NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4527 8.3049 118.1924 54.7704 32.8376 174.4865 2 D 4.3083 8.2764 118.0332 53.8723 41.6394 175.8590 3 K 3.8020 9.1366 123.6977 60.0194 33.0357 178.6085 4 N 4.2547 8.2572 116.2970 56.7799 38.5682 176.5900 5 E 3.9464 8.1141 119.9591 59.4394 29.5770 179.2110 6 L 3.9606 7.8582 118.5120 57.7444 41.5835 179.6801 7 V 3.5738 8.1824 118.7344 65.7928 31.4820 177.8993 8 Q 3.9154 8.1284 119.4263 59.0608 28.8963 178.1203 9 K 3.8892 8.3466 120.7016 59.4242 32.2337 178.4974 10 A 3.9792 8.1967 121.1323 55.2806 18.3197 179.8323 11 K 4.0901 8.3939 117.2393 59.3767 32.0538 179.7398 12 L 3.9103 7.9895 119.1912 57.5896 41.5531 179.0574 13 A 3.8817 8.2426 121.1802 55.1947 18.2705 178.9866 14 E 3.6552 8.4908 117.8903 59.8660 29.4761 179.2641 15 Q 4.0041 7.7933 115.9729 58.6666 28.8354 178.1096 16 A 4.0650 7.8093 119.7181 51.9129 19.0327 176.7398 17 E 2.9148 7.5968 115.6923 57.6778 27.8854 176.0708 18 R 4.4653 7.1598 116.2634 54.8842 29.8087 177.0051 19 Y 4.1725 7.5516 118.8093 60.8642 38.3473 177.5674 20 D 4.3068 8.1156 119.6970 57.2739 40.9926 178.2637 21 D 4.2954 7.9761 118.9605 57.4979 40.9382 178.1852 22 M 3.9633 8.1335 118.4675 58.6908 32.2410 178.1633 23 A 3.7464 8.2241 120.8951 54.9973 18.4402 179.4306 24 A 4.0463 8.1074 119.3847 55.4447 18.3990 179.6354 25 C 4.0814 8.1772 115.2152 63.4042 28.1947 176.3250 26 M 4.1661 8.2100 120.1220 57.8044 31.4438 178.8289 27 K 4.0382 8.5759 121.8039 59.0808 32.2176 178.9335 28 S 4.0541 7.8230 114.1149 61.6552 62.9597 176.5423 29 V 3.6874 7.7566 121.0094 66.2661 31.3754 178.2208 30 T 3.6724 7.9594 109.5470 64.6402 68.4511 176.0359 31 E 3.1892 7.8163 119.4127 57.4578 29.5647 178.2722 32 Q 4.1375 7.3887 117.2900 56.3090 28.9108 177.2095 33 G 4.1210 7.7322 108.1703 45.4922 0.0000 174.0562 34 A 4.2528 7.5840 122.1796 50.9767 19.3680 176.7184 35 E 3.9610 8.7474 122.1725 56.7798 30.0981 176.8839 36 L 4.4386 8.2401 124.7048 54.2821 42.8679 177.2490 37 S 4.4827 8.6156 116.4470 57.1607 64.6427 175.0569 38 N 4.1687 8.5199 121.3383 56.2329 36.7517 176.9606 39 E 3.9588 7.9057 121.1099 58.9378 29.5325 179.2950 40 E 3.9790 8.0640 118.1250 59.2446 29.5827 179.1375 41 R 3.9349 8.3542 119.1614 59.6969 30.1080 178.3800 42 N 4.4380 8.1261 116.1366 56.2034 38.3665 177.5293 43 L 4.0544 7.8665 120.2352 57.5780 41.7722 179.1106 44 L 4.0702 7.9994 120.3449 58.2603 41.9901 178.9723 45 S 4.3246 8.4727 113.0467 61.4763 62.4565 176.1144 46 V 3.6130 8.3320 121.0657 66.1605 31.2381 177.3289 47 A 4.1047 8.3200 120.4580 56.0163 18.1472 179.3183 48 Y 3.8544 8.3356 114.3926 60.7927 37.8795 178.6910 49 K 4.2159 8.5321 122.3376 59.1083 32.2978 178.6867 50 N 4.0747 8.1890 116.7958 55.9501 38.3938 177.6901 51 V 3.5613 7.9124 120.0098 66.0446 31.7261 178.5776 52 V 3.8912 8.4202 119.5820 64.6100 31.2432 178.3471 53 G 3.5420 8.2802 106.3895 47.5978 0.0000 175.4308 54 A 3.9952 7.9101 123.0974 55.0534 18.3311 180.0259 55 R 3.9287 7.6785 115.1939 59.2308 30.0268 179.4882 56 R 3.9195 8.4571 118.4704 59.2528 30.0203 179.2735 57 S 4.1585 8.2725 115.0322 61.7648 62.8192 176.9026 58 S 4.1622 8.3046 117.9504 61.2448 62.5600 176.5068 59 W 4.0147 8.5135 131.2357 60.6456 30.4915 178.2225 60 R 3.9847 8.6285 118.2479 59.1591 29.4855 179.2507 61 V 3.5386 7.8303 118.0015 66.1529 31.5241 178.3842 62 V 3.5857 8.0645 118.3803 65.8072 31.2441 177.9032 63 S 3.6132 8.0502 113.4082 61.1894 62.0569 176.1174 64 S 4.0408 7.9881 115.6579 61.0144 62.1933 176.1788 65 I 3.7689 7.6095 122.9836 63.8939 36.6237 177.7803 66 E 3.8807 8.1452 119.7493 59.3291 29.8796 178.6581 67 Q 4.1032 8.1146 117.9673 59.0508 28.7080 178.9767 68 K 4.1512 7.9584 117.5465 58.4064 31.8702 178.2168 69 T 4.6058 7.4602 109.7509 60.1625 69.3601 173.4531 70 E 4.0155 7.4281 122.8980 58.5073 29.7664 177.0250 71 G 3.9443 9.4692 114.4075 45.1642 0.0000 173.3052 72 A 4.5194 7.8136 123.1442 48.6008 18.5216 176.3937 73 E 3.6077 7.7559 115.7237 60.5333 29.7131 179.5116 74 K 3.9146 7.9359 117.7401 58.5937 32.5857 179.3475 75 K 3.9089 8.0174 118.0854 59.6406 31.9954 179.0301 76 Q 4.0017 8.2878 121.2535 58.5139 28.9565 177.9535 77 Q 3.9180 