NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4281 8.1633 120.6008 55.1761 34.1463 174.5873 2 K 4.3805 8.4234 125.5966 54.9755 33.1627 176.4327 3 R 3.8689 8.9209 124.0208 59.5056 30.8540 178.8013 4 S 4.7399 8.7487 115.2786 60.9891 62.8043 176.5199 5 A 3.9004 7.8102 123.8318 54.7038 18.1303 179.4796 6 I 3.4090 7.6427 118.2780 64.4501 37.1130 178.1270 7 N 4.1371 8.7613 118.4231 56.4572 38.3526 176.8263 8 D 4.2249 7.9890 118.9054 57.3763 41.2544 178.2018 9 I 3.6151 7.8791 120.5627 64.5299 37.0246 178.4767 10 L 3.6506 7.9154 119.9004 57.3596 41.4124 179.7591 11 G 3.5051 8.0488 105.8264 48.2290 0.0000 175.4704 12 H 4.3800 8.2910 119.1853 58.8006 28.6679 178.1329 13 T 3.8674 8.1534 117.8258 66.5913 68.1651 176.9251 14 R 4.0040 8.0710 120.2816 59.3106 30.0709 179.1579 15 Q 3.9984 7.9664 117.3051 58.8450 28.7238 178.4211 16 F 4.2040 8.3847 121.6539 61.4459 39.4366 176.8305 17 F 4.3738 8.6337 117.7245 61.0263 38.7954 177.6406 18 S 4.0891 8.4156 112.4739 61.6386 61.9724 176.2378 19 Q 4.0579 8.5060 119.7089 58.2886 28.3669 177.3997 20 H 4.5412 7.3806 115.0471 54.4214 29.0963 174.0498 21 D 4.2870 7.8005 118.6386 55.1180 40.0010 173.4826 22 V 3.9332 7.5339 116.4742 61.5602 32.3849 174.7211 23 H 4.8405 8.4515 123.1077 53.9178 31.6512 173.0275 24 L 4.4518 8.0604 123.2204 51.7917 44.1031 174.5841 25 P 4.4499 0.0000 0.0000 61.8405 32.3861 175.4208 26 P 4.1550 0.0000 0.0000 66.0335 31.0790 178.7546 27 F 2.0000 8.0311 111.7450 58.4230 37.3594 176.9084 28 A 4.1009 7.3079 121.1639 53.9746 18.0391 177.9525 29 S 4.7827 7.4444 109.4788 57.8136 63.7081 174.3978 30 F 4.7039 7.6649 121.5153 57.7741 39.0974 176.1222 31 S 4.8988 9.0429 122.2713 56.9378 65.1871 173.4431 32 P 4.3746 0.0000 0.0000 66.0155 30.8110 178.5810 33 A 4.2558 8.1010 117.9063 55.5794 18.7399 179.2806 34 Q 3.8634 7.9752 116.0205 58.7481 28.4706 178.9054 35 W 4.0856 8.0502 120.0258 59.8712 28.7770 178.4987 36 Q 4.3843 8.0820 116.4614 58.0208 28.1823 177.5709 37 Q 4.5151 7.3732 116.5416 54.6419 29.5691 175.5642 38 L 4.0894 6.9392 120.6663 53.8794 42.5509 176.6965 39 D 4.5790 8.7394 121.4868 54.4499 40.2154 176.8732 40 T 4.3985 8.6844 118.6636 64.4949 68.4745 175.9683 41 A 4.1949 8.0488 123.1202 54.9285 18.5245 178.9588 42 A 4.1380 8.1440 118.0428 53.5648 18.7288 178.7980 43 W 4.4131 7.4715 116.4695 56.6232 29.5621 177.6278 44 E 4.2305 8.2219 122.0024 59.6573 28.8925 178.7307 45 E 3.5081 7.9919 120.1817 58.3578 29.6788 178.7859 46 V 3.2668 7.0957 118.3212 65.9042 31.2423 178.1182 47 F 4.1879 7.2246 116.6960 60.8468 38.7204 177.3644 48 D 4.5149 8.6783 117.3676 56.6677 40.7273 177.8844 49 L 4.4046 7.5275 116.0951 53.0266 42.8722 176.2908 50 K 4.0733 7.7918 117.4233 57.4527 30.0818 175.4536 51 L 4.1989 7.7350 117.1373 55.4518 43.0721 177.9090 52 G 2.7626 8.0259 105.9994 43.2476 0.0000 172.7992 53 W 5.0053 8.4729 118.5849 57.0912 30.6460 175.1303 54 D 4.9830 9.5815 122.8225 52.7708 44.3396 173.9390 55 V 4.9002 8.5823 125.2783 61.4010 34.1856 174.3586 56 T 4.5773 8.9344 121.5152 60.0283 71.1299 173.6908 57 A 4.8213 8.3984 128.2348 50.5038 19.6505 176.6343 58 F 3.7786 8.4911 115.2376 59.8321 36.9098 176.4300 59 G 3.9501 8.1894 103.2917 45.6262 0.0000 173.7035 60 R 4.7041 7.7133 119.1436 54.3663 32.6779 175.8566 61 N 4.9529 8.6267 115.3064 52.9930 37.5840 174.6676 62 N 4.8873 7.7152 118.0961 51.5104 38.1032 173.9974 63 F 4.2572 8.8352 125.5726 60.7514 39.9229 177.1220 64 A 4.0756 8.2740 121.3857 54.7800 18.6116 178.0804 65 A 4.1200 7.7194 116.5605 54.1749 19.5841 176.3848 66 H 5.3856 7.8063 113.7098 54.2403 32.3929 173.2950 67 G 3.8876 8.4951 109.1847 46.2884 0.0000 170.7360 68 L 4.7606 8.0409 118.9876 54.4424 46.2332 173.5725 69 T 5.3532 8.5387 119.6149 61.9805 71.9063 173.1019 70 L 5.5684 9.5028 125.4391 53.0607 46.8285 175.3870 71 F 4.8687 9.4403 123.3451 56.7887 42.5701 173.8734 72 T 4.5813 8.2449 124.2794 63.0443 68.5258 175.6160 73 L 4.6096 9.2748 128.6225 57.1834 42.7371 177.5267 74 R 4.6254 7.5230 112.4269 55.7588 32.4963 173.3275 75 N 4.7021 7.5934 117.5568 54.3797 42.0855 