NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2990 8.2649 123.5839 51.5628 19.7671 176.4055 2 D 4.4774 8.2875 119.3077 54.3940 41.7153 173.7570 3 T 4.8924 9.9757 119.2676 62.0484 71.8848 173.4749 4 I 5.1567 8.4524 126.3147 59.4110 41.3670 174.4413 5 V 5.0470 8.9299 125.7335 61.2230 34.5051 174.1287 6 A 5.1626 9.4630 128.0824 50.6368 23.5526 174.9066 7 V 4.7847 9.2946 120.4733 61.2958 33.5650 174.4050 8 E 4.9355 9.4350 127.2317 55.0706 32.1274 175.3777 9 L 4.2489 9.3409 124.0462 53.1746 43.0485 174.5616 10 D 5.1624 9.1781 125.7605 52.5919 41.3966 176.7832 11 S 4.3620 9.2291 122.6997 60.2067 64.6205 173.2354 12 Y 4.9603 8.1618 121.9018 54.8411 40.9269 173.4226 13 P 4.5145 0.0000 0.0000 62.3861 31.4538 176.1073 14 N 4.8271 10.0122 124.8330 51.8946 37.4471 176.0339 15 T 4.3250 8.1115 112.5586 63.2766 69.8883 177.5527 16 D 4.4060 7.8224 122.0514 56.8688 41.4213 178.6420 17 I 4.3880 7.6831 111.4602 60.5247 37.7927 176.4041 18 G 3.8677 7.9027 107.4927 46.5662 0.0000 174.4488 19 D 4.3140 7.6530 119.7040 53.1962 41.6221 174.4162 20 P 4.4621 0.0000 0.0000 62.6350 31.9192 175.7348 21 S 4.3636 7.5879 111.4766 58.0526 63.5602 173.2776 22 Y 4.8072 6.5031 116.9161 55.7570 41.1718 172.4407 23 P 4.7957 0.0000 0.0000 63.9427 32.6538 175.0515 24 H 5.7711 9.6594 116.9260 55.0334 32.2547 172.4384 25 I 4.8340 8.9008 113.8390 59.7600 40.1945 174.7229 26 G 4.5202 9.1747 110.1522 45.0074 0.0000 171.3395 27 I 5.0463 8.6993 122.7549 59.6101 39.2781 174.3677 28 D 5.0786 9.5492 128.1357 52.5772 43.7927 175.6581 29 I 4.6613 7.8728 123.0930 59.6200 39.9900 175.2757 30 K 4.1550 9.9937 125.2860 56.6725 30.1822 175.9239 31 S 3.6270 7.0354 109.4454 56.7220 65.2860 174.9059 32 I 3.4475 6.8873 125.7414 62.9176 37.9396 176.0985 33 R 4.1953 7.3453 119.2173 54.7269 29.0481 176.3358 34 S 4.5683 8.2119 118.5399 58.2468 63.3453 175.3738 35 K 4.0245 8.8344 123.3307 58.6847 32.3942 177.4761 36 S 4.8247 7.5175 114.8027 57.5407 67.3221 173.4131 37 T 5.3838 8.4179 111.9337 60.6838 72.2590 172.6531 38 A 4.8275 9.1837 123.0081 50.0364 23.0776 175.7192 39 R 4.3707 8.8761 121.8449 56.9680 30.6442 175.2725 40 W 4.9478 9.2655 135.0000 55.9777 32.3732 175.6399 41 N 4.6203 9.1873 125.8279 52.0970 36.9651 174.8600 42 M 3.8768 7.5389 121.4732 54.6048 32.9637 177.0251 43 Q 4.2059 7.7379 119.2448 53.1771 29.1487 174.2980 44 T 4.0867 7.7323 116.4669 65.2315 69.2184 174.9814 45 G 4.0048 9.7752 114.8472 45.1800 0.0000 173.3476 46 K 4.6412 7.6528 118.4417 53.9805 34.7406 176.0126 47 V 3.8902 8.4490 122.3957 63.0848 32.0001 175.4476 48 G 3.1842 8.6389 115.5199 44.3681 0.0000 172.1160 49 T 5.0917 8.5025 117.7777 61.2608 71.7353 173.1524 50 A 5.0483 8.5193 127.0095 50.3333 22.3101 174.8022 51 H 5.1982 9.2080 117.5715 54.0907 33.3252 172.7266 52 I 5.1842 9.2702 122.5860 59.8476 41.2476 174.6558 53 S 5.1060 9.2259 121.0623 57.4382 67.6616 172.3686 54 Y 5.0866 8.3726 122.6968 56.5011 42.4181 173.1424 55 N 5.1101 7.4207 121.0607 51.0928 40.7274 175.2779 56 S 3.6405 8.7101 114.9126 60.0724 63.9010 176.0089 57 V 3.6409 7.8105 120.5065 65.7908 31.6066 176.9068 58 A 3.9234 8.3083 121.6855 53.2981 18.5456 177.6344 59 K 3.7360 8.4499 114.9584 57.5368 29.8999 175.6796 60 R 4.8383 7.4453 117.7265 54.5921 32.9021 173.9587 61 L 4.9843 9.2115 130.4621 54.6759 43.5404 175.5690 62 T 5.3939 9.1310 115.2364 60.2960 72.8231 172.4842 63 A 5.2383 9.3259 123.2239 50.7008 23.3161 175.3363 64 V 4.8598 8.9619 119.1960 61.1657 35.6019 174.3674 65 V 4.9845 8.9503 126.6712 61.2359 34.7483 174.3454 66 S 5.0060 8.9741 120.7087 57.4242 67.0776 172.1729 67 Y 4.9636 9.0981 117.7454 55.5488 42.3362 175.2136 68 S 3.8517 8.8907 115.1023 60.4476 62.5421 174.8408 69 G 3.9881 9.0796 114.9017 45.6007 0.0000 172.8740 70 S 4.9089 7.7601 113.4780 55.8132 65.3806 174.4019 71 S 4.2471 8.5466 118.5042 58.9301 63.1325 174.4026 72 S 4.8747 8.3943 118.9091 57.9823 65.1251 173.0691 73 T 4.8787 8.8876 116.8158 61.9317 71.1825 173.6974 74 T 5.3027 8.6277 115.4614 60.0045 72.2309 173.4849 75 V 4.7028 8.8195 121.4996 60.6573 35.0955 173.9664 76 S 5.2739 8.6023 117.2012 57.6406 67.5300 172.8079 77 Y 