NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2533 7.8300 120.8523 61.2929 38.5643 173.8440 17 V 4.3678 7.7124 125.3069 61.3749 32.2395 174.4223 18 G 3.6630 9.2226 115.3605 45.7965 0.0000 172.3786 19 G 4.2546 7.7641 107.3196 44.8269 0.0000 172.7593 20 T 4.9832 8.3319 108.5449 59.4006 72.7158 173.2514 21 N 4.8571 8.7815 119.0758 53.7319 39.2392 175.2737 22 S 4.8589 8.6322 118.7205 57.5966 65.2555 173.4450 23 S 4.7197 8.6330 116.8413 55.9424 65.3383 174.2186 24 W 4.1652 8.4740 121.6238 58.4106 29.1353 177.4922 25 G 4.3133 9.2695 109.2548 45.2745 0.0000 174.4772 26 E 3.2988 7.5874 120.4796 58.2317 30.1453 177.2570 27 W 3.6585 6.6972 117.7678 53.7802 29.2533 174.1352 28 P 4.4798 0.0000 0.0000 63.8490 31.7381 178.9908 29 W 4.7195 6.6366 115.4569 57.1820 28.9420 175.9043 30 Q 4.6013 7.4891 121.3223 56.7450 28.8061 175.9546 31 V 5.0391 9.1060 118.2829 59.7751 36.7662 174.1039 32 S 5.1367 9.3940 117.2095 56.7587 64.8909 172.5690 33 L 5.2415 9.1025 127.8973 53.6265 43.2884 175.6166 34 Q 5.1158 9.5109 122.9331 54.1365 32.7382 174.9098 35 V 4.2573 8.4121 115.5182 59.2599 34.6762 174.9658 36 K 4.6879 8.5195 125.9468 54.5577 33.5440 175.6126 37 L 4.5811 8.6270 128.3351 55.1683 41.8514 178.7878 38 T 3.9017 9.1473 123.5229 66.3668 68.6440 173.5768 38A A 4.6688 7.6689 122.2507 50.0877 22.0280 173.7835 38B Q 4.9511 8.3257 120.2473 54.6318 30.6121 174.9947 39 R 4.6238 8.8211 125.1982 54.1244 34.5047 174.2232 40 H 4.1811 8.9734 123.3341 57.2477 29.3227 174.3626 41 L 4.5782 8.8298 125.2101 56.3373 43.9586 175.6920 42 C 4.8276 7.6765 113.5594 55.8115 45.0753 174.3249 43 G 4.3579 8.7735 109.4244 46.1932 0.0000 172.5477 44 G 4.3395 8.1190 104.4465 45.8932 0.0000 172.7910 45 S 5.4452 8.6760 115.7995 56.2378 66.7637 173.6414 46 L 4.6376 9.3581 128.7484 55.2037 42.4790 177.1752 47 I 4.4591 8.5476 118.8380 60.3807 38.4548 174.8273 48 G 4.3945 7.7456 108.9092 43.2790 0.0000 173.8503 49 H 4.3656 8.9334 116.2371 58.6030 28.8287 176.7172 50 Q 4.7987 8.1492 115.8500 55.3004 30.0950 174.8589 51 W 5.5725 8.3310 117.7605 55.8560 33.7864 174.3727 52 V 4.9853 9.2590 123.6959 61.0578 34.6332 173.6716 53 L 5.2143 9.0870 129.4520 54.1341 44.4255 175.2748 54 T 5.3481 9.0982 118.7796 61.2600 71.4795 171.3240 55 A 4.7098 8.3970 122.9316 50.6845 20.5991 178.3709 56 A 4.0403 8.3056 124.4785 55.2139 18.3642 179.4781 57 H 4.8162 8.3408 114.4122 57.6336 28.4229 176.9431 58 C 4.1686 7.5592 118.8007 59.2955 37.0596 174.7551 59 F 4.7899 7.8039 117.5977 56.0659 38.7211 175.1764 60 D 4.6509 7.7449 121.2354 56.0235 40.8364 177.5819 60A G 4.0540 9.2641 112.3486 45.4281 0.0000 173.4329 60B L 4.6573 7.8615 120.6249 52.6252 41.5228 174.6709 60C P 4.9048 0.0000 0.0000 62.3996 31.7060 176.3315 61 L 4.9493 7.5976 117.1616 52.8401 45.3736 176.9091 62 Q 4.4678 8.8039 120.9029 58.9163 29.0953 177.5368 *65B D 4.6306 7.9082 116.2439 53.0821 41.2541 176.2626 65C V 3.9224 7.7159 111.7286 61.9053 32.5707 175.4718 65D W 5.2227 8.3661 121.1247 55.1217 31.1877 175.9255 65E R 4.9042 9.3934 122.0108 54.5734 33.4982 174.2159 66 I 5.0862 8.9054 124.7846 59.7855 40.0453 174.0738 67 Y 5.1061 9.2542 125.0256 56.2231 40.2976 175.0618 68 S 5.0621 8.6637 118.0412 56.6302 66.7703 173.2223 69 G 4.6994 9.0463 106.1913 47.9918 0.0000 173.4952 70 I 4.9806 7.8927 109.9809 58.7365 41.2649 174.4060 71 L 4.3287 8.2581 121.2024 55.2512 44.2490 175.4686 72 N 5.6122 7.8022 116.9398 51.3646 41.0212 174.5325 73 L 3.6672 8.6675 127.4190 57.6220 41.7903 179.5520 74 S 4.2684 8.5955 112.1005 60.0810 63.1970 175.0586 75 D 4.4464 7.7579 120.7982 56.4084 40.7219 176.5297 76 I 3.8970 7.2589 121.1829 60.9465 37.5033 175.1835 77 T 4.7247 8.6734 115.1638 59.3293 71.8100 174.5437 78 K 4.0953 8.5967 119.4254 59.2933 32.5020 177.5351 79 D 4.6071 8.0336 118.8979 56.1899 41.2519 177.0439 80 T 4.2261 7.9303 117.2679 62.3942 68.9785 172.7893 81 P 4.5284 0.0000 0.0000 62.9561 32.1264 175.2380 82 F 4.7269 7.4732 113.5664 55.7620 40.9258 173.4835 83 S 4.6920 9.2276 116.2376 57.4477 65.1759 173.4308 84 Q 5.1021 8.3345 120.2633 