NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.4575 8.3644 120.1912 55.3220 42.3283 174.9397 2 S 4.1359 8.8915 119.7817 57.7647 61.9759 168.5927 3 K 3.8149 7.8576 122.3499 58.4462 33.1561 177.0611 4 K 4.2388 7.3233 125.4343 54.2246 33.9569 175.6048 5 D 5.0179 8.2088 125.7165 51.4566 43.9612 173.7287 6 I 3.6043 7.7173 116.9238 64.4335 38.4986 179.2766 7 S 4.4012 7.7794 115.2963 59.2033 64.1427 174.9465 8 N 4.8469 8.8048 114.7061 53.9727 36.7956 175.4552 9 V 4.0580 7.7631 118.7269 65.1360 33.1696 178.1405 10 K 4.2942 7.7152 116.2072 55.7852 31.7769 178.6521 11 S 4.5887 8.0906 114.3433 61.4411 65.0596 176.4232 12 D 4.4126 7.5993 122.5262 58.0598 39.1912 180.7914 13 L 3.9333 7.8624 119.9576 57.6611 41.3991 179.1822 14 L 3.6971 7.7385 119.6536 58.2127 41.4813 178.3151 15 Y 4.2072 8.0797 118.6225 60.3049 39.0756 176.6914 16 A 3.5027 7.4569 120.1691 55.1579 18.4098 178.6820 17 Y 4.5752 8.4277 114.4120 60.3419 39.6381 177.8400 18 T 4.4297 7.4494 115.8866 62.9458 64.9187 173.7302 19 I 4.5156 6.9172 120.1026 59.0470 41.7469 174.0882 20 T 4.3919 8.2746 116.5364 59.6830 69.6815 172.8815 21 P 3.9790 0.0000 0.0000 61.9683 32.9924 175.0452 22 Y 4.0138 7.4603 118.3989 57.0133 38.9612 175.2302 23 D 5.0051 6.9579 122.0679 51.5943 40.3957 173.9607 24 Y 3.8456 6.9022 118.8169 56.5837 40.2912 176.1433 25 K 4.7550 8.4576 121.9496 55.6993 36.0451 175.5732 26 D 4.3625 9.1062 119.6093 55.8294 39.7513 173.2989 27 C 4.9434 8.7918 118.1509 58.0101 31.3427 175.5246 28 R 4.6937 8.4978 122.0124 56.1226 31.4167 175.9000 29 V 3.9843 8.6254 123.5617 63.1798 32.3855 176.4001 30 N 4.5488 9.3724 126.7417 55.4345 39.1247 175.0434 31 F 4.9545 7.0717 111.0413 56.4064 41.1851 172.5278 32 S 5.0099 8.8048 113.2847 56.8954 66.2016 174.2161 33 T 4.7359 8.5456 116.4898 61.8528 69.1773 175.1178 34 T 4.5890 8.7808 119.3579 64.7328 69.7410 174.5037 *35 H 5.1746 9.4730 119.7638 54.5667 31.2049 178.1968 36 T 5.0004 7.8006 106.8818 61.2976 72.1865 172.1778 37 L 4.7338 9.3747 127.3071 53.3686 44.6338 174.2715 38 N 5.0352 8.1532 124.5583 52.0064 40.6543 173.2968 39 I 4.6114 8.6556 127.4858 59.5593 40.6973 174.8884 40 D 4.8909 8.8838 126.0493 53.1936 41.1965 175.5743 41 T 4.4726 7.9707 115.1859 61.3119 68.6073 176.7897 42 Q 4.3491 9.1380 121.9445 58.3293 28.7486 178.0124 43 K 4.0095 7.8334 117.4321 58.8920 33.3342 177.3780 44 Y 4.4446 7.7940 116.1003 59.3148 38.6465 176.4095 45 R 4.2308 8.0708 115.1137 55.2074 31.6181 176.2199 46 G 3.9714 7.7972 104.3138 45.6131 0.0000 172.9642 47 K 4.1885 8.1320 120.9538 56.4898 33.3213 175.1785 48 D 4.4924 8.6777 123.0085 55.5820 38.5634 172.6499 49 Y 4.7571 7.5092 114.7978 56.6510 40.4064 174.7116 50 Y 4.9515 8.1206 120.3884 55.7442 42.6886 173.4445 51 I 4.6056 8.7713 119.2373 59.5168 40.7747 175.2207 52 S 4.7402 9.2519 121.7716 56.2380 64.0210 171.7388 53 S 4.5591 9.0897 122.4086 57.7553 63.8223 172.2301 54 E 4.9512 9.5287 129.6542 55.7279 30.3760 174.5955 55 M 5.5142 8.5265 127.7880 52.8273 35.3678 175.7825 56 S 4.4243 8.3529 114.1207 57.5048 65.4419 174.8261 57 Y 4.1433 8.2899 117.4274 61.4678 37.7590 178.7403 58 E 3.9850 8.6137 117.0888 59.3744 29.4455 178.2443 59 A 4.3764 8.0852 120.3111 53.2490 19.3150 178.9216 60 S 4.3866 7.9368 109.5190 59.9240 63.3018 174.9595 61 Q 4.4111 7.2123 117.5001 56.2844 29.3586 176.8227 62 K 3.8149 7.7517 120.1748 58.6739 32.2677 176.6259 63 F 5.1667 7.3245 114.5523 56.0354 41.3751 174.0299 64 K 4.4554 9.8446 120.8100 56.2450 36.4205 174.4500 65 R 3.5660 8.1049 119.2329 55.4826 31.7359 174.5656 66 D 4.4703 8.2631 122.0314 55.2315 39.4335 173.2781 67 D 4.7079 7.5329 116.9638 54.0563 42.7464 175.5679 68 H 5.2454 8.7333 120.0804 54.9633 29.9561 174.5695 69 V 4.9231 9.1359 123.4449 59.8440 35.2183 174.1553 70 D 5.2730 8.8314 121.5175 52.6260 43.5534 175.4387 71 V 4.7546 8.7535 122.7234 61.3551 34.8108 174.7893 72 F 5.1579 8.8715 