NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4968 8.3349 117.1033 57.7203 64.9015 174.2640 3 L 3.9897 7.8320 119.4471 53.5736 41.9518 174.2665 4 P 4.3307 0.0000 0.0000 62.7555 32.7109 175.8450 5 M 4.4520 8.6578 123.3031 54.6789 34.2283 174.6136 6 L 5.0272 9.0077 122.6261 53.3948 44.6923 174.7347 7 Q 5.0804 8.8465 127.4088 54.1527 32.1852 174.1314 8 V 4.6142 8.3030 125.9331 60.2672 33.5816 174.7029 9 A 4.4690 8.3469 127.8664 51.0758 19.4005 177.8476 10 L 4.2423 8.6660 125.3034 53.2876 40.6366 177.0773 11 D 4.7258 7.5806 129.3846 53.1551 40.5796 175.6574 12 N 5.1439 7.3667 117.4757 51.4936 41.6325 176.8065 13 Q 4.1031 8.4454 119.6852 58.1719 29.6868 176.1165 14 T 4.7126 7.3315 106.7502 59.1623 73.3137 174.5953 15 M 3.6995 8.9868 122.2818 58.3627 31.9165 178.9514 16 D 4.3053 7.8071 118.9110 56.2872 39.7180 178.4596 17 S 4.1552 7.6940 113.2367 61.1249 62.3222 175.7868 18 A 3.9857 7.6167 123.0376 55.6561 18.0469 179.2990 19 Y 4.7187 7.7728 116.2623 60.5219 37.6589 178.1881 20 E 4.0305 8.0509 119.1243 59.4935 29.7667 179.2683 21 T 4.1506 7.5879 115.1395 66.7246 68.8942 177.3129 22 T 3.8605 8.3045 112.2497 64.6626 68.5157 176.5322 23 R 4.0721 8.1790 118.1364 58.6588 29.2930 178.3430 24 L 4.3627 7.6434 119.1097 56.2633 42.4406 177.9781 25 I 4.3776 7.3030 109.0943 60.3420 38.0352 176.6747 26 A 3.5533 7.9717 124.7990 55.2182 18.1277 178.5357 27 E 4.4727 7.9909 111.8425 56.3920 29.6832 176.2189 28 E 4.5443 8.1135 117.5751 56.1200 30.4986 175.7336 29 V 4.5341 7.2474 110.8352 59.5917 34.4005 174.8059 30 D 4.6141 8.9457 120.6289 55.9092 42.4972 177.1704 31 I 4.6684 7.4054 118.0701 59.3167 41.2505 174.6499 32 I 4.3955 8.3439 127.6464 59.6787 38.9261 174.1960 33 E 4.6625 8.7317 129.5318 54.7786 31.3049 175.3632 34 V 4.0359 8.8231 128.2746 62.2336 31.8322 175.6300 35 G 4.2122 8.6206 115.7929 45.2861 0.0000 172.8676 36 T 4.0921 8.6855 119.1627 66.1534 68.4232 176.8723 37 I 3.7104 7.8080 120.8191 64.0707 37.0890 178.0920 38 L 4.4016 7.5968 122.2622 57.5358 41.9431 178.4890 39 C 4.0490 8.2894 117.1029 62.9288 27.8690 176.3219 40 V 3.6897 7.8449 118.7441 65.4750 31.1273 178.1684 41 G 3.7710 7.8643 106.4156 46.5799 0.0000 174.7510 42 E 4.5845 8.1941 117.7829 55.2313 31.7784 177.3475 43 G 3.8494 8.4570 109.0138 44.8589 0.0000 174.1688 44 V 3.7885 8.0483 117.1632 63.1649 31.4445 177.8545 45 R 3.9300 8.0393 117.1231 59.3737 29.0161 178.3363 46 A 3.9463 8.1645 121.7288 54.9550 18.2541 179.7026 47 V 3.4403 7.5502 116.2712 66.2227 31.6757 178.1967 48 R 4.4038 7.8170 119.1994 59.1009 29.9278 178.0686 49 D 4.3720 8.4373 118.9368 57.3332 40.9111 178.7916 50 L 4.1410 8.0112 119.6073 57.6291 41.2349 179.4464 51 K 3.9835 8.4453 119.7315 59.3478 31.8772 178.7525 52 A 3.9689 7.8212 120.4007 55.0835 18.3373 179.3236 53 L 3.7111 7.5353 116.6531 56.7370 43.0533 177.4732 54 Y 4.9581 7.6843 114.7215 56.1904 38.1962 174.8951 55 P 4.5219 0.0000 0.0000 64.7889 32.2372 177.7307 56 H 4.4980 8.2430 112.8900 56.3489 29.1531 175.1854 57 K 4.3661 7.3511 119.7640 54.7613 33.8435 175.9349 58 I 3.8481 7.3585 120.4613 61.1440 38.1950 175.1631 59 V 4.5932 9.0194 127.9190 60.9821 33.7067 173.8163 60 L 4.9600 8.6968 130.6190 53.3610 44.0993 174.8509 61 A 4.5069 8.8290 129.5835 50.2039 19.8575 176.8154 62 D 4.8630 8.4500 127.0945 54.0287 38.6907 177.2447 63 A 4.0606 7.8527 122.2543 52.6846 19.8009 177.7412 64 K 3.7062 7.9610 114.6000 56.8915 30.3185 176.2712 65 I 3.6130 7.7837 118.9076 62.0403 37.6346 177.1633 66 A 4.5465 8.0493 126.4601 51.9579 20.6143 174.8697 67 D 4.2192 8.1195 112.2893 53.9869 44.2160 174.4561 68 A 3.7987 8.3706 122.1970 52.7073 16.2974 179.1384 69 G 3.6747 8.0228 109.5093 48.2299 0.0000 174.7728 70 K 4.0143 7.9725 121.3319 59.2917 32.5033 178.8878 71 I 3.7164 7.6619 119.4992 64.5278 37.2084 178.3424 72 L 4.0121 8.1892 120.2918 57.6025 41.3326 179.7961 73 S 3.9998 8.1556 