4.9150 9.0130 122.3936 56.5832 42.5201 173.4552 78 D 4.9306 8.3179 127.4634 54.3483 41.4165 176.1556 79 V 4.1700 8.3758 122.0825 60.8026 34.8874 173.1564 80 D 4.7420 8.5793 124.0048 52.4681 40.8602 176.6245 81 L 3.9185 8.7502 128.9531 57.5642 41.7558 179.9641 82 T 3.9933 7.6236 107.7608 63.5663 68.5971 174.8841 83 N 4.6185 7.9500 118.5801 53.7196 39.1741 175.1872 84 V 4.1918 7.5928 116.0287 63.9411 33.5292 175.4520 85 L 4.6521 7.9553 118.2295 52.2015 43.1127 174.6371 86 P 4.6418 0.0000 0.0000 62.4452 32.2141 176.3436 87 E 4.3003 8.9346 116.6941 58.3158 30.6922 176.4106 88 W 5.2537 8.3321 119.1316 55.0598 31.7179 175.5331 89 V 4.7942 9.2001 116.0333 60.3847 36.4707 174.0139 90 R 4.9658 9.0122 120.3394 54.7332 33.1107 176.0353 91 V 4.2533 7.9252 114.5211 60.0992 35.0850 175.0262 92 G 3.9798 7.3515 109.0072 45.9228 0.0000 171.6529 93 L 5.2992 8.5240 119.1911 52.7616 45.4608 176.4357 94 S 5.1500 8.9147 115.5809 57.1803 67.0888 172.3031 95 A 4.9866 8.7722 121.2274 51.6712 22.9146 175.1784 96 T 5.1773 8.8777 108.6790 60.6015 72.4852 172.7026 97 T 4.8667 8.9362 112.6399 59.1077 73.0351 174.4649 98 G 4.4784 9.1320 112.1429 45.5645 0.0000 175.2981 99 L 3.7455 8.7739 126.0368 56.9378 42.2095 175.9147 100 Y 4.8183 6.8788 115.1205 56.3333 39.9099 173.6796 101 K 5.4634 9.1510 119.9229 55.1643 36.7451 174.4745 102 E 5.0388 8.2502 116.1849 55.8704 31.6655 175.5761 103 T 4.2771 8.7820 111.6820 61.2073 70.6685 173.6862 104 N 5.3627 8.1821 117.7978 52.1499 38.7543 173.3259 105 T 4.8582 8.4986 116.9035 62.6716 71.0438 175.2576 106 I 4.9304 9.1259 128.4377 60.0170 38.5958 176.4583 107 L 5.1168 9.3364 127.6763 56.0225 42.8032 176.9774 108 S 5.1207 8.2135 111.3707 57.6201 66.8936 173.7009 109 W 5.9634 9.5046 129.4008 57.0285 34.6278 173.3295 110 S 4.7285 9.7547 121.1841 57.0857 66.8027 172.3677 111 F 4.8006 7.7632 120.5783 57.4153 43.0575 172.8960 112 T 4.7063 7.9694 121.4820 61.7656 72.8364 172.8015 113 S 5.1125 9.4012 120.2123 56.4291 66.1718 172.7512 114 K 5.0925 9.4109 124.1094 54.6032 36.7476 175.3679 115 L 5.0314 9.1472 122.7217 53.2606 44.7789 176.2127 116 K 4.4778 9.3662 124.3156 55.6722 34.9325 175.3039 117 T 4.4334 8.3364 115.0265 63.2993 75.6057 174.0048 *123 A 4.2524 7.5064 125.3344 51.1499 20.4842 176.2203 124 N 4.5188 7.8690 118.6752 55.7236 40.2142 173.5947 125 A 5.2182 8.3960 124.4261 50.3886 22.9212 175.0889 126 L 4.8414 8.9955 121.2897 53.7547 45.8005 174.7611 127 H 5.2839 8.8471 124.9425 54.4967 33.0471 171.9362 128 F 4.6453 7.9907 119.2029 55.3250 41.7865 173.3652 129 S 4.5789 7.6272 112.8879 57.0268 65.4618 173.0610 130 F 4.9442 9.4877 126.1764 55.6599 41.6705 175.3664 131 N 4.8866 8.7725 119.7393 52.3826 37.9908 174.0223 132 Q 4.7761 7.2347 114.4619 55.7906 31.3725 173.1165 133 F 4.7549 9.5925 120.4952 55.7494 41.8261 175.5083 134 T 4.3669 8.5829 117.9339 61.7301 67.7921 174.0317 135 Q 4.1665 8.7528 124.6215 57.6473 29.2580 175.3681 136 N 4.7771 8.3508 116.8463 50.7356 38.8554 170.3481 137 P 4.5941 0.0000 0.0000 60.8407 30.7073 177.6764 138 K 4.0664 8.4400 124.7853 58.5116 32.4064 177.7351 139 D 4.6045 8.0082 117.8374 52.7304 39.7673 175.1898 140 L 5.1678 7.7252 119.3175 53.3823 44.7063 176.2817 141 I 4.2501 8.7202 124.0124 59.9948 38.4020 174.7117 142 L 4.8778 8.4138 127.8919 53.8864 42.6691 176.4993 143 Q 4.5085 9.2140 122.8873 54.3372 32.0534 176.5556 144 G 3.6598 8.6950 109.2979 47.2685 0.0000 174.7376 145 D 4.6668 9.3259 123.5877 54.8954 41.2691 176.7070 146 A 4.5811 7.7882 121.8143 52.3247 19.1852 176.8569 147 T 4.7656 8.9279 111.4875 60.6875 73.2772 172.7522 148 T 4.9389 8.4242 111.0837 59.8163 71.2721 173.1370 149 D 5.0818 8.4454 122.6125 51.2369 42.0213 176.8312 150 S 4.2354 8.5031 112.3612 60.7518 63.1113 174.6109 151 D 4.5044 8.2986 119.4961 54.7441 41.0690 176.8549 152 G 4.4867 8.7537 108.5946 45.9645 0.0000 172.7173 153 N 5.2408 8.6230 116.7298 51.5305 41.4175 173.7331 154 L 4.4741 8.7131 123.9627 53.5984 44.0237 175.1236 155 E 4.4895 9.3045 127.5458 54.8656 30.1156 176.7841 156 L 4.0424 8.9354 127.1932 56.8153 42.7641 177.4816 157 T 4.9040 7.5665 106.6871 58.9311 72.0149 174.1749 