91 0.95 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 89 F 8.05 4.80 0.00 2.90 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 H 8.26 4.61 0.00 2.58 2.97 0.00 5.74 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.52 4.56 0.00 1.82 1.81 0.00 3.23 0.00 0.00 3.40 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 92 E 8.60 4.05 0.00 2.14 2.23 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 0.00 2.32 2.28 0.00 93 N 7.48 4.88 0.00 2.82 2.80 0.00 0.00 6.76 7.67 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 94 L 7.29 4.31 0.00 1.20 1.15 -1.02 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.43 0.00 2.11 2.02 0.00 3.24 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 1.97 2.02 0.00 96 S 8.59 4.35 0.00 4.10 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 H 8.54 5.30 0.00 3.09 3.22 0.00 6.04 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 98 F 7.93 5.33 0.00 2.96 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 99 K 9.15 5.00 0.00 1.75 1.75 0.00 1.68 0.00 0.00 1.46 0.00 0.00 2.67 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.31 1.17 7.81 100 F 8.54 5.03 0.00 3.52 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 K 7.56 5.32 0.00 1.60 1.40 0.00 1.57 0.00 0.00 1.35 0.00 0.00 2.56 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.59 1.07 7.81 102 E 8.58 4.30 0.00 2.27 1.83 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 2.02 2.36 0.00 103 Y 8.84 4.31 0.00 2.96 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 0.00 104 C 8.78 4.09 0.00 3.05 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 0.00 105 P 0.00 5.21 0.00 2.15 2.37 0.00 3.87 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.26 0.00 106 Q 7.93 3.90 0.00 1.88 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.86 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 107 V 7.35 3.23 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 0.28 0.00 0.00 -0.21 0.00 0.00 108 F 7.65 4.42 0.00 3.12 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 0.00 109 R 7.80 3.84 0.00 1.93 2.05 0.00 3.07 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.83 0.00 110 N 7.78 4.17 0.00 2.85 2.87 0.00 0.00 7.22 6.54 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 0.00 111 L 7.90 3.60 0.00 1.74 1.79 0.87 0.96 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 0.00 112 R 8.57 4.10 0.00 1.97 2.12 0.00 2.82 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.76 0.00 113 D 7.91 4.31 0.00 2.87 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 0.00 114 R 7.69 3.73 0.00 1.59 1.69 0.00 3.14 0.00 0.00 3.06 7.64 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 1.12 0.51 0.85 0.00 0.00 144 S 9.70 4.54 0.00 3.87 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 0.00 145 Y 8.92 4.11 0.00 3.09 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 D 7.33 3.96 0.00 2.13 2.42 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 0.00 147 R 8.36 3.88 0.00 1.90 1.92 0.00 3.06 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 1.52 1.50 0.00 148 T 8.40 4.39 4.15 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 0.00 0.00 1.02 0.00 0.00 149 L 7.74 5.10 0.00 1.57 1.64 0.98 0.90 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 0.00 150 V 8.94 4.71 1.83 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 0.27 0.00 0.00 0.76 0.00 0.00 151 I 8.38 4.86 1.90 0.00 0.00 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 1.52 0.97 0.65 0.00 0.00 152 K 8.86 4.94 0.00 2.55 1.96 0.00 1.90 0.00 0.00 1.78 0.00 0.00 2.73 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.44 1.49 7.81 153 E 8.82 4.59 0.00 2.00 1.83 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 2.32 2.49 0.00 154 V 8.44 4.71 2.33 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 0.77 0.00 0.00 1.01 0.00 0.00 155 S 9.05 4.70 0.00 3.93 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 0.00 156 S 8.35 3.05 0.00 3.79 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 0.00 157 E 7.89 3.96 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 158 D 7.98 4.30 0.00 2.68 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 0.00 159 I 7.31 3.49 1.61 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.86 0.45 0.00 0.00 160 A 7.20 3.76 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 0.00 161 D 7.49 4.24 0.00 2.78 2.65 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 