NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6582 8.3644 120.4837 53.9213 42.3844 174.5786 2 V 3.8679 8.3828 124.1281 62.7308 32.0999 173.5956 3 Q 4.7624 10.2530 127.6700 54.2058 33.9889 173.7619 4 L 5.2563 8.4003 120.7530 53.0580 46.0936 175.0605 5 L 5.0122 8.9205 125.3351 53.2867 45.3178 175.0600 6 E 4.9202 8.9694 125.7652 56.0476 31.0140 176.1420 7 S 4.6492 9.4868 120.0310 56.9103 66.0360 173.4105 8 G 4.6505 8.5951 111.1684 44.1064 0.0000 169.6491 9 P 4.6500 0.0000 0.0000 61.8458 32.3350 176.0575 10 G 4.5646 8.4316 113.0838 45.1524 0.0000 173.3000 11 L 5.1037 7.4955 120.4913 52.9311 44.7891 175.6226 12 V 4.5568 8.4455 125.3860 60.8474 34.9587 174.6178 13 A 4.9896 8.3949 128.0484 50.0992 19.9735 175.1691 14 P 4.4704 0.0000 0.0000 64.4061 31.6510 177.1180 15 S 4.2767 9.2143 116.5829 58.1887 63.4015 169.0576 16 Q 4.5153 7.6554 120.2681 54.8461 31.0569 174.3294 17 S 5.1966 8.3873 114.0763 56.9449 65.4907 173.2132 18 L 4.5586 8.8012 124.2474 53.5463 44.0587 175.1762 19 S 4.8701 8.5092 121.3455 56.9054 65.8130 173.2541 20 I 4.7118 8.2904 125.7693 59.6622 40.2841 174.8018 21 T 5.1922 8.8390 122.4305 61.9918 71.4740 172.2963 22 C 5.2123 9.7141 127.0208 55.4807 46.2304 172.2226 23 T 5.0093 8.8256 123.8745 61.9783 70.2638 174.0420 24 V 4.8239 8.3418 125.3170 61.3441 34.7283 174.5436 25 S 4.4166 8.8331 119.2399 58.1318 65.9473 175.0634 26 G 4.0418 10.6732 113.7473 45.4485 0.0000 172.5060 27 F 4.8580 7.2173 112.3603 55.9146 40.8195 172.9087 28 S 4.6122 8.6476 115.2117 56.1834 63.4162 174.8696 29 L 4.2684 8.2936 127.2960 57.4819 41.6907 179.3589 30 T 3.6955 7.6267 108.6070 63.8145 68.7428 174.8535 31 N 4.7426 8.0951 117.2318 53.2298 39.8158 174.1860 32 Y 4.8559 7.5952 114.9295 55.9686 42.0407 175.5254 33 G 3.8421 8.8800 109.7063 45.9580 0.0000 172.4449 34 V 4.6621 8.0014 121.0253 60.8398 34.8214 174.4476 35 D 5.2699 8.5580 126.8723 52.7349 43.7959 175.1759 36 W 5.0907 8.8164 120.5293 54.9783 32.0216 175.0947 37 V 5.1129 9.5304 124.6391 61.1333 34.7832 174.2692 38 R 5.1279 9.2536 121.3647 54.6683 33.7175 174.1870 39 Q 4.6723 8.6248 120.7049 54.0064 31.9162 172.2631 40 P 4.8756 0.0000 0.0000 61.4415 32.9267 174.4424 41 P 4.2197 0.0000 0.0000 64.5413 31.4508 176.8484 42 G 3.9265 9.0675 110.5406 45.5785 0.0000 172.3179 43 K 4.6237 7.9299 118.2468 53.7761 35.2112 175.8273 44 G 3.9122 8.2775 108.7725 45.0346 0.0000 173.3600 45 L 4.4656 8.3088 120.0452 54.6696 42.5896 176.5857 46 E 4.7789 9.6902 123.4162 53.9138 32.5248 175.2046 47 W 4.4525 9.1796 135.0000 58.0871 30.9046 175.3934 48 V 3.7565 8.3936 127.7283 63.6946 32.7346 175.6373 49 G 3.4047 5.8894 104.4515 46.5724 0.0000 171.5701 50 V 4.9395 7.4430 117.3365 60.6434 35.4813 173.1789 51 I 4.7645 8.2816 121.7599 59.1768 41.0038 175.2048 52 W 4.8085 9.6528 130.4977 55.8036 30.0806 177.7721 53 S 4.3119 9.1870 114.6961 61.8259 62.1574 176.2509 54 G 3.6850 8.0787 107.4786 46.0251 0.0000 173.8675 55 G 4.1328 8.1155 108.4070 44.9982 0.0000 174.5188 56 S 4.6384 8.1160 114.6214 58.7448 64.3923 173.1753 57 T 5.2576 8.3984 110.0913 60.3340 72.2634 172.4540 58 N 4.9952 8.5407 117.6348 51.9266 43.2872 173.3481 59 Y 5.0900 8.3700 117.9845 55.5812 42.1283 174.8030 60 N 4.4765 8.8773 120.0644 54.7899 39.4785 176.0312 61 S 4.1898 9.1866 121.7563 61.7960 63.2415 175.8009 62 A 4.1756 8.2659 121.9077 54.2553 18.2979 177.9973 63 L 4.6410 7.9254 113.5990 54.7864 43.3354 178.1473 64 M 3.9259 7.7810 116.1560 57.7073 31.0940 177.7150 65 S 4.2905 8.0008 112.5305 59.8473 63.8345 174.4437 66 R 4.5116 8.2646 119.1485 55.7790 31.9355 175.3346 67 L 5.0133 7.4951 118.9152 53.3931 43.8352 176.2392 68 S 4.3824 8.4632 115.5493 57.3187 66.6287 173.0169 69 I 5.1714 8.8788 125.3471 59.6473 39.5969 174.9345 70 S 5.0049 9.1349 120.2313 57.5060 67.1737 172.2629 71 K 4.8954 8.4484 117.6258 56.3763 35.3482 175.2188 72 D 4.7328 9.0072 120.1829 52.2184 42.2133 175.4523 73 N 4.3364 9.0211 123.3887 56.0876 