NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2986 7.8827 121.4556 61.2199 38.7233 173.7692 17 V 4.3500 8.8680 125.8902 61.8706 32.8432 174.6392 18 G 4.0152 8.6003 114.0772 46.7431 0.0000 173.4194 19 G 4.1947 7.6148 109.6125 44.5120 0.0000 172.6129 20 Y 4.9643 7.9279 117.1181 55.3412 42.1403 174.9109 21 T 4.1977 8.6109 117.5478 64.1692 68.3965 175.0906 22 C 4.2837 8.6401 125.4667 59.1545 36.2404 175.6986 23 G 3.9797 8.3783 104.7539 45.1344 0.0000 172.4780 24 A 4.3815 8.2739 124.4901 52.8628 18.6719 176.9750 25 N 4.2462 8.8774 119.5372 54.4875 36.2252 175.4369 26 T 4.1558 7.7237 107.8947 62.9198 69.8969 175.0064 27 V 4.0729 7.0586 121.9872 60.3828 31.1486 173.7272 28 P 4.3449 0.0000 0.0000 64.3423 32.1829 178.1291 29 Y 4.9498 6.8253 115.8745 56.6014 38.8001 174.7607 30 Q 4.6138 7.4356 123.4621 56.4558 29.6372 175.4991 31 V 4.9301 8.9703 118.5428 59.7003 36.2518 174.1077 32 S 4.9886 8.8212 117.0692 56.6640 64.7618 172.6472 33 L 4.8584 8.6875 127.5054 53.3729 43.3808 175.0205 34 N 5.7603 8.8963 122.3231 50.3021 41.9353 174.1219 *37 S 4.1395 8.4284 120.7685 57.6450 62.7786 173.5529 38 G 3.4596 7.1531 107.5223 44.2675 0.0000 170.2852 39 Y 5.0782 6.6138 118.5497 55.1769 40.0039 170.4839 40 H 4.7338 8.2903 122.5872 56.3726 30.4200 174.8826 41 F 5.0185 8.0769 118.9140 56.6625 39.7872 173.6455 42 C 4.7198 6.9165 115.2533 56.0056 44.8068 173.4156 43 G 4.2313 8.8362 109.4204 45.6903 0.0000 172.0665 44 G 4.8039 8.1239 105.4640 46.4534 0.0000 172.6246 45 S 5.4498 8.7987 115.1889 56.4331 66.9622 173.7206 46 L 4.7827 9.3872 127.8972 54.9754 42.3273 177.1257 47 I 4.2812 8.9010 119.9619 61.0898 39.2748 174.4044 48 N 4.9023 7.7103 117.3760 51.8250 39.7496 174.8634 49 S 4.3064 8.8002 111.7804 60.6357 63.1611 175.2250 50 Q 4.5725 8.9611 118.7595 55.1475 30.0943 174.6335 51 W 5.5362 8.3342 117.9475 54.8369 33.7434 174.2967 52 V 4.9488 9.1536 123.5064 61.1652 34.4913 174.3027 53 V 4.6865 8.9044 127.7623 62.4557 33.2920 174.9641 54 S 5.1928 9.0181 120.5260 57.7441 66.1383 172.0591 55 A 4.6829 8.4983 120.7636 50.7208 20.2729 178.4643 56 A 3.7892 8.2845 124.4315 55.3092 18.4093 179.1694 57 H 4.5747 8.0386 109.0298 57.2132 28.7745 175.3637 58 C 4.7553 7.8530 117.1986 57.4452 40.4716 173.2709 59 Y 4.1791 7.8378 122.5637 57.8707 38.6167 175.2364 60 K 3.9025 7.3530 124.2660 55.8586 34.8646 174.6576 61 S 4.0435 8.2145 114.0425 58.8942 63.6518 173.5258 62 G 3.7541 8.3046 107.3469 46.7484 0.0000 173.9938 63 I 4.0440 7.5063 119.9556 60.6863 38.7856 175.3434 64 Q 4.7811 8.9307 128.4706 54.3018 31.4208 174.1237 65 V 4.4735 8.8280 126.8953 61.7615 33.5669 174.6227 66 R 5.1322 9.0630 127.7020 54.8903 31.9426 175.2637 67 L 4.6940 9.1044 125.0667 52.7997 44.5393 177.8206 *69 G 4.1639 8.2914 107.6289 45.3265 0.0000 172.6199 70 E 4.4574 8.1885 119.5307 55.4921 30.8651 174.4263 71 D 4.8192 8.5479 121.5602 55.3117 43.5629 174.5977 72 N 5.1092 8.0200 122.6434 51.7907 38.8540 175.5256 73 I 3.7877 8.5714 120.9937 62.8718 37.6845 176.5576 74 N 4.7110 8.4723 117.2227 53.0075 39.2922 174.8517 75 V 4.2945 7.5929 118.0899 60.6841 33.9262 174.8462 76 V 4.0699 8.5157 128.0422 62.8396 31.7566 175.2221 77 E 4.5957 10.6590 122.8940 55.0282 31.4549 174.1023 78 G 3.7976 9.3986 105.7765 45.1895 0.0000 174.3534 79 N 4.5818 8.9657 119.8924 52.7992 36.8755 174.2343 80 E 4.5015 7.6714 117.3738 56.2872 30.5638 176.2674 81 Q 4.3383 9.1085 122.3128 54.1052 32.2617 174.3151 82 F 5.6135 8.6409 123.2009 56.0842 40.7490 175.3353 83 I 4.6693 8.7912 124.9729 59.1998 40.8851 175.5805 84 S 4.5406 8.7393 122.6784 58.2721 64.0711 173.5449 85 A 4.4988 8.5695 126.2364 52.3187 18.1486 177.6116 86 S 4.5630 9.0560 116.3539 59.1090 64.9031 174.7394 87 K 4.7365 7.6079 118.4041 54.8849 36.7435 175.4433 88 S 5.0269 8.8191 118.7753 57.0955 66.1751 173.6720 89 I 4.5106 9.3494 127.3313 59.4938 38.8237 175.3454 90 V 4.2326 8.3865 127.4487 62.0136 32.6409 175.3748 91 H 3.4993 8.6628 127.0246 55.5159 30.0359 174.5958 92 P 