54.1925 32.2761 174.5752 85 I 4.2144 8.3293 122.1658 61.0947 37.3779 175.6539 86 K 4.3908 8.8630 129.2033 58.0888 33.4019 176.1853 87 E 4.9234 7.5557 114.4804 55.4457 32.5578 174.3605 88 I 4.6986 8.2657 121.8588 59.6710 39.6881 175.2286 89 I 4.3850 8.8573 128.6572 59.6480 38.6935 174.7237 90 I 4.4467 8.1969 127.8561 60.2075 38.4871 175.8393 91 H 4.1999 8.6076 125.8067 56.3230 30.3306 175.5038 92 Q 3.9805 8.9659 128.4957 59.7450 28.7461 177.7216 93 N 4.7803 8.1662 111.0697 53.4097 38.7512 174.4421 94 Y 4.4586 8.2405 121.5155 57.0439 39.6024 174.2392 95 K 4.1590 7.3813 126.7341 53.7321 34.7297 175.3391 96 V 3.7130 8.2863 125.2128 63.7142 31.6747 176.4345 97 S 3.8470 8.3014 118.8644 58.7554 62.9855 170.9070 98 E 4.3441 7.8346 120.7515 55.4184 30.8066 175.8611 99 G 3.9561 8.2362 106.7753 45.4071 0.0000 173.1002 100 N 4.7011 7.9395 116.5735 53.0633 40.0778 174.4369 101 H 3.9315 8.3877 115.9088 56.1262 26.1130 176.2706 102 D 4.5271 7.7554 119.1097 52.7424 40.1226 174.4191 103 I 4.4772 7.2670 120.3464 59.5560 41.6442 172.2298 104 A 5.2469 8.8499 129.2443 50.7926 23.1554 174.7826 105 L 5.2338 9.1478 120.3374 53.1908 44.7099 175.6425 106 I 4.8885 9.0963 123.8252 59.4168 40.0458 174.4762 107 K 3.5844 8.8125 129.6841 55.1458 33.1137 176.1697 108 L 4.6840 8.1147 127.9650 54.2205 42.3175 177.3324 109 Q 4.1826 8.8567 120.1014 58.2266 29.1699 176.7315 110 A 4.6210 7.5972 120.2164 49.2088 22.2902 173.7569 111 P 4.6303 0.0000 0.0000 63.0609 32.1352 175.5972 112 L 4.6974 8.6370 122.5936 53.5304 43.1601 176.3097 113 N 4.5896 8.6965 120.3657 53.2336 39.5972 174.5021 114 Y 5.0119 8.4536 120.4969 57.9128 39.1255 174.9845 115 T 5.0025 8.7645 113.4873 59.9504 72.2151 174.1095 116 E 3.8616 8.3105 118.7616 58.2585 29.7015 178.2926 117 F 4.8414 7.9386 116.7229 57.5556 40.2271 175.3164 118 Q 4.9919 7.9563 122.9641 55.3522 30.1515 172.7617 119 K 4.5664 8.6393 124.3389 53.9360 37.0232 174.3666 120 P 5.3332 0.0000 0.0000 62.5370 32.3763 175.0767 121 I 4.0548 8.0359 120.8882 59.3643 39.5258 175.3324 122 S 4.3166 8.2750 124.8867 58.5205 63.8100 173.7475 123 L 4.4958 8.3908 124.4814 53.1695 42.5439 174.9163 124 P 4.5790 0.0000 0.0000 62.4682 32.6163 175.5673 125 S 4.6970 8.7575 114.5465 56.9029 64.6255 175.6606 126 K 4.6764 8.1735 124.1584 59.3524 31.9641 179.1744 127 G 3.7627 8.1461 105.0748 47.5035 0.0000 174.3211 128 D 4.6797 8.1710 120.9737 54.9622 40.5516 177.8893 129 T 3.8625 7.6994 114.9970 65.0159 67.3939 174.6882 130 S 4.3023 7.4457 112.2286 59.5057 63.3956 174.4776 131 T 3.7421 7.8843 120.2558 63.3157 68.6513 173.7352 132 I 3.9688 7.7237 126.8004 59.9564 37.2514 175.2776 133 Y 4.5744 8.0111 123.2332 57.7351 39.0415 175.6916 134 T 4.7247 8.2296 113.0308 63.8321 73.5945 174.0605 135 N 5.0336 8.0558 119.5513 51.6148 39.8783 172.6506 136 C 5.6813 8.5047 117.3683 54.5343 44.9067 172.5589 137 W 5.3159 9.2859 121.5845 54.8532 32.9962 174.3606 138 V 4.9002 8.8295 123.6543 60.4371 33.8034 174.3913 139 T 4.8257 8.9666 115.8012 59.3235 72.4220 173.1605 140 G 3.8599 6.8899 110.4376 45.0774 0.0000 172.8946 141 W 4.5183 8.1426 116.5942 56.3862 29.3991 177.3802 142 G 4.4064 8.0807 109.3631 44.4634 0.0000 174.0256 143 F 5.3308 8.8103 118.1711 57.6672 39.2217 175.9289 144 S 5.1417 9.0205 117.2388 58.0663 63.8713 173.4893 145 K 4.4762 7.4746 119.0053 55.6158 34.7215 174.3501 146 E 4.0716 8.7856 121.2761 57.7503 30.6215 176.8757 147 K 3.9789 9.1288 123.7380 57.4339 29.7243 173.4106 148 G 4.0499 6.3154 111.0459 43.0453 0.0000 169.6442 147 E 4.0089 9.2588 123.5380 57.8339 26.5243 173.4106 148 I 4.2599 5.9854 122.1459 59.0453 40.0129 171.1442 152 Q 4.3650 8.4532 124.1306 56.0804 29.2955 175.7528 153 N 4.6753 8.9006 117.8678 54.9946 40.5128 175.2001 154 I 4.8136 7.6795 118.6004 59.2140 39.0432 175.6966 155 L 2.9214 8.9221 129.0388 56.0052 42.8189 176.3048 156 Q 5.0883 8.4239 125.2518 54.7382 31.4381 174.8420 157 K 5.0978 8.7358 119.9093 55.4530 36.5088 175.5506 158 V 4.6991 8.7423 121.3012 60.2592 35.2883 173.1721 159 N 3.5360 8.0268 122.1840 52.3062 38.8247 174.0986 