38.9610 177.0943 74 S 4.2271 8.2181 111.5162 60.7048 63.2158 174.9272 75 K 4.2868 8.0378 117.1107 55.3366 32.4838 176.2096 76 S 3.6376 7.6803 114.7683 59.9503 61.0001 171.4747 77 Q 4.9603 7.6459 116.4331 54.0250 32.9445 175.3473 78 V 4.5281 8.3609 121.2595 61.0533 35.4560 174.0901 79 F 5.4864 9.4928 125.5981 55.6158 42.4749 173.7295 80 L 4.8533 8.4193 124.8119 53.0565 44.2530 175.2120 81 K 5.0460 8.7449 125.0374 55.0485 36.4244 175.0795 82 M 5.5437 8.3644 121.6629 55.5081 35.9418 174.0609 83 N 4.8543 8.7550 123.5680 51.1049 41.3165 174.5263 84 S 3.8916 8.2224 112.4615 58.3393 60.4698 173.5728 85 L 4.1854 7.9128 119.9051 55.2325 42.5580 177.6799 86 Q 4.9098 9.7119 122.5961 54.1375 31.4018 176.8695 87 T 3.8975 8.6543 115.9481 67.2358 68.5432 176.4025 88 D 4.4271 8.2600 119.0135 57.6835 40.8299 177.7527 89 D 4.6244 7.8480 116.3014 55.3412 41.2299 176.4959 90 T 4.2308 7.8802 116.8007 64.7318 68.9791 173.2641 91 A 4.4472 8.8955 126.5301 51.4139 23.8976 174.6985 92 V 4.4322 8.0679 119.7387 62.3289 33.1068 174.2691 93 Y 5.0481 9.1908 126.4848 56.6922 39.9362 174.2970 94 Y 5.5766 9.7111 122.8788 56.4120 41.2157 172.3868 95 C 4.7300 9.1760 117.4658 53.5661 44.9581 172.5236 96 A 4.7071 7.8819 121.8707 49.8743 22.1811 175.1537 97 K 4.1978 8.6923 123.8294 55.8733 33.6388 176.0134 98 H 4.8719 8.7632 124.4587 55.8201 29.6942 174.7771 99 W 5.0533 9.1775 131.3792 56.9389 34.5421 175.9005 100 G 2.7528 7.8999 110.6863 45.8795 0.0000 173.4993 101 G 3.3787 6.1772 105.9966 45.5947 0.0000 171.3715 102 Y 4.3228 7.2950 117.8168 57.2913 40.0496 175.3025 103 Y 4.4405 6.8270 119.7113 56.4050 39.6603 175.6472 104 I 4.6700 7.1831 122.3040 58.4253 39.6823 173.0063 105 P 4.8093 0.0000 0.0000 62.6881 31.4652 176.1983 106 Y 4.5059 8.2630 118.7190 61.1404 38.7684 175.3264 107 G 4.1597 7.9882 104.5397 46.5227 0.0000 171.9462 108 M 5.3772 9.2152 120.0272 52.9990 32.7062 176.0484 109 D 4.4567 8.8731 124.4782 54.9210 40.7176 176.7629 110 H 5.0287 7.8444 115.8049 53.4365 32.1182 172.2478 111 W 5.1077 8.8040 122.6066 54.5936 32.2220 175.6123 112 G 4.5282 8.5144 110.8072 44.8630 0.0000 174.0558 113 Q 4.1402 8.6072 117.4732 56.9535 28.9461 177.6073 114 G 3.8038 8.8270 104.6263 45.7657 0.0000 172.5579 115 T 4.6591 8.3134 115.2875 60.2422 71.1879 172.6007 116 T 4.9092 8.3994 124.2152 62.3207 70.7127 173.5324 117 V 4.6885 9.1291 127.1593 61.4512 34.2511 174.1379 118 T 4.8528 8.6441 125.0750 61.9141 70.7262 173.8777 119 V 4.4175 8.8004 127.8610 62.3436 31.9373 174.8873 120 S 4.8407 8.9959 121.7430 57.7054 65.9465 175.4384 121 S 4.4825 8.8841 118.1800 58.7525 63.6891 174.3385 122 A 4.2375 7.8386 124.4358 51.9139 18.9481 176.7062 123 S 4.8177 8.1477 113.8497 56.7778 64.1382 174.1197 124 T 4.4568 8.3115 121.3833 63.9518 69.1920 173.8245 125 K 4.6302 9.8045 126.4376 54.9530 35.7598 175.6587 126 G 4.3781 8.8752 114.7454 44.9910 0.0000 171.4518 127 P 5.0968 0.0000 0.0000 62.5081 32.7017 175.8738 128 S 4.3178 8.6982 118.1481 57.9366 64.4631 173.3379 129 V 4.5590 7.7100 123.2508 61.1021 33.5024 174.4389 130 F 5.2885 8.7887 126.8943 54.8509 42.1841 173.4417 131 P 4.8025 0.0000 0.0000 62.9131 32.6968 175.9708 132 L 4.6988 9.2770 122.4268 53.0833 43.1104 175.3661 133 A 4.6976 8.5330 126.6913 50.5688 19.2629 175.2148 134 P 4.6499 0.0000 0.0000 62.4312 32.8735 176.7864 *140 S 4.0711 8.5603 114.7149 59.0407 62.7869 174.8466 141 G 4.1262 9.3339 118.9838 46.4352 0.0000 173.9671 142 G 4.2142 7.3529 103.9089 46.2392 0.0000 172.4861 143 T 5.0874 8.2202 115.8877 61.4032 72.8106 173.3888 144 A 4.6851 9.2733 126.7760 50.0004 22.0079 174.7032 145 A 4.7977 8.5522 125.0229 51.0161 20.4378 176.1623 146 L 4.7229 8.1922 122.2027 54.3219 45.0669 175.5115 147 G 4.3865 8.2227 104.3010 46.6096 0.0000 171.3615 148 C 5.6580 9.0892 116.2075 55.0601 45.0876 173.3866 149 L 4.9035 9.4615 125.5106 53.7396 43.5396 175.2115 150 V 4.6241 9.0970 127.9827 61.2758 33.2536 174.2222 151 K 4.8609 