4.3018 0.0000 0.0000 65.2058 31.2926 177.0298 93 S 4.6141 7.9580 113.2311 58.0618 63.4213 173.3963 94 Y 4.4360 8.0198 123.5774 57.9448 39.0651 174.5988 95 N 4.5063 8.3860 125.3621 51.3943 40.2008 175.0838 96 S 3.7846 7.7573 120.2562 59.7412 63.6505 175.3195 97 N 4.3751 8.3658 119.3820 55.3971 38.3994 175.9308 98 T 4.0907 7.6104 104.8801 60.3186 70.2899 174.5297 99 L 3.7533 7.8135 120.5689 55.4410 39.9366 173.9892 100 N 4.4183 7.7287 117.5171 54.8209 39.4640 174.5874 101 N 5.0014 8.6829 120.1360 54.0979 35.9306 175.5145 102 D 4.6803 7.9388 117.6806 52.9523 39.7967 174.6465 103 I 4.7821 7.1128 120.9831 59.3131 42.2944 172.7876 104 M 5.4825 9.1245 126.6735 54.2207 36.3462 173.1935 105 L 5.4270 9.4890 124.9557 53.1693 44.9160 175.3022 106 I 4.9452 9.2371 124.0907 59.4358 40.1674 174.4027 107 K 3.6580 8.4112 128.6606 54.6052 33.5569 175.6544 108 L 4.3243 8.2590 127.7282 54.1686 41.8958 177.2567 109 K 4.0651 8.8765 124.6198 58.9423 32.6430 177.2235 110 S 4.6874 7.7561 112.9987 55.8774 66.7172 173.3134 111 A 4.3765 8.3945 124.1953 51.9680 18.7142 177.5391 112 A 4.2825 9.0310 123.7635 52.0750 19.5609 177.3184 113 S 4.4977 9.0904 117.0083 57.5282 63.5474 174.5251 114 L 4.6125 8.5571 123.8639 54.7294 42.1053 177.3659 115 N 4.6516 7.7324 119.8799 50.5853 37.3447 173.7044 116 S 4.6012 7.0625 112.6230 58.1895 66.3216 176.8027 117 R 4.0820 8.7554 118.1456 59.1887 30.1886 177.7410 118 V 3.8937 7.3394 117.5841 62.9597 32.1002 174.5690 119 A 4.9039 8.3998 127.5168 50.6926 23.2547 175.2795 120 S 5.0599 8.6353 114.1267 57.9065 64.9017 173.1651 121 I 4.3833 8.1822 120.9316 58.9074 39.5610 175.5217 122 S 4.3527 8.5117 124.7911 58.5133 63.4171 174.3056 123 L 4.2922 8.3578 122.9899 53.4256 42.3621 175.2876 124 P 4.4368 0.0000 0.0000 63.1995 31.5357 176.5387 125 T 4.1312 8.2415 109.1231 62.3745 69.6999 174.3766 *127 S 4.2214 7.5266 115.3349 58.1985 64.0909 173.7504 128 C 4.5360 8.3348 117.5633 56.2938 40.7154 173.9498 129 A 4.2451 8.1575 125.6197 52.0241 19.1677 177.0243 130 S 4.4873 8.0598 114.6907 56.8185 65.0834 173.6752 *132 A 4.3019 8.2323 124.3875 53.5768 19.2906 176.6156 133 G 4.0476 9.0793 110.8299 45.5201 0.0000 174.5223 134 T 3.9727 7.6505 117.0305 63.8793 69.4273 173.6563 135 Q 4.7327 8.5995 125.1077 55.4285 30.0342 175.7638 136 C 5.2605 9.3571 120.3432 55.0453 46.3461 172.4002 137 L 5.1236 9.1451 122.8276 53.6216 43.7956 175.0746 138 I 5.3858 8.9894 127.3100 58.8987 40.1024 174.8398 139 S 4.8511 8.3039 119.0815 56.6610 66.3899 173.0908 140 G 3.8029 7.4218 108.3823 46.2488 0.0000 172.9442 141 W 4.6244 8.6525 116.9879 56.2805 29.4003 177.0722 142 G 4.1608 8.3381 109.2111 44.3378 0.0000 173.5383 143 N 4.2350 9.2745 118.5346 54.2867 39.0249 174.7110 144 T 5.2008 8.2921 112.8512 60.5942 69.6463 174.2457 145 K 4.5891 7.7806 121.8919 54.7771 34.0502 176.5869 146 S 4.3234 8.5565 116.9584 60.3464 63.6432 173.8115 147 S 4.3753 7.8599 113.4226 58.1808 64.8585 174.7921 148 G 3.8857 8.7023 113.8639 44.8827 0.0000 172.3052 149 T 4.6573 7.8779 111.5306 60.4720 70.7378 174.0673 150 S 4.2835 9.7859 123.7149 57.8439 65.6973 172.2478 151 Y 5.0586 8.4730 125.9485 55.8819 39.0093 174.2958 152 P 4.6703 0.0000 0.0000 62.3257 32.8787 176.1578 153 D 4.5575 8.8251 119.5560 56.8109 41.1658 176.8469 154 V 5.8755 7.3875 109.5395 58.2701 34.9022 175.7135 155 L 3.0464 8.6345 124.6118 55.0477 43.0636 175.9643 156 K 4.8818 8.0926 124.8470 54.9930 35.2660 174.5517 157 C 5.2553 8.4122 118.7238 55.3200 44.4917 173.0210 158 L 4.9868 8.5226 122.2026 53.8614 45.5783 174.4965 159 K 5.1269 8.9853 125.3919 55.4520 33.6381 175.9149 160 A 4.8693 9.2313 125.5870 50.1427 23.0766 173.6666 161 P 5.0060 0.0000 0.0000 61.8449 33.8361 175.3943 162 I 4.1768 8.4545 122.9955 61.6498 37.9448 175.6807 163 L 4.8869 8.8429 127.4924 53.0632 43.4991 176.9771 164 S 4.3000 8.4961 115.2586 58.2589 64.0485 174.7816 165 D 4.4761 9.0682 122.9901 57.9903 40.5653 179.7145 166 S 4.1890 8.0478 114.0693 61.5606 63.0812 176.5067 