160 I 4.7012 8.3370 127.3205 58.6995 41.5998 172.9998 161 P 4.5524 0.0000 0.0000 62.1848 32.7311 175.7453 162 L 4.5710 8.3337 122.4274 54.7594 42.5742 176.2531 163 V 4.5989 8.2570 120.8712 61.0210 34.6665 175.6581 164 T 4.2030 8.3254 115.2881 61.2612 69.6917 175.3559 165 N 4.5902 8.6048 119.8145 55.9772 38.4496 177.4146 166 E 3.9635 8.0603 120.7388 59.0542 29.7239 178.1951 167 E 3.9288 7.7539 116.8645 59.7103 29.9026 178.1867 168 C 4.4540 8.6609 118.8399 59.7738 38.0855 175.3285 169 Q 4.0375 8.3493 121.3524 59.2131 28.4497 178.3835 170 K 4.1792 8.0424 118.0332 58.5513 32.1504 178.5355 171 R 4.3371 7.8296 116.7540 56.5018 31.5570 175.7117 172 Y 5.0791 7.8610 116.3048 56.9968 38.7010 176.8735 173 Q 4.1542 8.2782 118.6040 58.7721 29.4106 178.2484 173A D 4.4339 8.1006 115.8247 55.4524 41.2918 175.2861 174 Y 4.8088 8.1941 116.1488 55.7101 41.6374 174.9131 175 K 4.6420 8.7238 120.0679 55.3373 33.6053 175.7966 176 I 4.2104 8.4526 126.2218 60.1689 37.5680 176.0768 177 T 4.5564 8.1261 116.4411 59.6488 71.0046 175.2010 178 Q 4.0344 8.4613 118.3303 58.7932 29.0149 176.9520 179 R 4.3988 7.7903 116.5030 56.3930 30.2122 175.2314 180 M 5.5306 7.6765 117.8925 53.4448 35.2405 175.5852 181 V 4.5847 8.8291 120.3733 60.2428 35.1584 173.7148 182 C 5.6733 8.7966 119.4131 55.4055 40.1918 172.6346 183 A 4.9551 8.7142 122.7125 49.9942 22.5301 175.8586 184 G 4.1418 7.9644 108.8698 46.9226 0.0000 171.6477 184A Y 4.5932 7.7678 116.8021 55.8392 40.0896 177.3188 185 K 4.2201 8.4896 122.3281 59.1267 32.4940 178.4729 186 E 4.1274 8.2875 115.7059 56.3356 30.0433 178.4644 186A G 3.8736 7.9011 107.6635 46.3322 0.0000 172.6051 186B G 4.0487 9.2690 106.8106 44.6738 0.0000 173.8974 186C K 5.2859 7.5868 118.4638 53.4923 34.9933 175.5099 186A D 4.5536 7.9111 119.2635 55.4322 39.0792 174.0051 186B A 4.4087 9.1790 121.8106 52.0738 17.2611 176.7974 186C C 5.5159 7.6168 116.6638 55.4923 29.8933 173.5099 192 K 3.4733 8.2212 120.9489 58.2951 31.5550 176.8011 193 G 4.2439 8.8342 114.1021 45.1913 0.0000 173.9961 194 D 4.5556 7.8670 118.2138 55.7790 41.5968 176.5198 195 S 4.3546 7.9237 115.2787 60.5278 63.4077 175.5091 196 G 4.0247 8.6618 112.6842 46.3278 0.0000 173.6268 197 G 4.5295 7.8031 107.5942 44.4565 0.0000 171.1550 198 P 4.9093 0.0000 0.0000 62.3698 33.2407 175.3868 199 L 4.5396 8.6526 124.1192 53.6703 44.2473 175.2521 200 V 4.9527 8.5648 120.0855 59.8137 34.8777 174.5514 201 C 5.6063 8.8739 120.2971 55.1330 44.3046 173.2534 202 K 4.1142 8.4185 125.1838 55.5827 31.9697 175.2811 203 H 4.7119 9.0379 128.2637 54.5836 32.1561 173.1067 204 N 3.8464 9.4751 125.1534 54.7444 37.2069 174.2338 205 G 3.6743 7.6090 101.9386 46.6218 0.0000 172.2061 *208B M 4.6675 7.5165 118.0651 54.6689 33.6482 174.8730 208C W 4.8297 8.7530 123.1022 56.7443 30.3482 175.9411 208D R 4.6886 8.8557 122.3156 54.0560 34.0981 174.4691 209 L 4.1289 8.6543 126.0247 55.2958 41.7566 176.2185 210 V 3.8931 8.5624 127.9544 64.2618 33.1807 175.7596 211 G 4.5289 7.7065 105.1667 44.4967 0.0000 171.3621 212 I 5.0078 8.5143 121.1088 59.2347 39.7664 175.6109 213 T 3.6681 8.7196 124.3652 64.9463 68.8643 172.8593 214 S 4.5693 8.0452 118.7817 58.2850 64.4314 173.4395 215 W 4.7204 7.6566 114.2005 56.1727 31.6077 172.3995 216 G 4.0549 8.4923 105.2805 45.3483 0.0000 173.5706 217 E 4.4363 9.2799 123.3411 55.3453 29.1633 176.7101 217 G 4.0463 9.1899 111.9411 43.8453 0.0000 175.0101 220 C 4.7990 8.5983 117.5570 56.7184 44.2014 174.1580 221 A 3.9219 9.2905 125.2689 52.7065 16.0367 177.7074 221A R 4.0926 7.3037 116.7199 56.3703 30.6988 176.4386 222 R 3.9411 8.5228 120.9176 58.2528 30.5297 175.9550 223 E 3.8923 9.2034 123.7424 57.6977 27.8576 174.4108 224 Q 4.5204 7.5438 116.3892 53.0524 29.2522 173.2555 225 P 4.4832 0.0000 0.0000 62.0885 32.7839 177.6551 226 G 3.6247 8.5614 108.0593 46.3272 0.0000 172.3411 227 V 4.5685 7.9002 121.3842 60.8713 34.1238 174.1786 228 Y 5.0030 8.7120 123.5622 56.2457 42.6999 174.6838 229 T 4.2930 8.6598 119.4569 63.4007 69.8049 173.9057 230 K 4.5870 9.0784 128.5694 55.6803 32.3629 177.5630 