8.9585 129.7152 55.3283 35.6620 174.2706 152 D 4.9843 8.7348 124.9095 55.1015 38.2637 172.4240 153 Y 5.2011 7.0084 117.7452 55.6298 42.5916 175.0213 154 F 5.1368 9.1555 120.8333 57.0002 43.6274 172.0807 155 P 3.9704 0.0000 0.0000 60.9465 33.1923 175.1933 156 E 4.0773 8.1145 119.0177 55.9614 29.7364 174.9725 157 P 4.7544 0.0000 0.0000 61.6918 33.4879 174.7185 158 V 4.4701 7.8175 111.0526 59.8493 34.1887 175.3264 159 T 4.5511 8.8284 118.3064 60.4863 69.5669 173.4024 160 V 4.8902 8.2644 127.2017 61.1250 34.5205 174.2879 161 S 4.9361 8.9870 121.3724 56.3553 67.5632 172.4386 162 W 5.0957 8.2878 118.2910 55.2017 32.4892 175.8399 163 N 4.4469 9.6205 122.5195 55.6039 35.9168 174.5458 164 S 3.9037 9.9581 106.2219 59.4632 61.5456 174.5719 165 G 4.0015 8.4713 108.6377 45.2441 0.0000 175.3313 166 A 3.9801 7.9845 122.5129 54.2374 18.4800 177.1749 167 L 4.5924 7.7920 117.6554 54.1084 42.5958 175.2961 168 T 4.4573 8.4584 122.2993 65.0553 70.5507 175.7051 169 S 4.1906 7.8127 115.6609 59.4672 63.7595 174.7105 170 G 3.7940 8.7302 111.1131 45.3540 0.0000 172.9272 171 V 4.2785 7.2034 119.2874 62.4390 32.9462 175.2979 172 H 4.5406 9.3105 124.0354 54.6559 32.2884 172.8284 173 T 4.7425 8.3069 121.5528 61.5975 68.8987 174.9756 174 F 4.3191 8.8096 125.9953 56.4828 39.6797 174.1367 175 P 4.2988 0.0000 0.0000 63.1589 31.7822 176.1472 176 A 4.6725 8.4858 122.7633 52.0683 19.6644 176.8464 177 V 4.5023 8.8354 119.3249 60.8497 34.8472 174.4289 178 L 4.0713 8.5398 129.7810 54.6929 42.7286 176.5564 179 Q 4.3960 8.7240 126.0377 54.4952 30.0647 177.0914 180 S 4.0663 8.4186 113.9556 61.3132 63.0451 175.7826 181 S 4.0268 7.9121 114.1424 59.2254 62.6276 175.0593 182 G 3.6811 8.0738 109.3663 45.4616 0.0000 173.0242 183 L 4.7746 7.3364 118.6893 52.9076 45.0430 175.5958 184 Y 4.7873 8.5580 119.4615 57.4375 40.1423 174.5715 185 S 5.4398 8.8053 115.1117 57.3118 66.6598 172.8146 186 L 5.3562 9.4306 126.0578 54.7323 44.8283 174.4302 187 S 5.2484 8.7366 112.1288 56.8364 66.5930 172.6122 188 S 5.3960 8.9142 117.6403 56.9501 64.3223 173.2459 189 V 5.2227 9.1890 119.9974 59.7545 35.7029 174.8978 190 V 4.6908 8.3693 121.0870 60.6433 34.8103 173.7876 191 T 4.6878 8.1138 121.1787 62.8135 69.3635 174.6340 192 V 4.5043 8.7042 119.1465 58.3805 36.4567 173.2841 193 P 4.5374 0.0000 0.0000 62.7929 31.4704 177.7854 194 S 4.2937 8.5852 120.0493 61.7064 63.5072 176.7030 195 S 4.1578 8.3392 112.3768 59.7621 63.3463 174.7452 196 S 4.5516 8.2109 116.2812 60.1222 63.9787 176.7245 197 L 4.1242 7.4171 120.4589 57.5922 41.5276 178.7227 198 G 3.8196 8.1426 106.7369 47.2883 0.0000 174.2806 199 T 4.3240 7.7699 108.1763 61.8440 70.5401 174.3240 200 Q 4.2733 8.4253 123.5271 54.4774 30.0972 174.7154 201 T 4.3251 7.9866 115.0492 60.7056 70.5647 173.6300 202 Y 4.9724 8.4662 120.8585 56.6463 41.1761 174.2407 203 I 5.0894 9.0954 126.2568 59.4946 40.1037 172.5020 204 C 4.0537 8.6424 122.3930 54.0931 42.7349 172.4023 205 N 5.1907 8.7395 121.4022 51.8097 39.9307 173.7737 206 V 4.5387 8.4785 125.4263 60.9951 33.9063 173.8996 207 N 5.2023 9.2708 126.9401 52.1598 41.6821 172.4314 208 H 4.9225 8.8651 127.2811 54.1829 30.5640 174.5740 209 K 3.7955 8.5716 126.5707 58.8550 32.4241 177.0423 210 P 3.8273 0.0000 0.0000 65.2287 31.1658 177.0422 211 S 4.5376 7.7740 109.0084 57.2497 63.6571 173.2644 212 N 4.1555 8.7126 118.8909 54.7843 36.7237 173.7697 213 T 4.6413 7.7260 107.0184 59.9292 71.5738 173.7458 214 K 4.8821 8.5714 123.3991 54.7185 35.3493 175.6075 215 V 4.2900 8.6497 125.6018 61.0155 34.3366 173.8214 216 D 5.1581 8.7440 127.8913 52.6243 42.5505 175.5671 217 K 4.5036 8.4739 125.9123 54.1470 34.5394 175.3035 218 K 4.5569 8.7919 127.7220 56.6208 32.7936 177.1991 219 V 4.2992 9.0540 126.6950 61.5391 31.3350 174.9163 220 E 4.5847 8.5279 126.0952 53.9815 31.1036 175.0939 221 P 4.4528 0.0000 0.0000 63.2409 31.3553 176.4928 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 1 D 8.36 4.66 