8.1626 120.6873 59.3647 29.1422 177.8542 78 M 4.0024 8.2083 119.0272 58.5330 32.2188 178.0188 79 A 4.0080 8.2730 121.1591 55.1267 18.5062 179.4030 80 R 3.8145 8.5543 117.5148 59.8844 30.1546 178.6369 81 E 4.0065 8.2622 118.2465 59.5282 29.3556 178.7492 82 Y 4.3091 8.2239 119.7794 60.4431 38.7601 177.7576 83 R 3.7307 8.4665 120.2492 59.5625 30.2272 178.4148 84 E 4.0777 8.4927 118.5603 59.2476 29.2715 179.3248 85 K 4.0058 8.2804 119.8196 59.4901 32.1854 179.0354 86 I 3.6647 7.8900 120.3706 64.2912 36.9266 178.1548 87 E 4.0158 8.7270 119.8802 59.7761 29.2457 179.5582 88 T 3.8785 8.0031 115.5663 66.7647 68.4674 176.4673 89 E 3.9688 7.9662 120.2846 59.2680 29.4937 179.1086 90 L 3.9466 8.2537 120.6445 58.4372 42.1740 179.3957 91 R 3.9639 8.3802 118.2781 59.1406 29.8727 178.7299 92 D 4.3534 8.4598 119.1391 57.3977 40.7790 178.7831 93 I 3.7826 8.0284 120.3870 64.7278 37.1383 178.1574 94 C 4.2481 8.1878 117.2578 63.1273 28.0281 176.0415 95 N 4.2248 8.6228 118.2458 56.1721 38.0648 176.9452 96 D 4.2284 8.1875 119.6045 57.2847 41.2813 178.4602 97 V 2.9413 7.5407 118.7285 65.8869 31.3996 178.0117 98 L 3.7432 7.9233 119.0133 57.6834 41.2688 179.3986 99 S 4.1398 8.0977 112.9910 60.8195 62.2062 176.1972 100 L 4.1096 7.6973 122.1266 57.5405 41.2412 179.3762 101 L 3.7834 7.9170 119.1097 57.7290 41.3748 179.2556 102 E 3.8457 7.7991 117.7887 59.1923 29.6902 178.6524 103 K 3.8731 7.9867 117.5630 58.4609 32.1157 177.5854 104 F 4.7223 8.1320 115.1414 59.0153 40.6553 177.7244 105 L 3.6008 7.6530 116.5759 57.7133 41.6684 179.2224 106 I 3.8697 7.7322 119.7372 64.0231 36.9723 176.6198 107 P 4.1980 0.0000 0.0000 65.6310 30.7905 176.8501 108 N 4.9382 7.5272 112.4648 51.5031 39.0600 174.6426 109 A 4.2937 7.8200 125.4233 52.5317 18.5061 177.8178 110 S 4.4088 10.2172 119.8388 60.1470 64.1121 175.0952 111 Q 4.7392 7.6658 118.2435 53.3039 32.9744 176.0834 112 A 4.0462 8.4482 123.1286 55.2592 18.2959 179.7674 113 E 3.8494 8.1115 117.4708 59.6215 29.7636 179.1453 114 S 3.9009 7.9464 114.6408 61.3448 62.9495 176.3973 115 K 4.0701 8.1582 122.3514 59.5522 31.9095 179.0440 116 V 3.6069 7.9754 118.5425 65.8400 31.4536 177.5730 117 F 3.9201 8.3298 120.4949 61.7260 39.1031 176.8235 118 Y 4.4832 8.1817 116.2323 61.1524 37.6314 178.2313 119 L 3.9851 8.5184 120.4683 57.4039 41.5740 179.4052 120 K 3.8166 8.3975 120.0897 59.7573 32.0843 178.3150 121 M 3.8953 7.9724 118.3806 58.7140 32.0850 178.0716 122 K 3.9634 8.3911 120.1451 59.3579 32.2407 179.0802 123 G 2.2950 7.8235 106.4137 47.1307 0.0000 175.2950 124 D 4.0624 8.0242 123.4467 56.7632 40.9510 178.7928 125 Y 3.5074 7.9073 117.0584 60.9592 37.7317 178.1303 126 Y 3.9860 7.7165 117.9025 60.8577 37.9395 178.3191 127 R 4.1038 8.0621 120.0967 59.5553 29.9277 178.2338 128 Y 4.3628 7.4327 116.2726 60.8874 38.2107 177.8349 129 L 4.0840 8.1528 119.9274 57.6833 41.3269 179.3647 130 A 4.1253 8.4796 121.2209 55.1503 18.0611 179.4200 131 E 3.9256 8.0083 116.3702 58.6628 29.5111 178.4330 132 V 3.9218 7.0127 108.3564 60.6631 31.8366 176.3490 133 A 3.8915 6.8725 123.6474 53.8712 18.3966 178.4966 *138 K 3.9859 7.7254 124.1824 55.2810 32.9342 175.2301 139 K 4.1112 8.1249 124.5073 54.6157 34.6277 175.6723 140 G 3.9071 8.1183 107.3823 46.6614 0.0000 175.2929 141 I 3.7364 7.6260 122.5752 64.0927 37.2318 178.0081 142 V 3.7610 8.3552 119.5486 66.4284 31.2415 177.9099 143 D 4.4473 8.0197 117.8962 57.3232 40.6981 178.6713 144 Q 3.5650 7.4964 118.4969 58.6145 28.5304 178.5909 145 S 3.7015 7.9548 114.4469 61.2896 62.4601 175.9085 146 Q 3.4192 8.1048 122.4793 59.2754 28.7585 178.4259 147 Q 4.0285 8.2057 119.0362 58.5577 28.5831 178.5931 148 A 3.7978 7.6572 121.8242 55.2886 18.2296 179.1533 149 Y 3.7984 7.1693 115.1136 61.0999 37.6548 178.7298 150 Q 4.1727 8.1418 120.5887 59.3555 29.1658 178.1340 151 E 3.9314 8.3419 120.0376 59.1822 29.6317 178.5451 152 A 4.0123 8.2218 121.0667 55.1208 18.4334 179.2623 153 F 4.2309 8.7728 119.5326 61.5338 39.3364 177.2673 154 E 3.8924 8.6645 118.2844 59.5233 29.3088 179.2821 155 I 3.7190 7.7326 120.0273 64.5522 37.2095 178.7675 156 S 4.1886 8.2651 114.9208 61.2069 62.5784 176.6419 157 K 