129.7885 58.7149 41.8170 172.7414 73 G 4.4745 8.0018 112.3021 44.9792 0.0000 170.2392 74 L 4.3076 8.9508 123.0583 53.1919 42.5977 176.9506 75 F 4.9973 8.2693 116.9837 55.7411 39.1060 175.0629 76 Y 4.6276 7.6067 118.3687 56.8078 39.0682 174.8533 77 I 4.4660 7.4541 118.2593 60.6674 40.7272 172.4240 78 L 4.6651 7.8822 125.5132 53.2739 45.4739 177.3851 79 N 4.4955 7.7743 110.7698 53.4199 38.6721 175.5701 80 S 3.8092 8.1527 102.7017 58.2247 59.3646 167.4028 81 H 5.0969 7.3937 121.3375 54.8042 31.7877 173.4440 82 T 3.5628 7.4022 113.7006 61.9129 69.5036 173.9464 83 G 2.9013 7.5826 107.7343 44.9016 0.0000 172.4686 84 E 4.7893 8.4103 123.6076 54.7338 32.0339 174.4436 85 Y 4.9691 8.6144 121.1936 56.3847 40.5832 174.9477 86 I 4.6340 8.0812 116.2957 60.2180 41.9847 172.7512 87 Y 5.2882 8.0715 119.3688 56.6667 39.7598 177.8945 88 G 3.9047 9.5108 117.8545 46.0166 0.0000 174.0441 89 G 4.5484 9.0860 108.4210 45.0409 0.0000 172.0909 90 I 5.0684 7.2818 117.4475 59.3975 39.6379 175.3598 91 T 4.9880 8.3202 114.4870 59.4128 72.8671 171.1994 92 P 4.7288 0.0000 0.0000 62.3503 31.8550 176.3244 93 A 4.2470 8.7898 126.4886 52.6824 19.0165 176.9521 94 Q 4.1556 8.8940 123.0893 55.8329 29.6513 175.8622 95 N 4.6516 8.7653 122.6249 54.7149 39.3794 175.1826 96 N 4.9968 7.7457 114.0133 50.5441 42.2264 173.9711 97 K 3.8995 8.5758 123.2604 57.3589 32.4508 176.1465 98 V 4.2889 7.9742 117.6784 61.0932 35.4290 172.4045 99 N 4.9699 8.4460 121.8695 51.6811 40.8245 173.8561 100 H 4.9222 8.6236 117.3370 53.1842 30.2828 171.4627 101 K 3.9550 8.3360 119.6399 56.8308 32.9649 176.6823 102 L 4.5550 8.1924 124.5316 53.6274 44.5263 175.2117 103 L 4.7170 7.8044 117.8441 53.4955 46.1887 176.6003 104 G 3.1374 7.3222 106.7378 46.2115 0.0000 171.6853 105 N 4.9493 8.7142 115.9755 51.1959 43.5213 174.0733 106 L 4.6147 7.6839 121.6324 53.5073 44.9492 174.9302 107 F 5.0226 9.3813 126.7329 56.2010 41.4421 175.5000 108 I 4.8126 8.2738 122.0907 59.1732 40.5123 176.6710 109 S 4.4395 9.3312 126.8757 56.8565 59.8959 175.4206 110 G 4.9266 8.1077 115.5713 46.3569 0.0000 167.2872 111 E 3.6948 8.2890 125.1795 56.3314 28.1614 175.6316 112 S 4.6349 8.3787 127.3099 58.1894 63.3914 175.3702 113 Q 2.8453 9.0027 118.7288 58.3023 26.2616 173.2670 114 Q 4.7073 7.9858 121.5462 53.8339 32.8577 174.4035 115 N 5.0889 8.3578 114.9106 52.2306 41.7349 175.3806 116 L 4.4920 7.9455 116.9560 55.4340 44.0903 175.6026 117 N 4.2549 7.9719 117.4849 54.5804 38.4833 174.6123 118 N 4.3970 8.6921 121.7396 54.7422 35.9941 175.0621 119 K 4.5799 7.8057 113.1317 55.5659 33.3485 176.4111 120 I 4.1563 7.3951 119.0120 60.8926 40.8909 173.2077 121 I 4.6777 8.4137 128.2798 59.4336 39.5247 175.2419 122 L 4.7070 8.1500 125.6578 52.5259 44.8886 176.3463 123 E 4.9002 8.2819 118.5902 54.6746 30.7386 176.0234 124 K 4.6950 7.8115 115.4352 55.1518 36.4762 176.2407 125 D 4.6622 8.6177 119.9762 55.4185 42.5352 175.8624 126 I 4.9180 7.7133 117.5940 59.5890 39.9542 174.7588 127 V 4.3792 8.1294 126.6045 61.1403 34.5908 174.8596 128 T 4.7759 8.0542 119.6075 60.6115 68.7544 175.6626 129 F 4.0145 8.7356 123.9874 60.2662 38.7720 177.8164 130 Q 3.6005 8.1813 119.1059 59.0026 28.6445 177.9443 131 E 3.2633 7.8263 119.5133 59.2394 29.5581 178.4513 132 I 3.4770 7.5715 119.7459 64.2042 37.1507 177.7532 133 D 4.4495 9.3093 119.5864 58.3615 41.1565 178.0170 134 F 4.4918 9.1380 121.7460 59.8130 38.5884 176.9081 135 K 3.5218 8.3974 117.4809 59.5686 32.3946 179.0834 136 I 3.4528 7.9018 120.1883 64.2268 37.0440 178.5627 137 R 3.6267 7.7923 118.8307 59.2789 29.8883 178.8982 138 K 3.9112 7.8184 119.2607 59.6454 31.8227 178.0852 139 Y 3.7780 7.3181 118.6403 60.7053 38.8312 177.7337 140 L 3.9108 7.8063 119.6896 58.2377 41.5503 179.0023 141 M 4.0463 8.3372 119.6298 57.8990 31.7339 178.0833 142 D 4.4006 8.2370 120.7641 56.9596 41.2269 177.6581 143 N 4.8271 7.9415 113.5485 52.9529 