0.00 2.58 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 2 V 8.38 3.87 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.82 0.00 0.00 3 Q 10.25 4.76 0.00 1.97 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.54 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 4 L 8.40 5.26 0.00 1.65 1.46 0.94 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 5 L 8.92 5.01 0.00 1.71 1.46 0.95 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.97 4.92 0.00 1.96 2.02 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 2.66 2.46 0.00 7 S 9.49 4.65 0.00 3.74 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 8 G 8.60 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 9 P 0.00 4.65 0.00 2.13 2.11 0.00 3.75 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.86 0.00 10 G 8.43 4.56 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 0.00 0.00 0.00 11 L 7.50 5.10 0.00 1.51 1.49 1.06 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 12 V 8.45 4.56 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 0.94 0.00 0.00 0.86 0.00 0.00 13 A 8.39 4.99 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 14 P 0.00 4.47 0.00 2.06 2.03 0.00 3.73 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 2.05 2.11 0.00 15 S 9.21 4.28 0.00 4.14 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 Q 7.66 4.52 0.00 2.21 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.79 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 17 S 8.39 5.20 0.00 3.77 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 18 L 8.80 4.56 0.00 1.55 1.35 0.63 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.51 4.87 0.00 3.67 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 20 I 8.29 4.71 1.38 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.81 1.16 0.00 0.00 21 T 8.84 5.19 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 1.22 0.00 0.00 22 C 9.71 5.21 0.00 2.77 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 T 8.83 5.01 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 1.21 0.00 0.00 24 V 8.34 4.82 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 -0.22 0.00 0.00 0.89 0.00 0.00 25 S 8.83 4.42 0.00 3.87 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 26 G 10.67 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 F 7.22 4.86 0.00 3.05 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 28 S 8.65 4.61 0.00 3.89 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 29 L 8.29 4.27 0.00 1.81 1.71 0.81 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 30 T 7.63 3.70 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 1.22 0.00 0.00 31 N 8.10 4.74 0.00 2.91 2.60 0.00 0.00 6.76 6.99 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 32 Y 7.60 4.86 0.00 2.86 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 33 G 8.88 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 0.00 0.00 0.00 34 V 8.00 4.66 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 0.55 0.00 0.00 0.91 0.00 0.00 35 D 8.56 5.27 0.00 2.42 2.58 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 36 W 8.82 5.09 0.00 3.10 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 37 V 9.53 5.11 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 1.01 0.00 0.00 38 R 9.25 5.13 0.00 0.98 1.51 0.00 2.22 0.00 0.00 2.94 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.34 0.00 39 Q 8.62 4.67 0.00 2.31 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.02 0.00 0.00 0.00 0.00 0.00 2.31 2.52 0.00 40 P 0.00 4.88 0.00 2.13 1.96 0.00 3.84 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 2.13 2.11 0.00 41 P 0.00 4.22 0.00 2.09 2.10 0.00 3.79 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 42 G 9.07 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 7.93 4.62 0.00 1.83 1.76 0.00 1.62 0.00 0.00 1.89 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.41 7.81 44 G 8.28 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.31 4.47 0.00 1.63 1.77 0.87 0.88 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 46 E 9.69 4.78 0.00 2.