3.8516 7.6223 121.5697 58.6400 31.7192 178.7009 158 K 4.1156 7.5475 119.3276 58.6653 32.5133 177.8714 159 E 4.4043 8.3585 116.3380 56.0286 30.2951 175.8702 160 M 4.8355 7.2072 117.6136 53.1088 36.0030 175.3343 161 Q 4.3267 8.3053 119.7408 54.8926 29.7637 175.7800 162 P 4.3043 0.0000 0.0000 65.4427 31.4119 177.7488 163 T 4.2552 7.6969 105.7142 61.6818 69.6144 174.8907 164 H 4.0907 8.0530 123.5694 56.0859 31.0670 173.9094 165 P 4.3098 0.0000 0.0000 66.0224 31.0850 178.8255 166 I 3.8132 8.0149 119.1910 64.2450 37.1710 178.1457 167 R 3.9263 8.0339 119.0812 59.4384 29.9284 178.4204 168 L 4.2014 8.2863 119.0361 57.7635 41.6473 179.7411 169 G 3.6502 8.7057 106.2107 47.5931 0.0000 175.5571 170 L 4.0510 8.3837 122.7593 57.9305 42.0996 178.9376 171 A 4.2192 8.2355 120.7916 55.0418 18.3334 179.2333 172 L 3.9599 8.3920 119.2529 58.6874 42.1681 179.0999 173 N 4.5074 8.3713 116.1816 56.0037 38.4682 177.3365 174 F 3.7850 8.2876 122.6189 60.8154 39.2956 177.4614 175 S 4.2367 8.4827 114.4505 61.4178 62.8944 176.6879 176 V 3.8201 8.1303 122.0177 65.6241 31.3010 177.6113 177 F 4.1343 8.6574 120.8854 61.7264 39.1283 176.7786 178 Y 3.7393 8.1041 116.2439 60.9342 37.7012 177.9467 179 Y 3.5263 8.0517 120.5331 60.4891 38.6709 177.3071 180 E 4.0729 8.4812 118.6485 58.1203 30.1288 177.1322 181 I 3.8780 7.4309 118.6016 63.1359 37.6084 176.6422 182 L 4.1747 7.2409 116.1448 53.6203 42.2776 175.7333 183 N 4.3513 7.4957 114.5139 53.7744 36.3453 175.8329 184 S 4.5474 8.0727 113.4456 55.2196 63.6075 173.5756 185 P 4.1390 0.0000 0.0000 65.6729 31.2502 178.6213 186 E 3.9090 7.8880 117.8436 59.0482 29.4375 178.9761 187 K 3.6305 7.7435 118.9813 59.1273 32.1744 178.4502 188 A 3.9202 8.1323 121.4870 55.4925 18.2402 179.4692 189 C 4.3656 8.5337 115.6112 63.0385 28.2198 176.3431 190 S 4.1116 8.2404 114.9065 61.1056 62.0468 175.9361 191 L 3.8891 8.0538 123.0008 58.1188 41.8158 178.8838 192 A 4.0850 8.3188 120.8569 55.0509 18.3706 179.4894 193 K 3.9857 8.5964 118.6335 59.9363 32.2575 179.1077 194 T 3.8929 8.1306 115.7536 66.6885 68.4519 176.5216 195 A 4.0915 8.0785 122.4501 54.9912 18.3644 179.4402 196 F 4.0621 8.7316 119.5831 61.6889 39.5584 177.0906 197 D 4.2833 8.8571 118.7910 57.5126 40.4063 178.7549 198 E 3.9702 8.5055 118.2459 59.1532 29.6050 179.0340 199 A 4.0825 7.9172 121.1791 54.9889 18.3268 179.6222 200 I 3.5127 7.3955 109.7662 63.2371 37.7264 177.8377 201 A 4.1446 7.7356 121.9735 53.6601 18.8733 177.0407 202 E 4.7323 8.2006 117.8620 55.8727 30.5696 177.9917 203 L 3.9866 7.8858 120.0634 57.3377 42.2053 179.1481 204 D 4.5768 8.0582 116.7211 54.9330 39.5976 176.7280 205 T 4.3391 7.7726 109.5804 61.5354 69.5037 175.0900 206 L 4.0587 7.6788 124.1611 55.0590 42.2400 177.3878 207 S 4.7866 8.3650 118.1228 56.4719 66.3129 174.6827 208 E 3.9014 8.7209 122.9148 59.7676 29.2865 178.5071 209 E 4.1303 8.1743 116.1417 59.5520 30.0289 178.8909 210 S 4.5417 7.8556 112.5010 58.7766 63.2753 175.3534 211 Y 3.9044 8.4298 123.9586 61.1657 38.3688 178.4630 212 K 4.0763 8.2004 118.2283 59.4924 32.3413 178.9956 213 D 4.3481 8.0482 118.5462 57.5713 40.7944 178.8602 214 S 4.1090 8.4468 116.0935 61.8963 62.8638 177.0308 215 T 3.7567 7.9867 112.8327 64.4871 68.5000 176.4305 216 L 3.9505 8.1215 123.3989 58.0680 42.1100 179.1046 217 I 3.7870 7.9488 119.8086 64.4754 36.9531 178.2063 218 M 4.2328 8.3975 120.0477 58.6301 31.8166 178.6417 219 Q 4.0123 8.3250 119.6309 59.0135 29.1213 178.1556 220 L 3.9394 8.0062 120.2169 57.5007 41.6094 179.3385 221 L 3.8401 8.4440 119.2756 57.9317 41.5855 179.6738 222 R 3.3644 8.0875 118.8388 59.2139 29.8401 178.2446 223 D 4.1762 8.4416 119.1210 57.1626 40.6948 178.5056 224 N 3.3981 7.9655 117.2841 55.8710 38.3642 177.3512 225 L 3.8504 7.3908 120.2329 58.0048 41.4392 179.6412 226 T 3.7626 7.6538 114.8134 66.7260 68.4850 176.3256 227 L 4.0780 7.4291 119.2991 57.6095 41.7358 179.4386 228 W 4.5908 8.3884 117.7202 58.9560 29.0313 177.0435 229 T 4.3940 7.8849 120.0751 63.5683 68.3219 174.1532 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 8.30 4.45 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.56 0.00 2 D 8.28 4.31 0.00 