0.00 162 M 7.71 3.72 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 163 H 7.95 4.59 0.00 3.12 3.35 0.00 5.77 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 S 7.39 4.22 0.00 4.01 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 0.00 165 N 8.11 4.56 0.00 2.83 2.78 0.00 0.00 6.87 6.79 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 0.00 166 L 8.29 4.48 0.00 1.91 1.77 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 167 S 8.08 4.23 0.00 2.72 3.46 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.18 4.53 0.00 3.17 3.09 0.00 0.00 6.56 7.48 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 0.00 169 Y 9.37 4.22 0.00 3.64 3.40 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 0.00 170 H 9.08 4.18 0.00 3.44 3.68 0.00 5.65 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 0.00 171 Q 9.01 3.97 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.53 0.00 0.00 0.00 0.00 0.00 2.58 2.45 0.00 172 Y 8.86 4.02 0.00 2.54 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 0.00 173 I 7.46 3.31 1.58 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.24 0.76 0.00 0.00 174 V 7.05 3.44 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 0.95 0.00 0.00 0.78 0.00 0.00 175 K 7.30 4.04 0.00 1.55 1.77 0.00 1.75 0.00 0.00 1.61 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.41 1.68 7.81 176 C 7.71 3.86 0.00 1.95 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 0.00 0.00 0.00 0.00 177 H 7.73 4.07 0.00 3.58 3.40 0.00 5.82 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 G 8.26 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 N 7.65 4.99 0.00 2.76 2.81 0.00 0.00 6.25 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 0.00 180 T 7.42 4.64 4.99 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 1.26 0.00 0.00 181 L 8.89 4.40 0.00 1.78 1.83 0.37 0.90 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 0.00 182 L 8.33 4.79 0.00 1.71 1.80 1.29 1.32 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 0.00 183 P 0.00 4.02 0.00 0.72 1.52 0.00 3.69 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.04 0.00 184 Q 8.34 4.19 0.00 1.74 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.08 0.00 0.00 0.00 0.00 0.00 1.43 1.98 0.00 185 F 10.09 4.73 0.00 3.26 3.22 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 0.00 186 L 9.19 4.78 0.00 1.58 1.65 1.13 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 187 G 7.82 3.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 M 6.36 4.82 0.00 1.76 1.73 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 189 Y 9.21 5.18 0.00 3.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 R 8.58 4.75 0.00 2.01 1.55 0.00 3.05 0.00 0.00 3.25 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.16 0.00 191 V 8.52 4.42 2.40 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 0.95 0.00 0.00 1.05 0.00 0.00 192 S 8.54 5.04 0.00 3.76 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 0.00 193 V 8.79 4.47 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 0.84 0.00 0.00 1.04 0.00 0.00 194 D 8.49 4.51 0.00 2.99 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 0.00 195 N 8.15 4.24 0.00 2.95 2.91 0.00 0.00 6.09 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 E 8.20 4.52 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.62 0.00 197 D 8.60 4.88 0.00 2.45 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 0.00 0.00 0.00 198 S 8.81 4.67 0.00 3.77 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 0.00 199 Y 8.68 5.02 0.00 3.11 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 0.00 200 M 8.66 5.23 0.00 1.56 1.78 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.49 0.00 201 L 8.66 5.20 0.00 1.83 1.70 0.80 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 202 V 8.72 5.13 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 1.41 0.00 0.00 203 M 9.64 5.44 0.00 1.80 1.87 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.68 0.00 204 R 8.33 4.18 0.00 1.81 1.74 0.00 3.46 0.00 0.00 3.03 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 205 N 8.93 4.36 0.00 2.65 2.62 0.00 0.00 7.18 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 M 8.69 4.13 0.00 2.18 1.90 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.56 0.00 207 F 7.57 4.28 0.00 2.82 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 0.00 208 S 7.08 4.13 0.00 3.40 