172.5053 76 G 4.7072 8.2047 108.5690 42.3625 0.0000 172.1171 77 S 4.3402 8.9919 115.5786 57.8695 63.3586 175.5850 78 A 3.9758 8.8202 128.0770 55.1106 18.0489 178.4536 79 K 4.3922 8.1328 111.3622 56.0537 32.0978 177.5249 80 G 4.0517 9.3970 108.6022 45.8201 0.0000 173.5944 81 M 4.7906 7.3986 117.6843 53.2295 35.9289 173.1984 82 P 4.2300 0.0000 0.0000 63.9058 32.5083 175.7664 83 Y 4.3987 7.7607 118.2799 56.7340 37.0071 176.5469 84 V 4.0376 8.1445 118.2670 62.0625 32.4073 177.1833 85 K 3.5559 8.0738 121.5514 57.2127 32.3415 176.4149 86 C 4.4062 8.5970 119.7795 58.9330 30.7694 172.2370 87 Y 5.4953 6.8718 118.2530 55.4101 41.2600 174.1333 88 A 5.1044 9.1365 120.6598 50.7570 23.6489 174.7285 89 E 5.2818 9.0978 119.2675 54.8245 33.5521 174.3150 90 K 5.2406 9.3003 125.3324 54.5908 36.6223 174.7554 91 I 4.9623 8.7517 122.4364 59.6635 40.9851 174.2234 92 M 5.7037 9.3508 127.3243 54.0768 37.4472 173.6405 93 H 5.3053 9.6712 120.3562 54.7620 32.9207 172.4538 94 V 4.3214 8.8434 127.3017 61.3195 32.9646 175.4669 95 R 4.4620 9.0339 127.7302 55.3383 31.5703 175.8373 96 D 4.3458 9.3951 120.8643 56.1965 41.3814 177.1293 97 A 3.9127 8.5182 127.1887 52.7556 16.8758 176.3009 98 Q 4.2661 8.2919 120.2086 56.2282 30.4692 174.8741 99 V 4.6426 8.4254 126.7649 61.8687 33.8030 174.5437 100 T 4.1824 8.6049 125.0403 61.1805 69.5262 172.7512 101 P 4.2765 0.0000 0.0000 62.4523 32.5571 176.0954 102 M 4.3983 8.5905 122.1930 56.8317 33.0617 174.7088 103 H 5.3965 9.0368 120.4285 54.5165 32.6497 171.9820 104 F 5.0040 8.0728 114.0137 55.3529 41.8980 172.9388 105 H 5.7499 8.3445 114.5229 53.0241 31.0517 175.7981 106 W 4.3582 9.0902 122.2461 59.5827 29.1038 176.9858 107 R 4.4896 8.9515 115.8098 57.3767 31.8668 176.3723 108 K 4.0025 8.5650 118.6245 56.9740 32.7138 175.7880 109 R 4.9572 8.9029 128.0951 54.6515 32.2839 174.5580 110 E 5.0905 8.9034 123.2885 54.7462 33.7863 174.0335 111 D 5.1401 9.4519 122.8758 53.2189 42.7578 175.4243 112 I 4.6132 8.5259 125.6999 60.1615 39.1020 175.0252 113 I 4.7812 8.6756 127.8809 59.3573 40.7629 174.3930 114 N 4.9062 9.0673 126.7636 53.2193 38.6678 175.3217 115 R 4.3143 9.2648 125.9153 56.0775 31.1493 177.0708 116 G 4.2396 8.7090 109.9406 45.1676 0.0000 172.1873 117 G 4.4599 8.2926 105.4572 44.2238 0.0000 174.4882 118 G 4.2235 9.0085 115.8299 46.1837 0.0000 171.3744 119 N 5.2257 8.8489 118.3104 51.3669 42.0517 173.5314 120 L 4.8362 8.6165 125.1467 53.8057 44.2336 174.9698 121 I 4.4755 8.4440 127.7284 59.6262 39.1099 174.6593 122 V 4.6013 8.3861 127.6241 60.9434 34.0466 173.6235 123 E 5.4332 8.9972 129.4529 54.0338 31.7704 174.5138 124 L 5.5333 8.1853 125.1077 52.9615 46.0749 175.3935 125 W 5.4322 9.1759 121.9262 54.8419 33.8099 174.5947 126 N 4.8270 9.1208 120.7829 53.4434 39.5014 173.7641 127 A 4.9396 7.7598 122.7212 51.1718 19.7610 177.3528 128 D 4.6077 9.8787 123.1158 53.4476 42.2815 177.2193 129 S 4.1147 8.6480 117.4351 61.6739 62.7300 175.3803 130 N 4.7512 8.2354 115.6180 52.8334 38.2554 175.2085 131 E 4.1154 8.2338 116.0408 57.5989 27.4769 174.4027 132 Q 4.7038 7.3750 118.9425 54.5005 31.5892 174.7651 133 T 4.8772 8.0491 110.6788 61.8109 69.2360 174.5936 134 A 4.6204 9.1024 128.4949 51.1747 20.3561 176.7154 135 D 4.8717 8.6753 117.5521 54.2407 41.4390 177.4874 136 S 4.4350 7.7655 115.1488 58.0174 64.3702 173.5073 137 D 4.8342 8.7064 121.5858 54.8169 41.5283 175.7215 138 I 4.4152 8.7410 115.9565 59.8959 40.1274 174.5422 139 T 5.0335 8.4204 121.0331 62.0758 70.4475 173.8507 140 V 4.5783 8.8838 119.2051 59.4640 36.8041 174.6219 141 V 4.6664 8.2869 121.9846 61.3040 34.1908 174.4675 142 I 4.5294 8.5661 129.3120 60.2506 37.8751 175.4975 143 D 4.4086 9.2297 128.6332 55.3688 38.5437 175.5753 144 G 3.8063 8.4297 105.7089 45.3936 0.0000 173.0934 145 C 4.4135 7.7459 120.9901 57.3848 31.7042 172.4874 146 R 4.6026 8.3726 128.4324 55.9835 30.6205 175.2458 147 Q 4.6221 8.9450 122.0235 54.7640 32.4709 173.0311 148 K 4.9639 8.3985 121.3994 55.1926 34.5835 174.6105 149 H 5.1547 9.1792 123.1173 53.9096 33.9561 172.7865 150 T 4.5553 8.3705 