158 K 4.1134 8.9844 124.7144 56.9134 33.1161 176.0393 159 V 4.9958 8.1870 119.7638 59.1842 35.3777 175.6195 160 S 4.4115 9.4198 120.1023 57.6862 63.6706 175.3445 161 S 4.0935 8.5913 114.9154 61.0855 62.5187 174.8190 162 S 4.5274 8.0634 114.3489 58.1808 63.0376 174.8993 163 G 3.8730 8.2514 107.6180 46.6270 0.0000 174.1978 164 S 4.4631 7.6738 116.6255 57.1803 63.3158 171.6380 165 P 4.9642 0.0000 0.0000 62.8590 32.1699 175.5787 166 Q 4.5920 8.7508 121.6989 54.3693 30.7745 175.7853 167 G 3.7450 8.5421 109.2784 45.4511 0.0000 172.7111 168 S 3.7851 8.2495 112.8639 59.6951 61.1934 172.6177 169 S 5.1162 8.0070 113.0409 56.6351 65.5087 173.0058 170 V 4.9129 8.6416 123.6397 60.5340 34.8941 173.9231 171 G 4.8380 8.8078 108.3274 46.8468 0.0000 172.0786 172 R 5.3149 8.7750 118.6100 54.7970 35.6276 174.1966 173 A 5.0577 9.0397 121.9041 50.6917 22.5200 175.3018 174 L 5.1646 9.0582 123.1157 52.7574 44.6718 176.0907 175 F 4.5119 9.3084 125.1078 58.3315 39.4593 174.8160 176 Y 3.7300 7.1449 126.9153 60.1960 39.2010 176.4579 177 A 4.3686 6.7807 121.6267 50.6313 19.5262 175.0870 178 P 4.7321 0.0000 0.0000 63.2499 32.4392 175.7961 179 V 4.6119 9.4634 122.4006 61.5359 34.4904 174.0885 180 H 4.2651 8.8758 128.2213 55.0270 29.2097 174.2289 181 I 4.4809 8.8206 119.7974 60.9157 38.5314 175.3423 182 W 5.2805 7.7470 130.8041 56.6344 33.8306 172.6295 183 E 4.4469 6.4619 120.9958 54.2833 31.8097 176.0099 184 S 4.2427 8.5932 119.3073 60.6017 62.8838 174.9867 185 S 4.4127 7.5900 112.3340 57.3389 64.2372 174.1250 186 A 3.9122 7.0064 123.6065 52.5129 18.6478 177.8187 187 V 3.9776 8.3081 120.8232 65.1940 32.5115 176.6834 188 V 4.8068 7.4467 117.8191 61.6277 34.9641 172.4816 189 A 5.4974 9.8232 128.5862 50.4381 22.6102 175.0919 190 S 5.1463 9.1769 114.4848 57.1628 66.9982 172.9307 191 F 5.3123 8.7673 115.4794 55.9452 41.8099 172.8389 192 D 5.3727 9.0980 118.6689 52.7936 45.3688 174.5166 193 A 5.1044 9.4081 122.5002 50.7888 23.2603 175.1770 194 T 5.2067 9.1685 115.8704 62.0616 73.3787 173.1805 195 F 5.7488 8.8737 119.3858 55.8049 42.1559 173.1262 196 T 5.3074 9.2304 109.6002 60.3051 71.7980 172.8544 197 F 5.6052 8.6865 117.5357 55.8744 42.4674 173.0374 198 L 4.9200 9.3815 121.5663 53.7504 45.1749 174.9669 199 I 5.2899 8.7255 127.3091 58.8976 39.7141 174.9553 200 K 4.9940 9.3903 126.3495 54.9346 36.1272 175.2278 201 S 5.0123 8.3326 115.3984 56.8660 64.9359 172.5276 202 P 4.5033 0.0000 0.0000 63.8880 31.9330 175.9265 203 D 4.7629 8.0835 119.8893 53.1469 42.0340 176.5368 204 S 4.0757 8.6563 117.0258 60.6298 62.5323 173.9360 205 E 4.4602 7.5185 119.7248 53.3830 30.7945 173.7665 206 P 4.6358 0.0000 0.0000 62.8618 32.5329 175.2808 207 A 4.8814 8.1622 118.5972 51.9180 22.6832 176.6950 208 D 4.7638 9.9741 119.1216 53.4635 43.1016 177.0623 209 G 4.7120 7.1002 104.7497 46.4905 0.0000 171.0504 210 I 5.2794 8.1742 112.5475 59.7528 41.3456 174.1866 211 T 5.1082 9.1132 112.7263 60.3877 72.9793 171.9507 212 F 5.3137 9.0446 124.6582 56.5802 41.9255 174.2988 213 F 5.1381 7.9697 119.5202 55.3990 41.8828 173.1567 214 I 4.6442 8.9737 119.5420 59.6779 41.1586 174.4486 215 A 5.8154 9.1524 126.2366 50.4605 23.4378 175.0533 216 N 4.6174 8.9768 116.5294 53.6121 37.5282 176.3379 217 T 3.9411 8.8216 111.2293 64.6298 68.9159 174.2076 218 D 4.7166 7.8535 119.7802 53.1268 39.7652 176.2565 219 T 4.2548 7.7964 113.6437 62.7025 67.7367 173.0207 220 S 4.7450 8.5996 120.1859 56.5243 66.2368 173.8294 221 I 3.6575 8.0654 122.1021 60.5081 37.1838 174.7760 222 P 4.2946 0.0000 0.0000 61.9645 31.8920 175.9471 223 S 4.2255 8.4208 116.6766 60.1489 62.3583 174.7309 224 G 3.9686 8.9579 115.0222 45.5887 0.0000 174.2164 225 S 4.9872 8.1927 113.8963 57.7536 63.1326 174.5205 226 S 4.3080 7.7310 116.8982 58.3016 65.2198 177.5936 227 G 3.8384 8.4348 111.5253 46.6508 0.0000 177.2386 228 R 4.0382 8.9547 121.7864 57.8869 29.5952 176.9247 229 L 4.3846 8.1769 118.4644 54.2201 41.8237 176.8840 230 L 3.7696 8.2772 117.1116 54.5367 39.6426 175.6140 231 G 3.8015 8.5163 104.6354 45.4994 0.0000 174.9153 232 L 3.9237 7.7863 119.6148 54.4566 43.9405 176.8395 233 F 4.8055 7.4372 115.3894 