167 S 4.1595 8.1347 118.1057 60.9812 62.7848 175.6744 168 C 4.3157 8.4162 122.1651 59.6549 42.8191 175.8251 169 K 3.9798 8.6658 120.2114 59.2889 31.3549 179.5884 170 S 4.2501 7.9864 114.9055 61.2231 62.8264 176.0463 171 A 4.0233 7.7894 122.8448 53.7525 19.7219 177.3025 172 Y 4.8243 7.6948 113.7217 55.5908 38.5030 173.4265 173 P 4.6060 0.0000 0.0000 63.5172 32.3345 177.7660 174 G 4.0446 9.1334 110.4749 45.7745 0.0000 173.5445 175 Q 4.5467 8.1633 116.3160 55.3340 30.6126 175.3783 176 I 4.3518 7.8697 119.5566 59.9855 38.0152 175.5809 177 T 4.4899 8.2405 116.4242 59.8810 70.5165 175.5458 178 S 4.3448 8.5500 115.1484 60.4082 63.1351 174.4263 179 N 4.9908 8.2682 118.7821 53.3172 38.5140 173.8265 180 M 5.6326 7.9635 116.8547 53.7838 36.0827 174.6002 181 F 5.1169 8.8015 115.0516 55.8457 42.2026 172.5818 182 C 5.3891 8.9918 116.4905 55.8800 40.9754 172.6213 183 A 5.0446 9.4424 122.5094 50.8390 22.3776 174.2881 184A G 4.0353 7.4364 106.2007 44.3891 0.0000 174.5231 184 Y 4.5815 8.4978 121.3934 56.2174 41.5156 176.0604 185 L 4.2078 8.7189 125.5683 57.2509 41.9789 178.5498 186 E 4.1590 8.2739 114.8243 56.5209 30.2257 177.9519 187 G 3.7545 8.0320 108.7815 45.1281 0.0000 171.9542 188A G 4.1085 9.4782 106.0004 44.8186 0.0000 173.5375 188 K 4.8134 7.2810 117.3435 54.9939 35.4617 175.3478 189 D 4.6629 8.8041 123.1148 53.6364 45.6149 175.1335 190 S 4.9275 8.2309 114.7588 58.3679 64.9458 171.6324 191 C 4.7577 9.2791 118.8396 55.5045 45.1539 172.4831 192 Q 4.3433 8.5774 120.0482 57.8439 28.4530 178.1714 193 G 4.2185 9.2391 110.5166 45.7247 0.0000 174.1170 194 D 4.6552 8.4849 119.0072 55.7541 41.6571 176.8138 195 S 4.5058 8.0993 115.0956 60.5221 63.4144 175.4483 196 G 4.1173 8.8499 112.6121 46.4376 0.0000 173.7592 197 G 4.3123 7.9019 107.4624 44.7006 0.0000 171.0060 198 P 5.1292 0.0000 0.0000 62.2685 33.3855 175.5717 199 V 4.6056 8.7759 122.1254 61.4124 33.9133 174.1275 200 V 4.8159 8.7174 128.6069 61.2461 34.3595 173.6333 201 C 5.1178 8.9561 124.8658 55.2344 43.4813 174.6011 202 S 3.3826 9.7785 120.7328 59.4180 61.4231 173.0528 203 G 3.9090 8.2779 103.7923 46.4351 0.0000 173.0700 204 K 4.3837 7.5940 118.7181 54.0697 34.9282 175.4488 *209 L 4.2143 8.2717 123.1431 55.4130 42.0925 175.7417 210 Q 4.4785 8.9889 126.3192 56.6603 30.7366 175.9719 211 G 5.3589 8.0784 104.4279 45.5326 0.0000 171.3859 212 I 5.2099 8.2383 120.0881 58.8054 40.8201 175.3803 213 V 3.8018 8.8312 127.2843 64.2126 31.8302 174.3333 214 S 4.7811 8.4607 121.1363 58.4900 64.0208 173.9105 215 W 4.9918 7.6933 114.0623 55.7557 31.9773 172.3456 216 G 3.8802 8.3263 105.7918 46.0593 0.0000 173.3697 217 S 4.5879 8.7788 115.9966 57.2165 62.5439 172.7911 *219 G 4.4874 8.0737 118.3388 45.6730 0.0000 171.2208 220 C 4.9411 8.0770 116.1250 56.3667 41.2549 173.8898 221A A 4.0164 9.3764 125.6720 53.2600 16.5241 177.2228 221 Q 4.6076 7.3135 117.4535 56.0003 29.9576 175.9943 222 K 4.1779 8.4467 119.9624 58.0453 32.4615 176.3575 223 N 4.2115 9.1907 120.7971 54.4237 38.3106 174.9339 224 K 4.3644 7.6259 112.5032 53.5633 32.6268 173.5950 225 P 4.6431 0.0000 0.0000 61.9670 33.2775 177.7967 226 G 3.5303 8.5081 106.0188 46.1665 0.0000 172.7246 227 V 4.3608 7.7799 122.1888 60.6323 34.0150 174.0770 228 Y 4.8271 8.0462 124.4343 55.9481 42.0520 175.0458 229 T 4.3732 8.6391 120.2533 63.7031 70.0434 174.2151 230 K 5.0933 9.4580 128.3097 55.3681 31.4664 177.2633 231 V 3.9808 9.0132 126.6791 65.7465 31.4145 174.8151 232 C 4.4810 8.2522 112.4496 57.8106 41.6340 174.6581 233 N 4.2290 8.0026 117.6544 54.4381 38.5108 174.9683 234 Y 4.8041 7.9593 117.7383 57.5297 39.3063 177.6242 235 V 3.6786 8.0225 121.5465 66.3828 31.6468 178.1600 236 S 4.1356 8.0920 114.4116 61.1995 62.6447 176.2512 237 W 4.2133 8.3256 130.6814 60.4690 30.4477 177.8658 238 I 3.2690 8.4589 120.0987 64.3847 36.6306 178.6565 239 K 3.7846 8.1028 119.2739 59.4648 31.9386 179.5768 240 Q 3.8890 8.0150 118.3905 58.9832 28.3554 178.8308 241 T 3.4604 7.2932 116.2847 66.3991 