2.80 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 3 K 9.14 3.80 0.00 1.78 1.86 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.76 1.50 7.81 4 N 8.26 4.25 0.00 2.78 2.82 0.00 0.00 7.13 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 5 E 8.11 3.95 0.00 2.27 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 2.32 2.34 0.00 6 L 7.86 3.96 0.00 1.84 1.70 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 7 V 8.18 3.57 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 1.09 0.00 0.00 1.00 0.00 0.00 8 Q 8.13 3.92 0.00 2.35 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 9 K 8.35 3.89 0.00 1.83 1.91 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.44 7.81 10 A 8.20 3.98 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 11 K 8.39 4.09 0.00 1.95 1.87 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.65 7.81 12 L 7.99 3.91 0.00 1.85 1.68 0.90 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 13 A 8.24 3.88 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 E 8.49 3.66 0.00 2.02 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 0.00 2.36 2.53 0.00 15 Q 7.79 4.00 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.73 0.00 0.00 0.00 0.00 0.00 2.52 2.51 0.00 16 A 7.81 4.07 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 17 E 7.60 2.91 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.20 0.00 18 R 7.16 4.47 0.00 1.70 1.75 0.00 3.08 0.00 0.00 3.10 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.66 0.00 19 Y 7.55 4.17 0.00 3.00 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 20 D 8.12 4.31 0.00 2.68 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 21 D 7.98 4.30 0.00 2.85 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 22 M 8.13 3.96 0.00 2.25 2.11 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.60 0.00 23 A 8.22 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.11 4.05 1.37 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 0.00 0.00 25 C 8.18 4.08 0.00 3.19 3.16 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 26 M 8.21 4.17 0.00 2.12 2.18 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.85 0.00 27 K 8.58 4.04 0.00 2.02 2.06 0.00 1.99 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.46 1.37 7.81 28 S 7.82 4.05 0.00 4.05 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 29 V 7.76 3.69 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 0.94 0.00 0.00 30 T 7.96 3.67 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 1.26 0.00 0.00 31 E 7.82 3.19 0.00 1.83 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 2.25 2.52 0.00 32 Q 7.39 4.14 0.00 2.10 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.71 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 33 G 7.73 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 34 A 7.58 4.25 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 35 E 8.75 3.96 0.00 1.97 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 2.34 2.43 0.00 36 L 8.24 4.44 0.00 1.77 1.61 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 37 S 8.62 4.48 0.00 3.90 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 38 N 8.52 4.17 0.00 2.86 3.01 0.00 0.00 5.93 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 39 E 7.91 3.96 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 40 E 8.06 3.98 0.00 2.23 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.36 0.00 41 R 8.35 3.93 0.00 1.84 1.84 0.00 2.21 0.00 0.00 2.58 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.51 0.00 42 N 8.13 4.44 0.00 2.85 2.90 0.00 0.00 7.10 6.13 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 43 L 7.87 4.05 0.00 1.90 1.76 0.94 0.92 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 44 L 8.00 4.07 0.00 1.89 2.05 1.20 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.47 4.32 0.00 4.39 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 V 8.33 3.61 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 1.17 0.00 0.00 1.04 0.00 0.00 47 A 8.32 4.10 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 0.00 0.00 0.00 0.00 0.00 48 Y 8.34 3.85 0.00 3.27 