54.7850 42.3796 173.8016 234 P 4.6362 0.0000 0.0000 64.2785 31.7511 174.9819 235 D 4.4837 7.6683 116.5808 53.2183 41.6508 174.4443 236 A 4.5212 8.2930 119.3290 52.0422 19.0396 176.9562 237 N 4.4527 8.3748 122.3100 55.0079 38.4864 175.0846 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 A 8.26 4.30 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 D 8.29 4.48 0.00 2.72 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 T 9.98 4.89 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 1.29 0.00 0.00 4 I 8.45 5.16 1.73 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.67 0.69 0.00 0.00 5 V 8.93 5.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.99 0.00 0.00 6 A 9.46 5.16 1.27 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 7 V 9.29 4.78 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 1.19 0.00 0.00 8 E 9.44 4.94 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.39 0.00 9 L 9.34 4.25 0.00 1.42 0.88 0.69 -1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 10 D 9.18 5.16 0.00 2.83 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 11 S 9.23 4.36 0.00 4.03 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 12 Y 8.16 4.96 0.00 3.30 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 13 P 0.00 4.51 0.00 1.96 2.09 0.00 2.97 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.75 0.00 14 N 10.01 4.83 0.00 2.89 2.89 0.00 0.00 6.40 6.93 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 15 T 8.11 4.33 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 16 D 7.82 4.41 0.00 2.68 2.76 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 17 I 7.68 4.39 1.84 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 1.25 0.99 0.90 0.00 0.00 18 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 19 D 7.65 4.31 0.00 2.73 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 P 0.00 4.46 0.00 0.53 1.87 0.00 3.13 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 1.34 1.67 0.00 21 S 7.59 4.36 0.00 3.92 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 6.50 4.81 0.00 3.10 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 23 P 0.00 4.80 0.00 2.22 1.83 0.00 3.74 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.20 0.00 24 H 9.66 5.77 0.00 3.49 3.70 0.00 5.24 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 I 8.90 4.83 1.76 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 1.32 0.83 0.31 0.00 0.00 26 G 9.17 4.52 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 I 8.70 5.05 1.85 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.37 1.04 0.00 0.00 28 D 9.55 5.08 0.00 2.79 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 29 I 7.87 4.66 1.91 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 1.39 1.38 1.01 0.00 0.00 30 K 9.99 4.16 0.00 1.90 1.99 0.00 1.80 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.43 7.81 31 S 7.04 3.63 0.00 3.63 3.42 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 32 I 6.89 3.45 1.72 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 1.55 0.80 0.77 0.00 0.00 33 R 7.35 4.20 0.00 1.72 1.80 0.00 3.14 0.00 0.00 3.15 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.46 0.00 34 S 8.21 4.57 0.00 3.82 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 35 K 8.83 4.02 0.00 0.79 0.74 0.00 1.60 0.00 0.00 1.53 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.14 1.08 7.81 36 S 7.52 4.82 0.00 3.75 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 37 T 8.42 5.38 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 1.21 0.00 0.00 38 A 9.18 4.83 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 39 R 8.88 4.37 0.00 1.29 1.74 0.00 2.97 0.00 0.00 2.84 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.02 0.00 40 W 9.27 4.95 0.00 3.35 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 N 9.19 4.62 0.00 2.83 2.78 0.00 0.00 7.20 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 42 M 7.54 3.88 0.00 1.48 1.57 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.81 0.00 43 Q 7.74 4.21 0.00 0.93 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 7.03 0.00 0.00 0.00 0.00 0.00 2.00 1.81 0.00 