40.9265 174.6148 144 Y 4.3049 8.4315 112.9068 57.6189 39.4793 176.1433 145 K 4.1645 8.1869 120.5061 57.4926 29.8634 176.3030 146 I 4.2647 7.5818 114.6258 63.5370 38.1562 176.5969 147 Y 4.9395 7.6889 116.5403 58.1605 38.5750 175.5924 148 D 4.6029 7.7590 120.1976 54.1262 41.5875 176.4972 149 A 4.1779 8.7491 125.4765 55.6532 19.0433 179.0484 150 T 4.3466 7.6923 105.6893 61.5858 68.2154 174.5004 151 S 4.6877 7.5036 116.0807 57.1003 66.0013 173.2081 152 P 4.3720 0.0000 0.0000 63.0192 31.4009 175.4967 153 Y 4.8888 7.1969 116.8006 56.2841 39.5873 175.7904 154 V 4.2283 8.0800 120.5497 60.8068 33.0839 174.5554 155 S 4.4393 7.6251 114.1431 56.3326 66.9449 171.7489 156 G 4.6320 7.9026 105.4956 44.5767 0.0000 172.9448 157 R 5.1729 8.4701 117.6263 54.9955 33.3346 173.4194 158 I 4.7842 8.5424 121.1446 59.9261 39.7719 174.5572 159 E 5.2770 9.1743 125.2816 54.7664 32.7650 174.9164 160 I 4.5976 8.9860 125.7490 59.7889 39.7054 174.8495 161 G 4.0925 8.9696 114.5700 45.0042 0.0000 172.8313 162 T 4.9749 8.0719 119.7888 61.3706 71.7007 174.8306 163 K 4.4656 8.6554 122.8159 56.2744 32.5394 177.1850 164 D 4.7994 7.8283 119.0390 52.7327 40.1404 176.4817 165 G 3.9992 7.5778 104.7943 47.0311 0.0000 175.3323 166 K 4.6731 7.2279 119.1211 55.0977 32.7516 175.3633 167 H 5.1355 8.3470 120.3697 55.3372 30.3653 174.6239 168 E 4.6851 8.5667 117.9402 54.9228 33.0532 175.3038 169 Q 4.6757 8.8087 123.5507 55.9897 30.3852 176.7983 170 I 4.5886 8.4484 121.9440 59.3187 39.8550 170.6464 171 D 4.5079 8.6542 122.7033 54.5244 41.1030 176.1433 172 L 4.2274 8.8868 126.8105 56.0134 42.1153 177.7992 173 F 4.9560 8.3212 116.5439 56.1655 39.2537 174.3636 174 D 4.8112 7.7239 118.3003 52.7012 44.6689 175.0478 175 S 4.2780 8.3332 120.3691 56.8132 63.1009 171.7857 176 P 4.4709 0.0000 0.0000 62.0390 32.4623 176.8844 177 N 4.0660 8.1289 116.2217 53.7429 37.7136 174.6028 178 E 3.7820 8.2942 116.2558 59.0536 29.9947 178.3209 179 G 3.9549 9.3464 107.1456 46.4702 0.0000 171.9367 180 T 4.6959 7.3217 112.6348 59.5232 74.0036 175.0331 181 R 3.1640 8.2110 118.8555 58.9300 29.6834 179.0841 182 S 4.2444 7.8637 111.6326 61.5496 62.6879 174.4831 183 D 4.4807 8.3870 123.0009 55.8548 40.5373 178.3071 184 I 3.3957 8.1322 118.4616 65.5741 37.4942 177.8788 185 F 4.5803 8.4760 119.1405 60.4053 39.0294 177.5107 186 A 3.1994 8.2808 120.7172 54.7012 17.7822 179.5036 187 K 3.7722 7.5454 115.9476 59.1820 32.2771 177.8392 188 Y 4.7191 7.8273 115.9567 58.0571 38.1064 176.9229 189 K 3.9146 8.0563 123.4432 59.4792 31.9993 177.8168 190 D 4.4918 8.1099 116.2822 53.9555 39.5384 175.3169 191 N 4.3095 8.3852 117.3690 54.1606 38.3294 173.7960 192 R 4.1620 8.2892 115.9904 56.0698 30.8577 175.2907 193 I 5.3958 7.9767 117.8020 60.4625 40.5016 173.7183 194 I 4.5075 7.9538 118.7135 60.5050 41.9071 174.0517 195 N 4.8931 8.7541 127.5564 53.1117 39.8450 175.8305 196 M 4.0562 9.3560 126.4233 58.2097 32.2377 178.4837 197 K 4.1725 8.0209 115.8622 58.4402 33.2773 177.0431 198 N 4.7225 8.2629 116.8905 53.2490 39.5276 174.3944 199 F 4.5247 8.0368 121.7646 57.9030 39.7480 173.1192 200 S 4.7506 7.4953 121.4970 58.9394 63.8114 173.5699 201 H 4.9772 7.4896 112.6080 54.7226 32.6106 171.3406 202 F 5.4060 8.2785 113.0760 55.1048 41.1935 173.7035 203 D 5.4139 9.2606 121.1809 52.7485 43.8601 174.6711 204 I 4.8866 9.0808 125.5372 59.9048 39.4923 174.4588 205 Y 5.0799 9.0919 124.6181 56.4403 41.4076 175.2774 206 L 4.7054 8.7140 122.1079 53.7465 46.1267 174.8542 207 E 5.0935 8.8402 123.4792 53.5447 32.5401 176.7949 208 K 4.1824 8.5983 121.6386 56.5953 32.5729 176.1303 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 4.46 0.00 2.65 2.63 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 0.00 0.00 0.00 0.00 2 S 8.89 4.14 0.00 4.14 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 3 K 7.86 3.81 0.00 1.73 1.76 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.50 