68.1018 176.4667 242 I 2.3821 7.0933 121.5536 63.8946 36.7698 178.4405 243 A 4.0049 7.6528 120.2682 54.3186 18.2194 178.8082 244 S 4.6324 7.4223 110.4812 58.4322 63.3911 174.1325 245 N 4.6982 7.8032 124.4894 53.5577 39.4636 174.0871 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 16 I 7.88 4.30 1.80 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 1.39 0.55 0.87 0.00 0.00 17 V 8.87 4.35 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 0.97 0.00 0.00 1.00 0.00 0.00 18 G 8.60 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 19 G 7.61 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 7.93 4.96 0.00 2.93 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 21 T 8.61 4.20 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 22 C 8.64 4.28 0.00 2.74 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.38 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 24 A 8.27 4.38 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 25 N 8.88 4.25 0.00 2.86 2.90 0.00 0.00 7.15 7.54 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 26 T 7.72 4.16 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 1.28 0.00 0.00 27 V 7.06 4.07 1.73 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 0.32 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.34 0.00 2.38 2.45 0.00 3.65 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.99 0.00 29 Y 6.83 4.95 0.00 3.28 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 30 Q 7.44 4.61 0.00 1.79 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.73 0.00 0.00 0.00 0.00 0.00 1.90 2.54 0.00 31 V 8.97 4.93 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.05 0.00 0.00 32 S 8.82 4.99 0.00 2.86 3.30 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 33 L 8.69 4.86 0.00 0.85 1.23 0.82 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.90 5.76 0.00 2.51 2.42 0.00 0.00 6.66 8.04 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 *37 S 8.43 4.14 0.00 3.82 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 38 G 7.15 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 0.00 0.00 0.00 39 Y 6.61 5.08 0.00 3.09 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 H 8.29 4.73 0.00 2.92 3.18 0.00 5.87 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.08 5.02 0.00 3.17 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 C 6.92 4.72 0.00 1.98 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 43 G 8.84 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 44 G 8.12 4.80 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 45 S 8.80 5.45 0.00 3.83 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 46 L 9.39 4.78 0.00 1.86 1.69 1.09 0.78 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 47 I 8.90 4.28 1.90 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 1.56 0.93 1.01 0.00 0.00 48 N 7.71 4.90 0.00 3.00 3.01 0.00 0.00 6.02 7.25 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 49 S 8.80 4.31 0.00 4.22 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 50 Q 8.96 4.57 0.00 2.17 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.80 0.00 0.00 0.00 0.00 0.00 2.18 2.29 0.00 51 W 8.33 5.54 0.00 3.35 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 52 V 9.15 4.95 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 0.99 0.00 0.00 53 V 8.90 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 0.94 0.00 0.00 1.03 0.00 0.00 54 S 9.02 5.19 0.00 3.90 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.50 4.68 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 56 A 8.28 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.04 4.57 0.00 3.41 3.60 0.00 5.55 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.85 4.76 0.00 3.20 3.28 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 59 Y 7.84 4.18 0.00 3.00 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 60 K 7.35 3.90 0.00 1.58 1.54 0.00 0.99 0.00 0.00 1.38 0.00 0.00 2.58 