114.3068 61.5596 62.9980 176.3915 74 R 3.9376 8.2250 122.7964 59.3092 29.6157 178.3673 75 M 4.0240 7.9466 118.0674 58.5830 31.9798 178.5196 76 C 3.9621 7.8050 116.7401 62.8336 28.2051 176.2846 77 F 4.0848 8.2138 119.7068 60.3101 38.1528 177.6761 78 E 4.0352 8.1549 117.6485 58.8648 29.5914 178.2030 79 A 4.3436 7.5129 119.0304 51.7620 18.2974 177.6052 80 N 4.3763 8.0693 114.1239 54.2088 36.4510 174.5962 81 A 4.0409 7.5129 120.6920 53.0286 19.2381 178.3248 82 D 4.8571 9.0534 121.7731 56.2610 42.2382 176.7534 83 W 6.2755 7.8849 116.0935 54.1029 33.5663 174.8622 84 V 5.0080 8.3158 113.7652 60.0342 36.0136 174.2014 85 T 4.8981 8.2217 113.3779 60.2288 71.3380 173.5868 86 V 4.8590 8.4747 124.3464 60.8614 34.6946 174.7909 87 I 4.1862 8.4217 121.8198 60.5240 38.3773 177.0957 88 C 4.0594 8.3233 119.4280 61.0950 29.6026 174.3443 89 C 4.4588 8.0117 112.6827 58.3154 29.6779 173.5235 90 A 4.1924 7.6760 123.9554 51.6725 18.8405 177.1504 91 D 4.4514 8.6927 119.6578 54.7490 41.7968 177.6584 92 I 3.8879 8.6088 124.7376 64.4795 37.7647 177.7325 93 N 4.4482 8.7010 116.9483 55.8088 38.3728 177.5596 94 T 3.8531 7.9518 117.5253 66.5370 68.4894 176.4058 95 A 3.9967 7.9859 122.0973 55.1734 18.5492 179.5756 96 K 4.0451 8.4783 117.4198 59.6173 32.0229 179.8729 97 G 3.6087 8.4652 105.9534 47.6548 0.0000 175.6823 98 A 4.3557 8.1033 124.6550 54.3285 18.3532 179.4359 99 L 3.9061 8.3285 119.2630 58.3041 41.9209 178.6454 100 D 4.2997 7.9948 116.9813 57.3248 41.5318 178.2000 101 V 3.7792 7.7352 118.1498 65.9422 31.5186 177.5697 102 A 2.6591 8.0473 120.5852 55.0861 17.9582 179.8277 103 K 3.8619 8.1960 116.7166 59.5496 31.8307 179.3936 104 E 3.8961 7.9031 117.9319 58.3363 29.2622 177.8313 105 F 4.5487 7.5243 114.8233 56.3474 39.3945 174.5589 106 N 4.1760 7.7639 117.4348 54.7295 37.8625 173.8068 107 G 4.6499 7.8301 105.8623 44.8844 0.0000 172.6870 108 D 4.9018 8.9651 117.6545 53.1901 45.3128 175.3319 109 V 4.9319 8.2450 121.5370 61.1681 34.2504 174.4782 110 Q 4.6963 8.7738 125.8670 54.1018 32.0202 174.5732 111 I 4.1790 7.5623 123.6274 60.0209 38.8898 174.6381 112 E 4.1715 8.8316 129.7939 55.6408 30.7480 175.3830 113 L 4.0974 8.4704 128.8864 53.7720 42.6246 175.7779 114 T 4.6635 8.1420 117.6458 60.2787 70.5183 175.7946 115 G 3.3457 8.6355 114.6991 47.1148 0.0000 174.6380 116 Y 4.4882 8.1451 122.4642 56.5869 38.5511 174.4185 117 W 5.5901 8.0557 119.7869 55.0760 31.3642 173.7000 118 T 4.3928 8.2541 107.9762 58.8879 72.7826 174.7222 119 W 4.4907 8.3348 120.6404 59.1459 29.0558 178.8075 120 E 3.9546 8.1876 118.9034 59.5275 28.9808 178.6815 121 Q 3.6961 8.0692 119.1444 58.1447 28.5982 179.2899 122 A 3.9922 7.5450 121.3397 55.1042 18.4569 179.4496 123 Q 3.9376 8.1207 118.0406 59.3408 28.7514 178.3057 124 Q 3.9699 8.0058 119.2129 58.8698 28.7744 179.2224 125 W 4.5200 8.0050 119.7901 60.0040 29.1836 178.6529 126 R 4.0799 8.4867 118.1391 59.6784 29.2930 178.8937 127 D 4.3978 8.4441 117.4455 57.1910 40.8832 178.2687 128 A 4.2898 8.1174 119.8360 53.1841 18.4955 178.2676 129 G 3.9675 7.8225 105.5990 45.2552 0.0000 173.4919 130 I 3.9937 7.8530 121.0957 61.0169 37.5560 176.0496 131 G 4.2275 8.7399 110.7688 45.9843 0.0000 172.1548 132 Q 5.1428 7.8987 118.9354 54.1486 33.1845 174.3981 133 V 4.4430 8.2947 115.2570 59.3650 36.4682 174.7986 134 V 4.3950 8.2970 123.5691 61.3377 33.5106 174.4998 135 Y 4.2764 9.3469 131.5800 57.5566 38.9589 173.1899 136 H 4.8136 8.3705 127.4344 53.6716 30.8661 172.2623 137 R 3.9879 8.9752 126.0207 55.6016 31.3407 175.6044 138 S 4.3048 8.5921 121.4244 57.9282 63.2226 175.0532 139 R 3.9782 8.5236 124.0867 59.0519 29.0862 178.4942 140 D 4.3308 7.8780 118.7717 56.5004 41.1707 178.0970 141 A 4.1908 7.9610 123.6987 55.5811 18.7012 179.9405 142 Q 3.8766 8.1438 119.0341 60.4170 27.9060 180.7313 143 A 4.2113 8.1526 121.7317 54.5439 18.4600 178.6469 144 A 4.3155 7.6983 116.8121 