7.81 4 K 7.32 4.24 0.00 1.77 1.55 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.24 0.96 7.81 5 D 8.21 5.02 0.00 2.58 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 6 I 7.72 3.60 1.90 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.49 0.94 0.00 0.00 7 S 7.78 4.40 0.00 3.96 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 8 N 8.80 4.85 0.00 2.96 2.94 0.00 0.00 7.05 7.68 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 9 V 7.76 4.06 2.47 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 1.04 0.00 0.00 1.08 0.00 0.00 10 K 7.72 4.29 0.00 1.93 1.70 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.39 1.25 7.81 11 S 8.09 4.59 0.00 3.96 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 D 7.60 4.41 0.00 2.75 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 13 L 7.86 3.93 0.00 1.26 1.09 0.84 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 14 L 7.74 3.70 0.00 1.95 1.91 1.06 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 8.08 4.21 0.00 2.90 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 16 A 7.46 3.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 Y 8.43 4.58 0.00 3.20 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 18 T 7.45 4.43 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 1.27 0.00 0.00 19 I 6.92 4.52 1.68 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.70 0.87 0.00 0.00 20 T 8.27 4.39 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 1.22 0.00 0.00 21 P 0.00 3.98 0.00 0.99 1.26 0.00 3.78 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.31 0.00 22 Y 7.46 4.01 0.00 2.72 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 0.00 0.00 0.00 0.00 23 D 6.96 5.01 0.00 2.27 2.25 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 24 Y 6.90 3.85 0.00 2.77 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 25 K 8.46 4.76 0.00 1.84 1.74 0.00 1.90 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.34 7.81 26 D 9.11 4.36 0.00 2.83 2.77 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 27 C 8.79 4.94 0.00 2.86 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 28 R 8.50 4.69 0.00 1.79 1.86 0.00 3.15 0.00 0.00 3.33 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.72 0.00 29 V 8.63 3.98 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 0.95 0.00 0.00 0.87 0.00 0.00 30 N 9.37 4.55 0.00 2.75 2.96 0.00 0.00 6.84 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 31 F 7.07 4.95 0.00 3.10 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 S 8.80 5.01 0.00 3.99 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 33 T 8.55 4.74 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 1.53 0.00 0.00 34 T 8.78 4.59 4.37 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 1.53 0.00 0.00 *35 H 9.47 5.17 0.00 2.42 2.97 0.00 7.21 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 36 T 7.80 5.00 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 37 L 9.37 4.73 0.00 1.80 1.55 0.92 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 38 N 8.15 5.04 0.00 1.72 1.42 0.00 0.00 6.72 7.28 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 39 I 8.66 4.61 1.81 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.31 0.96 0.00 0.00 40 D 8.88 4.89 0.00 2.79 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 41 T 7.97 4.47 3.32 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 0.73 0.00 0.00 42 Q 9.14 4.35 0.00 2.35 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.85 0.00 0.00 0.00 0.00 0.00 2.50 2.29 0.00 43 K 7.83 4.01 0.00 1.63 1.82 0.00 1.17 0.00 0.00 1.52 0.00 0.00 3.02 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.15 0.50 7.81 44 Y 7.79 4.44 0.00 2.96 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 45 R 8.07 4.23 0.00 1.41 1.03 0.00 2.63 0.00 0.00 2.79 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.47 0.00 46 G 7.80 