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.79 1.09 7.81 61 S 8.21 4.04 0.00 3.90 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 62 G 8.30 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 0.00 0.00 0.00 63 I 7.51 4.04 1.84 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.70 0.92 0.00 0.00 64 Q 8.93 4.78 0.00 2.01 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.85 0.00 0.00 0.00 0.00 0.00 2.16 2.23 0.00 65 V 8.83 4.47 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 1.01 0.00 0.00 0.91 0.00 0.00 66 R 9.06 5.13 0.00 1.71 1.88 0.00 2.71 0.00 0.00 2.35 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.32 0.00 67 L 9.10 4.69 0.00 1.65 1.62 1.06 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.29 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 70 E 8.19 4.46 0.00 2.00 2.01 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 1.83 2.14 0.00 71 D 8.55 4.82 0.00 2.83 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 72 N 8.02 5.11 0.00 2.83 2.76 0.00 0.00 6.78 7.82 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 73 I 8.57 3.79 1.54 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.61 -0.34 0.00 0.00 74 N 8.47 4.71 0.00 2.84 2.89 0.00 0.00 6.64 8.33 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 75 V 7.59 4.29 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 0.78 0.00 0.00 0.95 0.00 0.00 76 V 8.52 4.07 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 0.81 0.00 0.00 1.09 0.00 0.00 77 E 10.66 4.60 0.00 2.02 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 2.49 2.25 0.00 78 G 9.40 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 79 N 8.97 4.58 0.00 2.93 3.09 0.00 0.00 7.11 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 80 E 7.67 4.50 0.00 1.27 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 2.44 2.42 0.00 81 Q 9.11 4.34 0.00 1.90 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.77 0.00 0.00 0.00 0.00 0.00 2.19 2.23 0.00 82 F 8.64 5.61 0.00 2.87 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 83 I 8.79 4.67 1.88 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 1.24 0.70 0.93 0.00 0.00 84 S 8.74 4.54 0.00 3.74 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 85 A 8.57 4.50 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 86 S 9.06 4.56 0.00 3.74 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 87 K 7.61 4.74 0.00 1.59 1.72 0.00 1.69 0.00 0.00 1.88 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.37 7.81 88 S 8.82 5.03 0.00 3.96 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 89 I 9.35 4.51 2.10 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 1.27 0.95 1.13 0.00 0.00 90 V 8.39 4.23 1.99 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 0.64 0.00 0.00 0.81 0.00 0.00 91 H 8.66 3.50 0.00 2.59 2.98 0.00 5.64 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.30 0.00 2.21 2.21 0.00 2.64 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 1.78 2.03 0.00 93 S 7.96 4.61 0.00 3.94 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 94 Y 8.02 4.44 0.00 3.00 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 95 N 8.39 4.51 0.00 2.57 2.45 0.00 0.00 6.67 7.20 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 96 S 7.76 3.78 0.00 3.92 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 97 N 8.37 4.38 0.00 2.76 2.79 0.00 0.00 6.82 8.12 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 98 T 7.61 4.09 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 1.10 0.00 0.00 99 L 7.81 3.75 0.00 1.49 1.84 0.53 0.94 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 0.00 100 N 7.73 4.42 0.00 2.81 2.65 0.00 0.00 7.24 6.22 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 0.00 101 N 8.68 5.00 0.00 3.05 2.67 0.00 0.00 7.22 8.06 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 0.00 102 D 7.94 4.68 0.00 3.10 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 0.00 103 I 7.11 4.78 1.44 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 