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 47 W 9.18 4.45 0.00 3.37 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 8.39 3.76 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.00 0.00 0.00 49 G 5.89 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 0.00 0.00 0.00 50 V 7.44 4.94 2.45 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 0.66 0.00 0.00 0.13 0.00 0.00 51 I 8.28 4.76 1.94 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 1.29 1.68 0.93 0.00 0.00 52 W 9.65 4.81 0.00 3.56 3.15 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 0.00 53 S 9.19 4.31 0.00 4.24 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 0.00 54 G 8.08 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 0.00 0.00 0.00 55 G 8.12 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.12 4.64 0.00 3.99 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.40 5.26 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 1.35 0.00 0.00 58 N 8.54 5.00 0.00 3.02 2.94 0.00 0.00 7.17 8.83 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 59 Y 8.37 5.09 0.00 2.88 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 60 N 8.88 4.48 0.00 2.82 2.72 0.00 0.00 7.51 7.86 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 61 S 9.19 4.19 0.00 4.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.27 4.18 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 63 L 7.93 4.64 0.00 1.67 1.64 0.94 0.92 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 64 M 7.78 3.93 0.00 2.49 2.39 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.73 0.00 65 S 8.00 4.29 0.00 3.99 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 66 R 8.26 4.51 0.00 1.67 2.03 0.00 3.28 0.00 0.00 3.15 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.53 0.00 67 L 7.50 5.01 0.00 1.18 0.81 0.86 0.68 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 68 S 8.46 4.38 0.00 3.86 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 69 I 8.88 5.17 2.11 0.00 0.00 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 1.27 0.76 1.19 0.00 0.00 70 S 9.13 5.00 0.00 3.99 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 71 K 8.45 4.90 0.00 1.92 1.83 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.74 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.40 1.50 7.81 72 D 9.01 4.73 0.00 3.01 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 73 N 9.02 4.34 0.00 2.77 2.89 0.00 0.00 7.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 S 8.22 4.23 0.00 3.98 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 75 K 8.04 4.29 0.00 1.83 1.90 0.00 2.13 0.00 0.00 1.93 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.42 7.81 76 S 7.68 3.64 0.00 3.87 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 77 Q 7.65 4.96 0.00 1.77 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.87 0.00 0.00 0.00 0.00 0.00 2.23 2.43 0.00 78 V 8.36 4.53 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 1.32 0.00 0.00 0.85 0.00 0.00 79 F 9.49 5.49 0.00 2.94 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 80 L 8.42 4.85 0.00 0.27 0.33 0.34 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 81 K 8.74 5.05 0.00 1.58 1.53 0.00 1.65 0.00 0.00 1.48 0.00 0.00 2.63 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.25 1.28 7.81 82 M 8.36 5.54 0.00 1.90 1.70 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.28 0.00 83 N 8.75 4.85 0.00 2.58 2.70 0.00 0.00 7.31 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 S 8.22 3.89 0.00 3.94 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.91 4.19 0.00 1.77 1.59 0.85 0.82 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 86 Q 9.71 4.91 0.00 2.18 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.74 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 87 T 8.65 