52.0045 19.5347 177.4293 145 G 3.7585 8.2605 105.4161 46.2263 0.0000 174.3573 146 V 4.1958 7.4920 117.1273 60.5374 33.5212 174.1608 147 A 4.6787 8.1285 128.8529 49.5060 21.9978 175.3074 148 W 4.7847 8.5646 120.2187 56.8922 29.8540 176.3613 149 G 4.2654 9.3791 111.0139 43.5910 0.0000 172.5930 150 E 4.0361 8.8653 116.9809 59.0341 29.2869 179.0616 151 A 4.0910 8.1296 120.6792 55.4218 18.3874 179.1962 152 D 4.9296 8.2165 118.0647 57.1381 41.0082 178.8813 153 I 3.7063 7.6492 119.9081 64.7008 37.1307 178.2999 154 T 3.8930 8.2073 116.4376 66.8633 68.2855 176.2498 155 A 4.6077 8.3718 122.2925 55.6459 18.4660 179.7904 156 I 3.7375 8.1177 118.4921 64.4912 37.1574 178.8843 157 K 4.0617 8.3764 119.5050 59.3585 31.8670 179.4709 158 R 3.9104 8.2708 119.1284 59.3683 29.8793 178.5352 159 L 4.5690 8.7880 119.2694 58.1386 41.7053 179.4016 160 S 4.6568 8.4241 114.4694 61.1139 62.0733 176.0386 161 D 4.4314 8.0081 120.7361 57.4823 40.7011 178.2038 162 M 4.2410 8.0459 117.5669 56.1818 32.0170 177.1426 163 G 3.9793 7.5597 105.9009 44.8279 0.0000 174.1658 164 F 4.7764 7.8305 119.2429 57.2353 40.7695 174.8238 165 K 4.3580 9.1546 122.7718 55.8201 33.2682 175.9018 166 V 4.6194 8.3394 125.5228 61.7120 33.5939 174.3450 167 T 4.8045 8.6151 124.8456 62.0650 70.7794 173.6822 168 V 4.7861 8.0081 125.9161 61.5600 34.0357 174.2723 169 T 4.6274 8.7692 119.9449 61.9111 71.4172 171.1693 170 G 4.0165 9.9044 112.6969 46.4412 0.0000 174.0510 171 G 4.0270 8.5727 117.7692 45.8970 0.0000 171.7270 172 L 4.4796 7.5906 118.5431 54.7571 42.8531 175.9456 173 A 4.9856 9.2205 128.6942 50.0354 21.8486 176.8878 174 L 3.2630 8.4902 121.7358 58.2166 41.7197 179.3914 175 E 4.1100 7.9892 114.6912 58.7128 29.7104 178.0701 176 D 4.6194 8.2418 120.3186 56.7934 40.9396 178.1752 177 L 4.0659 7.8124 120.0496 57.6389 41.7333 177.8027 178 P 4.2383 0.0000 0.0000 65.1581 30.9836 178.3950 179 L 3.8591 7.4008 117.4467 56.9548 41.8123 177.8714 180 F 4.6832 8.0634 115.3710 56.5780 39.5705 175.4664 181 K 3.0503 7.2982 122.5364 58.0855 32.0995 176.9810 182 G 3.9358 8.4667 113.0994 45.2340 0.0000 172.8932 183 I 4.5666 7.4861 120.3738 58.8693 39.5418 175.0584 184 P 4.7378 0.0000 0.0000 61.8486 29.6517 176.8935 185 I 3.5076 7.3893 120.4329 62.7504 38.3451 177.0888 186 H 4.2752 9.1303 126.0420 58.8801 30.8743 175.2623 187 V 4.6842 7.1271 116.6845 61.3728 35.2310 172.8458 188 F 5.1184 8.9069 126.2564 55.8384 41.3105 174.4917 189 I 4.8512 8.3304 124.2503 59.5564 39.0392 174.9892 190 A 4.0993 8.8499 128.5505 51.1250 21.3121 174.8445 191 G 3.7758 8.9342 112.0613 46.6236 0.0000 175.6812 192 R 3.9221 8.4409 118.2623 58.8074 30.6893 178.6765 193 S 4.3462 8.0743 111.9397 60.5509 63.2327 175.8702 194 I 4.1312 7.5535 123.3355 63.9797 37.3523 177.9672 195 R 3.9671 8.1010 117.7677 58.8018 30.0023 177.9682 196 D 4.7289 7.8281 115.2333 53.1341 41.5231 176.7449 197 A 4.1932 7.0783 122.7077 51.5964 19.1472 177.7339 198 A 4.0285 8.7230 123.1999 54.6897 18.5903 178.4510 199 S 4.5398 7.7279 110.8774 55.3851 63.9730 172.1458 200 P 4.3555 0.0000 0.0000 65.3972 31.0888 178.5092 201 V 3.5635 7.7396 116.4891 66.1687 31.4710 177.6343 202 E 3.9222 8.2487 118.7578 58.9567 29.4196 178.5431 203 A 4.0243 8.3584 120.9637 55.0882 18.5293 179.4055 204 A 4.0282 8.3107 119.4443 55.5863 18.4420 179.9519 205 R 3.9447 8.2476 116.6788 59.6491 30.0771 179.3577 206 Q 3.9921 8.5472 118.0903 58.8798 28.6393 178.6969 207 F 3.9818 8.3235 118.8052 60.5758 38.9856 177.9275 208 K 4.0650 8.3242 117.9466 59.6161 31.8858 179.7206 209 R 3.9782 8.4174 118.7678 59.1785 29.9077 179.1249 210 S 4.1037 8.3068 113.0287 61.4010 62.4552 176.1629 211 I 4.1369 8.1251 122.4180 64.6857 36.6969 178.3125 212 A 4.1576 8.0728 120.1945 54.9365 18.1968 179.1930 213 E 4.0490 8.1284 117.2074 59.6636 29.9575 178.8687 214 L 3.8762 8.3194 120.3166 57.6671 41.6512 177.8767 *215 W 4.5537 8.3026 123.5289 