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 0.00 209 H 8.72 4.42 0.00 3.36 3.46 0.00 5.37 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 R 6.41 4.04 0.00 1.78 1.67 0.00 3.26 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 211 L 8.33 4.11 0.00 1.59 1.29 0.98 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 212 P 0.00 4.45 0.00 2.13 2.03 0.00 3.71 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 2.01 1.95 0.00 213 V 8.19 4.03 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 0.76 0.00 0.00 0.41 0.00 0.00 214 H 9.84 4.75 0.00 2.89 3.32 0.00 5.84 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 0.00 215 R 7.68 4.66 0.00 1.59 1.50 0.00 3.15 0.00 0.00 3.53 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 216 K 8.17 5.10 0.00 2.19 1.89 0.00 1.86 0.00 0.00 1.89 0.00 0.00 2.96 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.42 7.81 217 Y 8.42 5.21 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 0.00 218 D 9.14 4.92 0.00 2.69 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 L 8.31 4.22 0.00 1.91 1.52 0.58 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 220 K 8.44 4.45 0.00 1.53 1.49 0.00 1.79 0.00 0.00 1.63 0.00 0.00 3.12 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.33 7.81 221 G 7.42 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 0.00 0.00 0.00 *239 T 7.96 4.31 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 240 L 7.90 4.18 0.00 2.06 1.81 1.32 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 241 R 9.02 4.63 0.00 1.85 1.96 0.00 3.16 0.00 0.00 3.41 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.71 0.00 242 D 8.85 4.83 0.00 3.12 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 0.00 243 M 8.07 4.43 0.00 2.20 2.21 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.67 0.00 244 D 8.13 4.45 0.00 2.78 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 F 8.36 4.02 0.00 2.45 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 0.00 246 L 7.18 3.78 0.00 1.46 1.42 0.77 0.17 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 0.00 247 N 7.85 4.32 0.00 2.88 2.88 0.00 0.00 6.02 7.13 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 0.00 248 K 7.31 4.10 0.00 1.60 1.91 0.00 1.84 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.59 1.61 7.81 249 N 7.29 3.85 0.00 2.83 2.84 0.00 0.00 7.11 6.96 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 0.00 250 Q 7.53 4.26 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.08 6.36 0.00 0.00 0.00 0.00 0.00 2.61 2.50 0.00 251 K 8.35 4.56 0.00 1.89 1.76 0.00 1.80 0.00 0.00 1.83 0.00 0.00 2.87 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.43 7.81 252 V 8.45 3.82 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.83 0.00 0.00 253 Y 7.44 4.48 0.00 2.99 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 254 I 8.12 4.18 1.61 0.00 0.00 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 0.19 0.01 0.61 0.00 0.00 255 G 7.39 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 256 E 7.98 4.17 0.00 2.01 1.83 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 2.37 2.26 0.00 257 E 7.96 4.11 0.00 1.99 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 2.31 2.35 0.00 258 E 8.11 4.52 0.00 2.01 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 2.29 2.31 0.00 259 K 7.68 4.45 0.00 1.90 1.93 0.00 1.55 0.00 0.00 1.50 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.45 7.81 260 K 7.91 3.98 0.00 1.89 1.81 0.00 1.79 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.54 7.81 261 I 7.70 4.24 1.95 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 1.54 1.61 1.03 0.00 0.00 262 F 8.49 4.14 0.00 3.14 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 0.00 263 L 7.93 3.84 0.00 2.21 1.69 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 264 E 8.26 3.74 0.00 2.22 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 265 K 8.44 3.84 0.00 1.81 1.91 0.00 1.72 0.00 0.00 1.61 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.70 1.44 7.81 266 L 7.58 3.73 0.00 1.31 1.59 0.84 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 267 K 8.68 3.95 0.00 1.81 1.96 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.09 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.47 7.81 268 R 8.32 3.99 0.00 2.20 2.24 0.00 2.86 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.93 0.00 269 D 8.44 4.45 0.00 2.92 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 