109.3418 61.0448 70.2176 173.9423 151 A 3.7523 7.4337 127.4004 54.2163 18.6788 178.3377 152 G 2.2037 7.4212 109.9289 44.7546 0.0000 173.9481 153 S 4.0792 7.2786 116.0957 58.8283 64.0832 173.4111 154 Q 4.8603 8.5219 122.4070 54.3957 30.1485 174.8245 155 L 4.6356 8.7494 124.9399 52.7732 44.7684 175.5012 156 R 4.6592 8.3690 123.0673 54.8519 31.6102 175.1794 157 L 4.6515 8.7439 127.4739 53.2516 43.2046 176.5461 158 S 4.7856 9.0265 120.8733 56.9669 64.5229 172.4708 159 P 4.5946 0.0000 0.0000 64.8750 31.4317 176.3064 160 G 4.0321 9.4226 111.3618 45.1639 0.0000 173.6060 161 E 4.8087 8.3059 119.3549 55.8699 31.4008 175.7851 162 S 5.0162 9.3330 115.5660 57.1957 66.9966 172.7349 163 I 4.7253 8.5809 121.3850 59.4044 41.3182 173.4108 164 C 4.9027 8.6468 129.4827 58.3062 32.7206 172.7192 165 L 4.6010 9.2348 127.7784 52.3544 42.8213 174.5333 166 P 4.6835 0.0000 0.0000 61.3496 32.8275 174.6225 167 P 4.3470 0.0000 0.0000 64.6604 31.8351 177.2175 168 G 3.1284 8.9389 110.8333 44.5133 0.0000 172.3098 169 L 4.2869 7.1305 122.2197 53.9551 42.5614 176.0354 170 Y 4.7951 9.0179 125.8525 58.6058 39.2249 174.9660 171 H 5.9915 9.4637 118.3828 53.9349 32.6381 172.2161 172 S 5.2454 8.8313 114.1885 56.8024 66.2282 172.3545 173 F 5.8544 8.5832 119.8262 54.6163 41.7839 173.1167 174 W 5.8793 8.1737 114.7819 55.5322 31.6263 173.2758 175 A 4.6451 8.8520 123.3360 51.6021 19.3451 176.5555 176 E 4.2940 9.5451 124.4953 56.2415 30.7989 176.2879 177 A 4.5823 8.4451 129.5098 53.5582 18.6710 177.4781 178 G 3.9318 9.3296 112.1394 45.4418 0.0000 173.8825 179 F 4.3527 8.5010 117.5331 57.1379 39.5561 176.1775 180 G 4.1480 8.3880 106.2600 44.2708 0.0000 172.8888 181 D 4.7163 8.5617 117.9406 54.5082 42.2172 175.8092 182 V 4.9078 8.9234 121.1746 61.0959 34.7496 174.1962 183 L 5.0849 9.4407 130.6456 54.5923 43.1715 175.1711 184 V 4.6804 9.0041 127.5715 61.2015 33.6731 174.8685 185 G 4.3436 9.1921 115.5313 45.0391 0.0000 172.1531 186 E 5.2028 9.0474 122.2884 54.2383 33.0976 174.2520 187 V 4.9619 8.5262 126.9162 61.1965 34.5156 174.5253 188 S 4.9694 8.8757 121.4386 57.1886 67.2008 173.2887 189 S 5.4227 8.4729 115.3581 56.9759 64.4960 174.1788 190 V 3.8553 8.4086 112.5894 62.2550 31.7951 175.6440 191 N 4.7937 9.2520 123.7647 52.3640 40.0774 174.9316 192 D 4.7093 8.2179 124.1655 52.8310 41.8171 174.8395 193 D 4.5933 8.4505 124.0029 56.2071 41.4828 177.7887 194 D 4.5146 8.0832 118.6044 56.9510 40.8202 176.8539 195 H 4.9306 8.2122 111.7195 55.0460 31.1752 173.0997 196 D 5.2255 8.6238 118.3894 53.9830 42.3635 174.6375 197 N 5.0808 8.2926 114.7287 52.0079 40.6465 173.5003 198 H 4.5507 8.2121 124.9194 54.1861 31.5000 173.1144 199 F 4.6290 8.5492 124.9933 56.7305 39.4373 175.7346 200 L 4.0307 8.7018 125.5169 57.3651 41.8801 177.6065 201 Q 4.3301 7.7623 120.0627 53.6020 28.5137 173.8836 202 P 4.3510 0.0000 0.0000 62.8601 31.9727 176.2354 203 L 4.1999 8.2005 121.7868 53.9223 42.2512 177.3472 *205 R 4.3895 8.3826 118.2550 55.7232 31.3930 174.6286 206 Y 4.8343 7.6085 115.0254 55.3555 41.0131 173.9374 207 N 4.6433 8.5909 119.0480 51.6508 40.4694 174.3233 208 L 4.7307 7.9119 120.5143 53.9734 43.2460 175.4617 209 I 4.3830 7.9596 119.7850 59.5932 38.5210 175.1648 210 D 4.5260 8.8498 126.3062 53.4798 41.2358 176.1336 211 E 4.2159 8.4093 130.3025 55.4092 27.9346 176.4074 212 D 4.5269 7.8121 119.7500 54.8421 40.8992 176.9986 213 E 4.7586 7.6745 116.3838 53.3279 32.8713 172.7635 214 P 4.5186 0.0000 0.0000 62.3695 31.9324 176.4541 215 A 4.3149 8.3963 125.4743 52.3417 19.0369 177.8366 216 Q 4.2211 9.2099 122.1611 57.8338 29.2565 176.0183 217 L 5.0084 7.5112 114.9176 52.9820 45.9135 175.2020 218 V 4.4825 8.4970 119.1404 61.1863 33.4031 175.2970 219 L 4.6352 8.6301 126.8861 53.7084 42.6058 177.8223 220 C 3.5439 9.0332 116.6974 60.4113 29.5828 174.2875 221 N 4.7272 7.8205 116.2894 53.2736 38.4980 174.6803 222 E 4.7120 7.5272 116.5191 56.1794 30.1850 176.8910 223 Y 4.7117 8.0846 119.1071 61.1944 38.5522 178.2711 224 R 3.8054 8.1612 116.1720 59.4258 29.4162 177.7840 225 Q 3.8083 7.6954 115.9030 57.6350 