1.32 1.17 0.08 0.00 0.00 104 M 9.12 5.48 0.00 2.14 1.83 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.66 0.00 105 L 9.49 5.43 0.00 1.73 1.90 0.17 0.68 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 0.00 106 I 9.24 4.95 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.95 0.92 0.00 0.00 107 K 8.41 3.66 0.00 0.79 1.06 0.00 1.38 0.00 0.00 1.37 0.00 0.00 2.68 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.76 0.21 7.81 108 L 8.26 4.32 0.00 1.45 1.54 0.94 0.81 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 0.00 109 K 8.88 4.07 0.00 1.82 1.79 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.37 7.81 110 S 7.76 4.69 0.00 3.81 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 0.00 111 A 8.39 4.38 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 0.00 112 A 9.03 4.28 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 0.00 113 S 9.09 4.50 0.00 3.74 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 0.00 114 L 8.56 4.61 0.00 1.65 1.71 0.96 1.11 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 0.00 115 N 7.73 4.65 0.00 2.67 2.75 0.00 0.00 6.96 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 7.06 4.60 0.00 3.95 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 0.00 117 R 8.76 4.08 0.00 1.83 2.04 0.00 3.51 0.00 0.00 3.16 7.34 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.53 4.22 0.00 3.99 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 0.00 128 C 8.33 4.54 0.00 2.93 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 0.00 129 A 8.16 4.25 1.04 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 0.00 130 S 8.06 4.49 0.00 3.83 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *132 A 8.23 4.30 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 9.08 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.65 3.97 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 1.16 0.00 0.00 135 Q 8.60 4.73 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.80 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 136 C 9.36 5.26 0.00 2.74 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 0.00 137 L 9.15 5.12 0.00 1.76 1.58 1.02 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 138 I 8.99 5.39 1.87 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 1.69 0.96 0.00 0.00 139 S 8.30 4.85 0.00 3.56 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.42 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 0.00 141 W 8.65 4.62 0.00 3.02 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 0.00 142 G 8.34 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 0.00 143 N 9.27 4.24 0.00 2.54 2.71 0.00 0.00 7.10 8.35 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 0.00 144 T 8.29 5.20 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 145 K 7.78 4.59 0.00 1.67 1.91 0.00 1.68 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.32 1.34 7.81 146 S 8.56 4.32 0.00 3.98 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 0.00 147 S 7.86 4.38 0.00 3.80 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 0.00 148 G 8.70 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 0.00 0.00 0.00 149 T 7.88 4.66 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 1.16 0.00 0.00 150 S 9.79 4.28 0.00 3.74 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.47 5.06 0.00 2.97 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 0.00 152 P 0.00 4.67 0.00 2.44 2.10 0.00 4.19 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.06 0.00 153 D 8.83 4.56 0.00 2.81 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 0.00 154 V 7.39 5.88 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 0.90 0.00 0.00 0.97 0.00 0.00 155 L 8.63 3.05 0.00 1.21 1.22 -0.81 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.09 4.88 0.00 1.68 1.51 0.00 1.61 0.00 0.00 1.55 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.48 7.81 157 C 8.41 5.26 0.00 1.57 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 