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 49 K 8.53 4.22 0.00 2.14 1.89 0.00 1.51 0.00 0.00 1.88 0.00 0.00 3.19 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.38 7.81 50 N 8.19 4.07 0.00 2.32 1.76 0.00 0.00 6.66 7.15 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 51 V 7.91 3.56 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 1.09 0.00 0.00 0.89 0.00 0.00 52 V 8.42 3.89 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.93 0.00 0.00 53 G 8.28 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 A 7.91 4.00 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 55 R 7.68 3.93 0.00 2.11 1.99 0.00 3.19 0.00 0.00 3.39 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 56 R 8.46 3.92 0.00 1.78 1.87 0.00 2.21 0.00 0.00 2.63 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.54 0.00 57 S 8.27 4.16 0.00 3.88 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 58 S 8.30 4.16 0.00 3.88 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 59 W 8.51 4.01 0.00 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 0.00 60 R 8.63 3.98 0.00 2.16 2.06 0.00 3.27 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.17 0.00 61 V 7.83 3.54 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 1.00 0.00 0.00 1.00 0.00 0.00 62 V 8.06 3.59 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 1.10 0.00 0.00 1.11 0.00 0.00 63 S 8.05 3.61 0.00 2.72 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 64 S 7.99 4.04 0.00 3.90 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 65 I 7.61 3.77 1.96 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 1.11 0.89 0.00 0.00 66 E 8.15 3.88 0.00 1.98 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 67 Q 8.11 4.10 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.57 0.00 0.00 0.00 0.00 0.00 2.34 2.52 0.00 68 K 7.96 4.15 0.00 1.96 1.86 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.47 1.44 7.81 69 T 7.46 4.61 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 1.27 0.00 0.00 70 E 7.43 4.02 0.00 2.10 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 2.32 2.30 0.00 71 G 9.47 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 0.00 0.00 0.00 72 A 7.81 4.52 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 73 E 7.76 3.61 0.00 2.20 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 0.00 2.37 2.45 0.00 74 K 7.94 3.91 0.00 1.81 1.89 0.00 1.67 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.53 7.81 75 K 8.02 3.91 0.00 1.78 1.85 0.00 1.65 0.00 0.00 1.73 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.49 7.81 76 Q 8.29 4.00 0.00 2.43 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 77 Q 8.16 3.92 0.00 2.27 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 78 M 8.21 4.00 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.54 0.00 79 A 8.27 4.01 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 R 8.55 3.81 0.00 1.90 2.08 0.00 3.12 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 81 E 8.26 4.01 0.00 2.22 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 82 Y 8.22 4.31 0.00 3.11 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 83 R 8.47 3.73 0.00 1.73 2.04 0.00 2.83 0.00 0.00 2.68 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.16 0.00 84 E 8.49 4.08 0.00 2.21 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.59 0.00 85 K 8.28 4.01 0.00 1.88 1.95 0.00 1.76 0.00 0.00 1.84 0.00 0.00 3.26 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.50 7.81 86 I 7.89 3.66 2.02 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 1.19 0.09 1.02 0.00 0.00 87 E 8.73 4.02 0.00 2.43 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.69 0.00 88 T 8.00 3.88 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 89 E 7.97 3.97 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.52 0.00 90 L 8.25 3.95 0.00 1.95 1.88 0.88 0.69 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 91 R 8.38 3.96 0.00 1.87 1.95 0.00 3.19 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.89 0.00 92 D 8.46 4.35 0.00 2.83 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 93 I 8.03 3.78 2.12 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 