56.4764 29.3860 178.5328 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 2 S 8.33 4.50 0.00 3.65 3.85 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 3 L 7.83 3.99 0.00 1.71 1.63 0.98 0.89 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 4 P 0.00 4.33 0.00 1.58 1.28 0.00 3.09 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.91 0.00 5 M 8.66 4.45 0.00 1.98 1.86 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.44 0.00 6 L 9.01 5.03 0.00 1.71 1.44 0.60 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 7 Q 8.85 5.08 0.00 2.08 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.60 0.00 0.00 0.00 0.00 0.00 2.17 2.32 0.00 8 V 8.30 4.61 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 0.62 0.00 0.00 0.90 0.00 0.00 9 A 8.35 4.47 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.67 4.24 0.00 1.68 1.58 0.92 0.88 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 11 D 7.58 4.73 0.00 2.68 2.60 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 12 N 7.37 5.14 0.00 2.65 2.63 0.00 0.00 7.01 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 13 Q 8.45 4.10 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.77 0.00 0.00 0.00 0.00 0.00 2.42 2.31 0.00 14 T 7.33 4.71 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 1.17 0.00 0.00 15 M 8.99 3.70 0.00 1.46 1.98 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.72 0.00 16 D 7.81 4.31 0.00 2.89 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 17 S 7.69 4.16 0.00 3.91 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 A 7.62 3.99 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 7.77 4.72 0.00 3.10 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 20 E 8.05 4.03 0.00 2.15 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 0.00 2.39 2.57 0.00 21 T 7.59 4.15 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 22 T 8.30 3.86 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 23 R 8.18 4.07 0.00 2.04 2.26 0.00 3.09 0.00 0.00 3.28 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.71 0.00 24 L 7.64 4.36 0.00 1.81 1.76 0.98 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 25 I 7.30 4.38 1.82 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.78 0.94 0.00 0.00 26 A 7.97 3.55 0.62 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 27 E 7.99 4.47 0.00 1.96 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 2.27 2.29 0.00 28 E 8.11 4.54 0.00 2.01 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 2.23 2.38 0.00 29 V 7.25 4.53 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 0.66 0.00 0.00 0.84 0.00 0.00 30 D 8.95 4.61 0.00 2.60 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 31 I 7.41 4.67 1.74 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 0.89 0.61 0.71 0.00 0.00 32 I 8.34 4.40 1.76 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.57 0.85 0.00 0.00 33 E 8.73 4.66 0.00 2.01 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 2.29 2.21 0.00 34 V 8.82 4.04 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 0.81 0.00 0.00 0.90 0.00 0.00 35 G 8.62 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 T 8.69 4.09 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 1.17 0.00 0.00 37 I 7.81 3.71 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 1.50 0.87 0.91 0.00 0.00 38 L 7.60 4.40 0.00 1.91 1.77 0.89 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 39 C 8.29 4.05 0.00 3.14 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 40 V 7.84 3.69 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 0.78 0.00 0.00 0.90 0.00 0.00 41 G 7.86 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 E 8.19 4.58 0.00 1.96 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 2.17 2.34 0.00 43 G 8.46 3.85 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 0.00 0.00 0.00 44 V 8.05 3.79 