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 47 K 8.13 4.19 0.00 1.76 1.77 0.00 1.95 0.00 0.00 1.72 0.00 0.00 2.80 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.55 7.81 48 D 8.68 4.49 0.00 2.81 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 49 Y 7.51 4.76 0.00 3.17 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 50 Y 8.12 4.95 0.00 3.04 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 51 I 8.77 4.61 1.79 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 0.84 1.01 0.85 0.00 0.00 52 S 9.25 4.74 0.00 3.81 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 53 S 9.09 4.56 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 54 E 9.53 4.95 0.00 2.36 2.37 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 2.49 2.64 0.00 55 M 8.53 5.51 0.00 1.97 2.07 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.43 0.00 56 S 8.35 4.42 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 57 Y 8.29 4.14 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 58 E 8.61 3.98 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 59 A 8.09 4.38 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 60 S 7.94 4.39 0.00 4.22 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 61 Q 7.21 4.41 0.00 2.21 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.00 0.00 0.00 0.00 0.00 0.00 2.42 2.27 0.00 62 K 7.75 3.81 0.00 1.45 1.36 0.00 1.51 0.00 0.00 1.22 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.30 0.94 7.81 63 F 7.32 5.17 0.00 3.10 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 64 K 9.84 4.46 0.00 1.77 1.72 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.40 1.41 7.81 65 R 8.10 3.57 0.00 1.85 1.81 0.00 3.41 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.74 0.00 66 D 8.26 4.47 0.00 2.82 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 67 D 7.53 4.71 0.00 2.81 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 H 8.73 5.25 0.00 3.11 3.24 0.00 5.55 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 69 V 9.14 4.92 1.83 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 0.75 0.00 0.00 0.54 0.00 0.00 70 D 8.83 5.27 0.00 2.60 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 V 8.75 4.75 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 0.96 0.00 0.00 0.96 0.00 0.00 72 F 8.87 5.16 0.00 3.04 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 73 G 8.00 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.95 4.31 0.00 0.27 0.74 0.05 -0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 75 F 8.27 5.00 0.00 3.26 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 76 Y 7.61 4.63 0.00 3.06 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 77 I 7.45 4.47 2.19 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.63 0.76 0.00 0.00 78 L 7.88 4.67 0.00 1.50 1.33 0.48 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 79 N 7.77 4.50 0.00 2.75 2.47 0.00 0.00 6.74 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 80 S 8.15 3.81 0.00 3.99 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 81 H 7.39 5.10 0.00 3.23 3.37 0.00 5.97 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 T 7.40 3.56 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 83 G 7.58 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 0.00 0.00 0.00 84 E 8.41 4.79 0.00 1.43 1.41 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 2.07 2.01 0.00 85 Y 8.61 4.97 0.00 2.45 2.48 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 86 I 8.08 4.63 2.05 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 1.26 0.71 1.10 0.00 0.00 87 Y 8.07 5.29 0.00 3.18 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 G 9.51 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 0.00 0.00 0.00 89 G 9.09 4.55 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 0.00 0.00 0.00 90 I 7.28 5.07 2.01 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 