1.64 0.77 1.16 0.00 0.00 94 C 8.19 4.25 0.00 2.99 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 95 N 8.62 4.22 0.00 2.85 2.82 0.00 0.00 6.71 8.07 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 96 D 8.19 4.23 0.00 2.84 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 V 7.54 2.94 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 -0.11 0.00 0.00 98 L 7.92 3.74 0.00 1.64 1.44 -0.01 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 99 S 8.10 4.14 0.00 3.84 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 0.00 100 L 7.70 4.11 0.00 1.90 1.57 0.98 0.51 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 0.00 101 L 7.92 3.78 0.00 1.75 1.63 0.83 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 102 E 7.80 3.85 0.00 2.06 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 103 K 7.99 3.87 0.00 1.44 0.98 0.00 1.39 0.00 0.00 1.50 0.00 0.00 2.96 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.26 1.46 7.81 104 F 8.13 4.72 0.00 3.13 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 L 7.65 3.60 0.00 1.05 0.13 0.73 0.58 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 0.00 106 I 7.73 3.87 1.91 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 1.66 0.67 0.93 0.00 0.00 107 P 0.00 4.20 0.00 2.16 2.16 0.00 3.74 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.15 0.00 108 N 7.53 4.94 0.00 2.72 2.91 0.00 0.00 6.98 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.82 4.29 1.53 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 0.00 110 S 10.22 4.41 0.00 3.87 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 0.00 111 Q 7.67 4.74 0.00 2.12 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.92 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 112 A 8.45 4.05 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 E 8.11 3.85 0.00 2.04 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 2.36 2.44 0.00 114 S 7.95 3.90 0.00 4.10 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 0.00 115 K 8.16 4.07 0.00 1.90 1.85 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.51 7.81 116 V 7.98 3.61 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 1.09 0.00 0.00 1.03 0.00 0.00 117 F 8.33 3.92 0.00 3.09 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 0.00 118 Y 8.18 4.48 0.00 3.16 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 L 8.52 3.99 0.00 1.73 1.88 1.01 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 120 K 8.40 3.82 0.00 1.84 1.91 0.00 1.73 0.00 0.00 1.43 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.57 1.61 7.81 121 M 7.97 3.90 0.00 2.36 2.11 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.57 0.00 122 K 8.39 3.96 0.00 1.90 1.89 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.56 1.55 7.81 123 G 7.82 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 0.00 0.00 0.00 124 D 8.02 4.06 0.00 2.57 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 7.91 3.51 0.00 2.85 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 0.00 126 Y 7.72 3.99 0.00 2.99 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 0.00 127 R 8.06 4.10 0.00 2.09 2.03 0.00 3.31 0.00 0.00 3.62 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.85 0.00 128 Y 7.43 4.36 0.00 2.96 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 0.00 129 L 8.15 4.08 0.00 1.95 1.74 0.79 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 130 A 8.48 4.13 1.46 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 0.00 131 E 8.01 3.93 0.00 2.02 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 2.36 2.58 0.00 132 V 7.01 3.92 1.76 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 -1.06 0.00 0.00 0.76 0.00 0.00 133 A 6.87 3.89 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 *138 K 7.73 3.99 0.00 1.77 1.86 0.00 1.73 0.00 0.00 1.62 0.00 0.00 3.04 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.48 7.81 139 K 8.12 4.11 0.00 1.79 1.67 0.00 1.77 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 1.23 7.81 140 G 8.12 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 0.00 141 I 7.63 3.74 2.08 