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 0.83 0.00 0.00 0.85 0.00 0.00 45 R 8.04 3.93 0.00 2.05 2.24 0.00 2.96 0.00 0.00 3.33 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.69 0.00 46 A 8.16 3.95 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 7.55 3.44 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 1.01 0.00 0.00 0.85 0.00 0.00 48 R 7.82 4.40 0.00 1.90 2.04 0.00 3.27 0.00 0.00 3.30 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.58 0.00 49 D 8.44 4.37 0.00 2.88 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 L 8.01 4.14 0.00 1.88 1.87 1.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 51 K 8.45 3.98 0.00 1.92 1.80 0.00 1.52 0.00 0.00 1.63 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.50 7.81 52 A 7.82 3.97 1.33 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 0.00 0.00 0.00 53 L 7.54 3.71 0.00 1.03 0.16 0.43 0.41 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 54 Y 7.68 4.96 0.00 2.93 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 55 P 0.00 4.52 0.00 2.19 2.18 0.00 3.49 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.91 0.00 56 H 8.24 4.50 0.00 3.31 3.45 0.00 5.51 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 K 7.35 4.37 0.00 1.79 1.60 0.00 1.58 0.00 0.00 1.58 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.03 1.30 7.81 58 I 7.36 3.85 1.36 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.35 -0.47 0.00 0.00 59 V 9.02 4.59 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 0.95 0.00 0.00 0.89 0.00 0.00 60 L 8.70 4.96 0.00 1.63 1.45 0.95 1.49 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 61 A 8.83 4.51 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 62 D 8.45 4.86 0.00 2.80 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 63 A 7.85 4.06 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 K 7.96 3.71 0.00 1.82 1.78 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.47 7.81 65 I 7.78 3.61 1.82 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.67 0.92 0.00 0.00 66 A 8.05 4.55 1.23 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 0.00 0.00 0.00 67 D 8.12 4.22 0.00 2.57 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 0.00 0.00 0.00 0.00 68 A 8.37 3.80 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 69 G 8.02 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 70 K 7.97 4.01 0.00 1.87 1.84 0.00 1.77 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.58 7.81 71 I 7.66 3.72 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.00 0.92 0.00 0.00 72 L 8.19 4.01 0.00 1.76 1.67 0.94 1.04 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 73 S 8.16 4.00 0.00 4.37 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 R 8.23 3.94 0.00 2.08 2.20 0.00 3.17 0.00 0.00 3.41 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.83 0.00 75 M 7.95 4.02 0.00 2.09 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 2.84 2.57 0.00 76 C 7.80 3.96 0.00 2.64 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 77 F 8.21 4.08 0.00 2.37 1.50 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 0.00 0.00 0.00 0.00 78 E 8.15 4.04 0.00 1.96 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 0.00 2.55 2.47 0.00 79 A 7.51 4.34 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 N 8.07 4.38 0.00 2.93 3.03 0.00 0.00 6.84 6.87 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 81 A 7.51 4.04 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 D 9.05 4.86 0.00 2.41 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 83 W 7.88 6.28 0.00 3.14 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 84 V 8.32 5.01 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 -0.01 0.00 0.00 0.92 0.00 0.00 85 T 8.22 4.90 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 86 V 8.47 4.86 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.87 