1.57 0.88 0.18 0.00 0.00 91 T 8.32 4.99 4.33 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 1.27 0.00 0.00 92 P 0.00 4.73 0.00 2.07 2.21 0.00 3.83 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.47 0.00 93 A 8.79 4.25 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 94 Q 8.89 4.16 0.00 2.10 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.90 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 95 N 8.77 4.65 0.00 2.77 2.87 0.00 0.00 6.89 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 N 7.75 5.00 0.00 2.65 2.66 0.00 0.00 6.83 7.61 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 97 K 8.58 3.90 0.00 1.68 1.72 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.53 7.81 98 V 7.97 4.29 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 0.80 0.00 0.00 0.92 0.00 0.00 99 N 8.45 4.97 0.00 2.47 2.55 0.00 0.00 6.50 7.90 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 0.00 100 H 8.62 4.92 0.00 3.13 3.02 0.00 5.60 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.34 3.96 0.00 1.61 1.87 0.00 1.71 0.00 0.00 2.02 0.00 0.00 2.72 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.46 7.81 102 L 8.19 4.55 0.00 1.72 1.63 0.83 -0.14 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 0.00 103 L 7.80 4.72 0.00 1.42 1.33 0.88 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 104 G 7.32 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 0.00 0.00 0.00 105 N 8.71 4.95 0.00 2.30 1.66 0.00 0.00 6.84 6.78 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 0.00 106 L 7.68 4.61 0.00 1.49 1.31 0.31 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 107 F 9.38 5.02 0.00 2.67 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 0.00 108 I 8.27 4.81 2.16 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.63 1.11 0.00 0.00 109 S 9.33 4.44 0.00 3.90 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 0.00 110 G 8.11 4.93 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 0.00 111 E 8.29 3.69 0.00 2.13 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 0.00 2.22 2.43 0.00 112 S 8.38 4.63 0.00 4.12 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 0.00 113 Q 9.00 2.85 0.00 2.21 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.78 0.00 0.00 0.00 0.00 0.00 2.24 2.39 0.00 114 Q 7.99 4.71 0.00 2.13 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.46 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 115 N 8.36 5.09 0.00 2.62 2.63 0.00 0.00 6.65 7.85 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 0.00 116 L 7.95 4.49 0.00 1.52 1.60 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 117 N 7.97 4.25 0.00 2.64 2.70 0.00 0.00 7.20 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 N 8.69 4.40 0.00 2.90 2.99 0.00 0.00 6.86 7.68 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 0.00 119 K 7.81 4.58 0.00 1.70 1.62 0.00 1.82 0.00 0.00 1.87 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.41 7.81 120 I 7.40 4.16 1.87 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.31 0.78 0.00 0.00 121 I 8.41 4.68 1.83 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.54 0.86 0.00 0.00 122 L 8.15 4.71 0.00 1.39 1.36 0.50 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.28 4.90 0.00 1.87 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 0.00 2.15 2.20 0.00 124 K 7.81 4.70 0.00 1.62 1.72 0.00 1.68 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.32 1.40 7.81 125 D 8.62 4.66 0.00 2.62 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 0.00 126 I 7.71 4.92 1.91 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.63 0.97 0.00 0.00 127 V 8.13 4.38 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 0.69 0.00 0.00 0.81 0.00 0.00 128 T 8.05 4.78 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 1.16 0.00 0.00 129 F 8.74 4.01 0.00 3.30 