28.7806 176.7062 226 F 4.7780 8.2042 115.1847 56.8631 39.2959 176.0183 227 R 4.0436 7.4027 123.0838 56.1761 29.3469 175.1486 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 M 8.16 4.43 0.00 2.05 1.94 0.00 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.47 0.00 2 K 8.42 4.38 0.00 1.88 1.89 0.00 1.69 0.00 0.00 2.02 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.45 7.81 3 R 8.92 3.87 0.00 1.93 2.03 0.00 3.12 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.65 0.00 4 S 8.75 4.74 0.00 4.05 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 5 A 7.81 3.90 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 6 I 7.64 3.41 1.89 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 1.35 0.54 0.78 0.00 0.00 7 N 8.76 4.14 0.00 2.86 2.92 0.00 0.00 6.71 7.96 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 8 D 7.99 4.22 0.00 2.86 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 9 I 7.88 3.62 1.75 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.31 0.73 0.00 0.00 10 L 7.92 3.65 0.00 1.38 1.01 0.48 0.34 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 11 G 8.05 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.29 4.38 0.00 3.30 3.38 0.00 5.63 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 T 8.15 3.87 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 0.69 0.00 0.00 14 R 8.07 4.00 0.00 1.91 2.02 0.00 2.94 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.58 0.00 15 Q 7.97 4.00 0.00 2.36 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 16 F 8.38 4.20 0.00 3.14 3.11 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 17 F 8.63 4.37 0.00 3.24 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 18 S 8.42 4.09 0.00 4.00 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 19 Q 8.51 4.06 0.00 2.11 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.91 0.00 0.00 0.00 0.00 0.00 2.40 2.57 0.00 20 H 7.38 4.54 0.00 2.92 3.15 0.00 6.00 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 D 7.80 4.29 0.00 2.77 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 22 V 7.53 3.93 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.69 0.00 0.00 23 H 8.45 4.84 0.00 3.06 3.13 0.00 5.92 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 L 8.06 4.45 0.00 1.32 0.89 0.52 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.45 0.00 2.37 2.26 0.00 3.20 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 2.08 0.00 26 P 0.00 4.16 0.00 2.29 2.29 0.00 3.68 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.23 0.00 27 F 8.03 2.00 0.00 2.31 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 28 A 7.31 4.10 0.72 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 0.00 0.00 29 S 7.44 4.78 0.00 4.04 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 30 F 7.66 4.70 0.00 2.31 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 S 9.04 4.90 0.00 4.12 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 32 P 0.00 4.37 0.00 2.34 2.43 0.00 3.72 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 33 A 8.10 4.26 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 34 Q 7.98 3.86 0.00 1.98 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.73 0.00 0.00 0.00 0.00 0.00 2.14 2.28 0.00 35 W 8.05 4.09 0.00 3.13 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 36 Q 8.08 4.38 0.00 2.43 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.96 0.00 0.00 0.00 0.00 0.00 2.63 3.01 0.00 37 Q 7.37 4.52 0.00 1.95 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.90 0.00 0.00 0.00 0.00 0.00 2.45 2.49 0.00 38 L 6.94 4.09 0.00 1.64 1.41 -0.01 0.08 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 39 D 8.74 4.58 0.00 2.81 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 T 8.68 4.40 4.45 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 1.36 0.00 0.00 41 A 8.05 4.19 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 0.00 0.00 42 A 8.14 4.14 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 43 W 7.47 4.41 0.00 3.28 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 