231 V 3.7645 8.8260 128.8860 65.9645 31.4848 177.5108 232 A 4.0396 8.1647 120.1887 55.2726 18.0185 178.7609 233 E 4.0970 7.8927 114.3613 57.9445 29.6694 177.6467 234 Y 4.6142 7.9633 116.0822 57.6486 39.0742 177.0595 235 M 4.1587 8.0374 121.2863 58.6156 32.0499 178.1404 236 D 4.4005 8.1390 118.7301 56.9431 41.0485 178.3863 237 W 4.2952 8.2936 128.5700 60.4057 30.7741 178.0522 238 I 3.2712 8.3647 120.0963 64.2127 36.5950 178.3917 239 L 3.8135 7.7616 119.9895 57.7333 41.4816 179.4536 240 E 3.8710 8.1027 117.4867 59.3393 28.9571 179.2613 241 K 3.7664 7.6739 119.4658 58.7711 31.9219 179.2386 242 T 3.0100 7.2378 109.2532 63.6887 68.7821 176.4059 243 Q 4.0494 7.4986 121.9360 58.6441 29.2498 177.2182 244 S 4.1923 7.7799 113.2631 61.3845 62.5303 173.8458 245 S 4.3203 7.5574 118.4717 58.5808 62.1476 173.3647 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 7.83 4.25 1.85 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.39 0.90 0.00 0.00 17 V 7.71 4.37 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 1.33 0.00 0.00 1.06 0.00 0.00 18 G 9.22 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.76 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 20 T 8.33 4.98 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 21 N 8.78 4.86 0.00 2.63 2.79 0.00 0.00 6.87 7.59 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 22 S 8.63 4.86 0.00 3.74 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 23 S 8.63 4.72 0.00 3.71 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 24 W 8.47 4.17 0.00 3.43 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 9.27 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 0.00 0.00 0.00 0.00 26 E 7.59 3.30 0.00 1.46 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 0.00 0.00 0.00 1.47 1.47 0.00 27 W 6.70 3.66 0.00 2.92 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 28 P 0.00 4.48 0.00 2.21 2.27 0.00 2.20 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.67 0.00 29 W 6.64 4.72 0.00 3.53 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 30 Q 7.49 4.60 0.00 1.98 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.79 0.00 0.00 0.00 0.00 0.00 1.80 2.44 0.00 31 V 9.11 5.04 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 0.83 0.00 0.00 1.10 0.00 0.00 32 S 9.39 5.14 0.00 3.32 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 9.10 5.24 0.00 1.84 1.84 0.64 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 9.51 5.12 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.41 0.00 0.00 0.00 0.00 0.00 2.32 2.59 0.00 35 V 8.41 4.26 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 -0.87 0.00 0.00 0.70 0.00 0.00 36 K 8.52 4.69 0.00 1.59 1.58 0.00 1.60 0.00 0.00 1.60 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.25 1.28 7.81 37 L 8.63 4.58 0.00 1.53 0.70 0.81 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 38 T 9.15 3.90 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 1.19 0.00 0.00 38A A 7.67 4.67 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 38B Q 8.33 4.95 0.00 1.96 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.51 0.00 0.00 0.00 0.00 0.00 2.26 2.42 0.00 39 R 8.82 4.62 0.00 1.62 1.71 0.00 3.33 0.00 0.00 3.05 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.65 0.00 40 H 8.97 4.18 0.00 2.96 3.18 0.00 5.90 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 41 L 8.83 4.58 0.00 1.73 1.69 0.84 0.52 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 42 C 7.68 4.83 0.00 2.78 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 43 G 8.77 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.12 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 0.00 0.00 0.00 0.00 45 S 8.68 5.45 0.00 3.82 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 46 L 9.36 4.64 0.00 1.92 1.71 1.18 0.99 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 47 I 8.55 4.46 1.91 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 1.49 1.03 0.95 0.00 0.00 48 G 7.75 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 49 H 8.93 4.37 0.00 