44 T 7.73 4.09 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 45 G 9.78 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 46 K 7.65 4.64 0.00 1.69 1.75 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.71 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.27 1.50 7.81 47 V 8.45 3.89 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.96 0.00 0.00 48 G 8.64 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 0.00 0.00 0.00 49 T 8.50 5.09 4.07 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 0.95 0.00 0.00 50 A 8.52 5.05 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 H 9.21 5.20 0.00 2.94 3.08 0.00 5.56 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 I 9.27 5.18 1.88 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.67 1.35 0.00 0.00 53 S 9.23 5.11 0.00 3.65 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 8.37 5.09 0.00 2.51 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 55 N 7.42 5.11 0.00 2.71 2.58 0.00 0.00 5.91 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.71 3.64 0.00 3.83 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.81 3.64 2.15 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 0.75 0.00 0.00 0.92 0.00 0.00 58 A 8.31 3.92 1.16 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 59 K 8.45 3.74 0.00 1.85 1.95 0.00 1.53 0.00 0.00 1.50 0.00 0.00 2.77 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.30 1.36 7.81 60 R 7.45 4.84 0.00 1.69 1.70 0.00 3.20 0.00 0.00 3.15 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 61 L 9.21 4.98 0.00 2.03 1.74 1.29 0.68 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 62 T 9.13 5.39 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 1.24 0.00 0.00 63 A 9.33 5.24 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 64 V 8.96 4.86 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 0.96 0.00 0.00 1.00 0.00 0.00 65 V 8.95 4.98 1.86 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 0.99 0.00 0.00 0.58 0.00 0.00 66 S 8.97 5.01 0.00 3.86 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 9.10 4.96 0.00 2.90 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 S 8.89 3.85 0.00 3.86 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 69 G 9.08 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 S 7.76 4.91 0.00 4.15 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 71 S 8.55 4.25 0.00 3.94 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 72 S 8.39 4.87 0.00 3.97 3.90 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 73 T 8.89 4.88 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 1.36 0.00 0.00 74 T 8.63 5.30 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 75 V 8.82 4.70 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 0.81 0.00 0.00 1.02 0.00 0.00 76 S 8.60 5.27 0.00 3.76 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 77 Y 9.01 4.92 0.00 3.04 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 78 D 8.32 4.93 0.00 2.29 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 0.00 0.00 0.00 0.00 79 V 8.38 4.17 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 0.68 0.00 0.00 1.01 0.00 0.00 80 D 8.58 4.74 0.00 2.63 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 81 L 8.75 3.92 0.00 1.30 1.55 0.30 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 82 T 7.62 3.99 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 83 N 7.95 4.62 0.00 2.83 2.87 0.00 0.00 6.68 8.38 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 84 V 7.59 4.19 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 0.89 0.00 0.00 1.02 0.00 0.00 85 L 7.96 4.65 0.00 1.76 1.61 0.92 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 86 P 0.00 4.64 0.00 2.31 2.15 0.00 3.82 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 2.26 2.02 0.00 87 E 8.93 4.30 0.00 2.36 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 0.00 2.61 2.12 0.00 88 W 8.33 5.25 0.00 3.23 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 0.00 89 V 9.20 4.79 2.22 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 0.88 0.00 0.00 1.01 0.00 0.00 90 R 9.01 4.97 0.00 