44 E 8.22 4.23 0.00 2.19 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.69 0.00 45 E 7.99 3.51 0.00 1.96 1.72 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 2.01 1.47 0.00 46 V 7.10 3.27 1.65 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 0.57 0.00 0.00 0.43 0.00 0.00 47 F 7.22 4.19 0.00 3.25 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 48 D 8.68 4.51 0.00 2.65 2.91 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 49 L 7.53 4.40 0.00 1.55 1.56 0.49 0.92 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 50 K 7.79 4.07 0.00 1.92 1.92 0.00 1.75 0.00 0.00 1.82 0.00 0.00 3.08 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.64 1.49 7.81 51 L 7.73 4.20 0.00 1.68 1.92 0.82 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 52 G 8.03 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 0.00 0.00 0.00 53 W 8.47 5.01 0.00 3.40 3.17 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 54 D 9.58 4.98 0.00 2.80 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 V 8.58 4.90 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 0.61 0.00 0.00 0.90 0.00 0.00 56 T 8.93 4.58 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 0.52 0.00 0.00 57 A 8.40 4.82 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 F 8.49 3.78 0.00 3.08 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 59 G 8.19 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 60 R 7.71 4.70 0.00 1.98 1.87 0.00 3.04 0.00 0.00 3.18 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.48 0.00 61 N 8.63 4.95 0.00 2.78 2.84 0.00 0.00 5.59 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 62 N 7.72 4.89 0.00 2.70 2.71 0.00 0.00 6.73 7.71 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 63 F 8.84 4.26 0.00 3.10 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 64 A 8.27 4.08 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 A 7.72 4.12 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 66 H 7.81 5.39 0.00 3.11 3.20 0.00 5.87 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.50 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 68 L 8.04 4.76 0.00 2.09 1.54 1.29 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 69 T 8.54 5.35 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 70 L 9.50 5.57 0.00 1.74 1.67 1.10 1.21 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 71 F 9.44 4.87 0.00 2.57 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 72 T 8.24 4.58 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 73 L 9.27 4.61 0.00 1.67 1.83 0.98 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 74 R 7.52 4.63 0.00 1.88 2.05 0.00 3.21 0.00 0.00 3.47 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.76 0.00 75 N 7.59 4.70 0.00 2.65 2.61 0.00 0.00 7.04 7.98 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 76 G 8.20 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 77 S 8.99 4.34 0.00 4.13 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 78 A 8.82 3.98 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 K 8.13 4.39 0.00 1.75 1.82 0.00 1.82 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.35 7.81 80 G 9.40 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 81 M 7.40 4.79 0.00 1.92 1.90 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.45 0.00 82 P 0.00 4.23 0.00 1.75 1.98 0.00 3.78 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.80 0.00 83 Y 7.76 4.40 0.00 3.13 2.91 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 84 V 8.14 4.04 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 0.90 0.00 0.00 0.93 0.00 0.00 85 K 8.07 3.56 0.00 1.57 1.51 0.00 1.57 0.00 0.00 1.23 0.00 0.00 2.76 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.75 0.21 7.81 86 C 8.60 4.41 0.00 3.19 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 87 Y 6.87 5.50 0.00 3.17 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 88 A 9.14 5.10 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 89 E 9.10 5.28 0.00 2.10 1.81 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 2.23 2.41 0.00 90 K 9.30 5.24 0.00 1.77 1.73 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.40 7.81 91 I 8.75 4.96 1.69 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.94 0.60 0.00 0.00 92 M 9.35 5.70 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.68 0.00 93 H 9.67 5.31 0.00 3.33 3.23 0.00 5.58 0.00 0.00 0.00 0.00 6.