3.20 3.35 0.00 5.56 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.15 4.80 0.00 1.74 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.86 0.00 0.00 0.00 0.00 0.00 2.28 1.99 0.00 51 W 8.33 5.57 0.00 3.35 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 52 V 9.26 4.99 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.04 0.00 0.00 53 L 9.09 5.21 0.00 1.86 1.56 1.10 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 54 T 9.10 5.35 4.29 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 1.38 0.00 0.00 55 A 8.40 4.71 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 56 A 8.31 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 G 9.05 4.70 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 0.00 0.00 0.00 70 I 7.89 4.98 1.93 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.04 1.15 0.00 0.00 71 L 8.26 4.33 0.00 0.27 1.19 0.39 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 72 N 7.80 5.61 0.00 2.74 2.67 0.00 0.00 7.26 6.68 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 73 L 8.67 3.67 0.00 1.54 1.42 -0.38 -0.26 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 74 S 8.60 4.27 0.00 3.89 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 75 D 7.76 4.45 0.00 2.95 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 I 7.26 3.90 1.64 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.23 0.35 0.00 0.00 77 T 8.67 4.72 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 1.26 0.00 0.00 78 K 8.60 4.10 0.00 1.93 2.01 0.00 1.59 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.42 1.49 7.81 79 D 8.03 4.61 0.00 2.75 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 T 7.93 4.23 4.60 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 1.44 0.00 0.00 81 P 0.00 4.53 0.00 2.16 2.06 0.00 3.89 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.01 0.00 82 F 7.47 4.73 0.00 2.42 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 S 9.23 4.69 0.00 3.77 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 Q 8.33 5.10 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 7.05 0.00 0.00 0.00 0.00 0.00 2.56 2.57 0.00 85 I 8.33 4.21 1.95 0.00 0.00 0.76 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 8.24 4.46 0.00 3.24 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 95 K 7.38 4.16 0.00 1.61 1.36 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.78 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.41 1.22 7.81 96 V 8.29 3.71 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.11 0.00 0.00 97 S 8.30 3.85 0.00 4.12 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 98 E 7.83 4.34 0.00 1.95 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.18 0.00 99 G 8.24 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.94 4.70 0.00 2.57 2.36 0.00 0.00 7.07 8.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 H 8.39 3.93 0.00 3.29 3.00 0.00 5.74 0.00 0.00 0.00 0.00 8.17 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 0.00 111 P 0.00 4.63 0.00 2.02 2.03 0.00 3.69 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.94 0.00 112 L 8.64 4.70 0.00 1.66 1.77 1.04 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 0.00 113 N 8.70 4.59 0.00 2.64 2.78 0.00 0.00 7.03 7.44 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 0.00 114 Y 8.45 5.01 0.00 3.02 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 0.00 115 T 8.76 5.00 4.47 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 1.37 0.00 0.00 116 E 8.31 3.86 0.00 1.16 1.44 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 2.08 2.16 0.00 117 F 7.94 4.84 0.00 3.25 3.51 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 0.00 118 Q 7.96 4.99 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.31 6.82 0.00 0.00 0.00 0.00 0.00 2.60 2.50 0.00 119 K 8.64 4.57 0.00 1.73 1.49 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.28 1.54 7.81 120 P 0.00 5.33 0.00 2.04 2.05 0.00 2.34 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.47 0.00 121 I 8.04 4.05 0.62 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.29 