3.90 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 1.25 0.00 0.00 88 D 8.26 4.43 0.00 2.78 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 89 D 7.85 4.62 0.00 2.87 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 90 T 7.88 4.23 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 1.32 0.00 0.00 91 A 8.90 4.45 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 92 V 8.07 4.43 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 0.34 0.00 0.00 0.90 0.00 0.00 93 Y 9.19 5.05 0.00 2.95 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 9.71 5.58 0.00 3.17 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 95 C 9.18 4.73 0.00 2.10 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 96 A 7.88 4.71 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 8.69 4.20 0.00 1.29 1.28 0.00 0.61 0.00 0.00 0.90 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.11 0.63 7.81 98 H 8.76 4.87 0.00 3.23 3.26 0.00 5.67 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 W 9.18 5.05 0.00 3.66 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 G 7.90 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 0.00 0.00 0.00 101 G 6.18 3.38 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 0.00 102 Y 7.29 4.32 0.00 2.54 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 0.00 0.00 0.00 0.00 103 Y 6.83 4.44 0.00 2.73 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 0.00 104 I 7.18 4.67 1.94 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.35 1.01 0.00 0.00 105 P 0.00 4.81 0.00 2.11 1.92 0.00 3.59 0.00 0.00 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.37 0.00 106 Y 8.26 4.51 0.00 2.96 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 0.00 107 G 7.99 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 M 9.22 5.38 0.00 1.47 2.12 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.35 0.00 109 D 8.87 4.46 0.00 2.41 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 0.00 110 H 7.84 5.03 0.00 2.99 3.13 0.00 5.55 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 W 8.80 5.11 0.00 3.08 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 0.00 112 G 8.51 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 0.00 113 Q 8.61 4.14 0.00 2.13 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.53 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 114 G 8.83 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 0.00 0.00 0.00 115 T 8.31 4.66 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 116 T 8.40 4.91 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 117 V 9.13 4.69 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.76 0.00 0.00 118 T 8.64 4.85 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 1.36 0.00 0.00 119 V 8.80 4.42 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 0.75 0.00 0.00 1.01 0.00 0.00 120 S 9.00 4.84 0.00 4.12 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 0.00 121 S 8.88 4.48 0.00 4.02 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 0.00 122 A 7.84 4.24 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 S 8.15 4.82 0.00 3.88 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 0.00 124 T 8.31 4.46 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 1.30 0.00 0.00 125 K 9.80 4.63 0.00 1.85 1.76 0.00 1.68 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.46 7.81 126 G 8.88 4.38 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 0.00 127 P 0.00 5.10 0.00 1.98 1.91 0.00 3.72 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 1.86 1.76 0.00 128 S 8.70 4.32 0.00 3.70 3.24 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 0.00 129 V 7.71 4.56 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.76 0.00 0.00 130 F 8.79 5.29 0.00 3.04 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 0.00 131 P 0.00 4.80 0.00 2.17 2.15 0.00 3.94 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 2.08 2.09 0.00 132 