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 V 8.84 4.32 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 1.15 0.00 0.00 1.22 0.00 0.00 95 R 9.03 4.46 0.00 1.83 1.73 0.00 3.11 0.00 0.00 3.07 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.17 0.00 96 D 9.40 4.35 0.00 2.77 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 97 A 8.52 3.91 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Q 8.29 4.27 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.17 0.00 99 V 8.43 4.64 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.57 0.00 0.00 100 T 8.60 4.18 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 0.91 0.00 0.00 101 P 0.00 4.28 0.00 1.81 1.82 0.00 2.20 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.73 0.00 102 M 8.59 4.40 0.00 1.96 1.91 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.18 0.00 103 H 9.04 5.40 0.00 2.36 2.38 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 0.00 104 F 8.07 5.00 0.00 2.67 2.57 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 0.00 105 H 8.34 5.75 0.00 3.32 3.54 0.00 5.90 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 W 9.09 4.36 0.00 3.47 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 0.00 107 R 8.95 4.49 0.00 1.97 2.01 0.00 3.24 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 108 K 8.56 4.00 0.00 1.89 1.70 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.38 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.42 7.81 109 R 8.90 4.96 0.00 1.96 1.78 0.00 3.10 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 110 E 8.90 5.09 0.00 2.07 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 0.00 2.21 2.27 0.00 111 D 9.45 5.14 0.00 2.77 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 0.00 112 I 8.53 4.61 1.74 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 1.18 0.85 0.53 0.00 0.00 113 I 8.68 4.78 1.82 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 1.07 0.76 0.87 0.00 0.00 114 N 9.07 4.91 0.00 2.70 2.83 0.00 0.00 6.80 8.44 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 0.00 115 R 9.26 4.31 0.00 1.83 1.90 0.00 3.28 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 116 G 8.71 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 G 8.29 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 G 9.01 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 N 8.85 5.23 0.00 2.50 2.51 0.00 0.00 6.42 6.74 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 0.00 120 L 8.62 4.84 0.00 1.68 1.39 0.97 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 121 I 8.44 4.48 0.56 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 0.89 0.93 0.51 0.00 0.00 122 V 8.39 4.60 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 1.10 0.00 0.00 0.82 0.00 0.00 123 E 9.00 5.43 0.00 2.30 2.07 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 2.47 2.34 0.00 124 L 8.19 5.53 0.00 1.51 1.50 0.89 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 125 W 9.18 5.43 0.00 3.36 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 0.00 126 N 9.12 4.83 0.00 2.73 2.76 0.00 0.00 7.00 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 A 7.76 4.94 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 0.00 0.00 0.00 0.00 0.00 0.00 128 D 9.88 4.61 0.00 2.73 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 0.00 129 S 8.65 4.11 0.00 3.92 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 0.00 130 N 8.24 4.75 0.00 2.79 2.87 0.00 0.00 7.17 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 0.00 131 E 8.23 4.12 0.00 2.30 2.29 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 2.48 2.43 0.00 132 Q 7.37 4.70 0.00 1.97 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 7.02 