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 0.00 130 Q 8.18 3.60 0.00 1.58 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.91 0.00 0.00 0.00 0.00 0.00 1.80 1.16 0.00 131 E 7.83 3.26 0.00 1.22 1.68 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 1.85 1.47 0.00 132 I 7.57 3.48 1.85 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.39 0.85 0.00 0.00 133 D 9.31 4.45 0.00 3.06 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 0.00 134 F 9.14 4.49 0.00 3.18 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 0.00 135 K 8.40 3.52 0.00 1.59 1.66 0.00 1.51 0.00 0.00 1.52 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.44 7.81 136 I 7.90 3.45 1.62 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.65 0.44 0.00 0.00 137 R 7.79 3.63 0.00 1.77 1.75 0.00 2.23 0.00 0.00 2.74 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.80 0.00 138 K 7.82 3.91 0.00 1.21 1.28 0.00 1.23 0.00 0.00 1.26 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.28 1.37 7.81 139 Y 7.32 3.78 0.00 3.14 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 0.00 140 L 7.81 3.91 0.00 1.66 1.47 0.68 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 141 M 8.34 4.05 0.00 2.02 2.17 0.00 0.00 0.00 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.49 0.00 142 D 8.24 4.40 0.00 2.53 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 7.94 4.83 0.00 2.47 2.73 0.00 0.00 6.79 7.55 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 0.00 144 Y 8.43 4.30 0.00 2.83 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 0.00 145 K 8.19 4.16 0.00 1.95 2.36 0.00 1.82 0.00 0.00 1.97 0.00 0.00 3.06 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.40 1.53 7.81 146 I 7.58 4.26 1.92 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.25 0.79 0.00 0.00 147 Y 7.69 4.94 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 0.00 148 D 7.76 4.60 0.00 2.93 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 0.00 149 A 8.75 4.18 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 T 7.69 4.35 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 1.23 0.00 0.00 151 S 7.50 4.69 0.00 4.03 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 0.00 152 P 0.00 4.37 0.00 1.40 1.85 0.00 2.57 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.87 0.00 153 Y 7.20 4.89 0.00 3.14 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 0.00 154 V 8.08 4.23 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.90 0.00 0.00 155 S 7.63 4.44 0.00 3.93 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 0.00 156 G 7.90 4.63 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 R 8.47 5.17 0.00 1.91 2.08 0.00 2.98 0.00 0.00 3.34 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.66 0.00 158 I 8.54 4.78 1.94 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.97 0.94 0.00 0.00 159 E 9.17 5.28 0.00 2.29 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 2.33 2.52 0.00 160 I 8.99 4.60 2.11 0.00 0.00 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 1.59 1.74 0.81 0.00 0.00 161 G 8.97 4.09 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 0.00 0.00 0.00 162 T 8.07 4.97 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 1.38 0.00 0.00 163 K 8.66 4.47 0.00 1.64 1.82 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.53 7.81 164 D 7.83 4.80 0.00 2.72 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 0.00 165 G 7.58 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 K 7.23 4.67 0.00 1.84 1.73 0.00 1.84 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.37 0.00 0.00 0.00 0.00 1.34 1.48 7.81 167 H 8.35 5.14 0.00 3.07 3.36 0.00 5.94 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 E 8.57 4.69 0.00 2.03 1.85 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 2.34 2.42 0.00 169 Q 8.81 4.68 0.00 1.94 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 7.16 