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 1.67 0.75 1.09 0.00 0.00 142 V 8.36 3.76 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 1.14 0.00 0.00 1.01 0.00 0.00 143 D 8.02 4.45 0.00 2.83 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 0.00 144 Q 7.50 3.57 0.00 1.09 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.16 1.93 0.00 145 S 7.95 3.70 0.00 3.86 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 0.00 146 Q 8.10 3.42 0.00 2.34 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.58 0.00 0.00 0.00 0.00 0.00 2.47 2.58 0.00 147 Q 8.21 4.03 0.00 1.96 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.33 2.54 0.00 148 A 7.66 3.80 1.13 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 0.00 149 Y 7.17 3.80 0.00 1.93 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 0.00 150 Q 8.14 4.17 0.00 2.35 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.81 0.00 0.00 0.00 0.00 0.00 2.50 2.67 0.00 151 E 8.34 3.93 0.00 2.07 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 2.32 2.34 0.00 152 A 8.22 4.01 1.44 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 0.00 0.00 153 F 8.77 4.23 0.00 3.40 3.47 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 0.00 154 E 8.66 3.89 0.00 2.23 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 2.42 2.55 0.00 155 I 7.73 3.72 1.88 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 1.58 0.74 0.91 0.00 0.00 156 S 8.27 4.19 0.00 4.00 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 0.00 157 K 7.62 3.85 0.00 1.73 1.76 0.00 1.52 0.00 0.00 1.43 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.14 0.54 7.81 158 K 7.55 4.12 0.00 1.67 1.90 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.45 7.81 159 E 8.36 4.40 0.00 1.96 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 2.39 2.46 0.00 160 M 7.21 4.84 0.00 1.87 1.98 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 2.43 2.30 0.00 161 Q 8.31 4.33 0.00 2.13 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.90 0.00 0.00 0.00 0.00 0.00 2.45 2.39 0.00 162 P 0.00 4.30 0.00 2.12 2.10 0.00 3.77 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.05 0.00 163 T 7.70 4.26 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 164 H 8.05 4.09 0.00 3.40 3.24 0.00 5.79 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 P 0.00 4.31 0.00 2.34 2.31 0.00 3.46 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.03 0.00 166 I 8.01 3.81 1.94 0.00 0.00 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 1.73 1.08 1.02 0.00 0.00 167 R 8.03 3.93 0.00 1.86 2.11 0.00 3.33 0.00 0.00 3.47 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.72 0.00 168 L 8.29 4.20 0.00 1.92 1.75 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 169 G 8.71 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 0.00 0.00 0.00 0.00 170 L 8.38 4.05 0.00 1.89 2.04 1.06 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 171 A 8.24 4.22 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 L 8.39 3.96 0.00 1.88 1.97 0.90 0.57 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 0.00 173 N 8.37 4.51 0.00 3.00 3.04 0.00 0.00 6.73 7.53 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 0.00 174 F 8.29 3.78 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 0.00 175 S 8.48 4.24 0.00 4.60 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 0.00 176 V 8.13 3.82 2.42 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 1.04 0.00 0.00 1.25 0.00 0.00 177 F 8.66 4.13 0.00 3.16 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 0.00 178 Y 8.10 3.74 0.00 3.06 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 Y 8.05 3.53 0.00 1.80 2.49 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 0.00 180 E 8.48 4.07 0.00 2.13 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 2.32 2.43 0.00 181 I 7.43 3.88 1.23 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 1.30 1.09 0.75 0.00 0.00 182 L 7.24 4.17 0.00 1.48 1.59 0.99 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 183 N 7.50 4.35 0.00 2.65 2.63 0.00 0.00 7.07 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 S 8.07 4.55 0.00 3.75 