L 9.28 4.70 0.00 1.80 1.72 1.07 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 133 A 8.53 4.70 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 0.00 134 P 0.00 4.65 0.00 2.07 2.05 0.00 3.60 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.84 0.00 *140 S 8.56 4.07 0.00 3.92 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 G 9.33 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 7.35 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 0.00 143 T 8.22 5.09 4.46 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 1.17 0.00 0.00 144 A 9.27 4.69 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 A 8.55 4.80 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 L 8.19 4.72 0.00 1.87 1.63 0.82 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 147 G 8.22 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 0.00 148 C 9.09 5.66 0.00 2.81 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 0.00 149 L 9.46 4.90 0.00 1.88 1.81 1.07 1.14 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 0.00 150 V 9.10 4.62 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 0.79 0.00 0.00 0.87 0.00 0.00 151 K 8.96 4.86 0.00 2.04 1.82 0.00 1.99 0.00 0.00 1.89 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.51 7.81 152 D 8.73 4.98 0.00 2.97 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 0.00 153 Y 7.01 5.20 0.00 2.89 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 0.00 154 F 9.16 5.14 0.00 3.24 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 P 0.00 3.97 0.00 1.69 0.94 0.00 3.74 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.70 0.00 156 E 8.11 4.08 0.00 1.75 1.78 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 1.47 1.62 0.00 157 P 0.00 4.75 0.00 2.13 2.02 0.00 3.66 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.93 0.00 158 V 7.82 4.47 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 -0.35 0.00 0.00 0.61 0.00 0.00 159 T 8.83 4.55 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 1.23 0.00 0.00 160 V 8.26 4.89 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 0.65 0.00 0.00 0.85 0.00 0.00 161 S 8.99 4.94 0.00 3.88 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 0.00 162 W 8.29 5.10 0.00 3.49 3.24 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 0.00 163 N 9.62 4.45 0.00 2.99 2.90 0.00 0.00 6.75 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 S 9.96 3.90 0.00 3.95 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 G 8.47 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 A 7.98 3.98 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 0.00 167 L 7.79 4.59 0.00 1.75 1.93 0.98 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 168 T 8.46 4.46 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 1.20 0.00 0.00 169 S 7.81 4.19 0.00 3.83 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 G 8.73 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 0.00 0.00 0.00 171 V 7.20 4.28 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 0.92 0.00 0.00 0.91 0.00 0.00 172 H 9.31 4.54 0.00 2.85 2.53 0.00 5.65 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 T 8.31 4.74 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 1.27 0.00 0.00 174 F 8.81 4.32 0.00 3.16 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 P 0.00 4.30 0.00 2.16 2.11 0.00 3.95 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.19 0.00 176 A 8.49 4.67 1.49 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 0.00 0.00 177 V 8.84 4.50 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 0.94 0.00 0.00 0.98 0.00 0.00 178 L 8.54 4.07 0.00 1.29 1.39 0.12 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 179 Q 8.72 4.40 0.00 2.13 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.57 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 180 S 8.42 4.07 0.00 3.93 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 0.00 181 S 7.91 4.03 