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 170 I 8.45 4.59 2.08 0.00 0.00 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 1.20 0.58 1.02 0.00 0.00 171 D 8.65 4.51 0.00 2.74 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 0.00 172 L 8.89 4.23 0.00 2.01 1.78 0.93 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 173 F 8.32 4.96 0.00 3.05 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 D 7.72 4.81 0.00 2.62 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 0.00 175 S 8.33 4.28 0.00 3.77 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 0.00 176 P 0.00 4.47 0.00 2.19 2.02 0.00 3.94 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 1.93 1.95 0.00 177 N 8.13 4.07 0.00 3.10 2.86 0.00 0.00 6.94 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 0.00 178 E 8.29 3.78 0.00 1.92 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.41 0.00 179 G 9.35 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 T 7.32 4.70 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 1.18 0.00 0.00 181 R 8.21 3.16 0.00 1.65 1.44 0.00 2.79 0.00 0.00 2.76 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 1.22 0.00 182 S 7.86 4.24 0.00 3.78 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 0.00 183 D 8.39 4.48 0.00 2.99 2.62 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 0.00 184 I 8.13 3.40 1.49 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 1.43 1.05 0.86 0.00 0.00 185 F 8.48 4.58 0.00 3.47 3.48 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 0.00 186 A 8.28 3.20 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 0.00 187 K 7.55 3.77 0.00 1.29 1.71 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.57 1.52 7.81 188 Y 7.83 4.72 0.00 3.23 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 0.00 189 K 8.06 3.91 0.00 1.68 1.69 0.00 1.38 0.00 0.00 1.57 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.28 1.43 7.81 190 D 8.11 4.49 0.00 2.84 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 0.00 191 N 8.39 4.31 0.00 2.96 3.01 0.00 0.00 7.08 7.24 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 0.00 192 R 8.29 4.16 0.00 1.96 2.07 0.00 2.47 0.00 0.00 3.06 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.64 0.00 193 I 7.98 5.40 2.09 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.94 1.09 0.00 0.00 194 I 7.95 4.51 1.88 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 1.20 1.15 0.78 0.00 0.00 195 N 8.75 4.89 0.00 2.93 2.69 0.00 0.00 7.17 7.65 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 0.00 196 M 9.36 4.06 0.00 1.80 1.98 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.53 0.00 197 K 8.02 4.17 0.00 1.87 1.94 0.00 1.57 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.48 7.81 198 N 8.26 4.72 0.00 2.89 2.90 0.00 0.00 6.50 8.42 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 0.00 199 F 8.04 4.52 0.00 2.94 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 0.00 200 S 7.50 4.75 0.00 3.83 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 0.00 201 H 7.49 4.98 0.00 3.08 3.23 0.00 5.26 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 0.00 202 F 8.28 5.41 0.00 3.16 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 0.00 203 D 9.26 5.41 0.00 2.77 2.63 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 0.00 0.00 0.00 0.00 204 I 9.08 4.89 1.72 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.89 0.79 0.00 0.00 205 Y 9.09 5.08 0.00 2.91 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 0.00 206 L 8.71 4.71 0.00 1.55 1.55 0.44 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 207 E 8.84 5.09 0.00 1.95 1.84 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 2.30 2.24 0.00 208 K 8.60 4.18 0.00 1.74 1.69 0.00 1.97 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.71 1.52 7.81 * Residues marked with a * may have inaccurate shift predictions.