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 0.00 185 P 0.00 4.14 0.00 2.22 2.06 0.00 3.52 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.82 0.00 186 E 7.89 3.91 0.00 1.94 1.96 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 2.37 2.30 0.00 187 K 7.74 3.63 0.00 1.46 1.41 0.00 1.21 0.00 0.00 1.36 0.00 0.00 2.35 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.30 0.24 7.81 188 A 8.13 3.92 1.02 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 0.00 189 C 8.53 4.37 0.00 3.19 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.24 4.11 0.00 3.84 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 0.00 191 L 8.05 3.89 0.00 1.69 1.73 0.33 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 192 A 8.32 4.08 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 K 8.60 3.99 0.00 1.84 1.99 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.68 7.81 194 T 8.13 3.89 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 195 A 8.08 4.09 1.51 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 0.00 196 F 8.73 4.06 0.00 3.14 3.23 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 0.00 197 D 8.86 4.28 0.00 2.85 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 E 8.51 3.97 0.00 1.97 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 2.35 2.53 0.00 199 A 7.92 4.08 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 0.00 200 I 7.40 3.51 1.66 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 1.01 0.54 0.25 0.00 0.00 201 A 7.74 4.14 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 0.00 202 E 8.20 4.73 0.00 1.94 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 2.19 2.20 0.00 203 L 7.89 3.99 0.00 1.69 1.72 0.90 0.88 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 0.00 204 D 8.06 4.58 0.00 2.79 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 0.00 205 T 7.77 4.34 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 1.21 0.00 0.00 206 L 7.68 4.06 0.00 1.87 1.77 0.90 0.72 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 0.00 207 S 8.37 4.79 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 0.00 208 E 8.72 3.90 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 209 E 8.17 4.13 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 210 S 7.86 4.54 0.00 3.81 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 0.00 211 Y 8.43 3.90 0.00 3.16 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 0.00 212 K 8.20 4.08 0.00 1.92 1.91 0.00 1.79 0.00 0.00 1.88 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.69 1.72 7.81 213 D 8.05 4.35 0.00 2.85 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 S 8.45 4.11 0.00 3.86 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 0.00 215 T 7.99 3.76 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 216 L 8.12 3.95 0.00 1.84 1.93 0.92 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 217 I 7.95 3.79 2.00 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 1.55 0.66 0.95 0.00 0.00 218 M 8.40 4.23 0.00 2.21 2.29 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.48 0.00 219 Q 8.33 4.01 0.00 2.19 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.55 0.00 220 L 8.01 3.94 0.00 1.87 1.64 0.92 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 221 L 8.44 3.84 0.00 1.93 1.74 1.04 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 222 R 8.09 3.36 0.00 0.92 1.73 0.00 2.33 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.36 0.00 223 D 8.44 4.18 0.00 2.61 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 0.00 224 N 7.97 3.40 0.00 2.02 1.42 0.00 0.00 7.01 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 0.00 225 L 7.39 3.85 0.00 1.67 1.54 1.07 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 226 T 7.65 3.76 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 1.13 0.00 0.00 227 L 7.43 4.08 0.00 1.32 1.64 0.78 0.77 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 0.00 228 W 8.39 4.59 0.00 3.31 3.16 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 0.00 229 T 7.88 4.39 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 1.23 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.