0.00 0.00 0.00 0.00 158 L 8.52 4.99 0.00 1.71 1.45 1.02 0.73 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 0.00 159 K 8.99 5.13 0.00 1.81 1.82 0.00 1.90 0.00 0.00 1.81 0.00 0.00 2.81 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.63 1.49 7.81 160 A 9.23 4.87 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 0.00 161 P 0.00 5.01 0.00 2.02 2.09 0.00 3.01 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.73 0.00 162 I 8.45 4.18 1.91 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.44 0.78 0.00 0.00 163 L 8.84 4.89 0.00 1.63 1.60 0.93 0.73 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 0.00 164 S 8.50 4.30 0.00 4.01 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 0.00 165 D 9.07 4.48 0.00 2.73 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 0.00 166 S 8.05 4.19 0.00 4.06 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 S 8.13 4.16 0.00 4.10 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 0.00 168 C 8.42 4.32 0.00 3.22 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.67 3.98 0.00 1.91 1.90 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.67 7.81 170 S 7.99 4.25 0.00 4.09 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 0.00 171 A 7.79 4.02 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 0.00 172 Y 7.69 4.82 0.00 3.18 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 0.00 173 P 0.00 4.61 0.00 2.08 2.04 0.00 3.81 0.00 0.00 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.07 0.00 174 G 9.13 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 0.00 175 Q 8.16 4.55 0.00 2.53 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.67 0.00 0.00 0.00 0.00 0.00 2.32 2.65 0.00 176 I 7.87 4.35 1.98 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.93 0.99 0.00 0.00 177 T 8.24 4.49 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 1.26 0.00 0.00 178 S 8.55 4.34 0.00 4.01 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 0.00 179 N 8.27 4.99 0.00 3.09 3.11 0.00 0.00 6.61 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 0.00 180 M 7.96 5.63 0.00 1.89 2.10 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.61 0.00 181 F 8.80 5.12 0.00 3.05 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 C 8.99 5.39 0.00 2.98 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 0.00 183 A 9.44 5.04 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 184A G 7.44 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 0.00 184 Y 8.50 4.58 0.00 3.08 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 0.00 185 L 8.72 4.21 0.00 1.74 1.73 0.93 0.89 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 0.00 186 E 8.27 4.16 0.00 2.10 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 0.00 2.35 2.27 0.00 187 G 8.03 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 0.00 0.00 0.00 188A G 9.48 4.11 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 0.00 188 K 7.28 4.81 0.00 1.39 1.72 0.00 0.99 0.00 0.00 1.08 0.00 0.00 2.58 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.41 1.21 7.81 189 D 8.80 4.66 0.00 2.84 2.53 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 0.00 190 S 8.23 4.93 0.00 4.14 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 0.00 191 C 9.28 4.76 0.00 2.96 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 8.58 4.34 0.00 2.34 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.35 0.00 0.00 0.00 0.00 0.00 2.55 2.54 0.00 193 G 9.24 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 0.00 0.00 0.00 194 D 8.48 4.66 0.00 2.93 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 0.00 195 S 8.10 4.51 0.00 3.98 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 0.00 196 G 8.85 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 0.00 0.00 0.00 0.00 197 G 7.90 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.13 0.00 2.36 2.41 0.00 3.92 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 2.18 2.21 0.00 199 V 