0.79 0.00 0.00 122 S 8.28 4.32 0.00 3.95 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 0.00 123 L 8.39 4.50 0.00 1.62 1.58 0.91 1.06 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 0.00 124 P 0.00 4.58 0.00 2.24 2.08 0.00 3.76 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 2.01 2.14 0.00 125 S 8.76 4.70 0.00 4.01 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 0.00 126 K 8.17 4.68 0.00 1.83 1.82 0.00 2.00 0.00 0.00 1.78 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.37 7.81 127 G 8.15 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 8.17 4.68 0.00 2.97 2.84 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 0.00 129 T 7.70 3.86 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 130 S 7.45 4.30 0.00 4.08 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 0.00 131 T 7.88 3.74 3.67 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 0.38 0.00 0.00 132 I 7.72 3.97 1.75 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.34 0.85 0.00 0.00 133 Y 8.01 4.57 0.00 2.97 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 0.00 134 T 8.23 4.72 4.29 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 1.24 0.00 0.00 135 N 8.06 5.03 0.00 2.88 2.70 0.00 0.00 7.11 7.93 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 0.00 136 C 8.50 5.68 0.00 3.04 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 W 9.29 5.32 0.00 3.10 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 0.00 138 V 8.83 4.90 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 1.15 0.00 0.00 0.80 0.00 0.00 139 T 8.97 4.83 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 -0.12 0.00 0.00 140 G 6.89 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 8.14 4.52 0.00 3.16 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 8.08 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 0.00 0.00 0.00 143 F 8.81 5.33 0.00 2.90 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 0.00 144 S 9.02 5.14 0.00 4.03 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 0.00 145 K 7.47 4.48 0.00 1.93 1.92 0.00 1.49 0.00 0.00 1.82 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.40 7.81 146 E 8.79 4.07 0.00 2.01 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 147 K 9.13 3.98 0.00 2.08 1.79 0.00 1.65 0.00 0.00 1.89 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.49 7.81 148 G 6.32 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 0.00 147 E 9.26 4.01 0.00 2.30 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 2.33 2.36 0.00 148 I 5.99 4.26 1.87 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 1.43 1.17 0.91 0.00 0.00 152 Q 8.45 4.37 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.88 0.00 0.00 0.00 0.00 0.00 2.67 2.56 0.00 153 N 8.90 4.68 0.00 2.76 3.11 0.00 0.00 6.78 7.29 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 0.00 154 I 7.68 4.81 1.90 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 1.27 0.83 0.90 0.00 0.00 155 L 8.92 2.92 0.00 1.36 1.33 -0.33 0.41 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 0.00 156 Q 8.42 5.09 0.00 2.07 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.84 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 157 K 8.74 5.10 0.00 2.04 1.97 0.00 1.59 0.00 0.00 2.23 0.00 0.00 3.19 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.69 1.72 7.81 158 V 8.74 4.70 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 0.88 0.00 0.00 159 N 8.03 3.54 0.00 1.68 2.39 0.00 0.00 6.44 7.96 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 0.00 160 I 8.34 4.70 1.69 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 1.33 0.84 0.78 0.00 0.00 161 P 0.00 4.55 0.00 1.88 1.93 0.00 2.64 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.11 0.00 162 L 8.33 4.57 0.00 1.52 1.60 1.00 0.74 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 0.00 163 V 8.26 4.60 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 0.80 0.00 0.00 0.87 0.00 0.00 164 T 8.33 4.20 4.23 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 0.00 0.00 