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 133 T 8.05 4.88 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 134 A 9.10 4.62 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 0.00 135 D 8.68 4.87 0.00 2.75 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 0.00 136 S 7.77 4.44 0.00 3.92 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 0.00 137 D 8.71 4.83 0.00 2.55 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 0.00 138 I 8.74 4.42 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.25 0.94 0.00 0.00 139 T 8.42 5.03 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 1.19 0.00 0.00 140 V 8.88 4.58 2.07 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 0.71 0.00 0.00 0.99 0.00 0.00 141 V 8.29 4.67 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 1.03 0.00 0.00 0.92 0.00 0.00 142 I 8.57 4.53 1.99 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.78 0.92 0.00 0.00 143 D 9.23 4.41 0.00 2.73 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 0.00 144 G 8.43 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 0.00 0.00 0.00 145 C 7.75 4.41 0.00 2.96 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 0.00 146 R 8.37 4.60 0.00 1.79 1.79 0.00 3.27 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 147 Q 8.94 4.62 0.00 1.97 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.54 0.00 0.00 0.00 0.00 0.00 2.41 2.33 0.00 148 K 8.40 4.96 0.00 1.70 1.62 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.68 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.26 1.61 7.81 149 H 9.18 5.15 0.00 2.97 3.04 0.00 5.67 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 0.00 150 T 8.37 4.56 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 151 A 7.43 3.75 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 G 7.42 2.20 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 0.00 153 S 7.28 4.08 0.00 3.68 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 0.00 154 Q 8.52 4.86 0.00 1.92 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.72 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 155 L 8.75 4.64 0.00 1.42 1.42 0.83 0.19 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 0.00 156 R 8.37 4.66 0.00 1.68 1.71 0.00 3.07 0.00 0.00 3.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.46 0.00 157 L 8.74 4.65 0.00 1.48 1.51 0.81 0.66 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 0.00 158 S 9.03 4.79 0.00 3.84 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 0.00 159 P 0.00 4.59 0.00 2.04 2.04 0.00 3.63 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.24 0.00 160 G 9.42 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 E 8.31 4.81 0.00 1.97 1.82 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 2.26 2.32 0.00 162 S 9.33 5.02 0.00 3.87 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 0.00 163 I 8.58 4.73 1.81 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.81 0.84 0.00 0.00 164 C 8.65 4.90 0.00 3.08 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 0.00 165 L 9.23 4.60 0.00 1.51 1.52 0.72 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 166 P 0.00 4.68 0.00 2.05 1.96 0.00 3.60 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.11 0.00 167 P 0.00 4.35 0.00 2.05 2.21 0.00 3.68 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 2.07 2.34 0.00 168 G 8.94 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 0.00 0.00 0.00 169 L 7.13 4.29 0.00 1.59 1.73 1.04 1.39 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 0.00 170 Y 9.02 4.80 0.00 3.47 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 0.00 171 H 9.46 5.99 0.00 3.24 3.41 0.00 5.48 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 S 8.83 5.25 0.00 4.06 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 0.00 173 F 8.58 5.85 0.00 2.99 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 W 8.17 5.88 0.00 3.41 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 0.00 175 A 8.85 4.65 1.52 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 0.00 176 