0.00 0.00 87 I 8.42 4.19 1.78 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.40 0.80 0.00 0.00 88 C 8.32 4.06 0.00 3.37 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 C 8.01 4.46 0.00 3.17 3.16 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 90 A 7.68 4.19 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 91 D 8.69 4.45 0.00 2.80 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 92 I 8.61 3.89 1.95 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.39 0.96 0.00 0.00 93 N 8.70 4.45 0.00 2.94 2.88 0.00 0.00 6.89 6.33 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 94 T 7.95 3.85 4.43 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 1.24 0.00 0.00 95 A 7.99 4.00 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 96 K 8.48 4.05 0.00 1.85 1.92 0.00 1.88 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.72 7.81 97 G 8.47 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 A 8.10 4.36 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 0.00 0.00 0.00 0.00 0.00 99 L 8.33 3.91 0.00 1.90 1.88 0.92 1.19 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 0.00 100 D 7.99 4.30 0.00 2.73 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 0.00 101 V 7.74 3.78 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 1.04 0.00 0.00 102 A 8.05 2.66 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 103 K 8.20 3.86 0.00 1.93 1.84 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.53 7.81 104 E 7.90 3.90 0.00 1.98 1.62 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 2.26 2.53 0.00 105 F 7.52 4.55 0.00 2.46 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 0.00 106 N 7.76 4.18 0.00 2.80 2.91 0.00 0.00 6.87 7.83 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 0.00 107 G 7.83 4.65 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 0.00 108 D 8.97 4.90 0.00 2.80 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 0.00 0.00 0.00 0.00 109 V 8.25 4.93 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.03 0.00 0.00 110 Q 8.77 4.70 0.00 1.84 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.67 0.00 0.00 0.00 0.00 0.00 1.91 2.15 0.00 111 I 7.56 4.18 0.80 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 -0.36 -0.54 0.00 0.00 112 E 8.83 4.17 0.00 1.80 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 0.00 2.04 2.03 0.00 113 L 8.47 4.10 0.00 1.20 0.56 0.19 -0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 114 T 8.14 4.66 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 115 G 8.64 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 Y 8.15 4.49 0.00 2.98 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 0.00 117 W 8.06 5.59 0.00 3.57 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 0.00 118 T 8.25 4.39 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 0.00 119 W 8.33 4.49 0.00 3.52 3.45 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.19 3.95 0.00 1.97 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 2.44 2.44 0.00 121 Q 8.07 3.70 0.00 1.84 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.19 2.13 0.00 122 A 7.54 3.99 1.74 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 0.00 0.00 123 Q 8.12 3.94 0.00 2.39 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.70 0.00 0.00 0.00 0.00 0.00 2.38 2.64 0.00 124 Q 8.01 3.97 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.32 2.48 0.00 125 W 8.01 4.52 0.00 3.90 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 0.00 126 R 8.49 4.08 0.00 1.94 1.89 0.00 2.63 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 1.38 1.58 0.00 127 D 8.44 4.40 0.00 2.79 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 0.00 128 A 8.12 4.29 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.82 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 0.00 130 I 7.85 3.99 2.19 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 