1.65 1.70 0.00 3.13 0.00 0.00 3.13 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 91 V 7.93 4.25 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 0.16 0.00 0.00 0.45 0.00 0.00 92 G 7.35 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 93 L 8.52 5.30 0.00 1.00 0.94 -0.10 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 94 S 8.91 5.15 0.00 3.52 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 8.77 4.99 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 96 T 8.88 5.18 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 1.17 0.00 0.00 97 T 8.94 4.87 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 1.31 0.00 0.00 98 G 9.13 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.77 3.75 0.00 1.24 1.12 0.63 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 100 Y 6.88 4.82 0.00 2.97 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 0.00 101 K 9.15 5.46 0.00 1.77 1.87 0.00 1.86 0.00 0.00 1.85 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.62 1.32 7.81 102 E 8.25 5.04 0.00 2.02 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 2.33 2.29 0.00 103 T 8.78 4.28 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 1.25 0.00 0.00 104 N 8.18 5.36 0.00 2.61 2.73 0.00 0.00 6.88 7.05 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 0.00 105 T 8.50 4.86 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 1.32 0.00 0.00 106 I 9.13 4.93 1.71 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 1.10 0.64 1.22 0.00 0.00 107 L 9.34 5.12 0.00 1.70 1.88 1.00 1.12 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 0.00 108 S 8.21 5.12 0.00 3.97 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 0.00 109 W 9.50 5.96 0.00 3.80 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 0.00 110 S 9.75 4.73 0.00 3.69 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 0.00 111 F 7.76 4.80 0.00 2.28 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 0.00 112 T 7.97 4.71 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 1.10 0.00 0.00 113 S 9.40 5.11 0.00 4.01 3.83 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 0.00 114 K 9.41 5.09 0.00 1.62 1.60 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.80 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.31 1.33 7.81 115 L 9.15 5.03 0.00 1.42 1.41 0.52 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 116 K 9.37 4.48 0.00 1.62 1.68 0.00 1.67 0.00 0.00 1.55 0.00 0.00 2.77 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.34 7.81 117 T 8.34 4.43 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 *123 A 7.51 4.25 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 0.00 124 N 7.87 4.52 0.00 2.91 2.69 0.00 0.00 6.89 8.15 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 0.00 125 A 8.40 5.22 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 0.00 126 L 9.00 4.84 0.00 1.91 1.69 1.16 1.39 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 0.00 127 H 8.85 5.28 0.00 2.98 3.04 0.00 5.92 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 0.00 128 F 7.99 4.65 0.00 2.22 2.30 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 0.00 129 S 7.63 4.58 0.00 3.62 3.53 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 0.00 130 F 9.49 4.94 0.00 2.59 2.30 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 0.00 131 N 8.77 4.89 0.00 2.86 2.93 0.00 0.00 6.06 7.39 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 0.00 132 Q 7.23 4.78 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.72 0.00 0.00 0.00 0.00 0.00 2.21 2.37 0.00 133 F 9.59 4.75 0.00 3.07 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 0.00 134 T 8.58 4.37 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 1.31 0.00 0.00 135 Q 8.75 4.17 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.92 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 136 N 8.35 4.78 0.00 2.61 2.68 0.00 0.00 7.22 7.56 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 0.00 137 P 0.00 4.59 0.00 2.25 2.25 0.00 3.75 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.99 0.00 138 K 8.44 4.07 0.00 1.69 1.77 