0.00 3.94 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 0.00 182 G 8.07 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 0.00 0.00 0.00 183 L 7.34 4.77 0.00 1.56 1.52 0.93 0.66 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 0.00 184 Y 8.56 4.79 0.00 1.61 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 S 8.81 5.44 0.00 3.94 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 0.00 186 L 9.43 5.36 0.00 2.04 1.93 1.02 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 187 S 8.74 5.25 0.00 4.02 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 0.00 188 S 8.91 5.40 0.00 4.07 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 0.00 189 V 9.19 5.22 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 0.93 0.00 0.00 1.13 0.00 0.00 190 V 8.37 4.69 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 -0.77 0.00 0.00 0.51 0.00 0.00 191 T 8.11 4.69 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 1.14 0.00 0.00 192 V 8.70 4.50 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 0.11 0.00 0.00 0.65 0.00 0.00 193 P 0.00 4.54 0.00 2.09 1.98 0.00 3.65 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 2.14 2.12 0.00 194 S 8.59 4.29 0.00 3.82 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 0.00 195 S 8.34 4.16 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 S 8.21 4.55 0.00 4.10 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 0.00 197 L 7.42 4.12 0.00 1.73 1.84 0.97 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 198 G 8.14 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 T 7.77 4.32 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 1.22 0.00 0.00 200 Q 8.43 4.27 0.00 1.86 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.77 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 201 T 7.99 4.33 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 0.00 202 Y 8.47 4.97 0.00 3.07 3.18 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 0.00 203 I 9.10 5.09 1.89 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 1.31 0.89 0.92 0.00 0.00 204 C 8.64 4.05 0.00 1.28 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 0.00 205 N 8.74 5.19 0.00 2.55 2.70 0.00 0.00 6.18 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 V 8.48 4.54 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 0.78 0.00 0.00 0.73 0.00 0.00 207 N 9.27 5.20 0.00 2.72 2.55 0.00 0.00 6.24 7.89 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 0.00 208 H 8.87 4.92 0.00 3.05 3.09 0.00 5.66 0.00 0.00 0.00 0.00 6.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 K 8.57 3.80 0.00 1.80 1.70 0.00 1.65 0.00 0.00 1.78 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.48 7.81 210 P 0.00 3.83 0.00 1.81 2.02 0.00 3.26 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.98 0.00 211 S 7.77 4.54 0.00 4.02 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 N 8.71 4.16 0.00 2.69 2.90 0.00 0.00 6.80 7.42 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 0.00 213 T 7.73 4.64 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 1.29 0.00 0.00 214 K 8.57 4.88 0.00 1.57 1.69 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.38 7.81 215 V 8.65 4.29 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 0.97 0.00 0.00 0.85 0.00 0.00 216 D 8.74 5.16 0.00 2.54 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 K 8.47 4.50 0.00 1.77 1.57 0.00 1.48 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.44 7.81 218 K 8.79 4.56 0.00 1.73 1.80 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.46 7.81 219 V 9.05 4.30 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 0.94 0.00 0.00 1.23 0.00 0.00 220 E 8.53 4.58 0.00 2.05 1.91 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 2.33 2.38 0.00 221 P 0.00 4.45 0.00 2.07 2.01 0.00 3.76 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 2.07 2.15 0.00 * Residues marked with a * may have inaccurate shift predictions.