E 9.55 4.29 0.00 2.02 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 2.47 2.34 0.00 177 A 8.45 4.58 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 G 9.33 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 F 8.50 4.35 0.00 3.24 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 G 8.39 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 D 8.56 4.72 0.00 2.45 2.23 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 V 8.41 3.86 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 0.66 0.00 0.00 1.01 0.00 0.00 191 N 9.25 4.79 0.00 2.69 2.74 0.00 0.00 6.88 8.46 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 0.00 192 D 8.22 4.71 0.00 2.80 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 D 8.45 4.59 0.00 2.77 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 0.00 194 D 8.08 4.51 0.00 2.88 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 0.00 195 H 8.21 4.93 0.00 3.30 3.31 0.00 5.67 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 D 8.62 5.23 0.00 2.98 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 N 8.29 5.08 0.00 2.73 2.39 0.00 0.00 6.80 8.16 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 0.00 198 H 8.21 4.55 0.00 2.55 1.31 0.00 5.77 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 0.00 199 F 8.55 4.63 0.00 2.96 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 0.00 200 L 8.70 4.03 0.00 1.11 1.53 0.62 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 201 Q 7.76 4.33 0.00 2.02 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.65 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 202 P 0.00 4.35 0.00 2.05 2.03 0.00 3.67 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 2.06 2.15 0.00 203 L 8.20 4.20 0.00 1.48 1.50 0.11 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 *205 R 8.38 4.39 0.00 2.07 2.26 0.00 3.15 0.00 0.00 3.42 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.92 0.00 206 Y 7.61 4.83 0.00 3.04 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 0.00 207 N 8.59 4.64 0.00 2.68 2.70 0.00 0.00 6.81 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 0.00 208 L 7.91 4.73 0.00 1.72 1.60 0.90 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 209 I 7.96 4.38 1.85 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 1.25 0.59 0.93 0.00 0.00 210 D 8.85 4.53 0.00 2.69 2.52 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 0.00 211 E 8.41 4.22 0.00 1.99 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.23 0.00 212 D 7.81 4.53 0.00 2.76 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 0.00 213 E 7.67 4.76 0.00 2.09 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 2.22 2.28 0.00 214 P 0.00 4.52 0.00 2.07 2.05 0.00 3.67 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 215 A 8.40 4.31 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 0.00 216 Q 9.21 4.22 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 217 L 7.51 5.01 0.00 1.49 1.67 0.50 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 218 V 8.50 4.48 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 0.40 0.00 0.00 0.75 0.00 0.00 219 L 8.63 4.64 0.00 1.66 1.51 0.88 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 220 C 9.03 3.54 0.00 3.15 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 0.00 221 N 7.82 4.73 0.00 2.68 2.85 0.00 0.00 6.71 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 0.00 222 E 7.53 4.71 0.00 2.03 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.18 0.00 223 Y 8.08 4.71 0.00 3.13 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 0.00 224 R 8.16 3.81 0.00 1.86 2.07 0.00 3.00 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 225 Q 7.70 3.81 0.00 0.93 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 7.12 0.00 0.00 0.00 0.00 0.00 2.12 2.13 0.00 226 F 8.20 4.78 0.00 2.86 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 0.00 227 R 7.40 4.04 0.00 1.72 0.98 0.00 2.52 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.48 0.00 * Residues marked with a * may have inaccurate shift predictions.