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.56 7.81 139 D 8.01 4.60 0.00 2.70 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 0.00 140 L 7.73 5.17 0.00 1.64 1.62 0.97 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 141 I 8.72 4.25 1.77 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.33 0.83 0.00 0.00 142 L 8.41 4.88 0.00 1.50 1.70 0.94 0.86 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 0.00 143 Q 9.21 4.51 0.00 1.88 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 5.71 0.00 0.00 0.00 0.00 0.00 2.22 2.24 0.00 144 G 8.69 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 0.00 145 D 9.33 4.67 0.00 2.58 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 A 7.79 4.58 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 T 8.93 4.77 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 1.25 0.00 0.00 148 T 8.42 4.94 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 1.17 0.00 0.00 149 D 8.45 5.08 0.00 2.90 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 0.00 150 S 8.50 4.24 0.00 4.03 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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1.42 1.46 7.81 159 V 8.19 5.00 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 0.93 0.00 0.00 0.94 0.00 0.00 160 S 9.42 4.41 0.00 3.94 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 0.00 161 S 8.59 4.09 0.00 4.00 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 0.00 162 S 8.06 4.53 0.00 4.01 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 G 8.25 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 0.00 164 S 7.67 4.46 0.00 3.88 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 0.00 165 P 0.00 4.96 0.00 2.25 2.12 0.00 3.82 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.19 0.00 166 Q 8.75 4.59 0.00 1.92 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.97 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 167 G 8.54 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 0.00 0.00 0.00 168 S 8.25 3.79 0.00 3.96 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 S 8.01 5.12 0.00 3.85 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 V 8.64 4.91 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 0.63 0.00 0.00 0.88 0.00 0.00 171 G 8.81 4.84 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 0.00 172 R 8.77 5.31 0.00 1.74 2.01 0.00 2.55 0.00 0.00 3.07 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.48 0.00 173 A 9.04 5.06 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 0.00 0.00 0.00 0.00 0.00 174 L 9.06 5.16 0.00 1.55 1.50 1.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 175 F 9.31 4.51 0.00 2.26 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 0.00 176 Y 7.14 3.73 0.00 2.67 2.44 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 0.00 177 A 6.78 4.37 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 0.00 178 P 0.00 4.73 0.00 2.05 2.18 0.00 3.66 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 1.90 2.05 0.00 179 V 9.46 4.61 2.21 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 1.35 0.00 0.00 1.12 0.00 0.00 180 H 8.88 4.27 0.00 1.92 2.73 0.00 5.78 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 I 8.82 4.48 2.09 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.98 1.08 0.00 0.00 182 W 7.75 5.28 0.00 3.27 2.95 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 0.00 183 E 6.46 4.45 0.00 1.47 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 2.13 2.43 0.00 184 S 8.59 4.24 0.00 4.05 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 0.00 185 S 7.59 4.41 0.00 3.86 3.83 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 0.00 186 A 7.01 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 V 8.31 3.98 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 0.90 0.00 0.00 188 V 7.45 4.81 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.93 0.00 0.00 189 A 9.82 5.50 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 0.00 0.00 0.00 0.00 0.00 190 S 9.18 5.15 0.00 3.82 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 0.00 191 F 8.77 5.31 0.00 2.84 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 