8.78 4.61 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.48 0.00 0.00 200 V 8.72 4.82 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 0.94 0.00 0.00 0.70 0.00 0.00 201 C 8.96 5.12 0.00 2.79 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 0.00 202 S 9.78 3.38 0.00 4.05 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 0.00 203 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 0.00 204 K 7.59 4.38 0.00 1.81 1.64 0.00 1.79 0.00 0.00 1.53 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.30 1.43 7.81 *209 L 8.27 4.21 0.00 1.50 1.64 1.00 0.77 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 0.00 210 Q 8.99 4.48 0.00 1.96 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.44 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 211 G 8.08 5.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.24 5.21 1.93 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.03 1.00 0.00 0.00 213 V 8.83 3.80 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.16 0.00 0.00 214 S 8.46 4.78 0.00 3.91 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 0.00 215 W 7.69 4.99 0.00 3.37 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 0.00 216 G 8.33 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 0.00 0.00 0.00 217 S 8.78 4.59 0.00 4.21 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 *219 G 8.07 4.49 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 0.00 220 C 8.08 4.94 0.00 2.95 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 221A A 9.38 4.02 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 0.00 221 Q 7.31 4.61 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.54 6.93 0.00 0.00 0.00 0.00 0.00 2.51 2.49 0.00 222 K 8.45 4.18 0.00 1.74 1.75 0.00 1.90 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.60 1.44 7.81 223 N 9.19 4.21 0.00 2.72 2.78 0.00 0.00 6.98 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 K 7.63 4.36 0.00 1.68 1.72 0.00 1.40 0.00 0.00 1.09 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.44 7.81 225 P 0.00 4.64 0.00 2.25 2.12 0.00 3.75 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 2.15 2.03 0.00 226 G 8.51 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 0.00 0.00 0.00 227 V 7.78 4.36 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.00 0.00 -0.83 0.00 0.00 228 Y 8.05 4.83 0.00 1.43 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 0.00 229 T 8.64 4.37 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 1.24 0.00 0.00 230 K 9.46 5.09 0.00 2.11 1.93 0.00 1.80 0.00 0.00 1.86 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.59 7.81 231 V 9.01 3.98 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 1.08 0.00 0.00 232 C 8.25 4.48 0.00 3.15 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 0.00 233 N 8.00 4.23 0.00 2.31 2.26 0.00 0.00 6.78 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 Y 7.96 4.80 0.00 3.25 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 0.00 235 V 8.02 3.68 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 1.16 0.00 0.00 1.04 0.00 0.00 236 S 8.09 4.14 0.00 3.97 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 0.00 237 W 8.33 4.21 0.00 3.52 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 0.00 238 I 8.46 3.27 2.05 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 1.68 0.99 0.79 0.00 0.00 239 K 8.10 3.78 0.00 1.73 1.76 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.60 7.81 240 Q 8.01 3.89 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.63 0.00 241 T 7.29 3.46 3.36 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 0.66 0.00 0.00 242 I 7.09 2.38 1.49 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.20 0.48 0.00 0.00 243 A 7.65 4.00 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 0.00 244 S 7.42 4.63 0.00 3.80 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 0.00 245 N 7.80 4.70 0.00 3.08 3.03 0.00 0.00 6.75 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.