1.19 0.00 0.00 165 N 8.60 4.59 0.00 2.84 2.93 0.00 0.00 6.52 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 0.00 166 E 8.06 3.96 0.00 2.04 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 2.39 2.41 0.00 167 E 7.75 3.93 0.00 2.07 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 168 C 8.66 4.45 0.00 3.05 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 Q 8.35 4.04 0.00 2.38 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.22 0.00 0.00 0.00 0.00 0.00 2.41 2.52 0.00 170 K 8.04 4.18 0.00 1.98 1.88 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.65 7.81 171 R 7.83 4.34 0.00 1.78 1.91 0.00 3.41 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.78 0.00 172 Y 7.86 5.08 0.00 3.13 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 0.00 173 Q 8.28 4.15 0.00 2.08 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 7.06 0.00 0.00 0.00 0.00 0.00 2.59 2.42 0.00 173A D 8.10 4.43 0.00 1.80 2.36 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 0.00 174 Y 8.19 4.81 0.00 3.25 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 0.00 175 K 8.72 4.64 0.00 1.88 1.86 0.00 1.58 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.46 7.81 176 I 8.45 4.21 1.93 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 1.50 0.88 0.90 0.00 0.00 177 T 8.13 4.56 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 178 Q 8.46 4.03 0.00 2.18 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 7.24 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 179 R 7.79 4.40 0.00 2.01 2.02 0.00 3.22 0.00 0.00 3.06 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 180 M 7.68 5.53 0.00 1.78 2.12 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 2.58 2.49 0.00 181 V 8.83 4.58 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 0.85 0.00 0.00 0.93 0.00 0.00 182 C 8.80 5.67 0.00 2.85 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 0.00 183 A 8.71 4.96 1.05 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 0.00 184 G 7.96 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 184A Y 7.77 4.59 0.00 3.17 3.27 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 0.00 185 K 8.49 4.22 0.00 1.86 1.85 0.00 1.64 0.00 0.00 1.79 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.52 1.94 7.81 186 E 8.29 4.13 0.00 1.98 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 2.32 2.40 0.00 186A G 7.90 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 186B G 9.27 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 186C K 7.59 5.29 0.00 1.70 1.80 0.00 1.23 0.00 0.00 1.53 0.00 0.00 2.71 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.33 1.07 7.81 186A D 7.91 4.55 0.00 2.71 2.59 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 0.00 0.00 0.00 0.00 186B A 9.18 4.41 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186C C 7.62 5.52 0.00 2.79 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 0.00 192 K 8.22 3.47 0.00 1.24 0.74 0.00 1.56 0.00 0.00 1.79 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.21 1.32 7.81 193 G 8.83 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 0.00 0.00 0.00 0.00 194 D 7.87 4.56 0.00 2.85 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 S 7.92 4.35 0.00 3.81 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 0.00 196 G 8.66 4.02 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 0.00 0.00 0.00 197 G 7.80 4.53 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 0.00 0.00 0.00 198 P 0.00 4.91 0.00 2.16 2.26 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 2.03 2.15 0.00 199 L 8.65 4.54 0.00 1.26 1.39 0.45 0.33 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 0.00 200 V 8.56 4.95 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.99 0.00 0.00 201 C 8.87 5.61 0.00 2.43 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 0.00 202 K 8.42 4.11 0.00 0.79 1.16 0.00 0.92 0.00 0.00 1.21 0.00 0.00 2.47 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.73 0.21 7.81 203 H 9.04 4.71 0.00 3.33 3.24 0.00 6.15 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 