1.33 0.93 0.92 0.00 0.00 131 G 8.74 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 0.00 0.00 0.00 0.00 132 Q 7.90 5.14 0.00 1.68 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.68 6.76 0.00 0.00 0.00 0.00 0.00 2.04 2.16 0.00 133 V 8.29 4.44 1.54 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 -0.60 0.00 0.00 0.52 0.00 0.00 134 V 8.30 4.39 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 1.04 0.00 0.00 0.82 0.00 0.00 135 Y 9.35 4.28 0.00 3.06 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 0.00 136 H 8.37 4.81 0.00 3.25 3.20 0.00 5.81 0.00 0.00 0.00 0.00 6.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 R 8.98 3.99 0.00 1.66 1.76 0.00 2.78 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.31 0.00 138 S 8.59 4.30 0.00 3.84 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 0.00 139 R 8.52 3.98 0.00 2.06 2.16 0.00 3.00 0.00 0.00 3.33 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 140 D 7.88 4.33 0.00 2.67 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 0.00 141 A 7.96 4.19 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 Q 8.14 3.88 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 143 A 8.15 4.21 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 0.00 144 A 7.70 4.32 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 0.00 145 G 8.26 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 0.00 146 V 7.49 4.20 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.95 0.00 0.00 147 A 8.13 4.68 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 W 8.56 4.78 0.00 3.29 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 G 9.38 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 E 8.87 4.04 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.33 0.00 151 A 8.13 4.09 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 0.00 0.00 0.00 0.00 0.00 152 D 8.22 4.93 0.00 3.14 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 0.00 153 I 7.65 3.71 2.01 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.77 0.92 0.00 0.00 154 T 8.21 3.89 4.59 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 1.25 0.00 0.00 155 A 8.37 4.61 1.87 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 0.00 156 I 8.12 3.74 1.90 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 -0.21 0.92 0.00 0.00 157 K 8.38 4.06 0.00 2.01 1.90 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.62 7.81 158 R 8.27 3.91 0.00 1.85 2.08 0.00 2.41 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.40 0.00 159 L 8.79 4.57 0.00 2.13 2.03 1.17 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 160 S 8.42 4.66 0.00 4.02 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 0.00 161 D 8.01 4.43 0.00 2.90 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 M 8.05 4.24 0.00 1.94 2.39 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.99 2.67 0.00 163 G 7.56 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 F 7.83 4.78 0.00 3.25 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 0.00 165 K 9.15 4.36 0.00 1.58 1.40 0.00 1.44 0.00 0.00 1.09 0.00 0.00 2.65 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.27 1.28 7.81 166 V 8.34 4.62 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 1.06 0.00 0.00 1.06 0.00 0.00 167 T 8.62 4.80 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 168 V 8.01 4.79 1.54 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 0.28 0.00 0.00 0.46 0.00 0.00 169 T 8.77 4.63 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 1.15 0.00 0.00 170 G 9.90 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 0.00 171 G 8.57 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 0.00 172 L 7.59 4.48 0.00 1.90 1.74 1.06 0.99 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 0.00 173 A 9.22 4.99 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 0.00 174 L 