0.00 192 D 9.10 5.37 0.00 2.46 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 0.00 0.00 0.00 0.00 193 A 9.41 5.10 0.80 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 0.00 194 T 9.17 5.21 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 195 F 8.87 5.75 0.00 3.36 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 T 9.23 5.31 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 197 F 8.69 5.61 0.00 3.39 3.53 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 0.00 198 L 9.38 4.92 0.00 1.79 1.64 0.99 0.94 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 0.00 199 I 8.73 5.29 2.22 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.37 1.10 0.00 0.00 200 K 9.39 4.99 0.00 1.66 1.69 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.41 7.81 201 S 8.33 5.01 0.00 3.92 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 P 0.00 4.50 0.00 2.24 2.17 0.00 3.84 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 203 D 8.08 4.76 0.00 2.70 2.72 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 0.00 204 S 8.66 4.08 0.00 3.77 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 0.00 205 E 7.52 4.46 0.00 1.70 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.23 0.00 206 P 0.00 4.64 0.00 2.46 2.09 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 1.99 1.95 0.00 207 A 8.16 4.88 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 0.00 208 D 9.97 4.76 0.00 2.77 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 G 7.10 4.71 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 0.00 0.00 0.00 210 I 8.17 5.28 1.77 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 1.20 0.63 0.98 0.00 0.00 211 T 9.11 5.11 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 1.17 0.00 0.00 212 F 9.04 5.31 0.00 3.37 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 0.00 213 F 7.97 5.14 0.00 2.95 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 0.00 214 I 8.97 4.64 1.75 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.40 0.80 0.00 0.00 215 A 9.15 5.82 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 0.00 216 N 8.98 4.62 0.00 2.94 3.03 0.00 0.00 5.67 7.22 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 0.00 217 T 8.82 3.94 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 218 D 7.85 4.72 0.00 2.77 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 0.00 219 T 7.80 4.25 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 1.29 0.00 0.00 220 S 8.60 4.75 0.00 3.92 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 0.00 221 I 8.07 3.66 1.80 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.45 0.81 0.00 0.00 222 P 0.00 4.29 0.00 2.12 1.92 0.00 3.51 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.94 0.00 223 S 8.42 4.23 0.00 3.80 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 0.00 224 G 8.96 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 0.00 225 S 8.19 4.99 0.00 3.89 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 0.00 226 S 7.73 4.31 0.00 3.99 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 0.00 227 G 8.43 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 0.00 228 R 8.95 4.04 0.00 2.08 2.19 0.00 3.07 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 229 L 8.18 4.38 0.00 1.79 1.95 1.07 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 230 L 8.28 3.77 0.00 1.73 1.67 1.01 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 231 G 8.52 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 0.00 232 L 7.79 3.92 0.00 1.25 0.15 -0.29 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 233 F 7.44 4.81 0.00 3.04 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 0.00 234 P 0.00 4.64 0.00 2.19 2.17 0.00 3.99 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 2.03 1.98 0.00 235 D 7.67 4.48 0.00 2.74 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 236 A 8.29 4.52 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 N 8.37 4.45 0.00 2.75 2.71 0.00 0.00 6.70 7.10 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 * Residues marked with a * may have inaccurate shift predictions.