0.00 204 N 9.48 3.85 0.00 2.63 2.72 0.00 0.00 7.18 7.95 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 0.00 205 G 7.61 3.67 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 0.00 0.00 0.00 *208B M 7.52 4.67 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.45 0.00 208C W 8.75 4.83 0.00 3.11 2.89 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 208D R 8.86 4.69 0.00 1.48 1.62 0.00 3.27 0.00 0.00 3.05 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.71 0.00 209 L 8.65 4.13 0.00 1.40 1.50 0.90 0.88 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 0.00 210 V 8.56 3.89 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 0.72 0.00 0.00 0.01 0.00 0.00 211 G 7.71 4.53 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 0.00 0.00 0.00 212 I 8.51 5.01 1.87 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 1.25 0.86 0.92 0.00 0.00 213 T 8.72 3.67 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 214 S 8.05 4.57 0.00 3.89 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 0.00 215 W 7.66 4.72 0.00 3.26 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 0.00 216 G 8.49 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 E 9.28 4.44 0.00 2.22 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.42 0.00 217 G 9.19 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 0.00 220 C 8.60 4.80 0.00 3.00 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 0.00 221 A 9.29 3.92 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A R 7.30 4.09 0.00 1.93 1.86 0.00 3.28 0.00 0.00 3.11 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 222 R 8.52 3.94 0.00 1.77 1.86 0.00 3.39 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.84 0.00 223 E 9.20 3.89 0.00 2.13 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 224 Q 7.54 4.52 0.00 2.09 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.66 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 225 P 0.00 4.48 0.00 2.25 2.06 0.00 3.84 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 2.15 2.02 0.00 226 G 8.56 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 0.00 227 V 7.90 4.57 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 0.47 0.00 0.00 -0.68 0.00 0.00 228 Y 8.71 5.00 0.00 2.98 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 0.00 229 T 8.66 4.29 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 0.90 0.00 0.00 230 K 9.08 4.59 0.00 1.82 1.84 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.80 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.44 7.81 231 V 8.83 3.76 2.26 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 1.09 0.00 0.00 0.96 0.00 0.00 232 A 8.16 4.04 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 E 7.89 4.10 0.00 1.92 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.60 0.00 234 Y 7.96 4.61 0.00 3.07 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 0.00 235 M 8.04 4.16 0.00 2.06 2.31 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 2.95 2.82 0.00 236 D 8.14 4.40 0.00 2.78 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 0.00 237 W 8.29 4.30 0.00 3.47 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 8.36 3.27 1.92 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 1.72 1.04 0.78 0.00 0.00 239 L 7.76 3.81 0.00 1.70 1.64 0.90 0.84 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 0.00 240 E 8.10 3.87 0.00 2.11 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 2.55 2.34 0.00 241 K 7.67 3.77 0.00 0.96 1.39 0.00 1.44 0.00 0.00 1.42 0.00 0.00 2.94 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.49 0.32 7.81 242 T 7.24 3.01 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 243 Q 7.50 4.05 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.93 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 244 S 7.78 4.19 0.00 4.14 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 0.00 245 S 7.56 4.32 0.00 4.19 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 * Residues marked with a * may have inaccurate shift predictions.