8.49 3.26 0.00 1.15 1.45 0.24 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 175 E 7.99 4.11 0.00 2.16 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 0.00 2.33 2.38 0.00 176 D 8.24 4.62 0.00 3.03 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 0.00 177 L 7.81 4.07 0.00 1.72 1.83 0.86 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 178 P 0.00 4.24 0.00 2.10 2.03 0.00 3.75 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 179 L 7.40 3.86 0.00 0.74 1.29 0.99 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 180 F 8.06 4.68 0.00 3.77 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 K 7.30 3.05 0.00 1.52 1.53 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.16 1.01 7.81 182 G 8.47 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 0.00 183 I 7.49 4.57 2.26 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.90 1.02 0.00 0.00 184 P 0.00 4.74 0.00 2.21 2.18 0.00 3.87 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 185 I 7.39 3.51 1.13 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.13 -0.18 0.00 0.00 186 H 9.13 4.28 0.00 3.09 3.31 0.00 5.59 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 0.00 187 V 7.13 4.68 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 0.99 0.00 0.00 0.77 0.00 0.00 188 F 8.91 5.12 0.00 2.95 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 I 8.33 4.85 1.86 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 1.13 0.53 0.98 0.00 0.00 190 A 8.85 4.10 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 G 8.93 3.78 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 0.00 0.00 0.00 192 R 8.44 3.92 0.00 1.89 2.02 0.00 3.14 0.00 0.00 3.39 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.70 0.00 193 S 8.07 4.35 0.00 4.24 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 I 7.55 4.13 1.82 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.33 0.89 0.00 0.00 195 R 8.10 3.97 0.00 1.76 1.99 0.00 3.13 0.00 0.00 3.36 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.86 0.00 196 D 7.83 4.73 0.00 2.83 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 0.00 197 A 7.08 4.19 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 A 8.72 4.03 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 0.00 199 S 7.73 4.54 0.00 3.86 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 0.00 200 P 0.00 4.36 0.00 2.20 2.19 0.00 3.67 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.26 0.00 201 V 7.74 3.56 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 1.11 0.00 0.00 0.99 0.00 0.00 202 E 8.25 3.92 0.00 2.15 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 2.31 2.55 0.00 203 A 8.36 4.02 1.47 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 0.00 0.00 204 A 8.31 4.03 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 205 R 8.25 3.94 0.00 2.03 2.03 0.00 3.15 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.87 0.00 206 Q 8.55 3.99 0.00 2.18 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 207 F 8.32 3.98 0.00 3.30 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 0.00 208 K 8.32 4.06 0.00 1.99 1.90 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.65 7.81 209 R 8.42 3.98 0.00 1.98 1.99 0.00 3.13 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.89 0.00 210 S 8.31 4.10 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 0.00 211 I 8.13 4.14 2.12 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.02 1.01 0.00 0.00 212 A 8.07 4.16 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 0.00 0.00 0.00 0.00 0.00 213 E 8.13 4.05 0.00 2.10 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 214 L 8.32 3.88 0.00 1.66 0.96 1.00 0.59 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 *215 W 8.30 4.55 0.00 3.37 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 * Residues marked with a * may have inaccurate shift predictions.