0.00 270 V 7.90 3.65 2.41 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 1.22 0.00 0.00 1.35 0.00 0.00 271 E 7.94 4.27 0.00 2.11 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 2.36 2.48 0.00 272 F 8.34 4.33 0.00 2.63 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 0.00 273 L 7.33 3.20 0.00 1.45 1.43 -0.76 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 274 V 7.28 3.86 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 1.13 0.00 0.00 1.02 0.00 0.00 275 Q 7.92 4.14 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.96 0.00 0.00 0.00 0.00 0.00 2.40 2.75 0.00 276 L 7.43 4.14 0.00 1.25 1.44 -0.06 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 277 K 8.11 3.85 0.00 1.78 1.82 0.00 1.79 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.49 7.81 278 I 8.48 3.67 1.71 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 1.21 0.47 0.70 0.00 0.00 279 M 8.05 4.14 0.00 2.09 1.95 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.50 0.00 280 D 7.80 4.36 0.00 2.35 2.47 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 0.00 281 Y 7.76 5.15 0.00 2.89 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 0.00 282 S 8.77 4.87 0.00 3.77 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 0.00 283 L 9.21 5.03 0.00 2.36 1.85 1.40 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 284 L 8.78 5.00 0.00 1.97 1.68 1.12 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 285 L 8.77 5.14 0.00 1.94 1.62 1.09 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 286 G 8.30 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 0.00 287 I 9.22 5.42 1.76 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.31 0.78 0.00 0.00 288 H 8.08 5.20 0.00 3.31 2.91 0.00 5.88 0.00 0.00 0.00 0.00 6.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 289 D 8.26 4.45 0.00 2.46 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 0.00 0.00 0.00 0.00 290 I 7.36 4.21 1.78 0.00 0.00 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 1.28 0.65 0.88 0.00 0.00 *366 E 7.77 3.78 0.00 1.71 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 2.16 2.34 0.00 367 V 7.01 3.48 1.59 0.00 0.00 0.00 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 0.87 0.00 0.00 368 Y 7.50 5.46 0.00 2.64 2.65 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 0.00 369 F 8.22 5.18 0.00 2.76 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 370 M 8.07 6.15 0.00 2.13 2.23 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 2.42 2.36 0.00 371 G 8.42 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 0.00 0.00 0.00 0.00 372 L 8.60 5.05 0.00 1.65 1.70 1.15 0.61 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 0.00 373 I 8.71 4.62 1.93 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.59 1.00 0.00 0.00 374 D 8.22 4.87 0.00 2.74 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 375 I 7.71 4.17 1.77 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 1.45 0.83 0.73 0.00 0.00 376 L 8.09 3.79 0.00 1.80 1.84 0.90 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.00 0.00 *404 H 7.58 4.70 0.00 3.22 3.27 0.00 5.61 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 405 P 0.00 4.80 0.00 2.26 2.52 0.00 3.67 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.27 0.00 406 E 8.39 3.91 0.00 1.99 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 0.00 2.35 2.46 0.00 407 Q 7.87 4.11 0.00 2.36 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.73 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 408 Y 8.12 4.16 0.00 3.01 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 409 A 8.52 3.47 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 410 K 7.97 3.87 0.00 1.87 1.91 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.50 7.81 411 R 7.62 4.14 0.00 2.00 2.06 0.00 3.33 0.00 0.00 3.24 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.71 0.00 412 F 8.34 4.47 0.00 2.66 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 413 L 7.79 3.46 0.00 1.69 1.66 1.04 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 414 D 7.52 4.29 0.00 2.75 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 415 F 9.31 4.21 0.00 3.44 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 0.00 416 I 7.32 4.11 1.87 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.53 0.79 0.00 0.00 417 T 7.88 4.23 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.